USER MOD reduce.3.24.130724 H: found=0, std=0, add=1097, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1101 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 112 LYS NZ :NH3+ -174:sc= -0.961 (180deg=-1.09) USER MOD Set 1.2: A 152 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 119 SER OG : rot 180:sc= -1.76 USER MOD Set 3.1: A 50 SER OG : rot 96:sc= 0.74 USER MOD Set 3.2: A 63 THR OG1 : rot -59:sc= -0.658 USER MOD Set 4.1: A 14 ASN : amide:sc= -3.36 K(o=-3.5,f=-10!) USER MOD Set 4.2: A 18 GLN : amide:sc= -0.147 K(o=-3.5,f=-7.1!) USER MOD Set 5.1: A 8 LYS NZ :NH3+ 155:sc= 1.27 (180deg=0) USER MOD Set 5.2: A 155 ASN : amide:sc= 0.753 K(o=2,f=-13!) USER MOD Single : A 4 LYS NZ :NH3+ 156:sc= -0.0736 (180deg=-0.889) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 GLN : amide:sc= -0.0225 X(o=-0.022,f=-0.34) USER MOD Single : A 26 ASN : amide:sc= -2.91! C(o=-2.9!,f=-3.3!) USER MOD Single : A 51 MET CE :methyl -122:sc= -4.36! (180deg=-10.5!) USER MOD Single : A 52 TYR OH : rot 30:sc= -0.897 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 157:sc=-0.00354 (180deg=-0.691) USER MOD Single : A 65 SER OG : rot 160:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 122:sc= 0.273 USER MOD Single : A 75 SER OG : rot 141:sc= -1.27 USER MOD Single : A 76 CYS SG : rot -25:sc= 0.577 USER MOD Single : A 78 ASN : amide:sc= -0.498 X(o=-0.5,f=-0.03) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 36:sc= 0.504 USER MOD Single : A 84 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00272) USER MOD Single : A 86 MET CE :methyl -151:sc= -0.721 (180deg=-1.57) USER MOD Single : A 87 ASN : amide:sc= -0.877 X(o=-0.88,f=-1.4!) USER MOD Single : A 91 ASN : amide:sc= -2.18 K(o=-2.2,f=-1.1) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -3.93! C(o=-3.9!,f=-6.1!) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.151 K(o=-0.15,f=-1.6!) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= -1.27 K(o=-1.3,f=-0.36) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot -39:sc= -2.98 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot -69:sc= 1.16 USER MOD Single : A 129 LYS NZ :NH3+ -119:sc= -0.0706 (180deg=-1.95!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ -143:sc= -2.2! (180deg=-4.79!) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 150 MET CE :methyl -143:sc= -3.92 (180deg=-7.98!) USER MOD Single : A 154 GLN : amide:sc= -0.139 X(o=-0.14,f=-0.016) USER MOD ----------------------------------------------------------------- ATOM 21 N PHE A 2 1.310 2.214 -20.249 1.00 0.00 N ATOM 22 CA PHE A 2 0.714 1.674 -19.038 1.00 0.00 C ATOM 23 C PHE A 2 -0.773 2.010 -18.975 1.00 0.00 C ATOM 24 O PHE A 2 -1.223 2.988 -19.572 1.00 0.00 O ATOM 25 CB PHE A 2 1.439 2.239 -17.817 1.00 0.00 C ATOM 26 CG PHE A 2 1.382 1.348 -16.610 1.00 0.00 C ATOM 27 CD1 PHE A 2 1.825 0.037 -16.681 1.00 0.00 C ATOM 28 CD2 PHE A 2 0.894 1.823 -15.402 1.00 0.00 C ATOM 29 CE1 PHE A 2 1.780 -0.785 -15.571 1.00 0.00 C ATOM 30 CE2 PHE A 2 0.849 1.004 -14.288 1.00 0.00 C ATOM 31 CZ PHE A 2 1.293 -0.301 -14.373 1.00 0.00 C ATOM 0 HA PHE A 2 0.816 0.589 -19.046 1.00 0.00 H new ATOM 0 HB2 PHE A 2 2.483 2.417 -18.076 1.00 0.00 H new ATOM 0 HB3 PHE A 2 1.004 3.206 -17.564 1.00 0.00 H new ATOM 0 HD1 PHE A 2 2.210 -0.347 -17.614 1.00 0.00 H new ATOM 0 HD2 PHE A 2 0.546 2.843 -15.330 1.00 0.00 H new ATOM 0 HE1 PHE A 2 2.126 -1.806 -15.641 1.00 0.00 H new ATOM 0 HE2 PHE A 2 0.467 1.385 -13.352 1.00 0.00 H new ATOM 0 HZ PHE A 2 1.259 -0.942 -13.504 1.00 0.00 H new ATOM 41 N GLY A 3 -1.534 1.195 -18.252 1.00 0.00 N ATOM 42 CA GLY A 3 -2.962 1.429 -18.135 1.00 0.00 C ATOM 43 C GLY A 3 -3.572 0.742 -16.930 1.00 0.00 C ATOM 44 O GLY A 3 -2.913 -0.051 -16.257 1.00 0.00 O ATOM 0 H GLY A 3 -1.189 0.379 -17.746 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -3.146 2.501 -18.068 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -3.459 1.076 -19.039 1.00 0.00 H new ATOM 48 N LYS A 4 -4.836 1.049 -16.656 1.00 0.00 N ATOM 49 CA LYS A 4 -5.539 0.458 -15.524 1.00 0.00 C ATOM 50 C LYS A 4 -6.185 -0.868 -15.915 1.00 0.00 C ATOM 51 O LYS A 4 -6.837 -0.971 -16.954 1.00 0.00 O ATOM 52 CB LYS A 4 -6.605 1.422 -14.999 1.00 0.00 C ATOM 53 CG LYS A 4 -7.041 1.129 -13.573 1.00 0.00 C ATOM 54 CD LYS A 4 -8.149 0.089 -13.532 1.00 0.00 C ATOM 55 CE LYS A 4 -9.396 0.576 -14.254 1.00 0.00 C ATOM 56 NZ LYS A 4 -10.602 -0.206 -13.867 1.00 0.00 N ATOM 0 H LYS A 4 -5.394 1.704 -17.203 1.00 0.00 H new ATOM 0 HA LYS A 4 -4.810 0.268 -14.736 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.219 2.440 -15.050 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -7.476 1.378 -15.653 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -6.187 0.775 -12.996 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -7.386 2.049 -13.101 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -7.799 -0.836 -13.991 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.394 -0.143 -12.495 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.558 1.630 -14.028 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.245 0.501 -15.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -11.455 0.366 -14.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.651 -1.073 -14.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -10.544 -0.458 -12.860 1.00 0.00 H new ATOM 70 N LEU A 5 -5.999 -1.879 -15.074 1.00 0.00 N ATOM 71 CA LEU A 5 -6.559 -3.201 -15.323 1.00 0.00 C ATOM 72 C LEU A 5 -7.925 -3.345 -14.662 1.00 0.00 C ATOM 73 O LEU A 5 -8.921 -3.633 -15.325 1.00 0.00 O ATOM 74 CB LEU A 5 -5.612 -4.282 -14.800 1.00 0.00 C ATOM 75 CG LEU A 5 -5.575 -5.566 -15.628 1.00 0.00 C ATOM 76 CD1 LEU A 5 -4.337 -6.382 -15.292 1.00 0.00 C ATOM 77 CD2 LEU A 5 -6.836 -6.386 -15.396 1.00 0.00 C ATOM 0 H LEU A 5 -5.462 -1.807 -14.210 1.00 0.00 H new ATOM 0 HA LEU A 5 -6.681 -3.321 -16.399 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -4.604 -3.869 -14.753 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -5.901 -4.534 -13.780 1.00 0.00 H new ATOM 0 HG LEU A 5 -5.531 -5.295 -16.683 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -4.328 -7.293 -15.891 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.444 -5.795 -15.510 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -4.350 -6.644 -14.234 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -6.793 -7.297 -15.993 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -6.911 -6.648 -14.340 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -7.709 -5.802 -15.688 1.00 0.00 H new ATOM 89 N GLU A 6 -7.963 -3.142 -13.349 1.00 0.00 N ATOM 90 CA GLU A 6 -9.205 -3.249 -12.593 1.00 0.00 C ATOM 91 C GLU A 6 -9.022 -2.727 -11.173 1.00 0.00 C ATOM 92 O GLU A 6 -8.048 -3.062 -10.498 1.00 0.00 O ATOM 93 CB GLU A 6 -9.682 -4.704 -12.558 1.00 0.00 C ATOM 94 CG GLU A 6 -8.559 -5.711 -12.367 1.00 0.00 C ATOM 95 CD GLU A 6 -9.071 -7.121 -12.144 1.00 0.00 C ATOM 96 OE1 GLU A 6 -10.225 -7.268 -11.690 1.00 0.00 O ATOM 97 OE2 GLU A 6 -8.319 -8.077 -12.424 1.00 0.00 O ATOM 0 H GLU A 6 -7.147 -2.902 -12.786 1.00 0.00 H new ATOM 0 HA GLU A 6 -9.959 -2.639 -13.091 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -10.404 -4.821 -11.750 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -10.205 -4.928 -13.488 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -7.912 -5.698 -13.244 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.948 -5.411 -11.515 1.00 0.00 H new ATOM 104 N SER A 7 -9.964 -1.904 -10.724 1.00 0.00 N ATOM 105 CA SER A 7 -9.906 -1.334 -9.383 1.00 0.00 C ATOM 106 C SER A 7 -10.837 -2.080 -8.433 1.00 0.00 C ATOM 107 O SER A 7 -12.000 -2.327 -8.754 1.00 0.00 O ATOM 108 CB SER A 7 -10.278 0.149 -9.421 1.00 0.00 C ATOM 109 OG SER A 7 -10.577 0.633 -8.123 1.00 0.00 O ATOM 0 H SER A 7 -10.777 -1.617 -11.269 1.00 0.00 H new ATOM 0 HA SER A 7 -8.885 -1.436 -9.016 1.00 0.00 H new ATOM 0 HB2 SER A 7 -9.454 0.723 -9.846 1.00 0.00 H new ATOM 0 HB3 SER A 7 -11.138 0.295 -10.074 1.00 0.00 H new ATOM 0 HG SER A 7 -10.810 1.583 -8.174 1.00 0.00 H new ATOM 115 N LYS A 8 -10.317 -2.434 -7.264 1.00 0.00 N ATOM 116 CA LYS A 8 -11.100 -3.152 -6.265 1.00 0.00 C ATOM 117 C LYS A 8 -10.629 -2.806 -4.856 1.00 0.00 C ATOM 118 O LYS A 8 -9.652 -2.078 -4.680 1.00 0.00 O ATOM 119 CB LYS A 8 -11.000 -4.661 -6.495 1.00 0.00 C ATOM 120 CG LYS A 8 -9.598 -5.215 -6.298 1.00 0.00 C ATOM 121 CD LYS A 8 -9.530 -6.694 -6.644 1.00 0.00 C ATOM 122 CE LYS A 8 -8.347 -7.369 -5.972 1.00 0.00 C ATOM 123 NZ LYS A 8 -8.421 -8.854 -6.074 1.00 0.00 N ATOM 0 H LYS A 8 -9.356 -2.236 -6.984 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.141 -2.846 -6.366 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -11.682 -5.170 -5.814 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -11.333 -4.889 -7.508 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.896 -4.662 -6.922 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -9.289 -5.068 -5.263 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -10.453 -7.184 -6.335 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -9.452 -6.813 -7.725 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.422 -7.020 -6.430 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -8.312 -7.079 -4.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -7.464 -9.255 -6.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.008 -9.226 -5.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.843 -9.119 -6.987 1.00 0.00 H new ATOM 137 N LEU A 9 -11.328 -3.332 -3.857 1.00 0.00 N ATOM 138 CA LEU A 9 -10.978 -3.077 -2.464 1.00 0.00 C ATOM 139 C LEU A 9 -10.259 -4.274 -1.853 1.00 0.00 C ATOM 140 O LEU A 9 -10.754 -5.399 -1.898 1.00 0.00 O ATOM 141 CB LEU A 9 -12.231 -2.755 -1.649 1.00 0.00 C ATOM 142 CG LEU A 9 -12.687 -1.296 -1.708 1.00 0.00 C ATOM 143 CD1 LEU A 9 -14.053 -1.141 -1.059 1.00 0.00 C ATOM 144 CD2 LEU A 9 -11.668 -0.392 -1.033 1.00 0.00 C ATOM 0 H LEU A 9 -12.139 -3.937 -3.985 1.00 0.00 H new ATOM 0 HA LEU A 9 -10.306 -2.219 -2.440 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -13.046 -3.388 -1.999 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -12.046 -3.020 -0.608 1.00 0.00 H new ATOM 0 HG LEU A 9 -12.767 -1.000 -2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -14.363 -0.097 -1.109 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -14.779 -1.761 -1.586 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -13.998 -1.453 -0.016 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -12.009 0.642 -1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -11.556 -0.686 0.011 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.708 -0.483 -1.541 1.00 0.00 H new ATOM 156 N SER A 10 -9.089 -4.020 -1.279 1.00 0.00 N ATOM 157 CA SER A 10 -8.300 -5.072 -0.652 1.00 0.00 C ATOM 158 C SER A 10 -7.899 -4.667 0.763 1.00 0.00 C ATOM 159 O SER A 10 -7.563 -3.510 1.014 1.00 0.00 O ATOM 160 CB SER A 10 -7.052 -5.369 -1.484 1.00 0.00 C ATOM 161 OG SER A 10 -7.342 -5.337 -2.870 1.00 0.00 O ATOM 0 H SER A 10 -8.666 -3.093 -1.235 1.00 0.00 H new ATOM 0 HA SER A 10 -8.911 -5.973 -0.599 1.00 0.00 H new ATOM 0 HB2 SER A 10 -6.276 -4.638 -1.255 1.00 0.00 H new ATOM 0 HB3 SER A 10 -6.657 -6.348 -1.215 1.00 0.00 H new ATOM 0 HG SER A 10 -6.527 -5.528 -3.379 1.00 0.00 H new ATOM 167 N VAL A 11 -7.936 -5.624 1.683 1.00 0.00 N ATOM 168 CA VAL A 11 -7.580 -5.361 3.070 1.00 0.00 C ATOM 169 C VAL A 11 -6.067 -5.375 3.254 1.00 0.00 C ATOM 170 O VAL A 11 -5.371 -6.224 2.697 1.00 0.00 O ATOM 171 CB VAL A 11 -8.213 -6.395 4.019 1.00 0.00 C ATOM 172 CG1 VAL A 11 -7.986 -5.999 5.469 1.00 0.00 C ATOM 173 CG2 VAL A 11 -9.699 -6.546 3.726 1.00 0.00 C ATOM 0 H VAL A 11 -8.209 -6.588 1.493 1.00 0.00 H new ATOM 0 HA VAL A 11 -7.967 -4.372 3.317 1.00 0.00 H new ATOM 0 HB VAL A 11 -7.732 -7.359 3.851 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -8.441 -6.742 6.124 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -6.916 -5.946 5.668 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.439 -5.025 5.655 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.131 -7.281 4.406 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -10.197 -5.586 3.865 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.835 -6.880 2.697 1.00 0.00 H new ATOM 183 N ILE A 12 -5.568 -4.422 4.030 1.00 0.00 N ATOM 184 CA ILE A 12 -4.138 -4.310 4.283 1.00 0.00 C ATOM 185 C ILE A 12 -3.816 -4.586 5.747 1.00 0.00 C ATOM 186 O ILE A 12 -4.125 -3.781 6.627 1.00 0.00 O ATOM 187 CB ILE A 12 -3.617 -2.910 3.899 1.00 0.00 C ATOM 188 CG1 ILE A 12 -3.929 -2.619 2.430 1.00 0.00 C ATOM 189 CG2 ILE A 12 -2.119 -2.800 4.156 1.00 0.00 C ATOM 190 CD1 ILE A 12 -3.898 -1.147 2.085 1.00 0.00 C ATOM 0 H ILE A 12 -6.134 -3.713 4.496 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.640 -5.057 3.665 1.00 0.00 H new ATOM 0 HB ILE A 12 -4.122 -2.171 4.521 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.210 -3.146 1.803 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -4.914 -3.019 2.190 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -1.774 -1.804 3.878 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.918 -2.971 5.213 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -1.592 -3.546 3.561 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -4.128 -1.016 1.028 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -4.637 -0.617 2.686 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.906 -0.745 2.293 1.00 0.00 H new ATOM 202 N ARG A 13 -3.188 -5.730 5.998 1.00 0.00 N ATOM 203 CA ARG A 13 -2.816 -6.118 7.352 1.00 0.00 C ATOM 204 C ARG A 13 -1.301 -6.214 7.494 1.00 0.00 C ATOM 205 O ARG A 13 -0.589 -6.463 6.520 1.00 0.00 O ATOM 206 CB ARG A 13 -3.462 -7.457 7.717 1.00 0.00 C ATOM 207 CG ARG A 13 -4.958 -7.360 7.975 1.00 0.00 C ATOM 208 CD ARG A 13 -5.365 -8.151 9.208 1.00 0.00 C ATOM 209 NE ARG A 13 -6.375 -7.451 10.001 1.00 0.00 N ATOM 210 CZ ARG A 13 -7.673 -7.444 9.708 1.00 0.00 C ATOM 211 NH1 ARG A 13 -8.124 -8.092 8.641 1.00 0.00 N ATOM 212 NH2 ARG A 13 -8.523 -6.787 10.484 1.00 0.00 N ATOM 0 H ARG A 13 -2.926 -6.405 5.280 1.00 0.00 H new ATOM 0 HA ARG A 13 -3.178 -5.350 8.036 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.286 -8.168 6.910 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -2.973 -7.857 8.606 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -5.239 -6.315 8.103 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.503 -7.732 7.107 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -5.753 -9.123 8.903 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -4.486 -8.338 9.825 1.00 0.00 H new ATOM 0 HE ARG A 13 -6.066 -6.938 10.827 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -7.474 -8.599 8.040 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -9.120 -8.083 8.422 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -8.182 -6.287 11.305 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -9.518 -6.781 10.260 1.00 0.00 H new ATOM 226 N ASN A 14 -0.814 -6.011 8.714 1.00 0.00 N ATOM 227 CA ASN A 14 0.619 -6.069 8.987 1.00 0.00 C ATOM 228 C ASN A 14 0.966 -7.291 9.835 1.00 0.00 C ATOM 229 O ASN A 14 0.113 -8.139 10.098 1.00 0.00 O ATOM 230 CB ASN A 14 1.080 -4.789 9.693 1.00 0.00 C ATOM 231 CG ASN A 14 0.076 -4.292 10.715 1.00 0.00 C ATOM 232 OD1 ASN A 14 -1.066 -3.982 10.379 1.00 0.00 O ATOM 233 ND2 ASN A 14 0.501 -4.211 11.971 1.00 0.00 N ATOM 0 H ASN A 14 -1.390 -5.805 9.530 1.00 0.00 H new ATOM 0 HA ASN A 14 1.141 -6.155 8.034 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.034 -4.974 10.187 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.252 -4.010 8.950 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -0.129 -3.881 12.702 1.00 0.00 H new ATOM 0 HD22 ASN A 14 1.457 -4.479 12.204 1.00 0.00 H new ATOM 240 N LEU A 15 2.225 -7.374 10.253 1.00 0.00 N ATOM 241 CA LEU A 15 2.692 -8.493 11.066 1.00 0.00 C ATOM 242 C LEU A 15 1.883 -8.617 12.354 1.00 0.00 C ATOM 243 O LEU A 15 1.794 -9.696 12.939 1.00 0.00 O ATOM 244 CB LEU A 15 4.179 -8.329 11.402 1.00 0.00 C ATOM 245 CG LEU A 15 5.139 -8.396 10.209 1.00 0.00 C ATOM 246 CD1 LEU A 15 4.758 -9.535 9.277 1.00 0.00 C ATOM 247 CD2 LEU A 15 5.161 -7.072 9.461 1.00 0.00 C ATOM 0 H LEU A 15 2.941 -6.679 10.042 1.00 0.00 H new ATOM 0 HA LEU A 15 2.554 -9.404 10.484 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.316 -7.371 11.903 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.460 -9.104 12.115 1.00 0.00 H new ATOM 0 HG LEU A 15 6.142 -8.588 10.589 1.00 0.00 H new ATOM 0 HD11 LEU A 15 5.452 -9.565 8.437 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.803 -10.479 9.819 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.745 -9.378 8.906 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.849 -7.142 8.618 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.160 -6.844 9.095 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.490 -6.280 10.133 1.00 0.00 H new ATOM 259 N ASN A 16 1.297 -7.508 12.796 1.00 0.00 N ATOM 260 CA ASN A 16 0.500 -7.502 14.018 1.00 0.00 C ATOM 261 C ASN A 16 -0.964 -7.839 13.731 1.00 0.00 C ATOM 262 O ASN A 16 -1.824 -7.685 14.600 1.00 0.00 O ATOM 263 CB ASN A 16 0.597 -6.139 14.706 1.00 0.00 C ATOM 264 CG ASN A 16 1.686 -6.100 15.760 1.00 0.00 C ATOM 265 OD1 ASN A 16 2.825 -5.729 15.480 1.00 0.00 O ATOM 266 ND2 ASN A 16 1.339 -6.487 16.982 1.00 0.00 N ATOM 0 H ASN A 16 1.359 -6.604 12.327 1.00 0.00 H new ATOM 0 HA ASN A 16 0.900 -8.269 14.681 1.00 0.00 H new ATOM 0 HB2 ASN A 16 0.791 -5.370 13.958 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -0.361 -5.899 15.168 1.00 0.00 H new ATOM 0 HD21 ASN A 16 2.029 -6.484 17.733 1.00 0.00 H new ATOM 0 HD22 ASN A 16 0.382 -6.787 17.170 1.00 0.00 H new ATOM 273 N ASP A 17 -1.243 -8.303 12.515 1.00 0.00 N ATOM 274 CA ASP A 17 -2.602 -8.664 12.126 1.00 0.00 C ATOM 275 C ASP A 17 -3.549 -7.474 12.251 1.00 0.00 C ATOM 276 O ASP A 17 -4.755 -7.647 12.426 1.00 0.00 O ATOM 277 CB ASP A 17 -3.108 -9.825 12.985 1.00 0.00 C ATOM 278 CG ASP A 17 -4.230 -10.593 12.314 1.00 0.00 C ATOM 279 OD1 ASP A 17 -4.035 -11.044 11.165 1.00 0.00 O ATOM 280 OD2 ASP A 17 -5.302 -10.744 12.936 1.00 0.00 O ATOM 0 H ASP A 17 -0.545 -8.437 11.783 1.00 0.00 H new ATOM 0 HA ASP A 17 -2.579 -8.973 11.081 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -2.282 -10.504 13.196 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -3.457 -9.440 13.943 1.00 0.00 H new ATOM 285 N GLN A 18 -2.999 -6.268 12.154 1.00 0.00 N ATOM 286 CA GLN A 18 -3.803 -5.055 12.251 1.00 0.00 C ATOM 287 C GLN A 18 -4.304 -4.635 10.873 1.00 0.00 C ATOM 288 O GLN A 18 -4.277 -5.423 9.929 1.00 0.00 O ATOM 289 CB GLN A 18 -2.990 -3.923 12.884 1.00 0.00 C ATOM 290 CG GLN A 18 -2.146 -4.370 14.066 1.00 0.00 C ATOM 291 CD GLN A 18 -1.383 -3.225 14.703 1.00 0.00 C ATOM 292 OE1 GLN A 18 -0.845 -2.361 14.010 1.00 0.00 O ATOM 293 NE2 GLN A 18 -1.333 -3.212 16.030 1.00 0.00 N ATOM 0 H GLN A 18 -2.003 -6.105 12.009 1.00 0.00 H new ATOM 0 HA GLN A 18 -4.664 -5.264 12.886 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -2.338 -3.487 12.127 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -3.670 -3.136 13.210 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -2.790 -4.833 14.813 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -1.441 -5.133 13.736 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -1.793 -3.948 16.565 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -0.834 -2.466 16.514 1.00 0.00 H new ATOM 302 N VAL A 19 -4.761 -3.392 10.759 1.00 0.00 N ATOM 303 CA VAL A 19 -5.264 -2.880 9.491 1.00 0.00 C ATOM 304 C VAL A 19 -4.791 -1.451 9.248 1.00 0.00 C ATOM 305 O VAL A 19 -4.864 -0.602 10.137 1.00 0.00 O ATOM 306 CB VAL A 19 -6.804 -2.919 9.438 1.00 0.00 C ATOM 307 CG1 VAL A 19 -7.304 -2.481 8.068 1.00 0.00 C ATOM 308 CG2 VAL A 19 -7.313 -4.311 9.777 1.00 0.00 C ATOM 0 H VAL A 19 -4.793 -2.723 11.528 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.867 -3.528 8.709 1.00 0.00 H new ATOM 0 HB VAL A 19 -7.192 -2.222 10.181 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -8.393 -2.515 8.050 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -6.970 -1.463 7.867 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -6.908 -3.151 7.305 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.402 -4.320 9.735 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -6.916 -5.028 9.059 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -6.986 -4.583 10.781 1.00 0.00 H new ATOM 318 N LEU A 20 -4.309 -1.193 8.037 1.00 0.00 N ATOM 319 CA LEU A 20 -3.826 0.136 7.677 1.00 0.00 C ATOM 320 C LEU A 20 -4.934 1.173 7.824 1.00 0.00 C ATOM 321 O LEU A 20 -6.114 0.863 7.656 1.00 0.00 O ATOM 322 CB LEU A 20 -3.296 0.139 6.242 1.00 0.00 C ATOM 323 CG LEU A 20 -2.498 1.383 5.851 1.00 0.00 C ATOM 324 CD1 LEU A 20 -1.345 1.602 6.818 1.00 0.00 C ATOM 325 CD2 LEU A 20 -1.985 1.258 4.425 1.00 0.00 C ATOM 0 H LEU A 20 -4.242 -1.884 7.290 1.00 0.00 H new ATOM 0 HA LEU A 20 -3.014 0.397 8.356 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -2.664 -0.738 6.102 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -4.139 0.037 5.559 1.00 0.00 H new ATOM 0 HG LEU A 20 -3.158 2.249 5.904 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.788 2.492 6.524 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -1.736 1.735 7.827 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.683 0.736 6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.419 2.152 4.162 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -1.339 0.383 4.346 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.828 1.149 3.743 1.00 0.00 H new ATOM 337 N PHE A 21 -4.550 2.407 8.139 1.00 0.00 N ATOM 338 CA PHE A 21 -5.516 3.485 8.309 1.00 0.00 C ATOM 339 C PHE A 21 -4.880 4.842 8.021 1.00 0.00 C ATOM 340 O PHE A 21 -3.656 4.969 7.966 1.00 0.00 O ATOM 341 CB PHE A 21 -6.090 3.466 9.727 1.00 0.00 C ATOM 342 CG PHE A 21 -7.590 3.518 9.768 1.00 0.00 C ATOM 343 CD1 PHE A 21 -8.346 2.466 9.275 1.00 0.00 C ATOM 344 CD2 PHE A 21 -8.244 4.618 10.298 1.00 0.00 C ATOM 345 CE1 PHE A 21 -9.726 2.510 9.310 1.00 0.00 C ATOM 346 CE2 PHE A 21 -9.625 4.668 10.336 1.00 0.00 C ATOM 347 CZ PHE A 21 -10.367 3.613 9.841 1.00 0.00 C ATOM 0 H PHE A 21 -3.579 2.684 8.281 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.325 3.328 7.595 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -5.752 2.563 10.235 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.690 4.313 10.284 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -7.850 1.602 8.859 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.669 5.446 10.686 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -10.303 1.683 8.923 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.123 5.531 10.752 1.00 0.00 H new ATOM 0 HZ PHE A 21 -11.446 3.650 9.869 1.00 0.00 H new ATOM 357 N ILE A 22 -5.723 5.854 7.841 1.00 0.00 N ATOM 358 CA ILE A 22 -5.255 7.202 7.561 1.00 0.00 C ATOM 359 C ILE A 22 -5.266 8.053 8.830 1.00 0.00 C ATOM 360 O ILE A 22 -6.098 7.855 9.716 1.00 0.00 O ATOM 361 CB ILE A 22 -6.128 7.871 6.474 1.00 0.00 C ATOM 362 CG1 ILE A 22 -5.743 7.346 5.090 1.00 0.00 C ATOM 363 CG2 ILE A 22 -6.004 9.386 6.522 1.00 0.00 C ATOM 364 CD1 ILE A 22 -4.350 7.749 4.655 1.00 0.00 C ATOM 0 H ILE A 22 -6.738 5.763 7.885 1.00 0.00 H new ATOM 0 HA ILE A 22 -4.231 7.130 7.194 1.00 0.00 H new ATOM 0 HB ILE A 22 -7.169 7.616 6.672 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.814 6.258 5.091 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -6.463 7.712 4.358 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.629 9.827 5.746 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -6.328 9.747 7.498 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -4.965 9.671 6.357 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -4.146 7.342 3.665 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -4.280 8.836 4.622 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.620 7.360 5.365 1.00 0.00 H new ATOM 376 N ASP A 23 -4.335 8.999 8.908 1.00 0.00 N ATOM 377 CA ASP A 23 -4.236 9.880 10.065 1.00 0.00 C ATOM 378 C ASP A 23 -4.627 11.307 9.695 1.00 0.00 C ATOM 379 O ASP A 23 -4.815 11.625 8.520 1.00 0.00 O ATOM 380 CB ASP A 23 -2.814 9.857 10.628 1.00 0.00 C ATOM 381 CG ASP A 23 -2.779 10.119 12.121 1.00 0.00 C ATOM 382 OD1 ASP A 23 -3.682 9.628 12.832 1.00 0.00 O ATOM 383 OD2 ASP A 23 -1.849 10.815 12.580 1.00 0.00 O ATOM 0 H ASP A 23 -3.639 9.175 8.183 1.00 0.00 H new ATOM 0 HA ASP A 23 -4.927 9.519 10.827 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.360 8.888 10.421 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -2.211 10.607 10.116 1.00 0.00 H new ATOM 388 N GLN A 24 -4.745 12.165 10.705 1.00 0.00 N ATOM 389 CA GLN A 24 -5.111 13.561 10.487 1.00 0.00 C ATOM 390 C GLN A 24 -4.227 14.204 9.424 1.00 0.00 C ATOM 391 O GLN A 24 -4.629 15.161 8.761 1.00 0.00 O ATOM 392 CB GLN A 24 -5.011 14.348 11.796 1.00 0.00 C ATOM 393 CG GLN A 24 -5.974 13.869 12.870 1.00 0.00 C ATOM 394 CD GLN A 24 -7.022 14.906 13.221 1.00 0.00 C ATOM 395 OE1 GLN A 24 -7.516 15.625 12.351 1.00 0.00 O ATOM 396 NE2 GLN A 24 -7.368 14.990 14.500 1.00 0.00 N ATOM 0 H GLN A 24 -4.592 11.918 11.683 1.00 0.00 H new ATOM 0 HA GLN A 24 -6.142 13.585 10.133 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -3.992 14.277 12.176 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -5.202 15.402 11.592 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -6.469 12.960 12.529 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -5.412 13.609 13.767 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -6.933 14.375 15.187 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -8.069 15.670 14.795 1.00 0.00 H new ATOM 405 N GLY A 25 -3.024 13.668 9.266 1.00 0.00 N ATOM 406 CA GLY A 25 -2.100 14.195 8.282 1.00 0.00 C ATOM 407 C GLY A 25 -1.877 13.239 7.128 1.00 0.00 C ATOM 408 O GLY A 25 -0.762 13.116 6.623 1.00 0.00 O ATOM 0 H GLY A 25 -2.671 12.876 9.803 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -2.483 15.141 7.898 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -1.145 14.409 8.762 1.00 0.00 H new ATOM 412 N ASN A 26 -2.946 12.563 6.710 1.00 0.00 N ATOM 413 CA ASN A 26 -2.880 11.611 5.603 1.00 0.00 C ATOM 414 C ASN A 26 -1.659 10.701 5.720 1.00 0.00 C ATOM 415 O ASN A 26 -1.050 10.330 4.716 1.00 0.00 O ATOM 416 CB ASN A 26 -2.860 12.354 4.265 1.00 0.00 C ATOM 417 CG ASN A 26 -1.666 13.280 4.125 1.00 0.00 C ATOM 418 OD1 ASN A 26 -1.796 14.498 4.237 1.00 0.00 O ATOM 419 ND2 ASN A 26 -0.494 12.706 3.878 1.00 0.00 N ATOM 0 H ASN A 26 -3.873 12.658 7.124 1.00 0.00 H new ATOM 0 HA ASN A 26 -3.770 10.984 5.650 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -2.849 11.628 3.452 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -3.778 12.933 4.162 1.00 0.00 H new ATOM 0 HD21 ASN A 26 0.343 13.280 3.774 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -0.431 11.692 3.793 1.00 0.00 H new ATOM 426 N ARG A 27 -1.307 10.344 6.951 1.00 0.00 N ATOM 427 CA ARG A 27 -0.163 9.475 7.197 1.00 0.00 C ATOM 428 C ARG A 27 -0.603 8.014 7.305 1.00 0.00 C ATOM 429 O ARG A 27 -1.521 7.693 8.060 1.00 0.00 O ATOM 430 CB ARG A 27 0.558 9.897 8.479 1.00 0.00 C ATOM 431 CG ARG A 27 1.266 11.238 8.368 1.00 0.00 C ATOM 432 CD ARG A 27 1.269 11.976 9.696 1.00 0.00 C ATOM 433 NE ARG A 27 2.091 13.184 9.649 1.00 0.00 N ATOM 434 CZ ARG A 27 2.550 13.812 10.729 1.00 0.00 C ATOM 435 NH1 ARG A 27 2.269 13.351 11.942 1.00 0.00 N ATOM 436 NH2 ARG A 27 3.292 14.902 10.597 1.00 0.00 N ATOM 0 H ARG A 27 -1.798 10.643 7.793 1.00 0.00 H new ATOM 0 HA ARG A 27 0.522 9.570 6.354 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -0.165 9.944 9.293 1.00 0.00 H new ATOM 0 HB3 ARG A 27 1.287 9.132 8.744 1.00 0.00 H new ATOM 0 HG2 ARG A 27 2.292 11.083 8.034 1.00 0.00 H new ATOM 0 HG3 ARG A 27 0.774 11.849 7.612 1.00 0.00 H new ATOM 0 HD2 ARG A 27 0.247 12.243 9.965 1.00 0.00 H new ATOM 0 HD3 ARG A 27 1.642 11.314 10.478 1.00 0.00 H new ATOM 0 HE ARG A 27 2.327 13.568 8.734 1.00 0.00 H new ATOM 0 HH11 ARG A 27 1.699 12.512 12.049 1.00 0.00 H new ATOM 0 HH12 ARG A 27 2.623 13.836 12.767 1.00 0.00 H new ATOM 0 HH21 ARG A 27 3.512 15.260 9.667 1.00 0.00 H new ATOM 0 HH22 ARG A 27 3.644 15.383 11.425 1.00 0.00 H new ATOM 450 N PRO A 28 0.047 7.107 6.554 1.00 0.00 N ATOM 451 CA PRO A 28 -0.289 5.680 6.580 1.00 0.00 C ATOM 452 C PRO A 28 0.145 5.009 7.879 1.00 0.00 C ATOM 453 O PRO A 28 1.326 4.719 8.073 1.00 0.00 O ATOM 454 CB PRO A 28 0.493 5.109 5.396 1.00 0.00 C ATOM 455 CG PRO A 28 1.652 6.030 5.232 1.00 0.00 C ATOM 456 CD PRO A 28 1.158 7.396 5.626 1.00 0.00 C ATOM 0 HA PRO A 28 -1.364 5.512 6.517 1.00 0.00 H new ATOM 0 HB2 PRO A 28 0.822 4.089 5.593 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -0.119 5.078 4.495 1.00 0.00 H new ATOM 0 HG2 PRO A 28 2.487 5.721 5.861 1.00 0.00 H new ATOM 0 HG3 PRO A 28 2.010 6.027 4.202 1.00 0.00 H new ATOM 0 HD2 PRO A 28 1.941 7.982 6.107 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.820 7.966 4.760 1.00 0.00 H new ATOM 464 N LEU A 29 -0.815 4.766 8.765 1.00 0.00 N ATOM 465 CA LEU A 29 -0.525 4.130 10.046 1.00 0.00 C ATOM 466 C LEU A 29 -1.261 2.800 10.174 1.00 0.00 C ATOM 467 O LEU A 29 -2.423 2.682 9.782 1.00 0.00 O ATOM 468 CB LEU A 29 -0.918 5.055 11.202 1.00 0.00 C ATOM 469 CG LEU A 29 -0.709 6.548 10.941 1.00 0.00 C ATOM 470 CD1 LEU A 29 -1.067 7.361 12.176 1.00 0.00 C ATOM 471 CD2 LEU A 29 0.727 6.823 10.518 1.00 0.00 C ATOM 0 H LEU A 29 -1.798 4.999 8.621 1.00 0.00 H new ATOM 0 HA LEU A 29 0.547 3.938 10.091 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.969 4.887 11.439 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -0.343 4.773 12.084 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.369 6.849 10.127 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -0.912 8.420 11.972 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.112 7.190 12.434 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.433 7.056 13.009 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.855 7.890 10.337 1.00 0.00 H new ATOM 0 HD22 LEU A 29 1.406 6.505 11.309 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.949 6.271 9.605 1.00 0.00 H new ATOM 483 N PHE A 30 -0.580 1.801 10.727 1.00 0.00 N ATOM 484 CA PHE A 30 -1.172 0.480 10.909 1.00 0.00 C ATOM 485 C PHE A 30 -1.761 0.339 12.308 1.00 0.00 C ATOM 486 O PHE A 30 -1.049 0.445 13.306 1.00 0.00 O ATOM 487 CB PHE A 30 -0.125 -0.610 10.672 1.00 0.00 C ATOM 488 CG PHE A 30 0.096 -0.926 9.220 1.00 0.00 C ATOM 489 CD1 PHE A 30 -0.883 -1.571 8.482 1.00 0.00 C ATOM 490 CD2 PHE A 30 1.282 -0.576 8.595 1.00 0.00 C ATOM 491 CE1 PHE A 30 -0.682 -1.863 7.146 1.00 0.00 C ATOM 492 CE2 PHE A 30 1.488 -0.866 7.258 1.00 0.00 C ATOM 493 CZ PHE A 30 0.504 -1.510 6.534 1.00 0.00 C ATOM 0 H PHE A 30 0.382 1.881 11.057 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.975 0.365 10.181 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.820 -0.297 11.115 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.434 -1.518 11.190 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.813 -1.849 8.956 1.00 0.00 H new ATOM 0 HD2 PHE A 30 2.054 -0.072 9.157 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.452 -2.367 6.581 1.00 0.00 H new ATOM 0 HE2 PHE A 30 2.417 -0.589 6.781 1.00 0.00 H new ATOM 0 HZ PHE A 30 0.662 -1.737 5.490 1.00 0.00 H new ATOM 503 N GLU A 31 -3.066 0.099 12.373 1.00 0.00 N ATOM 504 CA GLU A 31 -3.750 -0.056 13.652 1.00 0.00 C ATOM 505 C GLU A 31 -4.922 -1.025 13.530 1.00 0.00 C ATOM 506 O GLU A 31 -5.501 -1.182 12.455 1.00 0.00 O ATOM 507 CB GLU A 31 -4.245 1.300 14.157 1.00 0.00 C ATOM 508 CG GLU A 31 -3.230 2.038 15.015 1.00 0.00 C ATOM 509 CD GLU A 31 -3.214 3.529 14.743 1.00 0.00 C ATOM 510 OE1 GLU A 31 -2.739 3.931 13.660 1.00 0.00 O ATOM 511 OE2 GLU A 31 -3.675 4.296 15.615 1.00 0.00 O ATOM 0 H GLU A 31 -3.671 0.008 11.557 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.038 -0.465 14.368 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -4.507 1.923 13.302 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -5.157 1.152 14.735 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -3.456 1.866 16.067 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.237 1.628 14.831 1.00 0.00 H new ATOM 518 N ASP A 32 -5.269 -1.670 14.639 1.00 0.00 N ATOM 519 CA ASP A 32 -6.374 -2.620 14.654 1.00 0.00 C ATOM 520 C ASP A 32 -7.709 -1.898 14.803 1.00 0.00 C ATOM 521 O ASP A 32 -7.807 -0.893 15.508 1.00 0.00 O ATOM 522 CB ASP A 32 -6.194 -3.625 15.794 1.00 0.00 C ATOM 523 CG ASP A 32 -6.717 -5.003 15.438 1.00 0.00 C ATOM 524 OD1 ASP A 32 -6.127 -5.649 14.547 1.00 0.00 O ATOM 525 OD2 ASP A 32 -7.717 -5.435 16.049 1.00 0.00 O ATOM 0 H ASP A 32 -4.801 -1.552 15.538 1.00 0.00 H new ATOM 0 HA ASP A 32 -6.375 -3.155 13.704 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -5.137 -3.695 16.049 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.712 -3.261 16.681 1.00 0.00 H new ATOM 719 N ILE A 46 -11.611 0.012 3.462 1.00 0.00 N ATOM 720 CA ILE A 46 -10.174 0.240 3.527 1.00 0.00 C ATOM 721 C ILE A 46 -9.718 1.083 2.328 1.00 0.00 C ATOM 722 O ILE A 46 -10.528 1.780 1.716 1.00 0.00 O ATOM 723 CB ILE A 46 -9.410 -1.109 3.575 1.00 0.00 C ATOM 724 CG1 ILE A 46 -8.047 -0.939 4.279 1.00 0.00 C ATOM 725 CG2 ILE A 46 -9.263 -1.699 2.175 1.00 0.00 C ATOM 726 CD1 ILE A 46 -6.878 -1.589 3.563 1.00 0.00 C ATOM 0 HA ILE A 46 -9.947 0.789 4.441 1.00 0.00 H new ATOM 0 HB ILE A 46 -9.992 -1.818 4.163 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.841 0.126 4.390 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -8.118 -1.356 5.283 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.724 -2.645 2.233 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.251 -1.870 1.747 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -8.709 -1.004 1.544 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.963 -1.418 4.130 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -7.055 -2.661 3.475 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -6.774 -1.156 2.568 1.00 0.00 H new ATOM 738 N PHE A 47 -8.432 1.021 1.992 1.00 0.00 N ATOM 739 CA PHE A 47 -7.902 1.780 0.866 1.00 0.00 C ATOM 740 C PHE A 47 -8.247 1.101 -0.454 1.00 0.00 C ATOM 741 O PHE A 47 -8.362 -0.122 -0.522 1.00 0.00 O ATOM 742 CB PHE A 47 -6.384 1.925 0.990 1.00 0.00 C ATOM 743 CG PHE A 47 -5.941 2.630 2.241 1.00 0.00 C ATOM 744 CD1 PHE A 47 -5.887 1.956 3.450 1.00 0.00 C ATOM 745 CD2 PHE A 47 -5.575 3.966 2.205 1.00 0.00 C ATOM 746 CE1 PHE A 47 -5.478 2.602 4.601 1.00 0.00 C ATOM 747 CE2 PHE A 47 -5.166 4.616 3.352 1.00 0.00 C ATOM 748 CZ PHE A 47 -5.116 3.934 4.552 1.00 0.00 C ATOM 0 H PHE A 47 -7.740 0.454 2.483 1.00 0.00 H new ATOM 0 HA PHE A 47 -8.359 2.770 0.880 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.931 0.934 0.963 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -6.009 2.471 0.124 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.168 0.914 3.493 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.610 4.504 1.269 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -5.441 2.066 5.538 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -4.885 5.658 3.311 1.00 0.00 H new ATOM 0 HZ PHE A 47 -4.795 4.441 5.450 1.00 0.00 H new ATOM 758 N ILE A 48 -8.409 1.901 -1.502 1.00 0.00 N ATOM 759 CA ILE A 48 -8.736 1.373 -2.820 1.00 0.00 C ATOM 760 C ILE A 48 -7.473 0.954 -3.566 1.00 0.00 C ATOM 761 O ILE A 48 -6.520 1.727 -3.676 1.00 0.00 O ATOM 762 CB ILE A 48 -9.509 2.405 -3.667 1.00 0.00 C ATOM 763 CG1 ILE A 48 -10.753 2.883 -2.915 1.00 0.00 C ATOM 764 CG2 ILE A 48 -9.896 1.811 -5.015 1.00 0.00 C ATOM 765 CD1 ILE A 48 -10.492 4.059 -1.998 1.00 0.00 C ATOM 0 H ILE A 48 -8.319 2.916 -1.464 1.00 0.00 H new ATOM 0 HA ILE A 48 -9.371 0.501 -2.666 1.00 0.00 H new ATOM 0 HB ILE A 48 -8.859 3.262 -3.845 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -11.520 3.160 -3.638 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -11.152 2.056 -2.327 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -10.440 2.554 -5.597 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -8.996 1.515 -5.554 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -10.529 0.937 -4.859 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.418 4.343 -1.498 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -9.748 3.780 -1.252 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -10.122 4.901 -2.583 1.00 0.00 H new ATOM 777 N ILE A 49 -7.472 -0.274 -4.070 1.00 0.00 N ATOM 778 CA ILE A 49 -6.327 -0.801 -4.803 1.00 0.00 C ATOM 779 C ILE A 49 -6.623 -0.888 -6.295 1.00 0.00 C ATOM 780 O ILE A 49 -7.493 -1.648 -6.722 1.00 0.00 O ATOM 781 CB ILE A 49 -5.926 -2.198 -4.289 1.00 0.00 C ATOM 782 CG1 ILE A 49 -5.879 -2.209 -2.759 1.00 0.00 C ATOM 783 CG2 ILE A 49 -4.581 -2.610 -4.868 1.00 0.00 C ATOM 784 CD1 ILE A 49 -4.937 -1.178 -2.175 1.00 0.00 C ATOM 0 H ILE A 49 -8.253 -0.925 -3.984 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.501 -0.110 -4.639 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.676 -2.918 -4.616 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -6.883 -2.033 -2.372 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -5.576 -3.200 -2.420 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.312 -3.598 -4.496 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.646 -2.637 -5.956 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -3.820 -1.890 -4.568 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -4.955 -1.243 -1.087 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -3.925 -1.366 -2.533 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -5.252 -0.181 -2.484 1.00 0.00 H new ATOM 796 N SER A 50 -5.897 -0.104 -7.085 1.00 0.00 N ATOM 797 CA SER A 50 -6.084 -0.093 -8.532 1.00 0.00 C ATOM 798 C SER A 50 -5.013 -0.927 -9.227 1.00 0.00 C ATOM 799 O SER A 50 -3.842 -0.548 -9.260 1.00 0.00 O ATOM 800 CB SER A 50 -6.055 1.343 -9.061 1.00 0.00 C ATOM 801 OG SER A 50 -6.236 2.278 -8.012 1.00 0.00 O ATOM 0 H SER A 50 -5.174 0.532 -6.748 1.00 0.00 H new ATOM 0 HA SER A 50 -7.057 -0.533 -8.750 1.00 0.00 H new ATOM 0 HB2 SER A 50 -5.104 1.531 -9.559 1.00 0.00 H new ATOM 0 HB3 SER A 50 -6.838 1.474 -9.808 1.00 0.00 H new ATOM 0 HG SER A 50 -5.362 2.590 -7.698 1.00 0.00 H new ATOM 807 N MET A 51 -5.422 -2.062 -9.782 1.00 0.00 N ATOM 808 CA MET A 51 -4.499 -2.951 -10.478 1.00 0.00 C ATOM 809 C MET A 51 -4.280 -2.487 -11.915 1.00 0.00 C ATOM 810 O MET A 51 -5.235 -2.305 -12.668 1.00 0.00 O ATOM 811 CB MET A 51 -5.033 -4.385 -10.467 1.00 0.00 C ATOM 812 CG MET A 51 -4.356 -5.279 -9.441 1.00 0.00 C ATOM 813 SD MET A 51 -5.516 -6.372 -8.597 1.00 0.00 S ATOM 814 CE MET A 51 -6.695 -5.184 -7.956 1.00 0.00 C ATOM 0 H MET A 51 -6.388 -2.389 -9.764 1.00 0.00 H new ATOM 0 HA MET A 51 -3.542 -2.924 -9.956 1.00 0.00 H new ATOM 0 HB2 MET A 51 -6.104 -4.363 -10.267 1.00 0.00 H new ATOM 0 HB3 MET A 51 -4.903 -4.820 -11.458 1.00 0.00 H new ATOM 0 HG2 MET A 51 -3.592 -5.879 -9.936 1.00 0.00 H new ATOM 0 HG3 MET A 51 -3.846 -4.658 -8.704 1.00 0.00 H new ATOM 0 HE1 MET A 51 -6.754 -5.279 -6.872 1.00 0.00 H new ATOM 0 HE2 MET A 51 -6.372 -4.175 -8.215 1.00 0.00 H new ATOM 0 HE3 MET A 51 -7.676 -5.374 -8.391 1.00 0.00 H new ATOM 824 N TYR A 52 -3.017 -2.300 -12.288 1.00 0.00 N ATOM 825 CA TYR A 52 -2.677 -1.859 -13.637 1.00 0.00 C ATOM 826 C TYR A 52 -2.270 -3.043 -14.509 1.00 0.00 C ATOM 827 O TYR A 52 -1.880 -4.095 -14.003 1.00 0.00 O ATOM 828 CB TYR A 52 -1.543 -0.834 -13.592 1.00 0.00 C ATOM 829 CG TYR A 52 -1.977 0.528 -13.101 1.00 0.00 C ATOM 830 CD1 TYR A 52 -2.293 0.738 -11.765 1.00 0.00 C ATOM 831 CD2 TYR A 52 -2.071 1.605 -13.974 1.00 0.00 C ATOM 832 CE1 TYR A 52 -2.691 1.982 -11.313 1.00 0.00 C ATOM 833 CE2 TYR A 52 -2.467 2.852 -13.529 1.00 0.00 C ATOM 834 CZ TYR A 52 -2.776 3.034 -12.198 1.00 0.00 C ATOM 835 OH TYR A 52 -3.171 4.275 -11.752 1.00 0.00 O ATOM 0 H TYR A 52 -2.214 -2.447 -11.677 1.00 0.00 H new ATOM 0 HA TYR A 52 -3.561 -1.394 -14.073 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -0.751 -1.209 -12.944 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -1.117 -0.732 -14.590 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -2.227 -0.084 -11.068 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -1.831 1.465 -15.018 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -2.934 2.128 -10.271 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -2.534 3.679 -14.220 1.00 0.00 H new ATOM 0 HH TYR A 52 -2.900 4.388 -10.817 1.00 0.00 H new ATOM 845 N LYS A 53 -2.364 -2.862 -15.822 1.00 0.00 N ATOM 846 CA LYS A 53 -2.006 -3.914 -16.766 1.00 0.00 C ATOM 847 C LYS A 53 -0.492 -3.986 -16.948 1.00 0.00 C ATOM 848 O LYS A 53 0.141 -3.016 -17.366 1.00 0.00 O ATOM 849 CB LYS A 53 -2.690 -3.673 -18.116 1.00 0.00 C ATOM 850 CG LYS A 53 -2.224 -4.608 -19.223 1.00 0.00 C ATOM 851 CD LYS A 53 -2.192 -6.057 -18.761 1.00 0.00 C ATOM 852 CE LYS A 53 -2.239 -7.019 -19.938 1.00 0.00 C ATOM 853 NZ LYS A 53 -2.949 -8.282 -19.595 1.00 0.00 N ATOM 0 H LYS A 53 -2.685 -1.997 -16.256 1.00 0.00 H new ATOM 0 HA LYS A 53 -2.349 -4.866 -16.362 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -3.767 -3.784 -17.991 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -2.509 -2.643 -18.424 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -2.889 -4.515 -20.082 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -1.230 -4.310 -19.556 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -1.287 -6.235 -18.180 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -3.037 -6.248 -18.100 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -2.738 -6.539 -20.780 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -1.223 -7.249 -20.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -2.959 -8.911 -20.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -2.458 -8.754 -18.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -3.926 -8.065 -19.313 1.00 0.00 H new ATOM 867 N ASP A 54 0.081 -5.143 -16.633 1.00 0.00 N ATOM 868 CA ASP A 54 1.520 -5.343 -16.763 1.00 0.00 C ATOM 869 C ASP A 54 1.848 -6.108 -18.041 1.00 0.00 C ATOM 870 O ASP A 54 1.027 -6.873 -18.547 1.00 0.00 O ATOM 871 CB ASP A 54 2.062 -6.100 -15.549 1.00 0.00 C ATOM 872 CG ASP A 54 1.434 -7.471 -15.395 1.00 0.00 C ATOM 873 OD1 ASP A 54 1.569 -8.293 -16.325 1.00 0.00 O ATOM 874 OD2 ASP A 54 0.810 -7.722 -14.343 1.00 0.00 O ATOM 0 H ASP A 54 -0.428 -5.956 -16.286 1.00 0.00 H new ATOM 0 HA ASP A 54 1.996 -4.364 -16.814 1.00 0.00 H new ATOM 0 HB2 ASP A 54 3.143 -6.207 -15.644 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.877 -5.516 -14.648 1.00 0.00 H new ATOM 945 N GLY A 59 5.579 -9.570 -10.639 1.00 0.00 N ATOM 946 CA GLY A 59 5.024 -8.707 -9.613 1.00 0.00 C ATOM 947 C GLY A 59 3.679 -8.128 -10.002 1.00 0.00 C ATOM 948 O GLY A 59 3.358 -8.027 -11.185 1.00 0.00 O ATOM 0 HA2 GLY A 59 4.918 -9.272 -8.687 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.721 -7.893 -9.412 1.00 0.00 H new ATOM 952 N MET A 60 2.889 -7.750 -9.001 1.00 0.00 N ATOM 953 CA MET A 60 1.569 -7.180 -9.245 1.00 0.00 C ATOM 954 C MET A 60 1.585 -5.664 -9.065 1.00 0.00 C ATOM 955 O MET A 60 1.793 -5.163 -7.959 1.00 0.00 O ATOM 956 CB MET A 60 0.538 -7.809 -8.303 1.00 0.00 C ATOM 957 CG MET A 60 -0.652 -8.420 -9.024 1.00 0.00 C ATOM 958 SD MET A 60 -1.359 -9.820 -8.136 1.00 0.00 S ATOM 959 CE MET A 60 -1.380 -9.185 -6.461 1.00 0.00 C ATOM 0 H MET A 60 3.140 -7.828 -8.015 1.00 0.00 H new ATOM 0 HA MET A 60 1.291 -7.399 -10.276 1.00 0.00 H new ATOM 0 HB2 MET A 60 1.026 -8.580 -7.707 1.00 0.00 H new ATOM 0 HB3 MET A 60 0.180 -7.048 -7.609 1.00 0.00 H new ATOM 0 HG2 MET A 60 -1.419 -7.658 -9.162 1.00 0.00 H new ATOM 0 HG3 MET A 60 -0.342 -8.744 -10.018 1.00 0.00 H new ATOM 0 HE1 MET A 60 -2.128 -9.722 -5.878 1.00 0.00 H new ATOM 0 HE2 MET A 60 -0.399 -9.323 -6.007 1.00 0.00 H new ATOM 0 HE3 MET A 60 -1.626 -8.123 -6.477 1.00 0.00 H new ATOM 969 N ALA A 61 1.363 -4.940 -10.156 1.00 0.00 N ATOM 970 CA ALA A 61 1.350 -3.481 -10.117 1.00 0.00 C ATOM 971 C ALA A 61 0.016 -2.963 -9.593 1.00 0.00 C ATOM 972 O ALA A 61 -1.019 -3.117 -10.242 1.00 0.00 O ATOM 973 CB ALA A 61 1.632 -2.914 -11.500 1.00 0.00 C ATOM 0 H ALA A 61 1.189 -5.339 -11.079 1.00 0.00 H new ATOM 0 HA ALA A 61 2.134 -3.151 -9.435 1.00 0.00 H new ATOM 0 HB1 ALA A 61 1.619 -1.825 -11.456 1.00 0.00 H new ATOM 0 HB2 ALA A 61 2.611 -3.252 -11.839 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.868 -3.258 -12.197 1.00 0.00 H new ATOM 979 N VAL A 62 0.044 -2.354 -8.411 1.00 0.00 N ATOM 980 CA VAL A 62 -1.167 -1.821 -7.800 1.00 0.00 C ATOM 981 C VAL A 62 -0.956 -0.402 -7.282 1.00 0.00 C ATOM 982 O VAL A 62 0.170 0.097 -7.243 1.00 0.00 O ATOM 983 CB VAL A 62 -1.644 -2.710 -6.636 1.00 0.00 C ATOM 984 CG1 VAL A 62 -2.024 -4.095 -7.140 1.00 0.00 C ATOM 985 CG2 VAL A 62 -0.572 -2.802 -5.560 1.00 0.00 C ATOM 0 H VAL A 62 0.891 -2.218 -7.859 1.00 0.00 H new ATOM 0 HA VAL A 62 -1.928 -1.807 -8.580 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.531 -2.254 -6.196 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -2.358 -4.708 -6.303 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.829 -4.008 -7.870 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -1.158 -4.562 -7.608 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.927 -3.434 -4.746 1.00 0.00 H new ATOM 0 HG22 VAL A 62 0.334 -3.233 -5.985 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -0.354 -1.805 -5.177 1.00 0.00 H new ATOM 995 N THR A 63 -2.049 0.241 -6.885 1.00 0.00 N ATOM 996 CA THR A 63 -1.997 1.602 -6.363 1.00 0.00 C ATOM 997 C THR A 63 -2.985 1.776 -5.213 1.00 0.00 C ATOM 998 O THR A 63 -4.194 1.627 -5.395 1.00 0.00 O ATOM 999 CB THR A 63 -2.306 2.610 -7.471 1.00 0.00 C ATOM 1000 OG1 THR A 63 -3.514 2.275 -8.129 1.00 0.00 O ATOM 1001 CG2 THR A 63 -1.219 2.699 -8.521 1.00 0.00 C ATOM 0 H THR A 63 -2.986 -0.161 -6.915 1.00 0.00 H new ATOM 0 HA THR A 63 -0.990 1.784 -5.989 1.00 0.00 H new ATOM 0 HB THR A 63 -2.383 3.575 -6.971 1.00 0.00 H new ATOM 0 HG1 THR A 63 -3.437 1.379 -8.519 1.00 0.00 H new ATOM 0 HG21 THR A 63 -1.502 3.432 -9.277 1.00 0.00 H new ATOM 0 HG22 THR A 63 -0.284 3.004 -8.052 1.00 0.00 H new ATOM 0 HG23 THR A 63 -1.087 1.725 -8.992 1.00 0.00 H new ATOM 1009 N ILE A 64 -2.464 2.088 -4.031 1.00 0.00 N ATOM 1010 CA ILE A 64 -3.302 2.280 -2.852 1.00 0.00 C ATOM 1011 C ILE A 64 -3.717 3.740 -2.704 1.00 0.00 C ATOM 1012 O ILE A 64 -2.873 4.635 -2.671 1.00 0.00 O ATOM 1013 CB ILE A 64 -2.578 1.830 -1.567 1.00 0.00 C ATOM 1014 CG1 ILE A 64 -2.010 0.420 -1.738 1.00 0.00 C ATOM 1015 CG2 ILE A 64 -3.527 1.883 -0.378 1.00 0.00 C ATOM 1016 CD1 ILE A 64 -0.726 0.188 -0.972 1.00 0.00 C ATOM 0 H ILE A 64 -1.466 2.213 -3.864 1.00 0.00 H new ATOM 0 HA ILE A 64 -4.191 1.665 -2.993 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.750 2.513 -1.379 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -2.755 -0.305 -1.410 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -1.830 0.236 -2.797 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.001 1.563 0.522 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -3.886 2.903 -0.244 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -4.374 1.221 -0.559 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -0.381 -0.832 -1.140 1.00 0.00 H new ATOM 0 HD12 ILE A 64 0.035 0.889 -1.316 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -0.905 0.340 0.092 1.00 0.00 H new ATOM 1028 N SER A 65 -5.023 3.974 -2.616 1.00 0.00 N ATOM 1029 CA SER A 65 -5.548 5.327 -2.471 1.00 0.00 C ATOM 1030 C SER A 65 -6.798 5.338 -1.598 1.00 0.00 C ATOM 1031 O SER A 65 -7.698 4.517 -1.774 1.00 0.00 O ATOM 1032 CB SER A 65 -5.866 5.922 -3.843 1.00 0.00 C ATOM 1033 OG SER A 65 -6.220 4.911 -4.770 1.00 0.00 O ATOM 0 H SER A 65 -5.736 3.245 -2.643 1.00 0.00 H new ATOM 0 HA SER A 65 -4.784 5.935 -1.986 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.683 6.638 -3.752 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.001 6.472 -4.213 1.00 0.00 H new ATOM 0 HG SER A 65 -6.716 5.310 -5.515 1.00 0.00 H new ATOM 1039 N VAL A 66 -6.849 6.275 -0.655 1.00 0.00 N ATOM 1040 CA VAL A 66 -7.991 6.394 0.245 1.00 0.00 C ATOM 1041 C VAL A 66 -9.011 7.391 -0.291 1.00 0.00 C ATOM 1042 O VAL A 66 -8.648 8.400 -0.898 1.00 0.00 O ATOM 1043 CB VAL A 66 -7.553 6.825 1.659 1.00 0.00 C ATOM 1044 CG1 VAL A 66 -6.947 8.222 1.638 1.00 0.00 C ATOM 1045 CG2 VAL A 66 -8.728 6.762 2.624 1.00 0.00 C ATOM 0 H VAL A 66 -6.113 6.962 -0.495 1.00 0.00 H new ATOM 0 HA VAL A 66 -8.451 5.408 0.305 1.00 0.00 H new ATOM 0 HB VAL A 66 -6.787 6.131 2.004 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.646 8.503 2.647 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -6.075 8.231 0.984 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.685 8.933 1.268 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -8.400 7.070 3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.518 7.430 2.280 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -9.109 5.742 2.668 1.00 0.00 H new ATOM 1055 N LYS A 67 -10.291 7.104 -0.069 1.00 0.00 N ATOM 1056 CA LYS A 67 -11.361 7.980 -0.534 1.00 0.00 C ATOM 1057 C LYS A 67 -12.429 8.164 0.538 1.00 0.00 C ATOM 1058 O LYS A 67 -12.836 7.207 1.197 1.00 0.00 O ATOM 1059 CB LYS A 67 -11.991 7.418 -1.808 1.00 0.00 C ATOM 1060 CG LYS A 67 -11.114 7.579 -3.037 1.00 0.00 C ATOM 1061 CD LYS A 67 -11.624 6.746 -4.200 1.00 0.00 C ATOM 1062 CE LYS A 67 -12.970 7.246 -4.697 1.00 0.00 C ATOM 1063 NZ LYS A 67 -13.834 6.133 -5.180 1.00 0.00 N ATOM 0 H LYS A 67 -10.611 6.273 0.429 1.00 0.00 H new ATOM 0 HA LYS A 67 -10.924 8.955 -0.751 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -12.207 6.360 -1.661 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -12.944 7.917 -1.983 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -11.082 8.629 -3.327 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -10.093 7.284 -2.797 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.901 6.776 -5.015 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -11.713 5.705 -3.891 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -13.479 7.777 -3.893 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -12.815 7.962 -5.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -14.742 6.517 -5.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -13.360 5.641 -5.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -14.003 5.463 -4.403 1.00 0.00 H new ATOM 1077 N CYS A 68 -12.877 9.404 0.699 1.00 0.00 N ATOM 1078 CA CYS A 68 -13.903 9.739 1.685 1.00 0.00 C ATOM 1079 C CYS A 68 -14.154 11.244 1.694 1.00 0.00 C ATOM 1080 O CYS A 68 -15.113 11.727 1.094 1.00 0.00 O ATOM 1081 CB CYS A 68 -13.485 9.259 3.082 1.00 0.00 C ATOM 1082 SG CYS A 68 -14.624 9.738 4.403 1.00 0.00 S ATOM 0 H CYS A 68 -12.544 10.201 0.156 1.00 0.00 H new ATOM 0 HA CYS A 68 -14.827 9.231 1.409 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -13.397 8.173 3.069 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -12.496 9.656 3.309 1.00 0.00 H new ATOM 0 HG CYS A 68 -14.185 9.285 5.540 1.00 0.00 H new ATOM 1088 N GLU A 69 -13.273 11.982 2.362 1.00 0.00 N ATOM 1089 CA GLU A 69 -13.385 13.433 2.432 1.00 0.00 C ATOM 1090 C GLU A 69 -12.542 14.075 1.335 1.00 0.00 C ATOM 1091 O GLU A 69 -12.851 15.164 0.850 1.00 0.00 O ATOM 1092 CB GLU A 69 -12.936 13.937 3.805 1.00 0.00 C ATOM 1093 CG GLU A 69 -13.099 15.438 3.986 1.00 0.00 C ATOM 1094 CD GLU A 69 -13.684 15.802 5.336 1.00 0.00 C ATOM 1095 OE1 GLU A 69 -13.043 15.496 6.363 1.00 0.00 O ATOM 1096 OE2 GLU A 69 -14.783 16.395 5.367 1.00 0.00 O ATOM 0 H GLU A 69 -12.472 11.597 2.863 1.00 0.00 H new ATOM 0 HA GLU A 69 -14.429 13.711 2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -13.508 13.422 4.577 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.889 13.673 3.955 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.129 15.921 3.872 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -13.743 15.827 3.198 1.00 0.00 H new ATOM 1103 N LYS A 70 -11.479 13.377 0.943 1.00 0.00 N ATOM 1104 CA LYS A 70 -10.582 13.851 -0.103 1.00 0.00 C ATOM 1105 C LYS A 70 -9.750 12.695 -0.645 1.00 0.00 C ATOM 1106 O LYS A 70 -9.051 12.015 0.107 1.00 0.00 O ATOM 1107 CB LYS A 70 -9.666 14.956 0.423 1.00 0.00 C ATOM 1108 CG LYS A 70 -9.161 14.715 1.837 1.00 0.00 C ATOM 1109 CD LYS A 70 -9.577 15.836 2.776 1.00 0.00 C ATOM 1110 CE LYS A 70 -9.396 15.438 4.233 1.00 0.00 C ATOM 1111 NZ LYS A 70 -8.131 15.976 4.803 1.00 0.00 N ATOM 0 H LYS A 70 -11.218 12.474 1.339 1.00 0.00 H new ATOM 0 HA LYS A 70 -11.187 14.264 -0.910 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -8.811 15.055 -0.246 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.203 15.904 0.396 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.550 13.766 2.207 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -8.074 14.632 1.827 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.986 16.727 2.565 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.620 16.095 2.595 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.241 15.803 4.817 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -9.398 14.351 4.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -8.046 15.682 5.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.322 15.608 4.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.140 17.015 4.748 1.00 0.00 H new ATOM 1125 N ILE A 71 -9.835 12.472 -1.950 1.00 0.00 N ATOM 1126 CA ILE A 71 -9.096 11.390 -2.590 1.00 0.00 C ATOM 1127 C ILE A 71 -7.591 11.597 -2.468 1.00 0.00 C ATOM 1128 O ILE A 71 -7.054 12.613 -2.911 1.00 0.00 O ATOM 1129 CB ILE A 71 -9.470 11.256 -4.078 1.00 0.00 C ATOM 1130 CG1 ILE A 71 -10.994 11.244 -4.240 1.00 0.00 C ATOM 1131 CG2 ILE A 71 -8.850 9.994 -4.664 1.00 0.00 C ATOM 1132 CD1 ILE A 71 -11.460 10.850 -5.626 1.00 0.00 C ATOM 0 H ILE A 71 -10.408 13.026 -2.587 1.00 0.00 H new ATOM 0 HA ILE A 71 -9.372 10.472 -2.071 1.00 0.00 H new ATOM 0 HB ILE A 71 -9.076 12.114 -4.623 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -11.421 10.553 -3.513 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -11.383 12.235 -4.005 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -9.121 9.910 -5.716 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -7.765 10.045 -4.572 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -9.219 9.122 -4.123 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -12.549 10.865 -5.662 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -11.063 11.554 -6.357 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -11.103 9.847 -5.858 1.00 0.00 H new ATOM 1144 N SER A 72 -6.915 10.626 -1.862 1.00 0.00 N ATOM 1145 CA SER A 72 -5.471 10.695 -1.679 1.00 0.00 C ATOM 1146 C SER A 72 -4.815 9.362 -2.028 1.00 0.00 C ATOM 1147 O SER A 72 -5.278 8.303 -1.603 1.00 0.00 O ATOM 1148 CB SER A 72 -5.136 11.080 -0.237 1.00 0.00 C ATOM 1149 OG SER A 72 -6.202 11.799 0.360 1.00 0.00 O ATOM 0 H SER A 72 -7.346 9.780 -1.489 1.00 0.00 H new ATOM 0 HA SER A 72 -5.080 11.459 -2.351 1.00 0.00 H new ATOM 0 HB2 SER A 72 -4.929 10.181 0.344 1.00 0.00 H new ATOM 0 HB3 SER A 72 -4.230 11.686 -0.220 1.00 0.00 H new ATOM 0 HG SER A 72 -5.964 12.032 1.282 1.00 0.00 H new ATOM 1155 N THR A 73 -3.740 9.421 -2.807 1.00 0.00 N ATOM 1156 CA THR A 73 -3.025 8.217 -3.214 1.00 0.00 C ATOM 1157 C THR A 73 -1.615 8.193 -2.633 1.00 0.00 C ATOM 1158 O THR A 73 -0.930 9.215 -2.597 1.00 0.00 O ATOM 1159 CB THR A 73 -2.960 8.129 -4.740 1.00 0.00 C ATOM 1160 OG1 THR A 73 -4.252 8.260 -5.306 1.00 0.00 O ATOM 1161 CG2 THR A 73 -2.367 6.829 -5.241 1.00 0.00 C ATOM 0 H THR A 73 -3.345 10.289 -3.169 1.00 0.00 H new ATOM 0 HA THR A 73 -3.570 7.356 -2.828 1.00 0.00 H new ATOM 0 HB THR A 73 -2.310 8.948 -5.048 1.00 0.00 H new ATOM 0 HG1 THR A 73 -4.263 9.020 -5.924 1.00 0.00 H new ATOM 0 HG21 THR A 73 -2.351 6.833 -6.331 1.00 0.00 H new ATOM 0 HG22 THR A 73 -1.350 6.723 -4.863 1.00 0.00 H new ATOM 0 HG23 THR A 73 -2.973 5.994 -4.890 1.00 0.00 H new ATOM 1169 N LEU A 74 -1.187 7.018 -2.182 1.00 0.00 N ATOM 1170 CA LEU A 74 0.144 6.859 -1.606 1.00 0.00 C ATOM 1171 C LEU A 74 1.216 6.957 -2.686 1.00 0.00 C ATOM 1172 O LEU A 74 1.402 6.032 -3.477 1.00 0.00 O ATOM 1173 CB LEU A 74 0.254 5.512 -0.885 1.00 0.00 C ATOM 1174 CG LEU A 74 1.595 5.253 -0.198 1.00 0.00 C ATOM 1175 CD1 LEU A 74 1.584 5.802 1.219 1.00 0.00 C ATOM 1176 CD2 LEU A 74 1.911 3.765 -0.191 1.00 0.00 C ATOM 0 H LEU A 74 -1.742 6.163 -2.204 1.00 0.00 H new ATOM 0 HA LEU A 74 0.300 7.663 -0.886 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -0.537 5.451 -0.138 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.073 4.715 -1.606 1.00 0.00 H new ATOM 0 HG LEU A 74 2.374 5.768 -0.760 1.00 0.00 H new ATOM 0 HD11 LEU A 74 2.547 5.608 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 74 1.403 6.877 1.191 1.00 0.00 H new ATOM 0 HD13 LEU A 74 0.794 5.316 1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.869 3.599 0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.129 3.229 0.347 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.962 3.399 -1.216 1.00 0.00 H new ATOM 1188 N SER A 75 1.916 8.086 -2.716 1.00 0.00 N ATOM 1189 CA SER A 75 2.968 8.306 -3.703 1.00 0.00 C ATOM 1190 C SER A 75 4.343 8.328 -3.043 1.00 0.00 C ATOM 1191 O SER A 75 4.547 8.998 -2.031 1.00 0.00 O ATOM 1192 CB SER A 75 2.727 9.619 -4.449 1.00 0.00 C ATOM 1193 OG SER A 75 3.294 9.580 -5.748 1.00 0.00 O ATOM 0 H SER A 75 1.775 8.862 -2.069 1.00 0.00 H new ATOM 0 HA SER A 75 2.942 7.480 -4.414 1.00 0.00 H new ATOM 0 HB2 SER A 75 1.656 9.808 -4.522 1.00 0.00 H new ATOM 0 HB3 SER A 75 3.159 10.446 -3.885 1.00 0.00 H new ATOM 0 HG SER A 75 2.696 10.031 -6.380 1.00 0.00 H new ATOM 1199 N CYS A 76 5.283 7.592 -3.627 1.00 0.00 N ATOM 1200 CA CYS A 76 6.640 7.529 -3.099 1.00 0.00 C ATOM 1201 C CYS A 76 7.574 8.435 -3.895 1.00 0.00 C ATOM 1202 O CYS A 76 8.013 8.083 -4.989 1.00 0.00 O ATOM 1203 CB CYS A 76 7.157 6.089 -3.132 1.00 0.00 C ATOM 1204 SG CYS A 76 7.072 5.313 -4.763 1.00 0.00 S ATOM 0 H CYS A 76 5.130 7.032 -4.465 1.00 0.00 H new ATOM 0 HA CYS A 76 6.618 7.876 -2.066 1.00 0.00 H new ATOM 0 HB2 CYS A 76 8.192 6.078 -2.789 1.00 0.00 H new ATOM 0 HB3 CYS A 76 6.581 5.491 -2.426 1.00 0.00 H new ATOM 0 HG CYS A 76 6.144 5.888 -5.469 1.00 0.00 H new ATOM 1210 N GLU A 77 7.874 9.602 -3.336 1.00 0.00 N ATOM 1211 CA GLU A 77 8.755 10.560 -3.990 1.00 0.00 C ATOM 1212 C GLU A 77 10.158 9.972 -4.160 1.00 0.00 C ATOM 1213 O GLU A 77 10.326 8.753 -4.174 1.00 0.00 O ATOM 1214 CB GLU A 77 8.805 11.859 -3.180 1.00 0.00 C ATOM 1215 CG GLU A 77 9.442 11.691 -1.813 1.00 0.00 C ATOM 1216 CD GLU A 77 10.591 12.653 -1.578 1.00 0.00 C ATOM 1217 OE1 GLU A 77 10.323 13.846 -1.324 1.00 0.00 O ATOM 1218 OE2 GLU A 77 11.757 12.213 -1.648 1.00 0.00 O ATOM 0 H GLU A 77 7.519 9.907 -2.430 1.00 0.00 H new ATOM 0 HA GLU A 77 8.361 10.782 -4.982 1.00 0.00 H new ATOM 0 HB2 GLU A 77 9.362 12.608 -3.743 1.00 0.00 H new ATOM 0 HB3 GLU A 77 7.792 12.241 -3.056 1.00 0.00 H new ATOM 0 HG2 GLU A 77 8.685 11.841 -1.043 1.00 0.00 H new ATOM 0 HG3 GLU A 77 9.803 10.668 -1.709 1.00 0.00 H new ATOM 1225 N ASN A 78 11.163 10.841 -4.292 1.00 0.00 N ATOM 1226 CA ASN A 78 12.549 10.404 -4.462 1.00 0.00 C ATOM 1227 C ASN A 78 12.897 9.263 -3.507 1.00 0.00 C ATOM 1228 O ASN A 78 13.729 8.411 -3.819 1.00 0.00 O ATOM 1229 CB ASN A 78 13.502 11.577 -4.230 1.00 0.00 C ATOM 1230 CG ASN A 78 13.287 12.704 -5.221 1.00 0.00 C ATOM 1231 OD1 ASN A 78 13.915 12.745 -6.279 1.00 0.00 O ATOM 1232 ND2 ASN A 78 12.394 13.627 -4.882 1.00 0.00 N ATOM 0 H ASN A 78 11.041 11.854 -4.284 1.00 0.00 H new ATOM 0 HA ASN A 78 12.659 10.039 -5.483 1.00 0.00 H new ATOM 0 HB2 ASN A 78 13.366 11.957 -3.217 1.00 0.00 H new ATOM 0 HB3 ASN A 78 14.531 11.225 -4.303 1.00 0.00 H new ATOM 0 HD21 ASN A 78 12.206 14.409 -5.509 1.00 0.00 H new ATOM 0 HD22 ASN A 78 11.896 13.553 -3.995 1.00 0.00 H new ATOM 1239 N LYS A 79 12.252 9.256 -2.347 1.00 0.00 N ATOM 1240 CA LYS A 79 12.489 8.223 -1.344 1.00 0.00 C ATOM 1241 C LYS A 79 11.453 8.297 -0.225 1.00 0.00 C ATOM 1242 O LYS A 79 11.075 7.278 0.352 1.00 0.00 O ATOM 1243 CB LYS A 79 13.901 8.357 -0.766 1.00 0.00 C ATOM 1244 CG LYS A 79 14.099 9.592 0.101 1.00 0.00 C ATOM 1245 CD LYS A 79 14.261 10.845 -0.743 1.00 0.00 C ATOM 1246 CE LYS A 79 15.651 11.443 -0.597 1.00 0.00 C ATOM 1247 NZ LYS A 79 16.059 12.206 -1.809 1.00 0.00 N ATOM 0 H LYS A 79 11.560 9.955 -2.077 1.00 0.00 H new ATOM 0 HA LYS A 79 12.396 7.252 -1.831 1.00 0.00 H new ATOM 0 HB2 LYS A 79 14.126 7.470 -0.174 1.00 0.00 H new ATOM 0 HB3 LYS A 79 14.618 8.383 -1.587 1.00 0.00 H new ATOM 0 HG2 LYS A 79 13.246 9.710 0.769 1.00 0.00 H new ATOM 0 HG3 LYS A 79 14.980 9.459 0.730 1.00 0.00 H new ATOM 0 HD2 LYS A 79 14.076 10.605 -1.790 1.00 0.00 H new ATOM 0 HD3 LYS A 79 13.514 11.582 -0.448 1.00 0.00 H new ATOM 0 HE2 LYS A 79 15.673 12.102 0.271 1.00 0.00 H new ATOM 0 HE3 LYS A 79 16.371 10.646 -0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 17.012 12.597 -1.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 16.063 11.572 -2.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 15.387 12.983 -1.973 1.00 0.00 H new ATOM 1261 N ILE A 80 11.003 9.510 0.079 1.00 0.00 N ATOM 1262 CA ILE A 80 10.015 9.719 1.130 1.00 0.00 C ATOM 1263 C ILE A 80 8.612 9.373 0.641 1.00 0.00 C ATOM 1264 O ILE A 80 8.288 9.564 -0.531 1.00 0.00 O ATOM 1265 CB ILE A 80 10.022 11.178 1.632 1.00 0.00 C ATOM 1266 CG1 ILE A 80 11.456 11.701 1.756 1.00 0.00 C ATOM 1267 CG2 ILE A 80 9.299 11.281 2.966 1.00 0.00 C ATOM 1268 CD1 ILE A 80 11.533 13.183 2.050 1.00 0.00 C ATOM 0 H ILE A 80 11.308 10.364 -0.389 1.00 0.00 H new ATOM 0 HA ILE A 80 10.288 9.058 1.953 1.00 0.00 H new ATOM 0 HB ILE A 80 9.497 11.795 0.904 1.00 0.00 H new ATOM 0 HG12 ILE A 80 11.967 11.154 2.549 1.00 0.00 H new ATOM 0 HG13 ILE A 80 11.992 11.494 0.830 1.00 0.00 H new ATOM 0 HG21 ILE A 80 9.312 12.316 3.308 1.00 0.00 H new ATOM 0 HG22 ILE A 80 8.267 10.951 2.847 1.00 0.00 H new ATOM 0 HG23 ILE A 80 9.799 10.650 3.701 1.00 0.00 H new ATOM 0 HD11 ILE A 80 12.578 13.485 2.125 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.051 13.739 1.246 1.00 0.00 H new ATOM 0 HD13 ILE A 80 11.026 13.394 2.992 1.00 0.00 H new ATOM 1280 N ILE A 81 7.781 8.868 1.547 1.00 0.00 N ATOM 1281 CA ILE A 81 6.411 8.502 1.208 1.00 0.00 C ATOM 1282 C ILE A 81 5.435 9.594 1.634 1.00 0.00 C ATOM 1283 O ILE A 81 5.565 10.168 2.715 1.00 0.00 O ATOM 1284 CB ILE A 81 6.004 7.170 1.873 1.00 0.00 C ATOM 1285 CG1 ILE A 81 6.976 6.057 1.477 1.00 0.00 C ATOM 1286 CG2 ILE A 81 4.577 6.795 1.493 1.00 0.00 C ATOM 1287 CD1 ILE A 81 6.905 5.683 0.013 1.00 0.00 C ATOM 0 H ILE A 81 8.033 8.703 2.522 1.00 0.00 H new ATOM 0 HA ILE A 81 6.370 8.383 0.125 1.00 0.00 H new ATOM 0 HB ILE A 81 6.047 7.297 2.955 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.992 6.372 1.714 1.00 0.00 H new ATOM 0 HG13 ILE A 81 6.768 5.173 2.080 1.00 0.00 H new ATOM 0 HG21 ILE A 81 4.309 5.853 1.972 1.00 0.00 H new ATOM 0 HG22 ILE A 81 3.895 7.578 1.824 1.00 0.00 H new ATOM 0 HG23 ILE A 81 4.505 6.685 0.411 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.622 4.888 -0.195 1.00 0.00 H new ATOM 0 HD12 ILE A 81 5.899 5.337 -0.226 1.00 0.00 H new ATOM 0 HD13 ILE A 81 7.143 6.554 -0.597 1.00 0.00 H new ATOM 1299 N SER A 82 4.458 9.876 0.779 1.00 0.00 N ATOM 1300 CA SER A 82 3.461 10.900 1.071 1.00 0.00 C ATOM 1301 C SER A 82 2.203 10.694 0.234 1.00 0.00 C ATOM 1302 O SER A 82 2.280 10.353 -0.946 1.00 0.00 O ATOM 1303 CB SER A 82 4.039 12.293 0.808 1.00 0.00 C ATOM 1304 OG SER A 82 4.638 12.825 1.978 1.00 0.00 O ATOM 0 H SER A 82 4.335 9.411 -0.120 1.00 0.00 H new ATOM 0 HA SER A 82 3.191 10.817 2.124 1.00 0.00 H new ATOM 0 HB2 SER A 82 4.779 12.239 0.009 1.00 0.00 H new ATOM 0 HB3 SER A 82 3.248 12.960 0.465 1.00 0.00 H new ATOM 0 HG SER A 82 5.069 12.103 2.482 1.00 0.00 H new ATOM 1310 N PHE A 83 1.047 10.906 0.853 1.00 0.00 N ATOM 1311 CA PHE A 83 -0.229 10.746 0.166 1.00 0.00 C ATOM 1312 C PHE A 83 -0.523 11.954 -0.717 1.00 0.00 C ATOM 1313 O PHE A 83 -0.949 13.002 -0.230 1.00 0.00 O ATOM 1314 CB PHE A 83 -1.359 10.555 1.179 1.00 0.00 C ATOM 1315 CG PHE A 83 -1.529 9.133 1.630 1.00 0.00 C ATOM 1316 CD1 PHE A 83 -0.540 8.503 2.369 1.00 0.00 C ATOM 1317 CD2 PHE A 83 -2.678 8.425 1.315 1.00 0.00 C ATOM 1318 CE1 PHE A 83 -0.695 7.195 2.786 1.00 0.00 C ATOM 1319 CE2 PHE A 83 -2.838 7.117 1.729 1.00 0.00 C ATOM 1320 CZ PHE A 83 -1.845 6.500 2.465 1.00 0.00 C ATOM 0 H PHE A 83 0.967 11.189 1.830 1.00 0.00 H new ATOM 0 HA PHE A 83 -0.165 9.860 -0.466 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.165 11.182 2.049 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -2.294 10.901 0.738 1.00 0.00 H new ATOM 0 HD1 PHE A 83 0.362 9.041 2.622 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -3.457 8.902 0.739 1.00 0.00 H new ATOM 0 HE1 PHE A 83 0.082 6.716 3.363 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -3.739 6.577 1.477 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.967 5.477 2.789 1.00 0.00 H new ATOM 1330 N LYS A 84 -0.292 11.802 -2.016 1.00 0.00 N ATOM 1331 CA LYS A 84 -0.534 12.881 -2.964 1.00 0.00 C ATOM 1332 C LYS A 84 -2.011 12.956 -3.338 1.00 0.00 C ATOM 1333 O LYS A 84 -2.592 11.978 -3.810 1.00 0.00 O ATOM 1334 CB LYS A 84 0.316 12.683 -4.221 1.00 0.00 C ATOM 1335 CG LYS A 84 1.656 13.400 -4.169 1.00 0.00 C ATOM 1336 CD LYS A 84 2.458 12.996 -2.942 1.00 0.00 C ATOM 1337 CE LYS A 84 3.917 13.403 -3.073 1.00 0.00 C ATOM 1338 NZ LYS A 84 4.079 14.882 -3.121 1.00 0.00 N ATOM 0 H LYS A 84 0.062 10.942 -2.436 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.252 13.820 -2.488 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.489 11.617 -4.368 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -0.243 13.038 -5.087 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.227 13.172 -5.069 1.00 0.00 H new ATOM 0 HG3 LYS A 84 1.493 14.478 -4.160 1.00 0.00 H new ATOM 0 HD2 LYS A 84 2.027 13.461 -2.055 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.391 11.917 -2.801 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.482 13.003 -2.231 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.337 12.962 -3.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.090 15.119 -3.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.589 15.258 -3.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.671 15.304 -2.262 1.00 0.00 H new ATOM 1352 N GLU A 85 -2.613 14.120 -3.124 1.00 0.00 N ATOM 1353 CA GLU A 85 -4.023 14.322 -3.437 1.00 0.00 C ATOM 1354 C GLU A 85 -4.263 14.230 -4.940 1.00 0.00 C ATOM 1355 O GLU A 85 -4.052 15.196 -5.673 1.00 0.00 O ATOM 1356 CB GLU A 85 -4.495 15.680 -2.910 1.00 0.00 C ATOM 1357 CG GLU A 85 -5.461 15.575 -1.741 1.00 0.00 C ATOM 1358 CD GLU A 85 -5.271 16.687 -0.727 1.00 0.00 C ATOM 1359 OE1 GLU A 85 -4.977 17.827 -1.144 1.00 0.00 O ATOM 1360 OE2 GLU A 85 -5.417 16.416 0.484 1.00 0.00 O ATOM 0 H GLU A 85 -2.146 14.939 -2.735 1.00 0.00 H new ATOM 0 HA GLU A 85 -4.597 13.534 -2.948 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -3.627 16.263 -2.602 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -4.976 16.228 -3.720 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -6.484 15.601 -2.116 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -5.327 14.612 -1.248 1.00 0.00 H new ATOM 1367 N MET A 86 -4.705 13.061 -5.393 1.00 0.00 N ATOM 1368 CA MET A 86 -4.973 12.843 -6.809 1.00 0.00 C ATOM 1369 C MET A 86 -5.533 11.445 -7.049 1.00 0.00 C ATOM 1370 O MET A 86 -5.007 10.457 -6.534 1.00 0.00 O ATOM 1371 CB MET A 86 -3.696 13.040 -7.627 1.00 0.00 C ATOM 1372 CG MET A 86 -2.554 12.129 -7.204 1.00 0.00 C ATOM 1373 SD MET A 86 -1.687 11.399 -8.606 1.00 0.00 S ATOM 1374 CE MET A 86 -2.759 10.014 -8.985 1.00 0.00 C ATOM 0 H MET A 86 -4.885 12.251 -4.800 1.00 0.00 H new ATOM 0 HA MET A 86 -5.718 13.572 -7.128 1.00 0.00 H new ATOM 0 HB2 MET A 86 -3.918 12.865 -8.680 1.00 0.00 H new ATOM 0 HB3 MET A 86 -3.374 14.077 -7.538 1.00 0.00 H new ATOM 0 HG2 MET A 86 -1.846 12.697 -6.601 1.00 0.00 H new ATOM 0 HG3 MET A 86 -2.946 11.333 -6.570 1.00 0.00 H new ATOM 0 HE1 MET A 86 -2.171 9.209 -9.425 1.00 0.00 H new ATOM 0 HE2 MET A 86 -3.232 9.659 -8.069 1.00 0.00 H new ATOM 0 HE3 MET A 86 -3.527 10.331 -9.691 1.00 0.00 H new ATOM 1384 N ASN A 87 -6.604 11.368 -7.831 1.00 0.00 N ATOM 1385 CA ASN A 87 -7.234 10.090 -8.138 1.00 0.00 C ATOM 1386 C ASN A 87 -6.410 9.307 -9.158 1.00 0.00 C ATOM 1387 O ASN A 87 -5.782 9.893 -10.040 1.00 0.00 O ATOM 1388 CB ASN A 87 -8.651 10.311 -8.672 1.00 0.00 C ATOM 1389 CG ASN A 87 -8.686 11.287 -9.832 1.00 0.00 C ATOM 1390 OD1 ASN A 87 -7.914 11.165 -10.783 1.00 0.00 O ATOM 1391 ND2 ASN A 87 -9.586 12.261 -9.759 1.00 0.00 N ATOM 0 H ASN A 87 -7.054 12.175 -8.263 1.00 0.00 H new ATOM 0 HA ASN A 87 -7.286 9.509 -7.217 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -9.069 9.356 -8.991 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -9.285 10.684 -7.868 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -9.657 12.947 -10.511 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -10.206 12.323 -8.951 1.00 0.00 H new ATOM 1398 N PRO A 88 -6.402 7.967 -9.052 1.00 0.00 N ATOM 1399 CA PRO A 88 -5.648 7.108 -9.972 1.00 0.00 C ATOM 1400 C PRO A 88 -5.975 7.402 -11.436 1.00 0.00 C ATOM 1401 O PRO A 88 -7.144 7.508 -11.806 1.00 0.00 O ATOM 1402 CB PRO A 88 -6.107 5.696 -9.596 1.00 0.00 C ATOM 1403 CG PRO A 88 -6.549 5.805 -8.179 1.00 0.00 C ATOM 1404 CD PRO A 88 -7.124 7.186 -8.030 1.00 0.00 C ATOM 0 HA PRO A 88 -4.572 7.259 -9.883 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -6.920 5.360 -10.239 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -5.297 4.975 -9.703 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -7.293 5.045 -7.943 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -5.712 5.655 -7.497 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -8.200 7.194 -8.203 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -6.959 7.584 -7.029 1.00 0.00 H new ATOM 1412 N PRO A 89 -4.946 7.539 -12.291 1.00 0.00 N ATOM 1413 CA PRO A 89 -5.141 7.823 -13.715 1.00 0.00 C ATOM 1414 C PRO A 89 -5.640 6.606 -14.486 1.00 0.00 C ATOM 1415 O PRO A 89 -5.485 5.469 -14.041 1.00 0.00 O ATOM 1416 CB PRO A 89 -3.743 8.218 -14.190 1.00 0.00 C ATOM 1417 CG PRO A 89 -2.817 7.497 -13.274 1.00 0.00 C ATOM 1418 CD PRO A 89 -3.515 7.432 -11.941 1.00 0.00 C ATOM 0 HA PRO A 89 -5.896 8.592 -13.878 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -3.580 7.927 -15.228 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -3.596 9.297 -14.134 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -2.598 6.497 -13.649 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -1.865 8.021 -13.190 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -3.299 6.499 -11.420 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -3.201 8.244 -11.284 1.00 0.00 H new ATOM 1426 N ASP A 90 -6.237 6.853 -15.647 1.00 0.00 N ATOM 1427 CA ASP A 90 -6.757 5.778 -16.483 1.00 0.00 C ATOM 1428 C ASP A 90 -5.631 5.114 -17.269 1.00 0.00 C ATOM 1429 O ASP A 90 -5.581 3.890 -17.389 1.00 0.00 O ATOM 1430 CB ASP A 90 -7.818 6.317 -17.444 1.00 0.00 C ATOM 1431 CG ASP A 90 -9.067 6.783 -16.723 1.00 0.00 C ATOM 1432 OD1 ASP A 90 -9.942 5.937 -16.445 1.00 0.00 O ATOM 1433 OD2 ASP A 90 -9.171 7.994 -16.435 1.00 0.00 O ATOM 0 H ASP A 90 -6.373 7.788 -16.030 1.00 0.00 H new ATOM 0 HA ASP A 90 -7.214 5.032 -15.833 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -7.400 7.147 -18.014 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -8.084 5.540 -18.160 1.00 0.00 H new ATOM 1438 N ASN A 91 -4.727 5.932 -17.800 1.00 0.00 N ATOM 1439 CA ASN A 91 -3.598 5.429 -18.571 1.00 0.00 C ATOM 1440 C ASN A 91 -2.363 6.297 -18.349 1.00 0.00 C ATOM 1441 O ASN A 91 -2.377 7.495 -18.627 1.00 0.00 O ATOM 1442 CB ASN A 91 -3.948 5.380 -20.060 1.00 0.00 C ATOM 1443 CG ASN A 91 -3.732 4.006 -20.660 1.00 0.00 C ATOM 1444 OD1 ASN A 91 -2.943 3.839 -21.591 1.00 0.00 O ATOM 1445 ND2 ASN A 91 -4.434 3.011 -20.129 1.00 0.00 N ATOM 0 H ASN A 91 -4.756 6.948 -17.709 1.00 0.00 H new ATOM 0 HA ASN A 91 -3.375 4.418 -18.229 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -4.989 5.673 -20.195 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -3.340 6.108 -20.597 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -4.330 2.063 -20.492 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -5.077 3.195 -19.358 1.00 0.00 H new ATOM 1452 N ILE A 92 -1.299 5.685 -17.841 1.00 0.00 N ATOM 1453 CA ILE A 92 -0.058 6.403 -17.577 1.00 0.00 C ATOM 1454 C ILE A 92 0.899 6.308 -18.759 1.00 0.00 C ATOM 1455 O ILE A 92 0.933 5.301 -19.467 1.00 0.00 O ATOM 1456 CB ILE A 92 0.647 5.860 -16.319 1.00 0.00 C ATOM 1457 CG1 ILE A 92 -0.354 5.712 -15.170 1.00 0.00 C ATOM 1458 CG2 ILE A 92 1.793 6.777 -15.918 1.00 0.00 C ATOM 1459 CD1 ILE A 92 0.258 5.164 -13.900 1.00 0.00 C ATOM 0 H ILE A 92 -1.271 4.693 -17.604 1.00 0.00 H new ATOM 0 HA ILE A 92 -0.328 7.447 -17.415 1.00 0.00 H new ATOM 0 HB ILE A 92 1.058 4.876 -16.546 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -0.798 6.685 -14.959 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.163 5.054 -15.487 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.282 6.381 -15.028 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.515 6.835 -16.733 1.00 0.00 H new ATOM 0 HG23 ILE A 92 1.405 7.773 -15.706 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.510 5.087 -13.130 1.00 0.00 H new ATOM 0 HD12 ILE A 92 0.677 4.177 -14.095 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.048 5.833 -13.559 1.00 0.00 H new ATOM 1471 N LYS A 93 1.678 7.365 -18.967 1.00 0.00 N ATOM 1472 CA LYS A 93 2.639 7.404 -20.063 1.00 0.00 C ATOM 1473 C LYS A 93 3.921 6.674 -19.682 1.00 0.00 C ATOM 1474 O LYS A 93 4.567 6.050 -20.524 1.00 0.00 O ATOM 1475 CB LYS A 93 2.959 8.853 -20.443 1.00 0.00 C ATOM 1476 CG LYS A 93 1.757 9.783 -20.373 1.00 0.00 C ATOM 1477 CD LYS A 93 1.912 10.815 -19.266 1.00 0.00 C ATOM 1478 CE LYS A 93 3.154 11.669 -19.465 1.00 0.00 C ATOM 1479 NZ LYS A 93 2.878 13.115 -19.240 1.00 0.00 N ATOM 0 H LYS A 93 1.662 8.206 -18.390 1.00 0.00 H new ATOM 0 HA LYS A 93 2.193 6.902 -20.922 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.738 9.230 -19.780 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.364 8.873 -21.455 1.00 0.00 H new ATOM 0 HG2 LYS A 93 1.633 10.290 -21.330 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.853 9.198 -20.202 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.030 11.455 -19.239 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.968 10.309 -18.302 1.00 0.00 H new ATOM 0 HE2 LYS A 93 3.935 11.338 -18.781 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.535 11.526 -20.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.751 13.662 -19.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.151 13.438 -19.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.539 13.256 -18.267 1.00 0.00 H new ATOM 1493 N ASP A 94 4.284 6.757 -18.406 1.00 0.00 N ATOM 1494 CA ASP A 94 5.489 6.103 -17.909 1.00 0.00 C ATOM 1495 C ASP A 94 5.170 4.711 -17.374 1.00 0.00 C ATOM 1496 O ASP A 94 4.060 4.454 -16.909 1.00 0.00 O ATOM 1497 CB ASP A 94 6.138 6.948 -16.811 1.00 0.00 C ATOM 1498 CG ASP A 94 6.918 8.121 -17.371 1.00 0.00 C ATOM 1499 OD1 ASP A 94 6.625 8.542 -18.509 1.00 0.00 O ATOM 1500 OD2 ASP A 94 7.825 8.620 -16.671 1.00 0.00 O ATOM 0 H ASP A 94 3.761 7.271 -17.697 1.00 0.00 H new ATOM 0 HA ASP A 94 6.187 6.003 -18.740 1.00 0.00 H new ATOM 0 HB2 ASP A 94 5.366 7.317 -16.136 1.00 0.00 H new ATOM 0 HB3 ASP A 94 6.805 6.321 -16.220 1.00 0.00 H new ATOM 1505 N THR A 95 6.151 3.817 -17.443 1.00 0.00 N ATOM 1506 CA THR A 95 5.974 2.450 -16.965 1.00 0.00 C ATOM 1507 C THR A 95 6.117 2.375 -15.447 1.00 0.00 C ATOM 1508 O THR A 95 5.697 1.399 -14.824 1.00 0.00 O ATOM 1509 CB THR A 95 6.991 1.522 -17.630 1.00 0.00 C ATOM 1510 OG1 THR A 95 7.166 1.863 -18.994 1.00 0.00 O ATOM 1511 CG2 THR A 95 6.597 0.061 -17.567 1.00 0.00 C ATOM 0 H THR A 95 7.076 4.014 -17.825 1.00 0.00 H new ATOM 0 HA THR A 95 4.967 2.129 -17.230 1.00 0.00 H new ATOM 0 HB THR A 95 7.916 1.657 -17.069 1.00 0.00 H new ATOM 0 HG1 THR A 95 7.822 1.259 -19.401 1.00 0.00 H new ATOM 0 HG21 THR A 95 7.361 -0.543 -18.057 1.00 0.00 H new ATOM 0 HG22 THR A 95 6.504 -0.246 -16.525 1.00 0.00 H new ATOM 0 HG23 THR A 95 5.642 -0.081 -18.074 1.00 0.00 H new ATOM 1519 N LYS A 96 6.714 3.405 -14.854 1.00 0.00 N ATOM 1520 CA LYS A 96 6.910 3.444 -13.411 1.00 0.00 C ATOM 1521 C LYS A 96 6.571 4.820 -12.848 1.00 0.00 C ATOM 1522 O LYS A 96 7.361 5.758 -12.951 1.00 0.00 O ATOM 1523 CB LYS A 96 8.354 3.077 -13.058 1.00 0.00 C ATOM 1524 CG LYS A 96 9.393 3.710 -13.970 1.00 0.00 C ATOM 1525 CD LYS A 96 9.952 4.991 -13.374 1.00 0.00 C ATOM 1526 CE LYS A 96 11.439 5.135 -13.657 1.00 0.00 C ATOM 1527 NZ LYS A 96 11.969 6.444 -13.185 1.00 0.00 N ATOM 0 H LYS A 96 7.069 4.222 -15.351 1.00 0.00 H new ATOM 0 HA LYS A 96 6.237 2.714 -12.962 1.00 0.00 H new ATOM 0 HB2 LYS A 96 8.554 3.380 -12.030 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.463 1.993 -13.097 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.205 3.004 -14.143 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.945 3.924 -14.940 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.418 5.848 -13.785 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.783 4.996 -12.297 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.982 4.326 -13.168 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.616 5.036 -14.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.986 6.503 -13.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.469 7.216 -13.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.823 6.528 -12.159 1.00 0.00 H new ATOM 1541 N SER A 97 5.389 4.933 -12.249 1.00 0.00 N ATOM 1542 CA SER A 97 4.946 6.193 -11.666 1.00 0.00 C ATOM 1543 C SER A 97 5.315 6.264 -10.188 1.00 0.00 C ATOM 1544 O SER A 97 5.757 5.276 -9.601 1.00 0.00 O ATOM 1545 CB SER A 97 3.433 6.357 -11.839 1.00 0.00 C ATOM 1546 OG SER A 97 3.113 7.642 -12.342 1.00 0.00 O ATOM 0 H SER A 97 4.722 4.167 -12.155 1.00 0.00 H new ATOM 0 HA SER A 97 5.451 7.006 -12.188 1.00 0.00 H new ATOM 0 HB2 SER A 97 3.057 5.593 -12.519 1.00 0.00 H new ATOM 0 HB3 SER A 97 2.936 6.204 -10.881 1.00 0.00 H new ATOM 0 HG SER A 97 2.142 7.720 -12.445 1.00 0.00 H new ATOM 1552 N ASP A 98 5.131 7.437 -9.593 1.00 0.00 N ATOM 1553 CA ASP A 98 5.446 7.635 -8.182 1.00 0.00 C ATOM 1554 C ASP A 98 4.399 6.976 -7.287 1.00 0.00 C ATOM 1555 O ASP A 98 4.674 6.653 -6.132 1.00 0.00 O ATOM 1556 CB ASP A 98 5.538 9.129 -7.865 1.00 0.00 C ATOM 1557 CG ASP A 98 4.314 9.894 -8.329 1.00 0.00 C ATOM 1558 OD1 ASP A 98 3.196 9.347 -8.228 1.00 0.00 O ATOM 1559 OD2 ASP A 98 4.474 11.042 -8.796 1.00 0.00 O ATOM 0 H ASP A 98 4.766 8.265 -10.064 1.00 0.00 H new ATOM 0 HA ASP A 98 6.410 7.166 -7.983 1.00 0.00 H new ATOM 0 HB2 ASP A 98 5.661 9.263 -6.790 1.00 0.00 H new ATOM 0 HB3 ASP A 98 6.426 9.545 -8.342 1.00 0.00 H new ATOM 1564 N ILE A 99 3.199 6.778 -7.826 1.00 0.00 N ATOM 1565 CA ILE A 99 2.117 6.158 -7.070 1.00 0.00 C ATOM 1566 C ILE A 99 2.079 4.650 -7.295 1.00 0.00 C ATOM 1567 O ILE A 99 1.647 3.893 -6.425 1.00 0.00 O ATOM 1568 CB ILE A 99 0.750 6.756 -7.456 1.00 0.00 C ATOM 1569 CG1 ILE A 99 0.545 6.680 -8.971 1.00 0.00 C ATOM 1570 CG2 ILE A 99 0.643 8.193 -6.972 1.00 0.00 C ATOM 1571 CD1 ILE A 99 -0.874 6.336 -9.372 1.00 0.00 C ATOM 0 H ILE A 99 2.953 7.037 -8.781 1.00 0.00 H new ATOM 0 HA ILE A 99 2.312 6.360 -6.017 1.00 0.00 H new ATOM 0 HB ILE A 99 -0.034 6.173 -6.973 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.818 7.637 -9.415 1.00 0.00 H new ATOM 0 HG13 ILE A 99 1.222 5.933 -9.384 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.328 8.600 -7.253 1.00 0.00 H new ATOM 0 HG22 ILE A 99 0.748 8.220 -5.887 1.00 0.00 H new ATOM 0 HG23 ILE A 99 1.432 8.790 -7.428 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -0.946 6.299 -10.459 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -1.144 5.365 -8.957 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -1.555 7.096 -8.989 1.00 0.00 H new ATOM 1583 N ILE A 100 2.535 4.218 -8.467 1.00 0.00 N ATOM 1584 CA ILE A 100 2.553 2.801 -8.806 1.00 0.00 C ATOM 1585 C ILE A 100 3.404 2.007 -7.818 1.00 0.00 C ATOM 1586 O ILE A 100 4.481 2.447 -7.417 1.00 0.00 O ATOM 1587 CB ILE A 100 3.091 2.576 -10.235 1.00 0.00 C ATOM 1588 CG1 ILE A 100 2.235 3.336 -11.249 1.00 0.00 C ATOM 1589 CG2 ILE A 100 3.123 1.091 -10.570 1.00 0.00 C ATOM 1590 CD1 ILE A 100 0.813 2.828 -11.343 1.00 0.00 C ATOM 0 H ILE A 100 2.897 4.831 -9.198 1.00 0.00 H new ATOM 0 HA ILE A 100 1.523 2.448 -8.753 1.00 0.00 H new ATOM 0 HB ILE A 100 4.111 2.958 -10.284 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.218 4.392 -10.978 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.702 3.266 -12.231 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.505 0.954 -11.582 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.772 0.573 -9.864 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.115 0.681 -10.505 1.00 0.00 H new ATOM 0 HD11 ILE A 100 0.265 3.414 -12.081 1.00 0.00 H new ATOM 0 HD12 ILE A 100 0.820 1.780 -11.644 1.00 0.00 H new ATOM 0 HD13 ILE A 100 0.328 2.923 -10.372 1.00 0.00 H new ATOM 1602 N PHE A 101 2.911 0.834 -7.432 1.00 0.00 N ATOM 1603 CA PHE A 101 3.623 -0.026 -6.494 1.00 0.00 C ATOM 1604 C PHE A 101 3.681 -1.459 -7.013 1.00 0.00 C ATOM 1605 O PHE A 101 2.761 -1.923 -7.685 1.00 0.00 O ATOM 1606 CB PHE A 101 2.946 0.006 -5.124 1.00 0.00 C ATOM 1607 CG PHE A 101 3.022 1.346 -4.447 1.00 0.00 C ATOM 1608 CD1 PHE A 101 4.247 1.899 -4.112 1.00 0.00 C ATOM 1609 CD2 PHE A 101 1.867 2.051 -4.147 1.00 0.00 C ATOM 1610 CE1 PHE A 101 4.320 3.132 -3.490 1.00 0.00 C ATOM 1611 CE2 PHE A 101 1.934 3.283 -3.525 1.00 0.00 C ATOM 1612 CZ PHE A 101 3.162 3.824 -3.197 1.00 0.00 C ATOM 0 H PHE A 101 2.020 0.457 -7.755 1.00 0.00 H new ATOM 0 HA PHE A 101 4.642 0.349 -6.395 1.00 0.00 H new ATOM 0 HB2 PHE A 101 1.899 -0.275 -5.239 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.409 -0.743 -4.482 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.156 1.361 -4.339 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.904 1.633 -4.402 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.281 3.553 -3.234 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.027 3.823 -3.295 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.216 4.787 -2.712 1.00 0.00 H new ATOM 1622 N PHE A 102 4.769 -2.159 -6.699 1.00 0.00 N ATOM 1623 CA PHE A 102 4.941 -3.538 -7.140 1.00 0.00 C ATOM 1624 C PHE A 102 4.722 -4.513 -5.988 1.00 0.00 C ATOM 1625 O PHE A 102 5.641 -4.804 -5.223 1.00 0.00 O ATOM 1626 CB PHE A 102 6.338 -3.737 -7.732 1.00 0.00 C ATOM 1627 CG PHE A 102 6.404 -3.479 -9.210 1.00 0.00 C ATOM 1628 CD1 PHE A 102 5.769 -2.379 -9.765 1.00 0.00 C ATOM 1629 CD2 PHE A 102 7.103 -4.337 -10.045 1.00 0.00 C ATOM 1630 CE1 PHE A 102 5.827 -2.142 -11.125 1.00 0.00 C ATOM 1631 CE2 PHE A 102 7.164 -4.103 -11.406 1.00 0.00 C ATOM 1632 CZ PHE A 102 6.527 -3.004 -11.947 1.00 0.00 C ATOM 0 H PHE A 102 5.542 -1.794 -6.142 1.00 0.00 H new ATOM 0 HA PHE A 102 4.195 -3.740 -7.909 1.00 0.00 H new ATOM 0 HB2 PHE A 102 7.037 -3.073 -7.224 1.00 0.00 H new ATOM 0 HB3 PHE A 102 6.666 -4.758 -7.534 1.00 0.00 H new ATOM 0 HD1 PHE A 102 5.223 -1.700 -9.127 1.00 0.00 H new ATOM 0 HD2 PHE A 102 7.605 -5.197 -9.628 1.00 0.00 H new ATOM 0 HE1 PHE A 102 5.325 -1.283 -11.545 1.00 0.00 H new ATOM 0 HE2 PHE A 102 7.710 -4.780 -12.046 1.00 0.00 H new ATOM 0 HZ PHE A 102 6.576 -2.819 -13.010 1.00 0.00 H new ATOM 1642 N GLN A 103 3.498 -5.018 -5.874 1.00 0.00 N ATOM 1643 CA GLN A 103 3.156 -5.965 -4.819 1.00 0.00 C ATOM 1644 C GLN A 103 3.295 -7.399 -5.316 1.00 0.00 C ATOM 1645 O GLN A 103 2.539 -7.841 -6.182 1.00 0.00 O ATOM 1646 CB GLN A 103 1.729 -5.720 -4.329 1.00 0.00 C ATOM 1647 CG GLN A 103 1.327 -6.601 -3.157 1.00 0.00 C ATOM 1648 CD GLN A 103 -0.170 -6.835 -3.090 1.00 0.00 C ATOM 1649 OE1 GLN A 103 -0.630 -7.976 -3.039 1.00 0.00 O ATOM 1650 NE2 GLN A 103 -0.937 -5.752 -3.088 1.00 0.00 N ATOM 0 H GLN A 103 2.726 -4.787 -6.500 1.00 0.00 H new ATOM 0 HA GLN A 103 3.847 -5.816 -3.990 1.00 0.00 H new ATOM 0 HB2 GLN A 103 1.629 -4.674 -4.038 1.00 0.00 H new ATOM 0 HB3 GLN A 103 1.037 -5.889 -5.154 1.00 0.00 H new ATOM 0 HG2 GLN A 103 1.838 -7.561 -3.237 1.00 0.00 H new ATOM 0 HG3 GLN A 103 1.661 -6.138 -2.228 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.512 -4.826 -3.132 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -1.952 -5.846 -3.043 1.00 0.00 H new ATOM 1659 N ARG A 104 4.266 -8.122 -4.767 1.00 0.00 N ATOM 1660 CA ARG A 104 4.501 -9.502 -5.161 1.00 0.00 C ATOM 1661 C ARG A 104 4.487 -10.420 -3.943 1.00 0.00 C ATOM 1662 O ARG A 104 4.814 -10.004 -2.834 1.00 0.00 O ATOM 1663 CB ARG A 104 5.837 -9.608 -5.903 1.00 0.00 C ATOM 1664 CG ARG A 104 6.417 -11.011 -5.949 1.00 0.00 C ATOM 1665 CD ARG A 104 5.629 -11.917 -6.882 1.00 0.00 C ATOM 1666 NE ARG A 104 6.467 -12.475 -7.940 1.00 0.00 N ATOM 1667 CZ ARG A 104 6.002 -13.222 -8.939 1.00 0.00 C ATOM 1668 NH1 ARG A 104 4.707 -13.499 -9.022 1.00 0.00 N ATOM 1669 NH2 ARG A 104 6.834 -13.691 -9.859 1.00 0.00 N ATOM 0 H ARG A 104 4.901 -7.773 -4.049 1.00 0.00 H new ATOM 0 HA ARG A 104 3.700 -9.819 -5.829 1.00 0.00 H new ATOM 0 HB2 ARG A 104 5.702 -9.250 -6.924 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.558 -8.945 -5.425 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.455 -10.965 -6.278 1.00 0.00 H new ATOM 0 HG3 ARG A 104 6.420 -11.436 -4.945 1.00 0.00 H new ATOM 0 HD2 ARG A 104 5.182 -12.728 -6.307 1.00 0.00 H new ATOM 0 HD3 ARG A 104 4.809 -11.353 -7.328 1.00 0.00 H new ATOM 0 HE ARG A 104 7.468 -12.281 -7.912 1.00 0.00 H new ATOM 0 HH11 ARG A 104 4.062 -13.139 -8.318 1.00 0.00 H new ATOM 0 HH12 ARG A 104 4.356 -14.072 -9.790 1.00 0.00 H new ATOM 0 HH21 ARG A 104 7.830 -13.479 -9.801 1.00 0.00 H new ATOM 0 HH22 ARG A 104 6.478 -14.263 -10.624 1.00 0.00 H new ATOM 1683 N SER A 105 4.110 -11.675 -4.163 1.00 0.00 N ATOM 1684 CA SER A 105 4.058 -12.657 -3.086 1.00 0.00 C ATOM 1685 C SER A 105 5.463 -13.028 -2.625 1.00 0.00 C ATOM 1686 O SER A 105 6.351 -13.269 -3.444 1.00 0.00 O ATOM 1687 CB SER A 105 3.311 -13.910 -3.547 1.00 0.00 C ATOM 1688 OG SER A 105 4.037 -14.596 -4.551 1.00 0.00 O ATOM 0 H SER A 105 3.836 -12.036 -5.077 1.00 0.00 H new ATOM 0 HA SER A 105 3.524 -12.214 -2.246 1.00 0.00 H new ATOM 0 HB2 SER A 105 3.146 -14.572 -2.697 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.329 -13.632 -3.930 1.00 0.00 H new ATOM 0 HG SER A 105 3.539 -15.394 -4.827 1.00 0.00 H new ATOM 1694 N VAL A 106 5.661 -13.068 -1.312 1.00 0.00 N ATOM 1695 CA VAL A 106 6.960 -13.405 -0.746 1.00 0.00 C ATOM 1696 C VAL A 106 7.089 -14.910 -0.521 1.00 0.00 C ATOM 1697 O VAL A 106 6.159 -15.555 -0.038 1.00 0.00 O ATOM 1698 CB VAL A 106 7.204 -12.677 0.589 1.00 0.00 C ATOM 1699 CG1 VAL A 106 8.662 -12.795 1.002 1.00 0.00 C ATOM 1700 CG2 VAL A 106 6.789 -11.216 0.487 1.00 0.00 C ATOM 0 H VAL A 106 4.938 -12.871 -0.620 1.00 0.00 H new ATOM 0 HA VAL A 106 7.709 -13.080 -1.468 1.00 0.00 H new ATOM 0 HB VAL A 106 6.592 -13.151 1.356 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.816 -12.275 1.947 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.923 -13.847 1.120 1.00 0.00 H new ATOM 0 HG13 VAL A 106 9.295 -12.348 0.235 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.969 -10.719 1.440 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.371 -10.726 -0.293 1.00 0.00 H new ATOM 0 HG23 VAL A 106 5.729 -11.155 0.241 1.00 0.00 H new ATOM 1761 N ASN A 111 1.784 -16.543 3.239 1.00 0.00 N ATOM 1762 CA ASN A 111 1.234 -15.756 2.141 1.00 0.00 C ATOM 1763 C ASN A 111 1.462 -14.265 2.371 1.00 0.00 C ATOM 1764 O ASN A 111 0.524 -13.516 2.646 1.00 0.00 O ATOM 1765 CB ASN A 111 -0.261 -16.040 1.983 1.00 0.00 C ATOM 1766 CG ASN A 111 -0.700 -16.033 0.532 1.00 0.00 C ATOM 1767 OD1 ASN A 111 0.074 -16.368 -0.365 1.00 0.00 O ATOM 1768 ND2 ASN A 111 -1.950 -15.650 0.293 1.00 0.00 N ATOM 0 HA ASN A 111 1.750 -16.044 1.225 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -0.493 -17.009 2.425 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -0.830 -15.293 2.536 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -2.302 -15.626 -0.664 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -2.558 -15.381 1.067 1.00 0.00 H new ATOM 1775 N LYS A 112 2.717 -13.839 2.257 1.00 0.00 N ATOM 1776 CA LYS A 112 3.069 -12.438 2.452 1.00 0.00 C ATOM 1777 C LYS A 112 3.223 -11.725 1.115 1.00 0.00 C ATOM 1778 O LYS A 112 3.153 -12.349 0.056 1.00 0.00 O ATOM 1779 CB LYS A 112 4.363 -12.319 3.260 1.00 0.00 C ATOM 1780 CG LYS A 112 4.315 -13.036 4.599 1.00 0.00 C ATOM 1781 CD LYS A 112 3.255 -12.442 5.511 1.00 0.00 C ATOM 1782 CE LYS A 112 3.668 -11.075 6.031 1.00 0.00 C ATOM 1783 NZ LYS A 112 2.495 -10.184 6.245 1.00 0.00 N ATOM 0 H LYS A 112 3.506 -14.445 2.031 1.00 0.00 H new ATOM 0 HA LYS A 112 2.260 -11.962 3.006 1.00 0.00 H new ATOM 0 HB2 LYS A 112 5.187 -12.722 2.671 1.00 0.00 H new ATOM 0 HB3 LYS A 112 4.579 -11.264 3.430 1.00 0.00 H new ATOM 0 HG2 LYS A 112 4.107 -14.094 4.439 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.290 -12.972 5.082 1.00 0.00 H new ATOM 0 HD2 LYS A 112 2.314 -12.356 4.968 1.00 0.00 H new ATOM 0 HD3 LYS A 112 3.079 -13.114 6.351 1.00 0.00 H new ATOM 0 HE2 LYS A 112 4.210 -11.192 6.969 1.00 0.00 H new ATOM 0 HE3 LYS A 112 4.353 -10.609 5.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 2.825 -9.232 6.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 1.934 -10.132 5.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 1.905 -10.565 7.012 1.00 0.00 H new ATOM 1797 N MET A 113 3.431 -10.413 1.170 1.00 0.00 N ATOM 1798 CA MET A 113 3.591 -9.620 -0.041 1.00 0.00 C ATOM 1799 C MET A 113 4.590 -8.487 0.170 1.00 0.00 C ATOM 1800 O MET A 113 4.580 -7.818 1.203 1.00 0.00 O ATOM 1801 CB MET A 113 2.240 -9.056 -0.482 1.00 0.00 C ATOM 1802 CG MET A 113 1.360 -10.082 -1.174 1.00 0.00 C ATOM 1803 SD MET A 113 -0.081 -10.546 -0.196 1.00 0.00 S ATOM 1804 CE MET A 113 -0.397 -12.190 -0.833 1.00 0.00 C ATOM 0 H MET A 113 3.492 -9.880 2.037 1.00 0.00 H new ATOM 0 HA MET A 113 3.980 -10.271 -0.824 1.00 0.00 H new ATOM 0 HB2 MET A 113 1.715 -8.665 0.390 1.00 0.00 H new ATOM 0 HB3 MET A 113 2.407 -8.216 -1.156 1.00 0.00 H new ATOM 0 HG2 MET A 113 1.029 -9.682 -2.132 1.00 0.00 H new ATOM 0 HG3 MET A 113 1.950 -10.973 -1.388 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.263 -12.616 -0.327 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.594 -12.134 -1.904 1.00 0.00 H new ATOM 0 HE3 MET A 113 0.474 -12.822 -0.657 1.00 0.00 H new ATOM 1814 N GLN A 114 5.452 -8.282 -0.820 1.00 0.00 N ATOM 1815 CA GLN A 114 6.462 -7.234 -0.755 1.00 0.00 C ATOM 1816 C GLN A 114 6.134 -6.104 -1.727 1.00 0.00 C ATOM 1817 O GLN A 114 5.684 -6.348 -2.848 1.00 0.00 O ATOM 1818 CB GLN A 114 7.842 -7.814 -1.074 1.00 0.00 C ATOM 1819 CG GLN A 114 8.990 -7.030 -0.457 1.00 0.00 C ATOM 1820 CD GLN A 114 9.896 -7.894 0.397 1.00 0.00 C ATOM 1821 OE1 GLN A 114 11.071 -8.082 0.082 1.00 0.00 O ATOM 1822 NE2 GLN A 114 9.353 -8.424 1.487 1.00 0.00 N ATOM 0 H GLN A 114 5.471 -8.830 -1.680 1.00 0.00 H new ATOM 0 HA GLN A 114 6.469 -6.827 0.256 1.00 0.00 H new ATOM 0 HB2 GLN A 114 7.885 -8.844 -0.720 1.00 0.00 H new ATOM 0 HB3 GLN A 114 7.973 -7.843 -2.156 1.00 0.00 H new ATOM 0 HG2 GLN A 114 9.577 -6.569 -1.251 1.00 0.00 H new ATOM 0 HG3 GLN A 114 8.586 -6.221 0.152 1.00 0.00 H new ATOM 0 HE21 GLN A 114 8.374 -8.242 1.710 1.00 0.00 H new ATOM 0 HE22 GLN A 114 9.915 -9.014 2.101 1.00 0.00 H new ATOM 1831 N PHE A 115 6.363 -4.870 -1.288 1.00 0.00 N ATOM 1832 CA PHE A 115 6.093 -3.700 -2.116 1.00 0.00 C ATOM 1833 C PHE A 115 7.387 -3.130 -2.691 1.00 0.00 C ATOM 1834 O PHE A 115 8.240 -2.632 -1.954 1.00 0.00 O ATOM 1835 CB PHE A 115 5.369 -2.628 -1.300 1.00 0.00 C ATOM 1836 CG PHE A 115 3.873 -2.755 -1.333 1.00 0.00 C ATOM 1837 CD1 PHE A 115 3.176 -2.588 -2.519 1.00 0.00 C ATOM 1838 CD2 PHE A 115 3.162 -3.039 -0.177 1.00 0.00 C ATOM 1839 CE1 PHE A 115 1.800 -2.702 -2.552 1.00 0.00 C ATOM 1840 CE2 PHE A 115 1.785 -3.154 -0.205 1.00 0.00 C ATOM 1841 CZ PHE A 115 1.103 -2.985 -1.394 1.00 0.00 C ATOM 0 H PHE A 115 6.735 -4.655 -0.363 1.00 0.00 H new ATOM 0 HA PHE A 115 5.454 -4.011 -2.943 1.00 0.00 H new ATOM 0 HB2 PHE A 115 5.707 -2.681 -0.265 1.00 0.00 H new ATOM 0 HB3 PHE A 115 5.650 -1.645 -1.677 1.00 0.00 H new ATOM 0 HD1 PHE A 115 3.715 -2.366 -3.428 1.00 0.00 H new ATOM 0 HD2 PHE A 115 3.690 -3.172 0.756 1.00 0.00 H new ATOM 0 HE1 PHE A 115 1.269 -2.570 -3.483 1.00 0.00 H new ATOM 0 HE2 PHE A 115 1.243 -3.376 0.702 1.00 0.00 H new ATOM 0 HZ PHE A 115 0.027 -3.074 -1.418 1.00 0.00 H new ATOM 1851 N GLU A 116 7.527 -3.213 -4.010 1.00 0.00 N ATOM 1852 CA GLU A 116 8.716 -2.714 -4.692 1.00 0.00 C ATOM 1853 C GLU A 116 8.396 -1.476 -5.522 1.00 0.00 C ATOM 1854 O GLU A 116 7.244 -1.238 -5.882 1.00 0.00 O ATOM 1855 CB GLU A 116 9.301 -3.801 -5.594 1.00 0.00 C ATOM 1856 CG GLU A 116 10.807 -3.698 -5.774 1.00 0.00 C ATOM 1857 CD GLU A 116 11.408 -4.956 -6.370 1.00 0.00 C ATOM 1858 OE1 GLU A 116 11.116 -6.056 -5.855 1.00 0.00 O ATOM 1859 OE2 GLU A 116 12.171 -4.842 -7.352 1.00 0.00 O ATOM 0 H GLU A 116 6.829 -3.623 -4.630 1.00 0.00 H new ATOM 0 HA GLU A 116 9.448 -2.439 -3.932 1.00 0.00 H new ATOM 0 HB2 GLU A 116 9.060 -4.778 -5.175 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.822 -3.747 -6.572 1.00 0.00 H new ATOM 0 HG2 GLU A 116 11.035 -2.849 -6.419 1.00 0.00 H new ATOM 0 HG3 GLU A 116 11.272 -3.499 -4.809 1.00 0.00 H new ATOM 1866 N SER A 117 9.427 -0.692 -5.827 1.00 0.00 N ATOM 1867 CA SER A 117 9.255 0.518 -6.622 1.00 0.00 C ATOM 1868 C SER A 117 8.936 0.165 -8.069 1.00 0.00 C ATOM 1869 O SER A 117 9.516 -0.763 -8.634 1.00 0.00 O ATOM 1870 CB SER A 117 10.518 1.378 -6.559 1.00 0.00 C ATOM 1871 OG SER A 117 10.194 2.758 -6.546 1.00 0.00 O ATOM 0 H SER A 117 10.388 -0.873 -5.536 1.00 0.00 H new ATOM 0 HA SER A 117 8.421 1.085 -6.209 1.00 0.00 H new ATOM 0 HB2 SER A 117 11.089 1.127 -5.665 1.00 0.00 H new ATOM 0 HB3 SER A 117 11.155 1.159 -7.416 1.00 0.00 H new ATOM 0 HG SER A 117 11.018 3.287 -6.504 1.00 0.00 H new ATOM 1877 N SER A 118 8.009 0.906 -8.666 1.00 0.00 N ATOM 1878 CA SER A 118 7.614 0.664 -10.048 1.00 0.00 C ATOM 1879 C SER A 118 8.814 0.750 -10.986 1.00 0.00 C ATOM 1880 O SER A 118 8.824 0.134 -12.052 1.00 0.00 O ATOM 1881 CB SER A 118 6.543 1.668 -10.480 1.00 0.00 C ATOM 1882 OG SER A 118 5.706 1.119 -11.484 1.00 0.00 O ATOM 0 H SER A 118 7.518 1.678 -8.215 1.00 0.00 H new ATOM 0 HA SER A 118 7.204 -0.344 -10.106 1.00 0.00 H new ATOM 0 HB2 SER A 118 5.941 1.957 -9.618 1.00 0.00 H new ATOM 0 HB3 SER A 118 7.019 2.574 -10.854 1.00 0.00 H new ATOM 0 HG SER A 118 6.245 0.584 -12.103 1.00 0.00 H new ATOM 1888 N SER A 119 9.824 1.518 -10.586 1.00 0.00 N ATOM 1889 CA SER A 119 11.022 1.680 -11.399 1.00 0.00 C ATOM 1890 C SER A 119 11.765 0.351 -11.540 1.00 0.00 C ATOM 1891 O SER A 119 11.442 -0.455 -12.413 1.00 0.00 O ATOM 1892 CB SER A 119 11.936 2.750 -10.794 1.00 0.00 C ATOM 1893 OG SER A 119 11.393 4.047 -10.975 1.00 0.00 O ATOM 0 H SER A 119 9.835 2.035 -9.707 1.00 0.00 H new ATOM 0 HA SER A 119 10.721 2.006 -12.395 1.00 0.00 H new ATOM 0 HB2 SER A 119 12.074 2.555 -9.730 1.00 0.00 H new ATOM 0 HB3 SER A 119 12.921 2.697 -11.258 1.00 0.00 H new ATOM 0 HG SER A 119 11.994 4.712 -10.579 1.00 0.00 H new ATOM 1899 N TYR A 120 12.759 0.121 -10.684 1.00 0.00 N ATOM 1900 CA TYR A 120 13.529 -1.117 -10.732 1.00 0.00 C ATOM 1901 C TYR A 120 14.261 -1.366 -9.417 1.00 0.00 C ATOM 1902 O TYR A 120 15.437 -1.028 -9.281 1.00 0.00 O ATOM 1903 CB TYR A 120 14.532 -1.070 -11.886 1.00 0.00 C ATOM 1904 CG TYR A 120 14.009 -1.678 -13.169 1.00 0.00 C ATOM 1905 CD1 TYR A 120 13.734 -3.037 -13.255 1.00 0.00 C ATOM 1906 CD2 TYR A 120 13.789 -0.891 -14.293 1.00 0.00 C ATOM 1907 CE1 TYR A 120 13.256 -3.595 -14.425 1.00 0.00 C ATOM 1908 CE2 TYR A 120 13.311 -1.442 -15.466 1.00 0.00 C ATOM 1909 CZ TYR A 120 13.046 -2.794 -15.528 1.00 0.00 C ATOM 1910 OH TYR A 120 12.571 -3.346 -16.695 1.00 0.00 O ATOM 0 H TYR A 120 13.048 0.772 -9.954 1.00 0.00 H new ATOM 0 HA TYR A 120 12.832 -1.939 -10.893 1.00 0.00 H new ATOM 0 HB2 TYR A 120 14.810 -0.033 -12.072 1.00 0.00 H new ATOM 0 HB3 TYR A 120 15.440 -1.595 -11.589 1.00 0.00 H new ATOM 0 HD1 TYR A 120 13.896 -3.667 -12.393 1.00 0.00 H new ATOM 0 HD2 TYR A 120 13.995 0.168 -14.249 1.00 0.00 H new ATOM 0 HE1 TYR A 120 13.048 -4.654 -14.476 1.00 0.00 H new ATOM 0 HE2 TYR A 120 13.145 -0.817 -16.331 1.00 0.00 H new ATOM 0 HH TYR A 120 12.478 -2.646 -17.374 1.00 0.00 H new ATOM 1920 N GLU A 121 13.561 -1.969 -8.456 1.00 0.00 N ATOM 1921 CA GLU A 121 14.133 -2.279 -7.151 1.00 0.00 C ATOM 1922 C GLU A 121 14.948 -1.113 -6.603 1.00 0.00 C ATOM 1923 O GLU A 121 14.940 -0.012 -7.156 1.00 0.00 O ATOM 1924 CB GLU A 121 15.000 -3.540 -7.239 1.00 0.00 C ATOM 1925 CG GLU A 121 16.053 -3.485 -8.332 1.00 0.00 C ATOM 1926 CD GLU A 121 16.999 -4.670 -8.292 1.00 0.00 C ATOM 1927 OE1 GLU A 121 17.441 -5.038 -7.183 1.00 0.00 O ATOM 1928 OE2 GLU A 121 17.297 -5.229 -9.368 1.00 0.00 O ATOM 0 H GLU A 121 12.587 -2.254 -8.562 1.00 0.00 H new ATOM 0 HA GLU A 121 13.309 -2.459 -6.461 1.00 0.00 H new ATOM 0 HB2 GLU A 121 15.493 -3.698 -6.280 1.00 0.00 H new ATOM 0 HB3 GLU A 121 14.355 -4.402 -7.412 1.00 0.00 H new ATOM 0 HG2 GLU A 121 15.561 -3.451 -9.304 1.00 0.00 H new ATOM 0 HG3 GLU A 121 16.627 -2.564 -8.232 1.00 0.00 H new ATOM 1935 N GLY A 122 15.643 -1.365 -5.506 1.00 0.00 N ATOM 1936 CA GLY A 122 16.456 -0.336 -4.885 1.00 0.00 C ATOM 1937 C GLY A 122 15.801 0.252 -3.652 1.00 0.00 C ATOM 1938 O GLY A 122 16.483 0.729 -2.745 1.00 0.00 O ATOM 0 H GLY A 122 15.660 -2.267 -5.031 1.00 0.00 H new ATOM 0 HA2 GLY A 122 17.424 -0.757 -4.613 1.00 0.00 H new ATOM 0 HA3 GLY A 122 16.645 0.459 -5.607 1.00 0.00 H new ATOM 1942 N TYR A 123 14.474 0.215 -3.618 1.00 0.00 N ATOM 1943 CA TYR A 123 13.723 0.747 -2.488 1.00 0.00 C ATOM 1944 C TYR A 123 12.419 -0.022 -2.298 1.00 0.00 C ATOM 1945 O TYR A 123 11.614 -0.137 -3.222 1.00 0.00 O ATOM 1946 CB TYR A 123 13.430 2.233 -2.699 1.00 0.00 C ATOM 1947 CG TYR A 123 14.530 3.143 -2.200 1.00 0.00 C ATOM 1948 CD1 TYR A 123 15.596 3.491 -3.021 1.00 0.00 C ATOM 1949 CD2 TYR A 123 14.502 3.655 -0.909 1.00 0.00 C ATOM 1950 CE1 TYR A 123 16.603 4.322 -2.568 1.00 0.00 C ATOM 1951 CE2 TYR A 123 15.505 4.487 -0.449 1.00 0.00 C ATOM 1952 CZ TYR A 123 16.553 4.817 -1.282 1.00 0.00 C ATOM 1953 OH TYR A 123 17.554 5.645 -0.828 1.00 0.00 O ATOM 0 H TYR A 123 13.896 -0.178 -4.361 1.00 0.00 H new ATOM 0 HA TYR A 123 14.328 0.630 -1.589 1.00 0.00 H new ATOM 0 HB2 TYR A 123 13.272 2.416 -3.762 1.00 0.00 H new ATOM 0 HB3 TYR A 123 12.500 2.487 -2.190 1.00 0.00 H new ATOM 0 HD1 TYR A 123 15.638 3.106 -4.029 1.00 0.00 H new ATOM 0 HD2 TYR A 123 13.683 3.399 -0.254 1.00 0.00 H new ATOM 0 HE1 TYR A 123 17.425 4.582 -3.218 1.00 0.00 H new ATOM 0 HE2 TYR A 123 15.468 4.877 0.558 1.00 0.00 H new ATOM 0 HH TYR A 123 17.368 5.906 0.098 1.00 0.00 H new ATOM 1963 N PHE A 124 12.220 -0.548 -1.094 1.00 0.00 N ATOM 1964 CA PHE A 124 11.014 -1.308 -0.784 1.00 0.00 C ATOM 1965 C PHE A 124 10.209 -0.626 0.316 1.00 0.00 C ATOM 1966 O PHE A 124 10.773 -0.008 1.219 1.00 0.00 O ATOM 1967 CB PHE A 124 11.379 -2.732 -0.357 1.00 0.00 C ATOM 1968 CG PHE A 124 11.787 -3.617 -1.500 1.00 0.00 C ATOM 1969 CD1 PHE A 124 13.036 -3.489 -2.083 1.00 0.00 C ATOM 1970 CD2 PHE A 124 10.919 -4.581 -1.989 1.00 0.00 C ATOM 1971 CE1 PHE A 124 13.414 -4.305 -3.133 1.00 0.00 C ATOM 1972 CE2 PHE A 124 11.291 -5.401 -3.037 1.00 0.00 C ATOM 1973 CZ PHE A 124 12.540 -5.263 -3.611 1.00 0.00 C ATOM 0 H PHE A 124 12.877 -0.462 -0.318 1.00 0.00 H new ATOM 0 HA PHE A 124 10.401 -1.352 -1.684 1.00 0.00 H new ATOM 0 HB2 PHE A 124 12.193 -2.688 0.366 1.00 0.00 H new ATOM 0 HB3 PHE A 124 10.525 -3.180 0.151 1.00 0.00 H new ATOM 0 HD1 PHE A 124 13.723 -2.743 -1.713 1.00 0.00 H new ATOM 0 HD2 PHE A 124 9.941 -4.692 -1.546 1.00 0.00 H new ATOM 0 HE1 PHE A 124 14.391 -4.194 -3.579 1.00 0.00 H new ATOM 0 HE2 PHE A 124 10.606 -6.149 -3.407 1.00 0.00 H new ATOM 0 HZ PHE A 124 12.833 -5.902 -4.431 1.00 0.00 H new ATOM 1983 N LEU A 125 8.887 -0.745 0.237 1.00 0.00 N ATOM 1984 CA LEU A 125 8.009 -0.140 1.231 1.00 0.00 C ATOM 1985 C LEU A 125 8.068 -0.911 2.545 1.00 0.00 C ATOM 1986 O LEU A 125 7.720 -2.090 2.602 1.00 0.00 O ATOM 1987 CB LEU A 125 6.570 -0.097 0.712 1.00 0.00 C ATOM 1988 CG LEU A 125 6.153 1.228 0.072 1.00 0.00 C ATOM 1989 CD1 LEU A 125 4.729 1.141 -0.454 1.00 0.00 C ATOM 1990 CD2 LEU A 125 6.285 2.367 1.071 1.00 0.00 C ATOM 0 H LEU A 125 8.402 -1.253 -0.503 1.00 0.00 H new ATOM 0 HA LEU A 125 8.351 0.879 1.413 1.00 0.00 H new ATOM 0 HB2 LEU A 125 6.440 -0.894 -0.020 1.00 0.00 H new ATOM 0 HB3 LEU A 125 5.894 -0.312 1.540 1.00 0.00 H new ATOM 0 HG LEU A 125 6.818 1.429 -0.768 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.449 2.093 -0.906 1.00 0.00 H new ATOM 0 HD12 LEU A 125 4.665 0.351 -1.202 1.00 0.00 H new ATOM 0 HD13 LEU A 125 4.050 0.917 0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.984 3.302 0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.644 2.173 1.931 1.00 0.00 H new ATOM 0 HD23 LEU A 125 7.321 2.444 1.400 1.00 0.00 H new ATOM 2002 N ALA A 126 8.514 -0.237 3.600 1.00 0.00 N ATOM 2003 CA ALA A 126 8.624 -0.859 4.913 1.00 0.00 C ATOM 2004 C ALA A 126 7.787 -0.114 5.948 1.00 0.00 C ATOM 2005 O ALA A 126 7.127 0.877 5.632 1.00 0.00 O ATOM 2006 CB ALA A 126 10.079 -0.912 5.352 1.00 0.00 C ATOM 0 H ALA A 126 8.805 0.740 3.571 1.00 0.00 H new ATOM 0 HA ALA A 126 8.240 -1.876 4.837 1.00 0.00 H new ATOM 0 HB1 ALA A 126 10.146 -1.379 6.335 1.00 0.00 H new ATOM 0 HB2 ALA A 126 10.655 -1.495 4.633 1.00 0.00 H new ATOM 0 HB3 ALA A 126 10.481 0.100 5.403 1.00 0.00 H new ATOM 2012 N CYS A 127 7.821 -0.599 7.184 1.00 0.00 N ATOM 2013 CA CYS A 127 7.068 0.020 8.269 1.00 0.00 C ATOM 2014 C CYS A 127 8.006 0.552 9.348 1.00 0.00 C ATOM 2015 O CYS A 127 9.036 -0.053 9.643 1.00 0.00 O ATOM 2016 CB CYS A 127 6.090 -0.987 8.879 1.00 0.00 C ATOM 2017 SG CYS A 127 6.880 -2.463 9.562 1.00 0.00 S ATOM 0 H CYS A 127 8.362 -1.419 7.460 1.00 0.00 H new ATOM 0 HA CYS A 127 6.506 0.858 7.856 1.00 0.00 H new ATOM 0 HB2 CYS A 127 5.522 -0.494 9.668 1.00 0.00 H new ATOM 0 HB3 CYS A 127 5.375 -1.291 8.115 1.00 0.00 H new ATOM 0 HG CYS A 127 7.372 -3.179 8.595 1.00 0.00 H new ATOM 2023 N GLU A 128 7.642 1.689 9.931 1.00 0.00 N ATOM 2024 CA GLU A 128 8.449 2.305 10.977 1.00 0.00 C ATOM 2025 C GLU A 128 7.638 2.482 12.256 1.00 0.00 C ATOM 2026 O GLU A 128 6.568 3.093 12.246 1.00 0.00 O ATOM 2027 CB GLU A 128 8.984 3.659 10.507 1.00 0.00 C ATOM 2028 CG GLU A 128 10.384 3.968 11.011 1.00 0.00 C ATOM 2029 CD GLU A 128 10.879 5.329 10.562 1.00 0.00 C ATOM 2030 OE1 GLU A 128 10.340 6.346 11.045 1.00 0.00 O ATOM 2031 OE2 GLU A 128 11.807 5.377 9.727 1.00 0.00 O ATOM 0 H GLU A 128 6.793 2.203 9.696 1.00 0.00 H new ATOM 0 HA GLU A 128 9.289 1.644 11.189 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.986 3.681 9.417 1.00 0.00 H new ATOM 0 HB3 GLU A 128 8.305 4.444 10.840 1.00 0.00 H new ATOM 0 HG2 GLU A 128 10.392 3.924 12.100 1.00 0.00 H new ATOM 0 HG3 GLU A 128 11.072 3.200 10.656 1.00 0.00 H new ATOM 2038 N LYS A 129 8.154 1.942 13.354 1.00 0.00 N ATOM 2039 CA LYS A 129 7.480 2.037 14.643 1.00 0.00 C ATOM 2040 C LYS A 129 7.752 3.384 15.302 1.00 0.00 C ATOM 2041 O LYS A 129 8.770 3.565 15.972 1.00 0.00 O ATOM 2042 CB LYS A 129 7.935 0.905 15.566 1.00 0.00 C ATOM 2043 CG LYS A 129 7.115 0.797 16.841 1.00 0.00 C ATOM 2044 CD LYS A 129 5.639 0.584 16.539 1.00 0.00 C ATOM 2045 CE LYS A 129 4.797 1.759 17.010 1.00 0.00 C ATOM 2046 NZ LYS A 129 3.440 1.330 17.451 1.00 0.00 N ATOM 0 H LYS A 129 9.038 1.433 13.377 1.00 0.00 H new ATOM 0 HA LYS A 129 6.408 1.947 14.470 1.00 0.00 H new ATOM 0 HB2 LYS A 129 7.878 -0.040 15.025 1.00 0.00 H new ATOM 0 HB3 LYS A 129 8.982 1.059 15.828 1.00 0.00 H new ATOM 0 HG2 LYS A 129 7.487 -0.031 17.445 1.00 0.00 H new ATOM 0 HG3 LYS A 129 7.239 1.704 17.432 1.00 0.00 H new ATOM 0 HD2 LYS A 129 5.503 0.445 15.467 1.00 0.00 H new ATOM 0 HD3 LYS A 129 5.295 -0.329 17.025 1.00 0.00 H new ATOM 0 HE2 LYS A 129 5.304 2.262 17.834 1.00 0.00 H new ATOM 0 HE3 LYS A 129 4.703 2.485 16.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.720 1.790 16.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 3.355 0.298 17.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 3.296 1.602 18.444 1.00 0.00 H new ATOM 2060 N GLU A 130 6.835 4.326 15.112 1.00 0.00 N ATOM 2061 CA GLU A 130 6.975 5.656 15.690 1.00 0.00 C ATOM 2062 C GLU A 130 5.990 5.851 16.837 1.00 0.00 C ATOM 2063 O GLU A 130 4.791 6.028 16.617 1.00 0.00 O ATOM 2064 CB GLU A 130 6.752 6.727 14.622 1.00 0.00 C ATOM 2065 CG GLU A 130 8.031 7.169 13.929 1.00 0.00 C ATOM 2066 CD GLU A 130 8.219 8.674 13.953 1.00 0.00 C ATOM 2067 OE1 GLU A 130 8.830 9.180 14.918 1.00 0.00 O ATOM 2068 OE2 GLU A 130 7.755 9.345 13.007 1.00 0.00 O ATOM 0 H GLU A 130 5.987 4.192 14.562 1.00 0.00 H new ATOM 0 HA GLU A 130 7.988 5.752 16.081 1.00 0.00 H new ATOM 0 HB2 GLU A 130 6.057 6.344 13.875 1.00 0.00 H new ATOM 0 HB3 GLU A 130 6.279 7.595 15.082 1.00 0.00 H new ATOM 0 HG2 GLU A 130 8.884 6.693 14.412 1.00 0.00 H new ATOM 0 HG3 GLU A 130 8.017 6.825 12.895 1.00 0.00 H new ATOM 2075 N ARG A 131 6.502 5.811 18.062 1.00 0.00 N ATOM 2076 CA ARG A 131 5.668 5.980 19.243 1.00 0.00 C ATOM 2077 C ARG A 131 4.618 4.865 19.325 1.00 0.00 C ATOM 2078 O ARG A 131 4.965 3.698 19.516 1.00 0.00 O ATOM 2079 CB ARG A 131 5.007 7.364 19.229 1.00 0.00 C ATOM 2080 CG ARG A 131 6.001 8.513 19.261 1.00 0.00 C ATOM 2081 CD ARG A 131 5.300 9.859 19.174 1.00 0.00 C ATOM 2082 NE ARG A 131 5.809 10.805 20.164 1.00 0.00 N ATOM 2083 CZ ARG A 131 5.447 10.804 21.446 1.00 0.00 C ATOM 2084 NH1 ARG A 131 4.576 9.911 21.897 1.00 0.00 N ATOM 2085 NH2 ARG A 131 5.959 11.700 22.279 1.00 0.00 N ATOM 0 H ARG A 131 7.491 5.663 18.262 1.00 0.00 H new ATOM 0 HA ARG A 131 6.296 5.911 20.131 1.00 0.00 H new ATOM 0 HB2 ARG A 131 4.390 7.454 18.335 1.00 0.00 H new ATOM 0 HB3 ARG A 131 4.340 7.448 20.087 1.00 0.00 H new ATOM 0 HG2 ARG A 131 6.585 8.465 20.180 1.00 0.00 H new ATOM 0 HG3 ARG A 131 6.702 8.412 18.432 1.00 0.00 H new ATOM 0 HD2 ARG A 131 5.433 10.273 18.175 1.00 0.00 H new ATOM 0 HD3 ARG A 131 4.229 9.720 19.322 1.00 0.00 H new ATOM 0 HE ARG A 131 6.481 11.508 19.856 1.00 0.00 H new ATOM 0 HH11 ARG A 131 4.179 9.219 21.261 1.00 0.00 H new ATOM 0 HH12 ARG A 131 4.303 9.916 22.880 1.00 0.00 H new ATOM 0 HH21 ARG A 131 6.629 12.389 21.938 1.00 0.00 H new ATOM 0 HH22 ARG A 131 5.682 11.700 23.261 1.00 0.00 H new ATOM 2099 N ASP A 132 3.339 5.215 19.181 1.00 0.00 N ATOM 2100 CA ASP A 132 2.268 4.226 19.240 1.00 0.00 C ATOM 2101 C ASP A 132 1.635 4.010 17.868 1.00 0.00 C ATOM 2102 O ASP A 132 0.529 3.479 17.765 1.00 0.00 O ATOM 2103 CB ASP A 132 1.198 4.665 20.242 1.00 0.00 C ATOM 2104 CG ASP A 132 1.788 5.083 21.574 1.00 0.00 C ATOM 2105 OD1 ASP A 132 2.548 4.286 22.163 1.00 0.00 O ATOM 2106 OD2 ASP A 132 1.490 6.207 22.028 1.00 0.00 O ATOM 0 H ASP A 132 3.023 6.172 19.023 1.00 0.00 H new ATOM 0 HA ASP A 132 2.704 3.282 19.566 1.00 0.00 H new ATOM 0 HB2 ASP A 132 0.631 5.496 19.823 1.00 0.00 H new ATOM 0 HB3 ASP A 132 0.495 3.847 20.400 1.00 0.00 H new ATOM 2111 N LEU A 133 2.333 4.427 16.814 1.00 0.00 N ATOM 2112 CA LEU A 133 1.819 4.275 15.456 1.00 0.00 C ATOM 2113 C LEU A 133 2.896 3.758 14.507 1.00 0.00 C ATOM 2114 O LEU A 133 4.056 4.164 14.583 1.00 0.00 O ATOM 2115 CB LEU A 133 1.279 5.611 14.942 1.00 0.00 C ATOM 2116 CG LEU A 133 0.195 6.249 15.812 1.00 0.00 C ATOM 2117 CD1 LEU A 133 0.243 7.764 15.697 1.00 0.00 C ATOM 2118 CD2 LEU A 133 -1.179 5.725 15.419 1.00 0.00 C ATOM 0 H LEU A 133 3.250 4.870 16.874 1.00 0.00 H new ATOM 0 HA LEU A 133 1.011 3.544 15.488 1.00 0.00 H new ATOM 0 HB2 LEU A 133 2.110 6.311 14.852 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.878 5.462 13.940 1.00 0.00 H new ATOM 0 HG LEU A 133 0.382 5.978 16.851 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.535 8.201 16.323 1.00 0.00 H new ATOM 0 HD12 LEU A 133 1.218 8.123 16.026 1.00 0.00 H new ATOM 0 HD13 LEU A 133 0.081 8.055 14.659 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -1.939 6.189 16.048 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -1.375 5.966 14.374 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -1.208 4.644 15.553 1.00 0.00 H new ATOM 2130 N PHE A 134 2.497 2.865 13.606 1.00 0.00 N ATOM 2131 CA PHE A 134 3.418 2.296 12.628 1.00 0.00 C ATOM 2132 C PHE A 134 3.283 3.023 11.294 1.00 0.00 C ATOM 2133 O PHE A 134 2.356 2.762 10.527 1.00 0.00 O ATOM 2134 CB PHE A 134 3.137 0.802 12.442 1.00 0.00 C ATOM 2135 CG PHE A 134 4.176 -0.088 13.060 1.00 0.00 C ATOM 2136 CD1 PHE A 134 5.484 -0.070 12.602 1.00 0.00 C ATOM 2137 CD2 PHE A 134 3.846 -0.946 14.097 1.00 0.00 C ATOM 2138 CE1 PHE A 134 6.442 -0.889 13.168 1.00 0.00 C ATOM 2139 CE2 PHE A 134 4.799 -1.767 14.667 1.00 0.00 C ATOM 2140 CZ PHE A 134 6.100 -1.739 14.201 1.00 0.00 C ATOM 0 H PHE A 134 1.540 2.519 13.533 1.00 0.00 H new ATOM 0 HA PHE A 134 4.437 2.419 12.995 1.00 0.00 H new ATOM 0 HB2 PHE A 134 2.165 0.567 12.876 1.00 0.00 H new ATOM 0 HB3 PHE A 134 3.071 0.583 11.376 1.00 0.00 H new ATOM 0 HD1 PHE A 134 5.757 0.592 11.793 1.00 0.00 H new ATOM 0 HD2 PHE A 134 2.831 -0.973 14.464 1.00 0.00 H new ATOM 0 HE1 PHE A 134 7.458 -0.864 12.803 1.00 0.00 H new ATOM 0 HE2 PHE A 134 4.528 -2.430 15.476 1.00 0.00 H new ATOM 0 HZ PHE A 134 6.847 -2.381 14.644 1.00 0.00 H new ATOM 2150 N LYS A 135 4.205 3.940 11.025 1.00 0.00 N ATOM 2151 CA LYS A 135 4.174 4.710 9.787 1.00 0.00 C ATOM 2152 C LYS A 135 4.874 3.967 8.653 1.00 0.00 C ATOM 2153 O LYS A 135 5.997 3.490 8.810 1.00 0.00 O ATOM 2154 CB LYS A 135 4.826 6.077 9.998 1.00 0.00 C ATOM 2155 CG LYS A 135 3.955 7.048 10.782 1.00 0.00 C ATOM 2156 CD LYS A 135 4.729 7.712 11.909 1.00 0.00 C ATOM 2157 CE LYS A 135 3.887 7.826 13.168 1.00 0.00 C ATOM 2158 NZ LYS A 135 3.266 9.173 13.301 1.00 0.00 N ATOM 0 H LYS A 135 4.982 4.168 11.646 1.00 0.00 H new ATOM 0 HA LYS A 135 3.130 4.849 9.506 1.00 0.00 H new ATOM 0 HB2 LYS A 135 5.771 5.943 10.524 1.00 0.00 H new ATOM 0 HB3 LYS A 135 5.060 6.513 9.027 1.00 0.00 H new ATOM 0 HG2 LYS A 135 3.565 7.812 10.109 1.00 0.00 H new ATOM 0 HG3 LYS A 135 3.097 6.517 11.193 1.00 0.00 H new ATOM 0 HD2 LYS A 135 5.629 7.136 12.123 1.00 0.00 H new ATOM 0 HD3 LYS A 135 5.053 8.704 11.595 1.00 0.00 H new ATOM 0 HE2 LYS A 135 3.106 7.066 13.152 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.509 7.625 14.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 2.700 9.210 14.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.012 9.897 13.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 2.652 9.355 12.482 1.00 0.00 H new ATOM 2172 N LEU A 136 4.200 3.875 7.510 1.00 0.00 N ATOM 2173 CA LEU A 136 4.752 3.191 6.346 1.00 0.00 C ATOM 2174 C LEU A 136 5.616 4.135 5.516 1.00 0.00 C ATOM 2175 O LEU A 136 5.178 5.223 5.140 1.00 0.00 O ATOM 2176 CB LEU A 136 3.618 2.623 5.485 1.00 0.00 C ATOM 2177 CG LEU A 136 4.053 2.002 4.154 1.00 0.00 C ATOM 2178 CD1 LEU A 136 4.311 0.513 4.319 1.00 0.00 C ATOM 2179 CD2 LEU A 136 2.998 2.244 3.084 1.00 0.00 C ATOM 0 H LEU A 136 3.269 4.266 7.366 1.00 0.00 H new ATOM 0 HA LEU A 136 5.381 2.373 6.697 1.00 0.00 H new ATOM 0 HB2 LEU A 136 3.089 1.866 6.064 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.906 3.422 5.278 1.00 0.00 H new ATOM 0 HG LEU A 136 4.981 2.479 3.839 1.00 0.00 H new ATOM 0 HD11 LEU A 136 4.619 0.089 3.363 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.100 0.360 5.055 1.00 0.00 H new ATOM 0 HD13 LEU A 136 3.399 0.021 4.657 1.00 0.00 H new ATOM 0 HD21 LEU A 136 3.323 1.796 2.145 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.055 1.793 3.394 1.00 0.00 H new ATOM 0 HD23 LEU A 136 2.859 3.316 2.946 1.00 0.00 H new ATOM 2191 N ILE A 137 6.841 3.708 5.226 1.00 0.00 N ATOM 2192 CA ILE A 137 7.763 4.514 4.433 1.00 0.00 C ATOM 2193 C ILE A 137 8.489 3.651 3.402 1.00 0.00 C ATOM 2194 O ILE A 137 8.311 2.434 3.366 1.00 0.00 O ATOM 2195 CB ILE A 137 8.799 5.246 5.323 1.00 0.00 C ATOM 2196 CG1 ILE A 137 9.974 4.328 5.686 1.00 0.00 C ATOM 2197 CG2 ILE A 137 8.134 5.777 6.584 1.00 0.00 C ATOM 2198 CD1 ILE A 137 9.557 2.984 6.243 1.00 0.00 C ATOM 0 H ILE A 137 7.218 2.810 5.528 1.00 0.00 H new ATOM 0 HA ILE A 137 7.166 5.266 3.916 1.00 0.00 H new ATOM 0 HB ILE A 137 9.195 6.086 4.752 1.00 0.00 H new ATOM 0 HG12 ILE A 137 10.584 4.168 4.797 1.00 0.00 H new ATOM 0 HG13 ILE A 137 10.604 4.833 6.418 1.00 0.00 H new ATOM 0 HG21 ILE A 137 8.875 6.288 7.198 1.00 0.00 H new ATOM 0 HG22 ILE A 137 7.343 6.476 6.312 1.00 0.00 H new ATOM 0 HG23 ILE A 137 7.706 4.947 7.147 1.00 0.00 H new ATOM 0 HD11 ILE A 137 10.444 2.395 6.474 1.00 0.00 H new ATOM 0 HD12 ILE A 137 8.973 3.132 7.151 1.00 0.00 H new ATOM 0 HD13 ILE A 137 8.953 2.456 5.505 1.00 0.00 H new ATOM 2210 N LEU A 138 9.310 4.283 2.571 1.00 0.00 N ATOM 2211 CA LEU A 138 10.063 3.562 1.551 1.00 0.00 C ATOM 2212 C LEU A 138 11.542 3.513 1.914 1.00 0.00 C ATOM 2213 O LEU A 138 12.236 4.528 1.876 1.00 0.00 O ATOM 2214 CB LEU A 138 9.879 4.219 0.182 1.00 0.00 C ATOM 2215 CG LEU A 138 10.690 3.589 -0.952 1.00 0.00 C ATOM 2216 CD1 LEU A 138 9.980 2.359 -1.496 1.00 0.00 C ATOM 2217 CD2 LEU A 138 10.932 4.602 -2.061 1.00 0.00 C ATOM 0 H LEU A 138 9.471 5.290 2.583 1.00 0.00 H new ATOM 0 HA LEU A 138 9.681 2.542 1.502 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.822 4.182 -0.083 1.00 0.00 H new ATOM 0 HB3 LEU A 138 10.151 5.272 0.261 1.00 0.00 H new ATOM 0 HG LEU A 138 11.656 3.279 -0.554 1.00 0.00 H new ATOM 0 HD11 LEU A 138 10.571 1.924 -2.302 1.00 0.00 H new ATOM 0 HD12 LEU A 138 9.859 1.626 -0.698 1.00 0.00 H new ATOM 0 HD13 LEU A 138 9.000 2.644 -1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 138 11.510 4.137 -2.859 1.00 0.00 H new ATOM 0 HD22 LEU A 138 9.976 4.943 -2.457 1.00 0.00 H new ATOM 0 HD23 LEU A 138 11.484 5.453 -1.662 1.00 0.00 H new ATOM 2229 N LYS A 139 12.017 2.325 2.276 1.00 0.00 N ATOM 2230 CA LYS A 139 13.412 2.147 2.657 1.00 0.00 C ATOM 2231 C LYS A 139 13.940 0.794 2.194 1.00 0.00 C ATOM 2232 O LYS A 139 13.235 0.032 1.531 1.00 0.00 O ATOM 2233 CB LYS A 139 13.557 2.272 4.174 1.00 0.00 C ATOM 2234 CG LYS A 139 12.839 1.176 4.944 1.00 0.00 C ATOM 2235 CD LYS A 139 12.967 1.375 6.446 1.00 0.00 C ATOM 2236 CE LYS A 139 14.400 1.183 6.914 1.00 0.00 C ATOM 2237 NZ LYS A 139 14.879 2.335 7.726 1.00 0.00 N ATOM 0 H LYS A 139 11.457 1.473 2.313 1.00 0.00 H new ATOM 0 HA LYS A 139 14.000 2.926 2.171 1.00 0.00 H new ATOM 0 HB2 LYS A 139 14.616 2.253 4.433 1.00 0.00 H new ATOM 0 HB3 LYS A 139 13.169 3.241 4.490 1.00 0.00 H new ATOM 0 HG2 LYS A 139 11.785 1.165 4.666 1.00 0.00 H new ATOM 0 HG3 LYS A 139 13.252 0.206 4.668 1.00 0.00 H new ATOM 0 HD2 LYS A 139 12.628 2.376 6.711 1.00 0.00 H new ATOM 0 HD3 LYS A 139 12.317 0.670 6.964 1.00 0.00 H new ATOM 0 HE2 LYS A 139 14.470 0.269 7.504 1.00 0.00 H new ATOM 0 HE3 LYS A 139 15.050 1.054 6.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 15.860 2.165 8.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 14.837 3.203 7.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 14.275 2.443 8.566 1.00 0.00 H new ATOM 2251 N LYS A 140 15.187 0.500 2.550 1.00 0.00 N ATOM 2252 CA LYS A 140 15.815 -0.762 2.177 1.00 0.00 C ATOM 2253 C LYS A 140 16.314 -1.502 3.413 1.00 0.00 C ATOM 2254 O LYS A 140 17.376 -1.189 3.951 1.00 0.00 O ATOM 2255 CB LYS A 140 16.976 -0.516 1.212 1.00 0.00 C ATOM 2256 CG LYS A 140 17.558 -1.790 0.622 1.00 0.00 C ATOM 2257 CD LYS A 140 16.558 -2.495 -0.280 1.00 0.00 C ATOM 2258 CE LYS A 140 15.850 -3.628 0.449 1.00 0.00 C ATOM 2259 NZ LYS A 140 14.397 -3.358 0.629 1.00 0.00 N ATOM 0 H LYS A 140 15.783 1.121 3.098 1.00 0.00 H new ATOM 0 HA LYS A 140 15.067 -1.379 1.680 1.00 0.00 H new ATOM 0 HB2 LYS A 140 16.633 0.126 0.401 1.00 0.00 H new ATOM 0 HB3 LYS A 140 17.764 0.025 1.736 1.00 0.00 H new ATOM 0 HG2 LYS A 140 18.457 -1.551 0.053 1.00 0.00 H new ATOM 0 HG3 LYS A 140 17.859 -2.460 1.427 1.00 0.00 H new ATOM 0 HD2 LYS A 140 15.822 -1.776 -0.640 1.00 0.00 H new ATOM 0 HD3 LYS A 140 17.072 -2.890 -1.156 1.00 0.00 H new ATOM 0 HE2 LYS A 140 15.979 -4.555 -0.110 1.00 0.00 H new ATOM 0 HE3 LYS A 140 16.314 -3.777 1.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 14.089 -3.720 1.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 14.226 -2.333 0.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 13.860 -3.832 -0.125 1.00 0.00 H new ATOM 2273 N GLU A 141 15.540 -2.486 3.860 1.00 0.00 N ATOM 2274 CA GLU A 141 15.901 -3.271 5.032 1.00 0.00 C ATOM 2275 C GLU A 141 17.230 -3.989 4.819 1.00 0.00 C ATOM 2276 O GLU A 141 17.750 -4.036 3.705 1.00 0.00 O ATOM 2277 CB GLU A 141 14.800 -4.290 5.338 1.00 0.00 C ATOM 2278 CG GLU A 141 14.058 -4.022 6.639 1.00 0.00 C ATOM 2279 CD GLU A 141 14.992 -3.785 7.810 1.00 0.00 C ATOM 2280 OE1 GLU A 141 15.367 -4.770 8.478 1.00 0.00 O ATOM 2281 OE2 GLU A 141 15.349 -2.614 8.057 1.00 0.00 O ATOM 0 H GLU A 141 14.658 -2.758 3.426 1.00 0.00 H new ATOM 0 HA GLU A 141 16.010 -2.593 5.878 1.00 0.00 H new ATOM 0 HB2 GLU A 141 14.084 -4.294 4.517 1.00 0.00 H new ATOM 0 HB3 GLU A 141 15.241 -5.286 5.381 1.00 0.00 H new ATOM 0 HG2 GLU A 141 13.414 -3.152 6.512 1.00 0.00 H new ATOM 0 HG3 GLU A 141 13.409 -4.869 6.863 1.00 0.00 H new ATOM 2288 N ASP A 142 17.771 -4.552 5.895 1.00 0.00 N ATOM 2289 CA ASP A 142 19.036 -5.273 5.824 1.00 0.00 C ATOM 2290 C ASP A 142 18.819 -6.680 5.279 1.00 0.00 C ATOM 2291 O ASP A 142 19.693 -7.247 4.624 1.00 0.00 O ATOM 2292 CB ASP A 142 19.688 -5.342 7.206 1.00 0.00 C ATOM 2293 CG ASP A 142 20.014 -3.969 7.761 1.00 0.00 C ATOM 2294 OD1 ASP A 142 19.094 -3.310 8.290 1.00 0.00 O ATOM 2295 OD2 ASP A 142 21.187 -3.553 7.665 1.00 0.00 O ATOM 0 H ASP A 142 17.353 -4.523 6.825 1.00 0.00 H new ATOM 0 HA ASP A 142 19.700 -4.735 5.148 1.00 0.00 H new ATOM 0 HB2 ASP A 142 19.020 -5.860 7.894 1.00 0.00 H new ATOM 0 HB3 ASP A 142 20.602 -5.932 7.144 1.00 0.00 H new ATOM 2300 N GLU A 143 17.641 -7.235 5.550 1.00 0.00 N ATOM 2301 CA GLU A 143 17.298 -8.573 5.084 1.00 0.00 C ATOM 2302 C GLU A 143 16.022 -8.539 4.251 1.00 0.00 C ATOM 2303 O GLU A 143 14.979 -8.078 4.713 1.00 0.00 O ATOM 2304 CB GLU A 143 17.121 -9.523 6.270 1.00 0.00 C ATOM 2305 CG GLU A 143 18.199 -9.377 7.331 1.00 0.00 C ATOM 2306 CD GLU A 143 18.561 -10.698 7.980 1.00 0.00 C ATOM 2307 OE1 GLU A 143 17.638 -11.479 8.291 1.00 0.00 O ATOM 2308 OE2 GLU A 143 19.768 -10.950 8.179 1.00 0.00 O ATOM 0 H GLU A 143 16.907 -6.777 6.091 1.00 0.00 H new ATOM 0 HA GLU A 143 18.115 -8.936 4.460 1.00 0.00 H new ATOM 0 HB2 GLU A 143 16.147 -9.344 6.726 1.00 0.00 H new ATOM 0 HB3 GLU A 143 17.118 -10.550 5.905 1.00 0.00 H new ATOM 0 HG2 GLU A 143 19.091 -8.942 6.880 1.00 0.00 H new ATOM 0 HG3 GLU A 143 17.857 -8.681 8.098 1.00 0.00 H new ATOM 2315 N LEU A 144 16.113 -9.026 3.019 1.00 0.00 N ATOM 2316 CA LEU A 144 14.966 -9.048 2.121 1.00 0.00 C ATOM 2317 C LEU A 144 13.907 -10.034 2.605 1.00 0.00 C ATOM 2318 O LEU A 144 12.731 -9.913 2.263 1.00 0.00 O ATOM 2319 CB LEU A 144 15.409 -9.405 0.700 1.00 0.00 C ATOM 2320 CG LEU A 144 16.476 -8.487 0.096 1.00 0.00 C ATOM 2321 CD1 LEU A 144 16.516 -8.638 -1.417 1.00 0.00 C ATOM 2322 CD2 LEU A 144 16.222 -7.034 0.479 1.00 0.00 C ATOM 0 H LEU A 144 16.969 -9.411 2.620 1.00 0.00 H new ATOM 0 HA LEU A 144 14.525 -8.051 2.115 1.00 0.00 H new ATOM 0 HB2 LEU A 144 15.791 -10.426 0.702 1.00 0.00 H new ATOM 0 HB3 LEU A 144 14.534 -9.393 0.051 1.00 0.00 H new ATOM 0 HG LEU A 144 17.445 -8.782 0.500 1.00 0.00 H new ATOM 0 HD11 LEU A 144 17.280 -7.978 -1.828 1.00 0.00 H new ATOM 0 HD12 LEU A 144 16.752 -9.671 -1.673 1.00 0.00 H new ATOM 0 HD13 LEU A 144 15.545 -8.373 -1.835 1.00 0.00 H new ATOM 0 HD21 LEU A 144 16.993 -6.402 0.038 1.00 0.00 H new ATOM 0 HD22 LEU A 144 15.244 -6.726 0.109 1.00 0.00 H new ATOM 0 HD23 LEU A 144 16.247 -6.934 1.564 1.00 0.00 H new ATOM 2334 N GLY A 145 14.328 -11.006 3.409 1.00 0.00 N ATOM 2335 CA GLY A 145 13.399 -11.990 3.931 1.00 0.00 C ATOM 2336 C GLY A 145 12.890 -11.620 5.310 1.00 0.00 C ATOM 2337 O GLY A 145 12.471 -12.486 6.078 1.00 0.00 O ATOM 0 H GLY A 145 15.296 -11.129 3.708 1.00 0.00 H new ATOM 0 HA2 GLY A 145 12.555 -12.089 3.248 1.00 0.00 H new ATOM 0 HA3 GLY A 145 13.889 -12.963 3.975 1.00 0.00 H new ATOM 2341 N ASP A 146 12.930 -10.329 5.625 1.00 0.00 N ATOM 2342 CA ASP A 146 12.473 -9.841 6.921 1.00 0.00 C ATOM 2343 C ASP A 146 10.991 -9.484 6.876 1.00 0.00 C ATOM 2344 O ASP A 146 10.566 -8.656 6.070 1.00 0.00 O ATOM 2345 CB ASP A 146 13.293 -8.620 7.343 1.00 0.00 C ATOM 2346 CG ASP A 146 13.585 -8.607 8.831 1.00 0.00 C ATOM 2347 OD1 ASP A 146 13.619 -9.697 9.440 1.00 0.00 O ATOM 2348 OD2 ASP A 146 13.781 -7.506 9.387 1.00 0.00 O ATOM 0 H ASP A 146 13.275 -9.601 4.999 1.00 0.00 H new ATOM 0 HA ASP A 146 12.613 -10.636 7.653 1.00 0.00 H new ATOM 0 HB2 ASP A 146 14.233 -8.608 6.791 1.00 0.00 H new ATOM 0 HB3 ASP A 146 12.753 -7.712 7.073 1.00 0.00 H new ATOM 2353 N ARG A 147 10.209 -10.113 7.747 1.00 0.00 N ATOM 2354 CA ARG A 147 8.772 -9.863 7.808 1.00 0.00 C ATOM 2355 C ARG A 147 8.476 -8.381 8.028 1.00 0.00 C ATOM 2356 O ARG A 147 7.407 -7.893 7.660 1.00 0.00 O ATOM 2357 CB ARG A 147 8.134 -10.691 8.925 1.00 0.00 C ATOM 2358 CG ARG A 147 8.903 -10.648 10.236 1.00 0.00 C ATOM 2359 CD ARG A 147 8.158 -9.855 11.298 1.00 0.00 C ATOM 2360 NE ARG A 147 8.848 -9.882 12.586 1.00 0.00 N ATOM 2361 CZ ARG A 147 8.267 -9.577 13.745 1.00 0.00 C ATOM 2362 NH1 ARG A 147 6.989 -9.223 13.782 1.00 0.00 N ATOM 2363 NH2 ARG A 147 8.967 -9.625 14.870 1.00 0.00 N ATOM 0 H ARG A 147 10.546 -10.800 8.421 1.00 0.00 H new ATOM 0 HA ARG A 147 8.343 -10.160 6.851 1.00 0.00 H new ATOM 0 HB2 ARG A 147 7.120 -10.331 9.097 1.00 0.00 H new ATOM 0 HB3 ARG A 147 8.053 -11.727 8.596 1.00 0.00 H new ATOM 0 HG2 ARG A 147 9.072 -11.664 10.592 1.00 0.00 H new ATOM 0 HG3 ARG A 147 9.883 -10.201 10.069 1.00 0.00 H new ATOM 0 HD2 ARG A 147 8.047 -8.822 10.968 1.00 0.00 H new ATOM 0 HD3 ARG A 147 7.154 -10.262 11.416 1.00 0.00 H new ATOM 0 HE ARG A 147 9.832 -10.150 12.598 1.00 0.00 H new ATOM 0 HH11 ARG A 147 6.446 -9.183 12.920 1.00 0.00 H new ATOM 0 HH12 ARG A 147 6.550 -8.991 14.673 1.00 0.00 H new ATOM 0 HH21 ARG A 147 9.950 -9.895 14.848 1.00 0.00 H new ATOM 0 HH22 ARG A 147 8.522 -9.391 15.758 1.00 0.00 H new ATOM 2377 N SER A 148 9.425 -7.669 8.632 1.00 0.00 N ATOM 2378 CA SER A 148 9.258 -6.244 8.899 1.00 0.00 C ATOM 2379 C SER A 148 8.912 -5.483 7.622 1.00 0.00 C ATOM 2380 O SER A 148 8.241 -4.452 7.665 1.00 0.00 O ATOM 2381 CB SER A 148 10.533 -5.666 9.517 1.00 0.00 C ATOM 2382 OG SER A 148 10.471 -5.692 10.932 1.00 0.00 O ATOM 0 H SER A 148 10.316 -8.055 8.945 1.00 0.00 H new ATOM 0 HA SER A 148 8.434 -6.130 9.603 1.00 0.00 H new ATOM 0 HB2 SER A 148 11.397 -6.237 9.177 1.00 0.00 H new ATOM 0 HB3 SER A 148 10.674 -4.641 9.175 1.00 0.00 H new ATOM 0 HG SER A 148 11.298 -5.319 11.303 1.00 0.00 H new ATOM 2388 N ILE A 149 9.375 -5.997 6.489 1.00 0.00 N ATOM 2389 CA ILE A 149 9.116 -5.366 5.202 1.00 0.00 C ATOM 2390 C ILE A 149 8.075 -6.142 4.397 1.00 0.00 C ATOM 2391 O ILE A 149 7.928 -5.934 3.193 1.00 0.00 O ATOM 2392 CB ILE A 149 10.406 -5.250 4.371 1.00 0.00 C ATOM 2393 CG1 ILE A 149 11.119 -6.601 4.308 1.00 0.00 C ATOM 2394 CG2 ILE A 149 11.322 -4.190 4.962 1.00 0.00 C ATOM 2395 CD1 ILE A 149 12.225 -6.652 3.279 1.00 0.00 C ATOM 0 H ILE A 149 9.932 -6.850 6.436 1.00 0.00 H new ATOM 0 HA ILE A 149 8.730 -4.369 5.413 1.00 0.00 H new ATOM 0 HB ILE A 149 10.143 -4.951 3.357 1.00 0.00 H new ATOM 0 HG12 ILE A 149 11.536 -6.829 5.289 1.00 0.00 H new ATOM 0 HG13 ILE A 149 10.389 -7.378 4.083 1.00 0.00 H new ATOM 0 HG21 ILE A 149 12.230 -4.119 4.364 1.00 0.00 H new ATOM 0 HG22 ILE A 149 10.812 -3.227 4.962 1.00 0.00 H new ATOM 0 HG23 ILE A 149 11.582 -4.463 5.985 1.00 0.00 H new ATOM 0 HD11 ILE A 149 12.687 -7.639 3.290 1.00 0.00 H new ATOM 0 HD12 ILE A 149 11.811 -6.456 2.290 1.00 0.00 H new ATOM 0 HD13 ILE A 149 12.976 -5.898 3.514 1.00 0.00 H new ATOM 2407 N MET A 150 7.353 -7.035 5.069 1.00 0.00 N ATOM 2408 CA MET A 150 6.327 -7.837 4.413 1.00 0.00 C ATOM 2409 C MET A 150 4.938 -7.464 4.923 1.00 0.00 C ATOM 2410 O MET A 150 4.765 -7.132 6.095 1.00 0.00 O ATOM 2411 CB MET A 150 6.585 -9.327 4.649 1.00 0.00 C ATOM 2412 CG MET A 150 8.014 -9.753 4.351 1.00 0.00 C ATOM 2413 SD MET A 150 8.217 -11.544 4.372 1.00 0.00 S ATOM 2414 CE MET A 150 9.927 -11.686 4.889 1.00 0.00 C ATOM 0 H MET A 150 7.460 -7.221 6.066 1.00 0.00 H new ATOM 0 HA MET A 150 6.370 -7.633 3.343 1.00 0.00 H new ATOM 0 HB2 MET A 150 6.352 -9.567 5.686 1.00 0.00 H new ATOM 0 HB3 MET A 150 5.904 -9.908 4.027 1.00 0.00 H new ATOM 0 HG2 MET A 150 8.309 -9.368 3.375 1.00 0.00 H new ATOM 0 HG3 MET A 150 8.684 -9.306 5.085 1.00 0.00 H new ATOM 0 HE1 MET A 150 10.397 -12.519 4.366 1.00 0.00 H new ATOM 0 HE2 MET A 150 10.457 -10.763 4.652 1.00 0.00 H new ATOM 0 HE3 MET A 150 9.969 -11.862 5.964 1.00 0.00 H new ATOM 2424 N PHE A 151 3.952 -7.524 4.035 1.00 0.00 N ATOM 2425 CA PHE A 151 2.578 -7.194 4.395 1.00 0.00 C ATOM 2426 C PHE A 151 1.607 -8.235 3.846 1.00 0.00 C ATOM 2427 O PHE A 151 1.990 -9.095 3.054 1.00 0.00 O ATOM 2428 CB PHE A 151 2.210 -5.806 3.867 1.00 0.00 C ATOM 2429 CG PHE A 151 3.029 -4.700 4.466 1.00 0.00 C ATOM 2430 CD1 PHE A 151 3.079 -4.522 5.839 1.00 0.00 C ATOM 2431 CD2 PHE A 151 3.751 -3.837 3.656 1.00 0.00 C ATOM 2432 CE1 PHE A 151 3.833 -3.504 6.393 1.00 0.00 C ATOM 2433 CE2 PHE A 151 4.506 -2.817 4.204 1.00 0.00 C ATOM 2434 CZ PHE A 151 4.548 -2.652 5.574 1.00 0.00 C ATOM 0 H PHE A 151 4.079 -7.798 3.061 1.00 0.00 H new ATOM 0 HA PHE A 151 2.503 -7.192 5.482 1.00 0.00 H new ATOM 0 HB2 PHE A 151 2.334 -5.793 2.784 1.00 0.00 H new ATOM 0 HB3 PHE A 151 1.156 -5.617 4.069 1.00 0.00 H new ATOM 0 HD1 PHE A 151 2.523 -5.186 6.484 1.00 0.00 H new ATOM 0 HD2 PHE A 151 3.723 -3.963 2.584 1.00 0.00 H new ATOM 0 HE1 PHE A 151 3.863 -3.375 7.465 1.00 0.00 H new ATOM 0 HE2 PHE A 151 5.062 -2.150 3.562 1.00 0.00 H new ATOM 0 HZ PHE A 151 5.139 -1.858 6.005 1.00 0.00 H new ATOM 2444 N THR A 152 0.351 -8.150 4.272 1.00 0.00 N ATOM 2445 CA THR A 152 -0.671 -9.088 3.820 1.00 0.00 C ATOM 2446 C THR A 152 -1.826 -8.354 3.146 1.00 0.00 C ATOM 2447 O THR A 152 -2.323 -7.352 3.660 1.00 0.00 O ATOM 2448 CB THR A 152 -1.191 -9.916 4.999 1.00 0.00 C ATOM 2449 OG1 THR A 152 -0.836 -9.314 6.231 1.00 0.00 O ATOM 2450 CG2 THR A 152 -0.664 -11.334 5.012 1.00 0.00 C ATOM 0 H THR A 152 0.017 -7.444 4.928 1.00 0.00 H new ATOM 0 HA THR A 152 -0.217 -9.757 3.089 1.00 0.00 H new ATOM 0 HB THR A 152 -2.273 -9.949 4.874 1.00 0.00 H new ATOM 0 HG1 THR A 152 -1.179 -9.857 6.971 1.00 0.00 H new ATOM 0 HG21 THR A 152 -1.071 -11.865 5.872 1.00 0.00 H new ATOM 0 HG22 THR A 152 -0.965 -11.842 4.096 1.00 0.00 H new ATOM 0 HG23 THR A 152 0.424 -11.317 5.077 1.00 0.00 H new ATOM 2458 N VAL A 153 -2.251 -8.862 1.994 1.00 0.00 N ATOM 2459 CA VAL A 153 -3.351 -8.257 1.251 1.00 0.00 C ATOM 2460 C VAL A 153 -4.509 -9.237 1.095 1.00 0.00 C ATOM 2461 O VAL A 153 -4.330 -10.354 0.610 1.00 0.00 O ATOM 2462 CB VAL A 153 -2.906 -7.781 -0.147 1.00 0.00 C ATOM 2463 CG1 VAL A 153 -3.859 -6.720 -0.676 1.00 0.00 C ATOM 2464 CG2 VAL A 153 -1.477 -7.254 -0.112 1.00 0.00 C ATOM 0 H VAL A 153 -1.851 -9.691 1.555 1.00 0.00 H new ATOM 0 HA VAL A 153 -3.678 -7.392 1.828 1.00 0.00 H new ATOM 0 HB VAL A 153 -2.933 -8.635 -0.823 1.00 0.00 H new ATOM 0 HG11 VAL A 153 -3.530 -6.395 -1.663 1.00 0.00 H new ATOM 0 HG12 VAL A 153 -4.864 -7.136 -0.747 1.00 0.00 H new ATOM 0 HG13 VAL A 153 -3.867 -5.867 0.003 1.00 0.00 H new ATOM 0 HG21 VAL A 153 -1.186 -6.924 -1.109 1.00 0.00 H new ATOM 0 HG22 VAL A 153 -1.416 -6.414 0.580 1.00 0.00 H new ATOM 0 HG23 VAL A 153 -0.805 -8.046 0.219 1.00 0.00 H new ATOM 2474 N GLN A 154 -5.696 -8.811 1.512 1.00 0.00 N ATOM 2475 CA GLN A 154 -6.886 -9.650 1.424 1.00 0.00 C ATOM 2476 C GLN A 154 -7.922 -9.030 0.492 1.00 0.00 C ATOM 2477 O GLN A 154 -7.863 -7.840 0.187 1.00 0.00 O ATOM 2478 CB GLN A 154 -7.489 -9.859 2.814 1.00 0.00 C ATOM 2479 CG GLN A 154 -7.827 -11.310 3.117 1.00 0.00 C ATOM 2480 CD GLN A 154 -9.086 -11.454 3.948 1.00 0.00 C ATOM 2481 OE1 GLN A 154 -9.064 -12.029 5.036 1.00 0.00 O ATOM 2482 NE2 GLN A 154 -10.195 -10.931 3.437 1.00 0.00 N ATOM 0 H GLN A 154 -5.860 -7.888 1.915 1.00 0.00 H new ATOM 0 HA GLN A 154 -6.591 -10.616 1.015 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -6.788 -9.493 3.564 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -8.394 -9.257 2.903 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -7.950 -11.854 2.180 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -6.993 -11.771 3.646 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -10.168 -10.463 2.531 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -11.074 -10.998 3.950 1.00 0.00 H new ATOM 2491 N ASN A 155 -8.870 -9.844 0.041 1.00 0.00 N ATOM 2492 CA ASN A 155 -9.918 -9.370 -0.855 1.00 0.00 C ATOM 2493 C ASN A 155 -11.108 -8.834 -0.064 1.00 0.00 C ATOM 2494 O ASN A 155 -11.593 -9.484 0.863 1.00 0.00 O ATOM 2495 CB ASN A 155 -10.371 -10.496 -1.785 1.00 0.00 C ATOM 2496 CG ASN A 155 -9.836 -10.332 -3.194 1.00 0.00 C ATOM 2497 OD1 ASN A 155 -9.547 -9.220 -3.635 1.00 0.00 O ATOM 2498 ND2 ASN A 155 -9.701 -11.443 -3.908 1.00 0.00 N ATOM 0 H ASN A 155 -8.934 -10.833 0.281 1.00 0.00 H new ATOM 0 HA ASN A 155 -9.509 -8.557 -1.455 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -10.038 -11.453 -1.382 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -11.460 -10.524 -1.814 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -9.345 -11.396 -4.863 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -9.953 -12.344 -3.502 1.00 0.00 H new ATOM 2505 N GLU A 156 -11.575 -7.646 -0.436 1.00 0.00 N ATOM 2506 CA GLU A 156 -12.708 -7.025 0.239 1.00 0.00 C ATOM 2507 C GLU A 156 -13.970 -7.125 -0.612 1.00 0.00 C ATOM 2508 O GLU A 156 -14.057 -6.524 -1.684 1.00 0.00 O ATOM 2509 CB GLU A 156 -12.401 -5.559 0.556 1.00 0.00 C ATOM 2510 CG GLU A 156 -12.538 -5.215 2.030 1.00 0.00 C ATOM 2511 CD GLU A 156 -13.805 -4.441 2.333 1.00 0.00 C ATOM 2512 OE1 GLU A 156 -14.892 -4.894 1.914 1.00 0.00 O ATOM 2513 OE2 GLU A 156 -13.713 -3.382 2.989 1.00 0.00 O ATOM 0 H GLU A 156 -11.186 -7.095 -1.201 1.00 0.00 H new ATOM 0 HA GLU A 156 -12.881 -7.560 1.173 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -11.386 -5.330 0.231 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -13.072 -4.923 -0.021 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -12.529 -6.134 2.616 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -11.675 -4.629 2.344 1.00 0.00 H new