USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 804 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: B 16 ASN : amide:sc= -2.62! C(o=-1.7!,f=-17!) USER MOD Set 1.2: B 19 THR OG1 : rot 57:sc= 0.934 USER MOD Single : A 96 A O2' : rot 171:sc= -1.01 USER MOD Single : A 96 A O5' : rot 180:sc= 0 USER MOD Single : A 97 U O2' : rot 2:sc= 0.561 USER MOD Single : A 98 C O2' : rot 20:sc= 0.114 USER MOD Single : A 99 A O2' : rot -39:sc= 1.23 USER MOD Single : A 100 A O2' : rot 180:sc= 0 USER MOD Single : A 101 A O2' : rot 180:sc= 0.606 USER MOD Single : A 101 A O3' : rot 133:sc= 0.159 USER MOD Single : B 1 MET CE :methyl -137:sc= -0.856 (180deg=-0.891) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 169:sc= 1.57 (180deg=1.22) USER MOD Single : B 17 THR OG1 : rot 86:sc= 1.33 USER MOD Single : B 20 ASN : amide:sc= -0.0643 X(o=-0.064,f=-0.064) USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00424) USER MOD Single : B 31 TYR OH : rot 150:sc= -0.667 USER MOD Single : B 40 MET CE :methyl -127:sc= -0.406 (180deg=-3.1!) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.468 USER MOD Single : B 46 ASN : amide:sc= 0 K(o=0,f=-0.98) USER MOD Single : B 47 LYS NZ :NH3+ -161:sc= 1.09 (180deg=0.815) USER MOD Single : B 48 SER OG : rot 19:sc= 0.363 USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD Single : B 58 SER OG : rot 180:sc= -0.158 USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 MET CE :methyl -143:sc= -1.49 (180deg=-3.13!) USER MOD Single : B 70 ASN : amide:sc= 0.0915 K(o=0.091,f=-3.5!) USER MOD Single : B 72 LYS NZ :NH3+ -152:sc= 0.908 (180deg=0.256) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 77 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0126) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 GLN : amide:sc= 0.709 K(o=0.71,f=-0.8) USER MOD Single : B 85 THR OG1 : rot -50:sc= 0.508 USER MOD Single : B 86 LYS NZ :NH3+ 162:sc= 2.39 (180deg=1.99) USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : B 91 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET B 1 -1.530 4.783 -1.479 1.00 0.00 N ATOM 2 CA MET B 1 -0.839 3.818 -2.353 1.00 0.00 C ATOM 3 C MET B 1 -1.844 2.904 -3.045 1.00 0.00 C ATOM 4 O MET B 1 -2.222 1.860 -2.519 1.00 0.00 O ATOM 5 CB MET B 1 0.193 3.011 -1.558 1.00 0.00 C ATOM 6 CG MET B 1 0.940 2.051 -2.484 1.00 0.00 C ATOM 7 SD MET B 1 1.760 2.867 -3.879 1.00 0.00 S ATOM 8 CE MET B 1 2.205 1.395 -4.834 1.00 0.00 C ATOM 0 H1 MET B 1 -0.829 5.397 -1.017 1.00 0.00 H new ATOM 0 H2 MET B 1 -2.178 5.365 -2.048 1.00 0.00 H new ATOM 0 H3 MET B 1 -2.072 4.269 -0.755 1.00 0.00 H new ATOM 0 HA MET B 1 -0.305 4.372 -3.125 1.00 0.00 H new ATOM 0 HB2 MET B 1 0.900 3.686 -1.075 1.00 0.00 H new ATOM 0 HB3 MET B 1 -0.304 2.451 -0.766 1.00 0.00 H new ATOM 0 HG2 MET B 1 1.686 1.508 -1.903 1.00 0.00 H new ATOM 0 HG3 MET B 1 0.237 1.313 -2.870 1.00 0.00 H new ATOM 0 HE1 MET B 1 3.222 1.500 -5.211 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.144 0.514 -4.195 1.00 0.00 H new ATOM 0 HE3 MET B 1 1.517 1.283 -5.672 1.00 0.00 H new ATOM 20 N VAL B 2 -2.269 3.325 -4.234 1.00 0.00 N ATOM 21 CA VAL B 2 -3.115 2.563 -5.143 1.00 0.00 C ATOM 22 C VAL B 2 -2.434 2.537 -6.510 1.00 0.00 C ATOM 23 O VAL B 2 -3.002 2.156 -7.534 1.00 0.00 O ATOM 24 CB VAL B 2 -4.517 3.193 -5.158 1.00 0.00 C ATOM 25 CG1 VAL B 2 -4.450 4.699 -5.427 1.00 0.00 C ATOM 26 CG2 VAL B 2 -5.406 2.573 -6.228 1.00 0.00 C ATOM 0 H VAL B 2 -2.022 4.243 -4.603 1.00 0.00 H new ATOM 0 HA VAL B 2 -3.244 1.528 -4.826 1.00 0.00 H new ATOM 0 HB VAL B 2 -4.940 3.004 -4.171 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -5.458 5.113 -5.431 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -3.862 5.182 -4.646 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -3.982 4.875 -6.395 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -6.388 3.046 -6.205 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -4.954 2.723 -7.208 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -5.514 1.505 -6.038 1.00 0.00 H new ATOM 36 N GLU B 3 -1.176 2.959 -6.511 1.00 0.00 N ATOM 37 CA GLU B 3 -0.433 3.237 -7.717 1.00 0.00 C ATOM 38 C GLU B 3 -0.048 1.972 -8.472 1.00 0.00 C ATOM 39 O GLU B 3 0.238 0.934 -7.879 1.00 0.00 O ATOM 40 CB GLU B 3 0.808 4.044 -7.333 1.00 0.00 C ATOM 41 CG GLU B 3 0.454 5.330 -6.589 1.00 0.00 C ATOM 42 CD GLU B 3 -0.251 6.326 -7.505 1.00 0.00 C ATOM 43 OE1 GLU B 3 0.448 6.909 -8.365 1.00 0.00 O ATOM 44 OE2 GLU B 3 -1.479 6.496 -7.344 1.00 0.00 O ATOM 0 H GLU B 3 -0.642 3.118 -5.657 1.00 0.00 H new ATOM 0 HA GLU B 3 -1.066 3.808 -8.397 1.00 0.00 H new ATOM 0 HB2 GLU B 3 1.458 3.432 -6.708 1.00 0.00 H new ATOM 0 HB3 GLU B 3 1.372 4.291 -8.233 1.00 0.00 H new ATOM 0 HG2 GLU B 3 -0.188 5.096 -5.740 1.00 0.00 H new ATOM 0 HG3 GLU B 3 1.361 5.781 -6.187 1.00 0.00 H new ATOM 51 N ALA B 4 -0.043 2.086 -9.799 1.00 0.00 N ATOM 52 CA ALA B 4 0.351 1.025 -10.704 1.00 0.00 C ATOM 53 C ALA B 4 1.073 1.669 -11.883 1.00 0.00 C ATOM 54 O ALA B 4 0.447 2.185 -12.807 1.00 0.00 O ATOM 55 CB ALA B 4 -0.899 0.256 -11.128 1.00 0.00 C ATOM 0 H ALA B 4 -0.321 2.942 -10.279 1.00 0.00 H new ATOM 0 HA ALA B 4 1.028 0.310 -10.236 1.00 0.00 H new ATOM 0 HB1 ALA B 4 -0.619 -0.547 -11.810 1.00 0.00 H new ATOM 0 HB2 ALA B 4 -1.381 -0.168 -10.247 1.00 0.00 H new ATOM 0 HB3 ALA B 4 -1.590 0.933 -11.630 1.00 0.00 H new ATOM 61 N ASP B 5 2.405 1.639 -11.840 1.00 0.00 N ATOM 62 CA ASP B 5 3.246 2.377 -12.770 1.00 0.00 C ATOM 63 C ASP B 5 3.356 1.703 -14.133 1.00 0.00 C ATOM 64 O ASP B 5 3.682 0.523 -14.215 1.00 0.00 O ATOM 65 CB ASP B 5 4.628 2.540 -12.142 1.00 0.00 C ATOM 66 CG ASP B 5 5.589 3.289 -13.059 1.00 0.00 C ATOM 67 OD1 ASP B 5 5.255 4.437 -13.431 1.00 0.00 O ATOM 68 OD2 ASP B 5 6.644 2.701 -13.377 1.00 0.00 O ATOM 0 H ASP B 5 2.930 1.097 -11.153 1.00 0.00 H new ATOM 0 HA ASP B 5 2.786 3.348 -12.950 1.00 0.00 H new ATOM 0 HB2 ASP B 5 4.536 3.077 -11.198 1.00 0.00 H new ATOM 0 HB3 ASP B 5 5.039 1.557 -11.911 1.00 0.00 H new ATOM 73 N ARG B 6 3.085 2.486 -15.185 1.00 0.00 N ATOM 74 CA ARG B 6 3.202 2.128 -16.596 1.00 0.00 C ATOM 75 C ARG B 6 2.660 0.736 -16.930 1.00 0.00 C ATOM 76 O ARG B 6 3.329 -0.265 -16.683 1.00 0.00 O ATOM 77 CB ARG B 6 4.666 2.274 -17.015 1.00 0.00 C ATOM 78 CG ARG B 6 4.808 2.067 -18.525 1.00 0.00 C ATOM 79 CD ARG B 6 6.260 2.271 -18.952 1.00 0.00 C ATOM 80 NE ARG B 6 6.419 2.078 -20.399 1.00 0.00 N ATOM 81 CZ ARG B 6 7.547 2.326 -21.069 1.00 0.00 C ATOM 82 NH1 ARG B 6 8.628 2.780 -20.440 1.00 0.00 N ATOM 83 NH2 ARG B 6 7.600 2.118 -22.382 1.00 0.00 N ATOM 0 H ARG B 6 2.758 3.444 -15.061 1.00 0.00 H new ATOM 0 HA ARG B 6 2.573 2.812 -17.166 1.00 0.00 H new ATOM 0 HB2 ARG B 6 5.033 3.263 -16.740 1.00 0.00 H new ATOM 0 HB3 ARG B 6 5.278 1.547 -16.482 1.00 0.00 H new ATOM 0 HG2 ARG B 6 4.480 1.063 -18.794 1.00 0.00 H new ATOM 0 HG3 ARG B 6 4.163 2.766 -19.057 1.00 0.00 H new ATOM 0 HD2 ARG B 6 6.585 3.275 -18.678 1.00 0.00 H new ATOM 0 HD3 ARG B 6 6.901 1.571 -18.416 1.00 0.00 H new ATOM 0 HE ARG B 6 5.617 1.733 -20.926 1.00 0.00 H new ATOM 0 HH11 ARG B 6 8.602 2.943 -19.433 1.00 0.00 H new ATOM 0 HH12 ARG B 6 9.483 2.965 -20.964 1.00 0.00 H new ATOM 0 HH21 ARG B 6 6.779 1.769 -22.877 1.00 0.00 H new ATOM 0 HH22 ARG B 6 8.462 2.307 -22.894 1.00 0.00 H new ATOM 97 N PRO B 7 1.448 0.649 -17.499 1.00 0.00 N ATOM 98 CA PRO B 7 0.911 -0.586 -18.028 1.00 0.00 C ATOM 99 C PRO B 7 1.945 -1.278 -18.907 1.00 0.00 C ATOM 100 O PRO B 7 2.569 -0.630 -19.747 1.00 0.00 O ATOM 101 CB PRO B 7 -0.300 -0.156 -18.850 1.00 0.00 C ATOM 102 CG PRO B 7 -0.800 1.074 -18.118 1.00 0.00 C ATOM 103 CD PRO B 7 0.509 1.740 -17.696 1.00 0.00 C ATOM 0 HA PRO B 7 0.644 -1.296 -17.246 1.00 0.00 H new ATOM 0 HB2 PRO B 7 -0.026 0.073 -19.880 1.00 0.00 H new ATOM 0 HB3 PRO B 7 -1.059 -0.938 -18.888 1.00 0.00 H new ATOM 0 HG2 PRO B 7 -1.398 1.719 -18.763 1.00 0.00 H new ATOM 0 HG3 PRO B 7 -1.422 0.815 -17.261 1.00 0.00 H new ATOM 0 HD2 PRO B 7 0.863 2.431 -18.461 1.00 0.00 H new ATOM 0 HD3 PRO B 7 0.379 2.317 -16.781 1.00 0.00 H new ATOM 111 N GLY B 8 2.131 -2.584 -18.717 1.00 0.00 N ATOM 112 CA GLY B 8 3.149 -3.328 -19.433 1.00 0.00 C ATOM 113 C GLY B 8 4.318 -3.620 -18.506 1.00 0.00 C ATOM 114 O GLY B 8 5.186 -4.413 -18.867 1.00 0.00 O ATOM 0 H GLY B 8 1.582 -3.146 -18.067 1.00 0.00 H new ATOM 0 HA2 GLY B 8 2.732 -4.261 -19.813 1.00 0.00 H new ATOM 0 HA3 GLY B 8 3.491 -2.757 -20.296 1.00 0.00 H new ATOM 118 N LYS B 9 4.354 -3.002 -17.317 1.00 0.00 N ATOM 119 CA LYS B 9 5.411 -3.292 -16.368 1.00 0.00 C ATOM 120 C LYS B 9 4.923 -4.396 -15.452 1.00 0.00 C ATOM 121 O LYS B 9 3.847 -4.298 -14.869 1.00 0.00 O ATOM 122 CB LYS B 9 5.845 -2.052 -15.585 1.00 0.00 C ATOM 123 CG LYS B 9 7.013 -2.455 -14.683 1.00 0.00 C ATOM 124 CD LYS B 9 7.499 -1.296 -13.820 1.00 0.00 C ATOM 125 CE LYS B 9 8.199 -0.243 -14.678 1.00 0.00 C ATOM 126 NZ LYS B 9 8.678 0.880 -13.851 1.00 0.00 N ATOM 0 H LYS B 9 3.672 -2.312 -17.003 1.00 0.00 H new ATOM 0 HA LYS B 9 6.302 -3.620 -16.904 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.145 -1.256 -16.266 1.00 0.00 H new ATOM 0 HB3 LYS B 9 5.017 -1.667 -14.989 1.00 0.00 H new ATOM 0 HG2 LYS B 9 6.706 -3.281 -14.041 1.00 0.00 H new ATOM 0 HG3 LYS B 9 7.836 -2.818 -15.298 1.00 0.00 H new ATOM 0 HD2 LYS B 9 6.655 -0.845 -13.298 1.00 0.00 H new ATOM 0 HD3 LYS B 9 8.184 -1.666 -13.057 1.00 0.00 H new ATOM 0 HE2 LYS B 9 9.039 -0.697 -15.203 1.00 0.00 H new ATOM 0 HE3 LYS B 9 7.511 0.128 -15.438 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 9.306 1.485 -14.418 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 7.866 1.438 -13.520 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 9.201 0.510 -13.032 1.00 0.00 H new ATOM 140 N LEU B 10 5.723 -5.449 -15.326 1.00 0.00 N ATOM 141 CA LEU B 10 5.357 -6.615 -14.556 1.00 0.00 C ATOM 142 C LEU B 10 6.264 -6.729 -13.341 1.00 0.00 C ATOM 143 O LEU B 10 7.423 -6.319 -13.385 1.00 0.00 O ATOM 144 CB LEU B 10 5.478 -7.849 -15.449 1.00 0.00 C ATOM 145 CG LEU B 10 4.480 -7.899 -16.607 1.00 0.00 C ATOM 146 CD1 LEU B 10 4.775 -9.170 -17.401 1.00 0.00 C ATOM 147 CD2 LEU B 10 3.030 -7.967 -16.142 1.00 0.00 C ATOM 0 H LEU B 10 6.644 -5.511 -15.759 1.00 0.00 H new ATOM 0 HA LEU B 10 4.329 -6.532 -14.204 1.00 0.00 H new ATOM 0 HB2 LEU B 10 6.488 -7.889 -15.856 1.00 0.00 H new ATOM 0 HB3 LEU B 10 5.346 -8.740 -14.835 1.00 0.00 H new ATOM 0 HG LEU B 10 4.594 -6.987 -17.193 1.00 0.00 H new ATOM 0 HD11 LEU B 10 4.082 -9.244 -18.239 1.00 0.00 H new ATOM 0 HD12 LEU B 10 5.798 -9.135 -17.777 1.00 0.00 H new ATOM 0 HD13 LEU B 10 4.656 -10.039 -16.754 1.00 0.00 H new ATOM 0 HD21 LEU B 10 2.371 -8.000 -17.010 1.00 0.00 H new ATOM 0 HD22 LEU B 10 2.883 -8.864 -15.540 1.00 0.00 H new ATOM 0 HD23 LEU B 10 2.798 -7.086 -15.544 1.00 0.00 H new ATOM 159 N PHE B 11 5.732 -7.287 -12.256 1.00 0.00 N ATOM 160 CA PHE B 11 6.473 -7.614 -11.058 1.00 0.00 C ATOM 161 C PHE B 11 6.719 -9.114 -11.070 1.00 0.00 C ATOM 162 O PHE B 11 5.779 -9.888 -11.225 1.00 0.00 O ATOM 163 CB PHE B 11 5.673 -7.202 -9.829 1.00 0.00 C ATOM 164 CG PHE B 11 6.250 -7.756 -8.548 1.00 0.00 C ATOM 165 CD1 PHE B 11 7.408 -7.186 -8.005 1.00 0.00 C ATOM 166 CD2 PHE B 11 5.631 -8.842 -7.910 1.00 0.00 C ATOM 167 CE1 PHE B 11 7.953 -7.701 -6.823 1.00 0.00 C ATOM 168 CE2 PHE B 11 6.177 -9.357 -6.728 1.00 0.00 C ATOM 169 CZ PHE B 11 7.340 -8.787 -6.186 1.00 0.00 C ATOM 0 H PHE B 11 4.743 -7.528 -12.193 1.00 0.00 H new ATOM 0 HA PHE B 11 7.424 -7.082 -11.026 1.00 0.00 H new ATOM 0 HB2 PHE B 11 5.642 -6.114 -9.768 1.00 0.00 H new ATOM 0 HB3 PHE B 11 4.644 -7.545 -9.938 1.00 0.00 H new ATOM 0 HD1 PHE B 11 7.881 -6.349 -8.498 1.00 0.00 H new ATOM 0 HD2 PHE B 11 4.737 -9.279 -8.329 1.00 0.00 H new ATOM 0 HE1 PHE B 11 8.845 -7.261 -6.403 1.00 0.00 H new ATOM 0 HE2 PHE B 11 5.704 -10.192 -6.233 1.00 0.00 H new ATOM 0 HZ PHE B 11 7.763 -9.187 -5.276 1.00 0.00 H new ATOM 179 N ILE B 12 7.977 -9.519 -10.909 1.00 0.00 N ATOM 180 CA ILE B 12 8.375 -10.911 -11.014 1.00 0.00 C ATOM 181 C ILE B 12 8.959 -11.371 -9.682 1.00 0.00 C ATOM 182 O ILE B 12 10.175 -11.461 -9.535 1.00 0.00 O ATOM 183 CB ILE B 12 9.377 -11.086 -12.164 1.00 0.00 C ATOM 184 CG1 ILE B 12 9.093 -10.254 -13.425 1.00 0.00 C ATOM 185 CG2 ILE B 12 9.405 -12.564 -12.540 1.00 0.00 C ATOM 186 CD1 ILE B 12 7.739 -10.500 -14.084 1.00 0.00 C ATOM 0 H ILE B 12 8.748 -8.884 -10.701 1.00 0.00 H new ATOM 0 HA ILE B 12 7.507 -11.531 -11.238 1.00 0.00 H new ATOM 0 HB ILE B 12 10.334 -10.719 -11.793 1.00 0.00 H new ATOM 0 HG12 ILE B 12 9.165 -9.198 -13.166 1.00 0.00 H new ATOM 0 HG13 ILE B 12 9.875 -10.456 -14.156 1.00 0.00 H new ATOM 0 HG21 ILE B 12 10.110 -12.718 -13.357 1.00 0.00 H new ATOM 0 HG22 ILE B 12 9.715 -13.153 -11.677 1.00 0.00 H new ATOM 0 HG23 ILE B 12 8.410 -12.878 -12.856 1.00 0.00 H new ATOM 0 HD11 ILE B 12 7.641 -9.863 -14.963 1.00 0.00 H new ATOM 0 HD12 ILE B 12 7.664 -11.546 -14.383 1.00 0.00 H new ATOM 0 HD13 ILE B 12 6.943 -10.267 -13.377 1.00 0.00 H new ATOM 198 N GLY B 13 8.108 -11.664 -8.694 1.00 0.00 N ATOM 199 CA GLY B 13 8.587 -12.036 -7.368 1.00 0.00 C ATOM 200 C GLY B 13 8.730 -13.545 -7.211 1.00 0.00 C ATOM 201 O GLY B 13 7.929 -14.292 -7.760 1.00 0.00 O ATOM 0 H GLY B 13 7.093 -11.650 -8.790 1.00 0.00 H new ATOM 0 HA2 GLY B 13 9.550 -11.560 -7.185 1.00 0.00 H new ATOM 0 HA3 GLY B 13 7.896 -11.658 -6.614 1.00 0.00 H new ATOM 205 N GLY B 14 9.739 -14.003 -6.466 1.00 0.00 N ATOM 206 CA GLY B 14 9.901 -15.412 -6.129 1.00 0.00 C ATOM 207 C GLY B 14 10.906 -16.101 -7.043 1.00 0.00 C ATOM 208 O GLY B 14 10.988 -17.328 -7.067 1.00 0.00 O ATOM 0 H GLY B 14 10.467 -13.402 -6.080 1.00 0.00 H new ATOM 0 HA2 GLY B 14 10.230 -15.502 -5.094 1.00 0.00 H new ATOM 0 HA3 GLY B 14 8.938 -15.916 -6.203 1.00 0.00 H new ATOM 212 N LEU B 15 11.675 -15.309 -7.796 1.00 0.00 N ATOM 213 CA LEU B 15 12.635 -15.815 -8.765 1.00 0.00 C ATOM 214 C LEU B 15 13.786 -16.579 -8.118 1.00 0.00 C ATOM 215 O LEU B 15 14.004 -16.529 -6.910 1.00 0.00 O ATOM 216 CB LEU B 15 13.216 -14.640 -9.546 1.00 0.00 C ATOM 217 CG LEU B 15 12.217 -13.977 -10.488 1.00 0.00 C ATOM 218 CD1 LEU B 15 12.740 -12.598 -10.872 1.00 0.00 C ATOM 219 CD2 LEU B 15 12.139 -14.811 -11.760 1.00 0.00 C ATOM 0 H LEU B 15 11.644 -14.291 -7.745 1.00 0.00 H new ATOM 0 HA LEU B 15 12.101 -16.508 -9.415 1.00 0.00 H new ATOM 0 HB2 LEU B 15 13.588 -13.895 -8.842 1.00 0.00 H new ATOM 0 HB3 LEU B 15 14.072 -14.987 -10.124 1.00 0.00 H new ATOM 0 HG LEU B 15 11.243 -13.897 -10.005 1.00 0.00 H new ATOM 0 HD11 LEU B 15 12.032 -12.115 -11.546 1.00 0.00 H new ATOM 0 HD12 LEU B 15 12.858 -11.991 -9.975 1.00 0.00 H new ATOM 0 HD13 LEU B 15 13.704 -12.700 -11.371 1.00 0.00 H new ATOM 0 HD21 LEU B 15 11.429 -14.356 -12.451 1.00 0.00 H new ATOM 0 HD22 LEU B 15 13.123 -14.855 -12.227 1.00 0.00 H new ATOM 0 HD23 LEU B 15 11.809 -15.820 -11.514 1.00 0.00 H new ATOM 231 N ASN B 16 14.520 -17.295 -8.976 1.00 0.00 N ATOM 232 CA ASN B 16 15.698 -18.051 -8.635 1.00 0.00 C ATOM 233 C ASN B 16 16.900 -17.111 -8.502 1.00 0.00 C ATOM 234 O ASN B 16 16.999 -16.117 -9.219 1.00 0.00 O ATOM 235 CB ASN B 16 15.818 -19.138 -9.693 1.00 0.00 C ATOM 236 CG ASN B 16 17.223 -19.555 -10.034 1.00 0.00 C ATOM 237 OD1 ASN B 16 17.963 -18.785 -10.627 1.00 0.00 O ATOM 238 ND2 ASN B 16 17.590 -20.772 -9.668 1.00 0.00 N ATOM 0 H ASN B 16 14.287 -17.357 -9.967 1.00 0.00 H new ATOM 0 HA ASN B 16 15.645 -18.539 -7.662 1.00 0.00 H new ATOM 0 HB2 ASN B 16 15.269 -20.016 -9.351 1.00 0.00 H new ATOM 0 HB3 ASN B 16 15.329 -18.791 -10.603 1.00 0.00 H new ATOM 0 HD21 ASN B 16 18.530 -21.106 -9.879 1.00 0.00 H new ATOM 0 HD22 ASN B 16 16.933 -21.376 -9.174 1.00 0.00 H new ATOM 245 N THR B 17 17.811 -17.431 -7.581 1.00 0.00 N ATOM 246 CA THR B 17 18.953 -16.589 -7.235 1.00 0.00 C ATOM 247 C THR B 17 20.037 -16.616 -8.306 1.00 0.00 C ATOM 248 O THR B 17 20.997 -15.846 -8.251 1.00 0.00 O ATOM 249 CB THR B 17 19.544 -17.062 -5.905 1.00 0.00 C ATOM 250 OG1 THR B 17 20.004 -18.389 -6.017 1.00 0.00 O ATOM 251 CG2 THR B 17 18.478 -17.047 -4.813 1.00 0.00 C ATOM 0 H THR B 17 17.773 -18.299 -7.046 1.00 0.00 H new ATOM 0 HA THR B 17 18.595 -15.563 -7.155 1.00 0.00 H new ATOM 0 HB THR B 17 20.363 -16.389 -5.653 1.00 0.00 H new ATOM 0 HG1 THR B 17 20.921 -18.389 -6.362 1.00 0.00 H new ATOM 0 HG21 THR B 17 18.915 -17.386 -3.874 1.00 0.00 H new ATOM 0 HG22 THR B 17 18.097 -16.033 -4.691 1.00 0.00 H new ATOM 0 HG23 THR B 17 17.660 -17.711 -5.094 1.00 0.00 H new ATOM 259 N GLU B 18 19.876 -17.512 -9.280 1.00 0.00 N ATOM 260 CA GLU B 18 20.835 -17.785 -10.334 1.00 0.00 C ATOM 261 C GLU B 18 20.385 -17.103 -11.625 1.00 0.00 C ATOM 262 O GLU B 18 21.148 -17.003 -12.585 1.00 0.00 O ATOM 263 CB GLU B 18 20.924 -19.308 -10.513 1.00 0.00 C ATOM 264 CG GLU B 18 20.810 -20.060 -9.181 1.00 0.00 C ATOM 265 CD GLU B 18 22.041 -19.824 -8.301 1.00 0.00 C ATOM 266 OE1 GLU B 18 22.074 -18.794 -7.590 1.00 0.00 O ATOM 267 OE2 GLU B 18 22.952 -20.681 -8.342 1.00 0.00 O ATOM 0 H GLU B 18 19.037 -18.088 -9.353 1.00 0.00 H new ATOM 0 HA GLU B 18 21.819 -17.394 -10.076 1.00 0.00 H new ATOM 0 HB2 GLU B 18 20.131 -19.639 -11.183 1.00 0.00 H new ATOM 0 HB3 GLU B 18 21.871 -19.561 -10.990 1.00 0.00 H new ATOM 0 HG2 GLU B 18 19.914 -19.734 -8.652 1.00 0.00 H new ATOM 0 HG3 GLU B 18 20.696 -21.127 -9.372 1.00 0.00 H new ATOM 274 N THR B 19 19.134 -16.630 -11.639 1.00 0.00 N ATOM 275 CA THR B 19 18.523 -15.949 -12.768 1.00 0.00 C ATOM 276 C THR B 19 19.018 -14.512 -12.841 1.00 0.00 C ATOM 277 O THR B 19 19.322 -13.896 -11.819 1.00 0.00 O ATOM 278 CB THR B 19 17.001 -15.989 -12.605 1.00 0.00 C ATOM 279 OG1 THR B 19 16.574 -17.332 -12.584 1.00 0.00 O ATOM 280 CG2 THR B 19 16.268 -15.280 -13.742 1.00 0.00 C ATOM 0 H THR B 19 18.507 -16.717 -10.839 1.00 0.00 H new ATOM 0 HA THR B 19 18.799 -16.449 -13.697 1.00 0.00 H new ATOM 0 HB THR B 19 16.766 -15.474 -11.674 1.00 0.00 H new ATOM 0 HG1 THR B 19 17.036 -17.811 -11.865 1.00 0.00 H new ATOM 0 HG21 THR B 19 15.193 -15.340 -13.575 1.00 0.00 H new ATOM 0 HG22 THR B 19 16.573 -14.234 -13.775 1.00 0.00 H new ATOM 0 HG23 THR B 19 16.515 -15.760 -14.689 1.00 0.00 H new ATOM 288 N ASN B 20 19.096 -13.974 -14.059 1.00 0.00 N ATOM 289 CA ASN B 20 19.474 -12.592 -14.287 1.00 0.00 C ATOM 290 C ASN B 20 18.560 -11.988 -15.344 1.00 0.00 C ATOM 291 O ASN B 20 17.512 -12.546 -15.666 1.00 0.00 O ATOM 292 CB ASN B 20 20.931 -12.471 -14.733 1.00 0.00 C ATOM 293 CG ASN B 20 21.794 -13.637 -14.289 1.00 0.00 C ATOM 294 OD1 ASN B 20 22.358 -13.630 -13.200 1.00 0.00 O ATOM 295 ND2 ASN B 20 21.888 -14.646 -15.148 1.00 0.00 N ATOM 0 H ASN B 20 18.896 -14.493 -14.914 1.00 0.00 H new ATOM 0 HA ASN B 20 19.369 -12.051 -13.346 1.00 0.00 H new ATOM 0 HB2 ASN B 20 20.966 -12.396 -15.820 1.00 0.00 H new ATOM 0 HB3 ASN B 20 21.350 -11.546 -14.336 1.00 0.00 H new ATOM 0 HD21 ASN B 20 22.450 -15.465 -14.914 1.00 0.00 H new ATOM 0 HD22 ASN B 20 21.398 -14.602 -16.042 1.00 0.00 H new ATOM 302 N GLU B 21 18.967 -10.841 -15.883 1.00 0.00 N ATOM 303 CA GLU B 21 18.154 -10.080 -16.821 1.00 0.00 C ATOM 304 C GLU B 21 18.068 -10.784 -18.167 1.00 0.00 C ATOM 305 O GLU B 21 17.022 -10.750 -18.804 1.00 0.00 O ATOM 306 CB GLU B 21 18.770 -8.693 -16.983 1.00 0.00 C ATOM 307 CG GLU B 21 18.663 -7.947 -15.659 1.00 0.00 C ATOM 308 CD GLU B 21 19.524 -6.686 -15.663 1.00 0.00 C ATOM 309 OE1 GLU B 21 19.005 -5.631 -16.087 1.00 0.00 O ATOM 310 OE2 GLU B 21 20.697 -6.794 -15.238 1.00 0.00 O ATOM 0 H GLU B 21 19.871 -10.415 -15.680 1.00 0.00 H new ATOM 0 HA GLU B 21 17.139 -9.994 -16.433 1.00 0.00 H new ATOM 0 HB2 GLU B 21 19.814 -8.777 -17.285 1.00 0.00 H new ATOM 0 HB3 GLU B 21 18.255 -8.141 -17.769 1.00 0.00 H new ATOM 0 HG2 GLU B 21 17.623 -7.679 -15.473 1.00 0.00 H new ATOM 0 HG3 GLU B 21 18.975 -8.601 -14.844 1.00 0.00 H new ATOM 317 N LYS B 22 19.153 -11.424 -18.614 1.00 0.00 N ATOM 318 CA LYS B 22 19.173 -12.072 -19.917 1.00 0.00 C ATOM 319 C LYS B 22 18.208 -13.252 -19.954 1.00 0.00 C ATOM 320 O LYS B 22 17.666 -13.586 -21.002 1.00 0.00 O ATOM 321 CB LYS B 22 20.611 -12.504 -20.224 1.00 0.00 C ATOM 322 CG LYS B 22 20.720 -13.287 -21.537 1.00 0.00 C ATOM 323 CD LYS B 22 20.068 -12.525 -22.696 1.00 0.00 C ATOM 324 CE LYS B 22 20.323 -13.264 -24.008 1.00 0.00 C ATOM 325 NZ LYS B 22 19.708 -12.557 -25.145 1.00 0.00 N ATOM 0 H LYS B 22 20.024 -11.504 -18.090 1.00 0.00 H new ATOM 0 HA LYS B 22 18.839 -11.374 -20.684 1.00 0.00 H new ATOM 0 HB2 LYS B 22 21.249 -11.622 -20.277 1.00 0.00 H new ATOM 0 HB3 LYS B 22 20.985 -13.119 -19.406 1.00 0.00 H new ATOM 0 HG2 LYS B 22 21.769 -13.473 -21.766 1.00 0.00 H new ATOM 0 HG3 LYS B 22 20.241 -14.260 -21.424 1.00 0.00 H new ATOM 0 HD2 LYS B 22 18.996 -12.430 -22.524 1.00 0.00 H new ATOM 0 HD3 LYS B 22 20.473 -11.514 -22.752 1.00 0.00 H new ATOM 0 HE2 LYS B 22 21.396 -13.359 -24.173 1.00 0.00 H new ATOM 0 HE3 LYS B 22 19.920 -14.275 -23.944 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 19.897 -13.081 -26.023 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 18.681 -12.489 -24.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 20.111 -11.601 -25.219 1.00 0.00 H new ATOM 339 N ALA B 23 17.982 -13.892 -18.809 1.00 0.00 N ATOM 340 CA ALA B 23 17.110 -15.055 -18.752 1.00 0.00 C ATOM 341 C ALA B 23 15.676 -14.569 -18.599 1.00 0.00 C ATOM 342 O ALA B 23 14.723 -15.290 -18.882 1.00 0.00 O ATOM 343 CB ALA B 23 17.526 -15.940 -17.576 1.00 0.00 C ATOM 0 H ALA B 23 18.390 -13.624 -17.914 1.00 0.00 H new ATOM 0 HA ALA B 23 17.188 -15.648 -19.663 1.00 0.00 H new ATOM 0 HB1 ALA B 23 16.875 -16.813 -17.529 1.00 0.00 H new ATOM 0 HB2 ALA B 23 18.558 -16.264 -17.711 1.00 0.00 H new ATOM 0 HB3 ALA B 23 17.442 -15.375 -16.648 1.00 0.00 H new ATOM 349 N LEU B 24 15.540 -13.323 -18.147 1.00 0.00 N ATOM 350 CA LEU B 24 14.276 -12.686 -17.865 1.00 0.00 C ATOM 351 C LEU B 24 13.748 -12.024 -19.130 1.00 0.00 C ATOM 352 O LEU B 24 12.541 -11.900 -19.319 1.00 0.00 O ATOM 353 CB LEU B 24 14.563 -11.669 -16.759 1.00 0.00 C ATOM 354 CG LEU B 24 14.093 -12.193 -15.414 1.00 0.00 C ATOM 355 CD1 LEU B 24 14.537 -11.249 -14.307 1.00 0.00 C ATOM 356 CD2 LEU B 24 12.579 -12.304 -15.374 1.00 0.00 C ATOM 0 H LEU B 24 16.340 -12.718 -17.964 1.00 0.00 H new ATOM 0 HA LEU B 24 13.510 -13.390 -17.541 1.00 0.00 H new ATOM 0 HB2 LEU B 24 15.632 -11.459 -16.720 1.00 0.00 H new ATOM 0 HB3 LEU B 24 14.061 -10.728 -16.984 1.00 0.00 H new ATOM 0 HG LEU B 24 14.531 -13.181 -15.268 1.00 0.00 H new ATOM 0 HD11 LEU B 24 14.196 -11.631 -13.345 1.00 0.00 H new ATOM 0 HD12 LEU B 24 15.625 -11.177 -14.305 1.00 0.00 H new ATOM 0 HD13 LEU B 24 14.109 -10.261 -14.477 1.00 0.00 H new ATOM 0 HD21 LEU B 24 12.267 -12.682 -14.400 1.00 0.00 H new ATOM 0 HD22 LEU B 24 12.138 -11.321 -15.540 1.00 0.00 H new ATOM 0 HD23 LEU B 24 12.244 -12.989 -16.153 1.00 0.00 H new ATOM 368 N GLU B 25 14.663 -11.603 -20.004 1.00 0.00 N ATOM 369 CA GLU B 25 14.280 -11.100 -21.315 1.00 0.00 C ATOM 370 C GLU B 25 13.966 -12.261 -22.240 1.00 0.00 C ATOM 371 O GLU B 25 13.177 -12.141 -23.174 1.00 0.00 O ATOM 372 CB GLU B 25 15.436 -10.316 -21.932 1.00 0.00 C ATOM 373 CG GLU B 25 15.633 -9.011 -21.180 1.00 0.00 C ATOM 374 CD GLU B 25 16.692 -8.134 -21.845 1.00 0.00 C ATOM 375 OE1 GLU B 25 17.887 -8.484 -21.724 1.00 0.00 O ATOM 376 OE2 GLU B 25 16.301 -7.124 -22.466 1.00 0.00 O ATOM 0 H GLU B 25 15.667 -11.602 -19.826 1.00 0.00 H new ATOM 0 HA GLU B 25 13.407 -10.459 -21.194 1.00 0.00 H new ATOM 0 HB2 GLU B 25 16.350 -10.909 -21.895 1.00 0.00 H new ATOM 0 HB3 GLU B 25 15.230 -10.113 -22.983 1.00 0.00 H new ATOM 0 HG2 GLU B 25 14.688 -8.470 -21.135 1.00 0.00 H new ATOM 0 HG3 GLU B 25 15.928 -9.223 -20.152 1.00 0.00 H new ATOM 383 N ALA B 26 14.602 -13.396 -21.961 1.00 0.00 N ATOM 384 CA ALA B 26 14.508 -14.592 -22.773 1.00 0.00 C ATOM 385 C ALA B 26 13.239 -15.378 -22.459 1.00 0.00 C ATOM 386 O ALA B 26 12.766 -16.150 -23.291 1.00 0.00 O ATOM 387 CB ALA B 26 15.734 -15.447 -22.485 1.00 0.00 C ATOM 0 H ALA B 26 15.207 -13.506 -21.147 1.00 0.00 H new ATOM 0 HA ALA B 26 14.466 -14.315 -23.826 1.00 0.00 H new ATOM 0 HB1 ALA B 26 15.692 -16.357 -23.083 1.00 0.00 H new ATOM 0 HB2 ALA B 26 16.635 -14.888 -22.738 1.00 0.00 H new ATOM 0 HB3 ALA B 26 15.755 -15.709 -21.427 1.00 0.00 H new ATOM 393 N VAL B 27 12.691 -15.183 -21.257 1.00 0.00 N ATOM 394 CA VAL B 27 11.542 -15.940 -20.786 1.00 0.00 C ATOM 395 C VAL B 27 10.248 -15.143 -20.863 1.00 0.00 C ATOM 396 O VAL B 27 9.186 -15.700 -21.125 1.00 0.00 O ATOM 397 CB VAL B 27 11.850 -16.374 -19.366 1.00 0.00 C ATOM 398 CG1 VAL B 27 11.721 -15.234 -18.376 1.00 0.00 C ATOM 399 CG2 VAL B 27 10.942 -17.505 -18.914 1.00 0.00 C ATOM 0 H VAL B 27 13.035 -14.495 -20.588 1.00 0.00 H new ATOM 0 HA VAL B 27 11.379 -16.806 -21.428 1.00 0.00 H new ATOM 0 HB VAL B 27 12.884 -16.717 -19.383 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.951 -15.595 -17.374 1.00 0.00 H new ATOM 0 HG12 VAL B 27 12.417 -14.439 -18.644 1.00 0.00 H new ATOM 0 HG13 VAL B 27 10.702 -14.847 -18.397 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.194 -17.788 -17.892 1.00 0.00 H new ATOM 0 HG22 VAL B 27 9.904 -17.176 -18.954 1.00 0.00 H new ATOM 0 HG23 VAL B 27 11.076 -18.364 -19.571 1.00 0.00 H new ATOM 409 N PHE B 28 10.332 -13.836 -20.635 1.00 0.00 N ATOM 410 CA PHE B 28 9.170 -12.974 -20.802 1.00 0.00 C ATOM 411 C PHE B 28 9.098 -12.418 -22.220 1.00 0.00 C ATOM 412 O PHE B 28 8.078 -11.850 -22.605 1.00 0.00 O ATOM 413 CB PHE B 28 9.156 -11.870 -19.753 1.00 0.00 C ATOM 414 CG PHE B 28 8.854 -12.387 -18.368 1.00 0.00 C ATOM 415 CD1 PHE B 28 7.522 -12.539 -17.950 1.00 0.00 C ATOM 416 CD2 PHE B 28 9.899 -12.732 -17.505 1.00 0.00 C ATOM 417 CE1 PHE B 28 7.244 -13.039 -16.672 1.00 0.00 C ATOM 418 CE2 PHE B 28 9.621 -13.246 -16.233 1.00 0.00 C ATOM 419 CZ PHE B 28 8.294 -13.390 -15.812 1.00 0.00 C ATOM 0 H PHE B 28 11.182 -13.356 -20.338 1.00 0.00 H new ATOM 0 HA PHE B 28 8.274 -13.575 -20.649 1.00 0.00 H new ATOM 0 HB2 PHE B 28 10.124 -11.369 -19.746 1.00 0.00 H new ATOM 0 HB3 PHE B 28 8.412 -11.123 -20.028 1.00 0.00 H new ATOM 0 HD1 PHE B 28 6.713 -12.271 -18.613 1.00 0.00 H new ATOM 0 HD2 PHE B 28 10.923 -12.601 -17.821 1.00 0.00 H new ATOM 0 HE1 PHE B 28 6.220 -13.154 -16.349 1.00 0.00 H new ATOM 0 HE2 PHE B 28 10.430 -13.531 -15.577 1.00 0.00 H new ATOM 0 HZ PHE B 28 8.079 -13.771 -14.825 1.00 0.00 H new ATOM 429 N GLY B 29 10.171 -12.575 -23.003 1.00 0.00 N ATOM 430 CA GLY B 29 10.167 -12.151 -24.400 1.00 0.00 C ATOM 431 C GLY B 29 9.367 -13.126 -25.254 1.00 0.00 C ATOM 432 O GLY B 29 9.162 -12.899 -26.444 1.00 0.00 O ATOM 0 H GLY B 29 11.048 -12.991 -22.691 1.00 0.00 H new ATOM 0 HA2 GLY B 29 9.739 -11.152 -24.481 1.00 0.00 H new ATOM 0 HA3 GLY B 29 11.190 -12.090 -24.770 1.00 0.00 H new ATOM 436 N LYS B 30 8.914 -14.220 -24.633 1.00 0.00 N ATOM 437 CA LYS B 30 8.148 -15.278 -25.269 1.00 0.00 C ATOM 438 C LYS B 30 6.690 -14.871 -25.420 1.00 0.00 C ATOM 439 O LYS B 30 5.931 -15.520 -26.139 1.00 0.00 O ATOM 440 CB LYS B 30 8.259 -16.524 -24.389 1.00 0.00 C ATOM 441 CG LYS B 30 9.732 -16.879 -24.169 1.00 0.00 C ATOM 442 CD LYS B 30 9.918 -18.044 -23.191 1.00 0.00 C ATOM 443 CE LYS B 30 9.114 -19.285 -23.575 1.00 0.00 C ATOM 444 NZ LYS B 30 9.533 -19.830 -24.881 1.00 0.00 N ATOM 0 H LYS B 30 9.080 -14.392 -23.641 1.00 0.00 H new ATOM 0 HA LYS B 30 8.540 -15.476 -26.267 1.00 0.00 H new ATOM 0 HB2 LYS B 30 7.772 -16.347 -23.430 1.00 0.00 H new ATOM 0 HB3 LYS B 30 7.741 -17.360 -24.860 1.00 0.00 H new ATOM 0 HG2 LYS B 30 10.187 -17.137 -25.126 1.00 0.00 H new ATOM 0 HG3 LYS B 30 10.260 -16.004 -23.790 1.00 0.00 H new ATOM 0 HD2 LYS B 30 10.975 -18.304 -23.143 1.00 0.00 H new ATOM 0 HD3 LYS B 30 9.623 -17.722 -22.192 1.00 0.00 H new ATOM 0 HE2 LYS B 30 9.236 -20.049 -22.807 1.00 0.00 H new ATOM 0 HE3 LYS B 30 8.054 -19.034 -23.610 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 8.987 -20.690 -25.089 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 9.361 -19.123 -25.624 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 10.546 -20.062 -24.851 1.00 0.00 H new ATOM 458 N TYR B 31 6.312 -13.792 -24.737 1.00 0.00 N ATOM 459 CA TYR B 31 4.942 -13.308 -24.700 1.00 0.00 C ATOM 460 C TYR B 31 4.762 -11.955 -25.377 1.00 0.00 C ATOM 461 O TYR B 31 3.629 -11.551 -25.634 1.00 0.00 O ATOM 462 CB TYR B 31 4.538 -13.209 -23.235 1.00 0.00 C ATOM 463 CG TYR B 31 4.675 -14.518 -22.499 1.00 0.00 C ATOM 464 CD1 TYR B 31 3.736 -15.532 -22.717 1.00 0.00 C ATOM 465 CD2 TYR B 31 5.742 -14.711 -21.606 1.00 0.00 C ATOM 466 CE1 TYR B 31 3.880 -16.765 -22.071 1.00 0.00 C ATOM 467 CE2 TYR B 31 5.884 -15.941 -20.945 1.00 0.00 C ATOM 468 CZ TYR B 31 4.970 -16.987 -21.207 1.00 0.00 C ATOM 469 OH TYR B 31 5.133 -18.213 -20.635 1.00 0.00 O ATOM 0 H TYR B 31 6.960 -13.226 -24.189 1.00 0.00 H new ATOM 0 HA TYR B 31 4.313 -14.005 -25.254 1.00 0.00 H new ATOM 0 HB2 TYR B 31 5.154 -12.456 -22.744 1.00 0.00 H new ATOM 0 HB3 TYR B 31 3.505 -12.868 -23.170 1.00 0.00 H new ATOM 0 HD1 TYR B 31 2.902 -15.364 -23.382 1.00 0.00 H new ATOM 0 HD2 TYR B 31 6.451 -13.916 -21.429 1.00 0.00 H new ATOM 0 HE1 TYR B 31 3.154 -17.548 -22.235 1.00 0.00 H new ATOM 0 HE2 TYR B 31 6.688 -16.088 -20.239 1.00 0.00 H new ATOM 0 HH TYR B 31 6.087 -18.379 -20.484 1.00 0.00 H new ATOM 479 N GLY B 32 5.852 -11.243 -25.671 1.00 0.00 N ATOM 480 CA GLY B 32 5.733 -9.917 -26.252 1.00 0.00 C ATOM 481 C GLY B 32 7.068 -9.205 -26.342 1.00 0.00 C ATOM 482 O GLY B 32 8.071 -9.679 -25.806 1.00 0.00 O ATOM 0 H GLY B 32 6.809 -11.561 -25.517 1.00 0.00 H new ATOM 0 HA2 GLY B 32 5.299 -9.997 -27.249 1.00 0.00 H new ATOM 0 HA3 GLY B 32 5.046 -9.321 -25.652 1.00 0.00 H new ATOM 486 N ARG B 33 7.083 -8.058 -27.024 1.00 0.00 N ATOM 487 CA ARG B 33 8.298 -7.317 -27.232 1.00 0.00 C ATOM 488 C ARG B 33 8.634 -6.513 -25.990 1.00 0.00 C ATOM 489 O ARG B 33 7.910 -5.598 -25.599 1.00 0.00 O ATOM 490 CB ARG B 33 8.134 -6.440 -28.468 1.00 0.00 C ATOM 491 CG ARG B 33 9.520 -6.136 -29.011 1.00 0.00 C ATOM 492 CD ARG B 33 9.455 -5.367 -30.330 1.00 0.00 C ATOM 493 NE ARG B 33 8.871 -6.181 -31.402 1.00 0.00 N ATOM 494 CZ ARG B 33 7.645 -6.018 -31.910 1.00 0.00 C ATOM 495 NH1 ARG B 33 6.825 -5.073 -31.455 1.00 0.00 N ATOM 496 NH2 ARG B 33 7.231 -6.813 -32.892 1.00 0.00 N ATOM 0 H ARG B 33 6.254 -7.632 -27.438 1.00 0.00 H new ATOM 0 HA ARG B 33 9.135 -7.993 -27.407 1.00 0.00 H new ATOM 0 HB2 ARG B 33 7.533 -6.950 -29.221 1.00 0.00 H new ATOM 0 HB3 ARG B 33 7.612 -5.517 -28.215 1.00 0.00 H new ATOM 0 HG2 ARG B 33 10.078 -5.554 -28.278 1.00 0.00 H new ATOM 0 HG3 ARG B 33 10.065 -7.068 -29.160 1.00 0.00 H new ATOM 0 HD2 ARG B 33 8.862 -4.462 -30.195 1.00 0.00 H new ATOM 0 HD3 ARG B 33 10.458 -5.051 -30.617 1.00 0.00 H new ATOM 0 HE ARG B 33 9.445 -6.930 -31.790 1.00 0.00 H new ATOM 0 HH11 ARG B 33 7.128 -4.454 -30.703 1.00 0.00 H new ATOM 0 HH12 ARG B 33 5.894 -4.968 -31.859 1.00 0.00 H new ATOM 0 HH21 ARG B 33 7.847 -7.541 -33.253 1.00 0.00 H new ATOM 0 HH22 ARG B 33 6.297 -6.695 -33.285 1.00 0.00 H new ATOM 510 N ILE B 34 9.752 -6.876 -25.377 1.00 0.00 N ATOM 511 CA ILE B 34 10.271 -6.200 -24.205 1.00 0.00 C ATOM 512 C ILE B 34 10.894 -4.868 -24.605 1.00 0.00 C ATOM 513 O ILE B 34 11.537 -4.766 -25.648 1.00 0.00 O ATOM 514 CB ILE B 34 11.272 -7.126 -23.504 1.00 0.00 C ATOM 515 CG1 ILE B 34 10.508 -8.356 -22.989 1.00 0.00 C ATOM 516 CG2 ILE B 34 11.981 -6.393 -22.365 1.00 0.00 C ATOM 517 CD1 ILE B 34 11.393 -9.281 -22.156 1.00 0.00 C ATOM 0 H ILE B 34 10.328 -7.659 -25.687 1.00 0.00 H new ATOM 0 HA ILE B 34 9.467 -5.976 -23.504 1.00 0.00 H new ATOM 0 HB ILE B 34 12.044 -7.444 -24.205 1.00 0.00 H new ATOM 0 HG12 ILE B 34 9.660 -8.029 -22.387 1.00 0.00 H new ATOM 0 HG13 ILE B 34 10.103 -8.910 -23.836 1.00 0.00 H new ATOM 0 HG21 ILE B 34 12.687 -7.068 -21.881 1.00 0.00 H new ATOM 0 HG22 ILE B 34 12.518 -5.533 -22.765 1.00 0.00 H new ATOM 0 HG23 ILE B 34 11.245 -6.055 -21.636 1.00 0.00 H new ATOM 0 HD11 ILE B 34 10.808 -10.135 -21.815 1.00 0.00 H new ATOM 0 HD12 ILE B 34 12.227 -9.632 -22.764 1.00 0.00 H new ATOM 0 HD13 ILE B 34 11.777 -8.737 -21.293 1.00 0.00 H new ATOM 529 N VAL B 35 10.697 -3.851 -23.764 1.00 0.00 N ATOM 530 CA VAL B 35 11.281 -2.531 -23.958 1.00 0.00 C ATOM 531 C VAL B 35 12.283 -2.225 -22.847 1.00 0.00 C ATOM 532 O VAL B 35 13.153 -1.372 -23.014 1.00 0.00 O ATOM 533 CB VAL B 35 10.193 -1.445 -24.018 1.00 0.00 C ATOM 534 CG1 VAL B 35 10.319 -0.680 -25.332 1.00 0.00 C ATOM 535 CG2 VAL B 35 8.767 -1.991 -23.931 1.00 0.00 C ATOM 0 H VAL B 35 10.123 -3.925 -22.924 1.00 0.00 H new ATOM 0 HA VAL B 35 11.806 -2.531 -24.913 1.00 0.00 H new ATOM 0 HB VAL B 35 10.355 -0.807 -23.149 1.00 0.00 H new ATOM 0 HG11 VAL B 35 9.550 0.091 -25.379 1.00 0.00 H new ATOM 0 HG12 VAL B 35 11.303 -0.215 -25.389 1.00 0.00 H new ATOM 0 HG13 VAL B 35 10.194 -1.369 -26.167 1.00 0.00 H new ATOM 0 HG21 VAL B 35 8.058 -1.165 -23.980 1.00 0.00 H new ATOM 0 HG22 VAL B 35 8.587 -2.673 -24.762 1.00 0.00 H new ATOM 0 HG23 VAL B 35 8.638 -2.524 -22.989 1.00 0.00 H new ATOM 545 N GLU B 36 12.158 -2.921 -21.709 1.00 0.00 N ATOM 546 CA GLU B 36 13.068 -2.772 -20.581 1.00 0.00 C ATOM 547 C GLU B 36 12.947 -3.990 -19.667 1.00 0.00 C ATOM 548 O GLU B 36 11.880 -4.592 -19.585 1.00 0.00 O ATOM 549 CB GLU B 36 12.706 -1.495 -19.821 1.00 0.00 C ATOM 550 CG GLU B 36 13.639 -1.263 -18.637 1.00 0.00 C ATOM 551 CD GLU B 36 13.370 0.088 -17.980 1.00 0.00 C ATOM 552 OE1 GLU B 36 12.495 0.134 -17.084 1.00 0.00 O ATOM 553 OE2 GLU B 36 14.036 1.070 -18.380 1.00 0.00 O ATOM 0 H GLU B 36 11.417 -3.604 -21.551 1.00 0.00 H new ATOM 0 HA GLU B 36 14.097 -2.701 -20.932 1.00 0.00 H new ATOM 0 HB2 GLU B 36 12.756 -0.642 -20.497 1.00 0.00 H new ATOM 0 HB3 GLU B 36 11.677 -1.561 -19.467 1.00 0.00 H new ATOM 0 HG2 GLU B 36 13.507 -2.059 -17.905 1.00 0.00 H new ATOM 0 HG3 GLU B 36 14.675 -1.307 -18.973 1.00 0.00 H new ATOM 560 N VAL B 37 14.029 -4.350 -18.975 1.00 0.00 N ATOM 561 CA VAL B 37 13.996 -5.389 -17.950 1.00 0.00 C ATOM 562 C VAL B 37 14.802 -4.946 -16.740 1.00 0.00 C ATOM 563 O VAL B 37 15.812 -4.256 -16.861 1.00 0.00 O ATOM 564 CB VAL B 37 14.472 -6.742 -18.498 1.00 0.00 C ATOM 565 CG1 VAL B 37 15.106 -7.627 -17.425 1.00 0.00 C ATOM 566 CG2 VAL B 37 13.269 -7.510 -19.037 1.00 0.00 C ATOM 0 H VAL B 37 14.949 -3.930 -19.110 1.00 0.00 H new ATOM 0 HA VAL B 37 12.963 -5.535 -17.635 1.00 0.00 H new ATOM 0 HB VAL B 37 15.215 -6.523 -19.265 1.00 0.00 H new ATOM 0 HG11 VAL B 37 15.423 -8.570 -17.871 1.00 0.00 H new ATOM 0 HG12 VAL B 37 15.971 -7.119 -16.998 1.00 0.00 H new ATOM 0 HG13 VAL B 37 14.377 -7.825 -16.639 1.00 0.00 H new ATOM 0 HG21 VAL B 37 13.598 -8.473 -19.429 1.00 0.00 H new ATOM 0 HG22 VAL B 37 12.550 -7.671 -18.233 1.00 0.00 H new ATOM 0 HG23 VAL B 37 12.798 -6.935 -19.835 1.00 0.00 H new ATOM 576 N LEU B 38 14.330 -5.368 -15.568 1.00 0.00 N ATOM 577 CA LEU B 38 14.996 -5.167 -14.290 1.00 0.00 C ATOM 578 C LEU B 38 15.209 -6.521 -13.649 1.00 0.00 C ATOM 579 O LEU B 38 14.487 -7.475 -13.931 1.00 0.00 O ATOM 580 CB LEU B 38 14.096 -4.317 -13.403 1.00 0.00 C ATOM 581 CG LEU B 38 14.475 -2.835 -13.407 1.00 0.00 C ATOM 582 CD1 LEU B 38 13.394 -2.051 -12.677 1.00 0.00 C ATOM 583 CD2 LEU B 38 15.798 -2.591 -12.687 1.00 0.00 C ATOM 0 H LEU B 38 13.448 -5.873 -15.483 1.00 0.00 H new ATOM 0 HA LEU B 38 15.954 -4.666 -14.425 1.00 0.00 H new ATOM 0 HB2 LEU B 38 13.064 -4.423 -13.736 1.00 0.00 H new ATOM 0 HB3 LEU B 38 14.142 -4.695 -12.382 1.00 0.00 H new ATOM 0 HG LEU B 38 14.574 -2.516 -14.444 1.00 0.00 H new ATOM 0 HD11 LEU B 38 13.653 -0.992 -12.673 1.00 0.00 H new ATOM 0 HD12 LEU B 38 12.439 -2.189 -13.184 1.00 0.00 H new ATOM 0 HD13 LEU B 38 13.315 -2.409 -11.651 1.00 0.00 H new ATOM 0 HD21 LEU B 38 16.034 -1.527 -12.710 1.00 0.00 H new ATOM 0 HD22 LEU B 38 15.715 -2.922 -11.652 1.00 0.00 H new ATOM 0 HD23 LEU B 38 16.591 -3.150 -13.184 1.00 0.00 H new ATOM 595 N LEU B 39 16.206 -6.599 -12.777 1.00 0.00 N ATOM 596 CA LEU B 39 16.424 -7.761 -11.956 1.00 0.00 C ATOM 597 C LEU B 39 17.151 -7.267 -10.721 1.00 0.00 C ATOM 598 O LEU B 39 18.245 -6.712 -10.823 1.00 0.00 O ATOM 599 CB LEU B 39 17.239 -8.765 -12.773 1.00 0.00 C ATOM 600 CG LEU B 39 17.574 -10.100 -12.107 1.00 0.00 C ATOM 601 CD1 LEU B 39 18.735 -9.979 -11.135 1.00 0.00 C ATOM 602 CD2 LEU B 39 16.410 -10.750 -11.379 1.00 0.00 C ATOM 0 H LEU B 39 16.883 -5.851 -12.626 1.00 0.00 H new ATOM 0 HA LEU B 39 15.509 -8.268 -11.648 1.00 0.00 H new ATOM 0 HB2 LEU B 39 16.693 -8.974 -13.693 1.00 0.00 H new ATOM 0 HB3 LEU B 39 18.175 -8.286 -13.060 1.00 0.00 H new ATOM 0 HG LEU B 39 17.845 -10.743 -12.944 1.00 0.00 H new ATOM 0 HD11 LEU B 39 18.937 -10.952 -10.686 1.00 0.00 H new ATOM 0 HD12 LEU B 39 19.621 -9.634 -11.668 1.00 0.00 H new ATOM 0 HD13 LEU B 39 18.481 -9.264 -10.352 1.00 0.00 H new ATOM 0 HD21 LEU B 39 16.737 -11.691 -10.937 1.00 0.00 H new ATOM 0 HD22 LEU B 39 16.055 -10.084 -10.593 1.00 0.00 H new ATOM 0 HD23 LEU B 39 15.601 -10.942 -12.084 1.00 0.00 H new ATOM 614 N MET B 40 16.549 -7.459 -9.552 1.00 0.00 N ATOM 615 CA MET B 40 17.071 -6.844 -8.347 1.00 0.00 C ATOM 616 C MET B 40 18.016 -7.814 -7.666 1.00 0.00 C ATOM 617 O MET B 40 17.727 -9.008 -7.622 1.00 0.00 O ATOM 618 CB MET B 40 15.930 -6.396 -7.426 1.00 0.00 C ATOM 619 CG MET B 40 14.778 -5.689 -8.147 1.00 0.00 C ATOM 620 SD MET B 40 15.178 -4.774 -9.663 1.00 0.00 S ATOM 621 CE MET B 40 16.399 -3.589 -9.052 1.00 0.00 C ATOM 0 H MET B 40 15.712 -8.027 -9.418 1.00 0.00 H new ATOM 0 HA MET B 40 17.631 -5.944 -8.602 1.00 0.00 H new ATOM 0 HB2 MET B 40 15.536 -7.268 -6.905 1.00 0.00 H new ATOM 0 HB3 MET B 40 16.333 -5.726 -6.667 1.00 0.00 H new ATOM 0 HG2 MET B 40 14.025 -6.438 -8.394 1.00 0.00 H new ATOM 0 HG3 MET B 40 14.318 -4.993 -7.445 1.00 0.00 H new ATOM 0 HE1 MET B 40 16.099 -2.580 -9.334 1.00 0.00 H new ATOM 0 HE2 MET B 40 16.462 -3.659 -7.966 1.00 0.00 H new ATOM 0 HE3 MET B 40 17.373 -3.813 -9.487 1.00 0.00 H new ATOM 631 N LYS B 41 19.139 -7.327 -7.129 1.00 0.00 N ATOM 632 CA LYS B 41 20.068 -8.214 -6.449 1.00 0.00 C ATOM 633 C LYS B 41 20.625 -7.652 -5.150 1.00 0.00 C ATOM 634 O LYS B 41 20.598 -6.446 -4.909 1.00 0.00 O ATOM 635 CB LYS B 41 21.230 -8.630 -7.341 1.00 0.00 C ATOM 636 CG LYS B 41 20.984 -8.537 -8.846 1.00 0.00 C ATOM 637 CD LYS B 41 22.298 -8.850 -9.561 1.00 0.00 C ATOM 638 CE LYS B 41 22.133 -8.706 -11.073 1.00 0.00 C ATOM 639 NZ LYS B 41 23.419 -8.917 -11.767 1.00 0.00 N ATOM 0 H LYS B 41 19.417 -6.346 -7.154 1.00 0.00 H new ATOM 0 HA LYS B 41 19.463 -9.086 -6.203 1.00 0.00 H new ATOM 0 HB2 LYS B 41 22.092 -8.010 -7.095 1.00 0.00 H new ATOM 0 HB3 LYS B 41 21.498 -9.659 -7.099 1.00 0.00 H new ATOM 0 HG2 LYS B 41 20.209 -9.240 -9.149 1.00 0.00 H new ATOM 0 HG3 LYS B 41 20.633 -7.540 -9.114 1.00 0.00 H new ATOM 0 HD2 LYS B 41 23.080 -8.177 -9.209 1.00 0.00 H new ATOM 0 HD3 LYS B 41 22.618 -9.864 -9.319 1.00 0.00 H new ATOM 0 HE2 LYS B 41 21.399 -9.427 -11.433 1.00 0.00 H new ATOM 0 HE3 LYS B 41 21.747 -7.714 -11.308 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 23.281 -8.814 -12.793 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 24.110 -8.213 -11.438 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 23.773 -9.873 -11.560 1.00 0.00 H new ATOM 653 N ASP B 42 21.136 -8.565 -4.323 1.00 0.00 N ATOM 654 CA ASP B 42 21.842 -8.244 -3.096 1.00 0.00 C ATOM 655 C ASP B 42 23.132 -7.491 -3.423 1.00 0.00 C ATOM 656 O ASP B 42 23.736 -7.719 -4.470 1.00 0.00 O ATOM 657 CB ASP B 42 22.130 -9.548 -2.352 1.00 0.00 C ATOM 658 CG ASP B 42 22.471 -9.298 -0.885 1.00 0.00 C ATOM 659 OD1 ASP B 42 23.621 -8.883 -0.625 1.00 0.00 O ATOM 660 OD2 ASP B 42 21.578 -9.523 -0.039 1.00 0.00 O ATOM 0 H ASP B 42 21.066 -9.568 -4.497 1.00 0.00 H new ATOM 0 HA ASP B 42 21.236 -7.598 -2.460 1.00 0.00 H new ATOM 0 HB2 ASP B 42 21.262 -10.203 -2.417 1.00 0.00 H new ATOM 0 HB3 ASP B 42 22.958 -10.067 -2.835 1.00 0.00 H new ATOM 665 N ARG B 43 23.556 -6.594 -2.526 1.00 0.00 N ATOM 666 CA ARG B 43 24.718 -5.747 -2.754 1.00 0.00 C ATOM 667 C ARG B 43 25.992 -6.359 -2.169 1.00 0.00 C ATOM 668 O ARG B 43 27.087 -5.845 -2.391 1.00 0.00 O ATOM 669 CB ARG B 43 24.404 -4.360 -2.182 1.00 0.00 C ATOM 670 CG ARG B 43 25.467 -3.323 -2.549 1.00 0.00 C ATOM 671 CD ARG B 43 25.005 -1.931 -2.121 1.00 0.00 C ATOM 672 NE ARG B 43 23.832 -1.497 -2.891 1.00 0.00 N ATOM 673 CZ ARG B 43 23.254 -0.297 -2.783 1.00 0.00 C ATOM 674 NH1 ARG B 43 23.725 0.612 -1.930 1.00 0.00 N ATOM 675 NH2 ARG B 43 22.199 -0.006 -3.534 1.00 0.00 N ATOM 0 H ARG B 43 23.101 -6.440 -1.626 1.00 0.00 H new ATOM 0 HA ARG B 43 24.917 -5.657 -3.822 1.00 0.00 H new ATOM 0 HB2 ARG B 43 23.434 -4.028 -2.552 1.00 0.00 H new ATOM 0 HB3 ARG B 43 24.325 -4.427 -1.097 1.00 0.00 H new ATOM 0 HG2 ARG B 43 26.411 -3.568 -2.062 1.00 0.00 H new ATOM 0 HG3 ARG B 43 25.649 -3.341 -3.624 1.00 0.00 H new ATOM 0 HD2 ARG B 43 24.763 -1.937 -1.058 1.00 0.00 H new ATOM 0 HD3 ARG B 43 25.817 -1.218 -2.259 1.00 0.00 H new ATOM 0 HE ARG B 43 23.430 -2.158 -3.555 1.00 0.00 H new ATOM 0 HH11 ARG B 43 24.536 0.395 -1.350 1.00 0.00 H new ATOM 0 HH12 ARG B 43 23.275 1.524 -1.857 1.00 0.00 H new ATOM 0 HH21 ARG B 43 21.833 -0.697 -4.189 1.00 0.00 H new ATOM 0 HH22 ARG B 43 21.754 0.908 -3.456 1.00 0.00 H new ATOM 689 N GLU B 44 25.852 -7.456 -1.422 1.00 0.00 N ATOM 690 CA GLU B 44 26.974 -8.133 -0.783 1.00 0.00 C ATOM 691 C GLU B 44 27.161 -9.561 -1.298 1.00 0.00 C ATOM 692 O GLU B 44 28.199 -10.171 -1.033 1.00 0.00 O ATOM 693 CB GLU B 44 26.753 -8.149 0.729 1.00 0.00 C ATOM 694 CG GLU B 44 26.729 -6.728 1.298 1.00 0.00 C ATOM 695 CD GLU B 44 26.560 -6.756 2.817 1.00 0.00 C ATOM 696 OE1 GLU B 44 27.569 -7.017 3.510 1.00 0.00 O ATOM 697 OE2 GLU B 44 25.422 -6.516 3.277 1.00 0.00 O ATOM 0 H GLU B 44 24.951 -7.899 -1.245 1.00 0.00 H new ATOM 0 HA GLU B 44 27.882 -7.583 -1.029 1.00 0.00 H new ATOM 0 HB2 GLU B 44 25.813 -8.651 0.957 1.00 0.00 H new ATOM 0 HB3 GLU B 44 27.545 -8.723 1.209 1.00 0.00 H new ATOM 0 HG2 GLU B 44 27.654 -6.212 1.040 1.00 0.00 H new ATOM 0 HG3 GLU B 44 25.913 -6.164 0.847 1.00 0.00 H new ATOM 704 N THR B 45 26.182 -10.104 -2.030 1.00 0.00 N ATOM 705 CA THR B 45 26.305 -11.439 -2.610 1.00 0.00 C ATOM 706 C THR B 45 26.099 -11.402 -4.112 1.00 0.00 C ATOM 707 O THR B 45 26.440 -12.369 -4.791 1.00 0.00 O ATOM 708 CB THR B 45 25.308 -12.416 -1.987 1.00 0.00 C ATOM 709 OG1 THR B 45 24.000 -12.126 -2.426 1.00 0.00 O ATOM 710 CG2 THR B 45 25.345 -12.327 -0.471 1.00 0.00 C ATOM 0 H THR B 45 25.298 -9.637 -2.233 1.00 0.00 H new ATOM 0 HA THR B 45 27.316 -11.786 -2.395 1.00 0.00 H new ATOM 0 HB THR B 45 25.588 -13.423 -2.298 1.00 0.00 H new ATOM 0 HG1 THR B 45 23.371 -12.760 -2.021 1.00 0.00 H new ATOM 0 HG21 THR B 45 24.628 -13.030 -0.048 1.00 0.00 H new ATOM 0 HG22 THR B 45 26.346 -12.572 -0.116 1.00 0.00 H new ATOM 0 HG23 THR B 45 25.087 -11.315 -0.160 1.00 0.00 H new ATOM 718 N ASN B 46 25.554 -10.296 -4.630 1.00 0.00 N ATOM 719 CA ASN B 46 25.383 -10.116 -6.065 1.00 0.00 C ATOM 720 C ASN B 46 24.539 -11.228 -6.700 1.00 0.00 C ATOM 721 O ASN B 46 24.585 -11.426 -7.913 1.00 0.00 O ATOM 722 CB ASN B 46 26.766 -9.978 -6.705 1.00 0.00 C ATOM 723 CG ASN B 46 27.447 -8.659 -6.364 1.00 0.00 C ATOM 724 OD1 ASN B 46 26.895 -7.814 -5.668 1.00 0.00 O ATOM 725 ND2 ASN B 46 28.668 -8.472 -6.856 1.00 0.00 N ATOM 0 H ASN B 46 25.224 -9.511 -4.068 1.00 0.00 H new ATOM 0 HA ASN B 46 24.816 -9.203 -6.249 1.00 0.00 H new ATOM 0 HB2 ASN B 46 27.397 -10.803 -6.375 1.00 0.00 H new ATOM 0 HB3 ASN B 46 26.670 -10.063 -7.787 1.00 0.00 H new ATOM 0 HD21 ASN B 46 29.171 -7.607 -6.657 1.00 0.00 H new ATOM 0 HD22 ASN B 46 29.102 -9.193 -7.432 1.00 0.00 H new ATOM 732 N LYS B 47 23.773 -11.950 -5.877 1.00 0.00 N ATOM 733 CA LYS B 47 22.872 -13.008 -6.310 1.00 0.00 C ATOM 734 C LYS B 47 21.614 -12.404 -6.917 1.00 0.00 C ATOM 735 O LYS B 47 21.644 -11.851 -8.014 1.00 0.00 O ATOM 736 CB LYS B 47 22.576 -13.927 -5.119 1.00 0.00 C ATOM 737 CG LYS B 47 23.727 -14.903 -4.883 1.00 0.00 C ATOM 738 CD LYS B 47 23.733 -15.977 -5.972 1.00 0.00 C ATOM 739 CE LYS B 47 24.720 -17.087 -5.620 1.00 0.00 C ATOM 740 NZ LYS B 47 24.694 -18.150 -6.645 1.00 0.00 N ATOM 0 H LYS B 47 23.766 -11.807 -4.867 1.00 0.00 H new ATOM 0 HA LYS B 47 23.335 -13.613 -7.090 1.00 0.00 H new ATOM 0 HB2 LYS B 47 22.413 -13.327 -4.224 1.00 0.00 H new ATOM 0 HB3 LYS B 47 21.656 -14.482 -5.303 1.00 0.00 H new ATOM 0 HG2 LYS B 47 24.676 -14.367 -4.884 1.00 0.00 H new ATOM 0 HG3 LYS B 47 23.625 -15.368 -3.902 1.00 0.00 H new ATOM 0 HD2 LYS B 47 22.732 -16.394 -6.086 1.00 0.00 H new ATOM 0 HD3 LYS B 47 24.003 -15.532 -6.929 1.00 0.00 H new ATOM 0 HE2 LYS B 47 25.726 -16.675 -5.541 1.00 0.00 H new ATOM 0 HE3 LYS B 47 24.470 -17.507 -4.646 1.00 0.00 H new ATOM 0 HZ1 LYS B 47 25.106 -19.021 -6.253 1.00 0.00 H new ATOM 0 HZ2 LYS B 47 23.711 -18.331 -6.933 1.00 0.00 H new ATOM 0 HZ3 LYS B 47 25.247 -17.848 -7.472 1.00 0.00 H new ATOM 754 N SER B 48 20.506 -12.514 -6.192 1.00 0.00 N ATOM 755 CA SER B 48 19.245 -11.889 -6.542 1.00 0.00 C ATOM 756 C SER B 48 18.479 -11.579 -5.264 1.00 0.00 C ATOM 757 O SER B 48 18.596 -12.302 -4.277 1.00 0.00 O ATOM 758 CB SER B 48 18.423 -12.815 -7.438 1.00 0.00 C ATOM 759 OG SER B 48 17.278 -12.139 -7.903 1.00 0.00 O ATOM 0 H SER B 48 20.463 -13.053 -5.327 1.00 0.00 H new ATOM 0 HA SER B 48 19.435 -10.966 -7.090 1.00 0.00 H new ATOM 0 HB2 SER B 48 19.027 -13.149 -8.282 1.00 0.00 H new ATOM 0 HB3 SER B 48 18.130 -13.706 -6.883 1.00 0.00 H new ATOM 0 HG SER B 48 17.411 -11.172 -7.817 1.00 0.00 H new ATOM 765 N ARG B 49 17.685 -10.501 -5.284 1.00 0.00 N ATOM 766 CA ARG B 49 16.774 -10.174 -4.192 1.00 0.00 C ATOM 767 C ARG B 49 15.607 -11.150 -4.228 1.00 0.00 C ATOM 768 O ARG B 49 14.805 -11.208 -3.298 1.00 0.00 O ATOM 769 CB ARG B 49 16.235 -8.755 -4.366 1.00 0.00 C ATOM 770 CG ARG B 49 17.334 -7.698 -4.358 1.00 0.00 C ATOM 771 CD ARG B 49 17.722 -7.235 -2.959 1.00 0.00 C ATOM 772 NE ARG B 49 16.644 -6.468 -2.325 1.00 0.00 N ATOM 773 CZ ARG B 49 16.447 -5.164 -2.538 1.00 0.00 C ATOM 774 NH1 ARG B 49 17.242 -4.491 -3.363 1.00 0.00 N ATOM 775 NH2 ARG B 49 15.453 -4.529 -1.924 1.00 0.00 N ATOM 0 H ARG B 49 17.660 -9.836 -6.057 1.00 0.00 H new ATOM 0 HA ARG B 49 17.305 -10.242 -3.242 1.00 0.00 H new ATOM 0 HB2 ARG B 49 15.685 -8.693 -5.305 1.00 0.00 H new ATOM 0 HB3 ARG B 49 15.526 -8.541 -3.567 1.00 0.00 H new ATOM 0 HG2 ARG B 49 18.216 -8.099 -4.857 1.00 0.00 H new ATOM 0 HG3 ARG B 49 17.003 -6.837 -4.938 1.00 0.00 H new ATOM 0 HD2 ARG B 49 17.964 -8.101 -2.343 1.00 0.00 H new ATOM 0 HD3 ARG B 49 18.621 -6.622 -3.015 1.00 0.00 H new ATOM 0 HE ARG B 49 16.013 -6.955 -1.689 1.00 0.00 H new ATOM 0 HH11 ARG B 49 18.007 -4.970 -3.838 1.00 0.00 H new ATOM 0 HH12 ARG B 49 17.087 -3.495 -3.522 1.00 0.00 H new ATOM 0 HH21 ARG B 49 14.838 -5.038 -1.288 1.00 0.00 H new ATOM 0 HH22 ARG B 49 15.305 -3.533 -2.089 1.00 0.00 H new ATOM 789 N GLY B 50 15.524 -11.915 -5.320 1.00 0.00 N ATOM 790 CA GLY B 50 14.451 -12.871 -5.535 1.00 0.00 C ATOM 791 C GLY B 50 13.241 -12.230 -6.208 1.00 0.00 C ATOM 792 O GLY B 50 12.227 -12.897 -6.388 1.00 0.00 O ATOM 0 H GLY B 50 16.205 -11.883 -6.079 1.00 0.00 H new ATOM 0 HA2 GLY B 50 14.816 -13.693 -6.151 1.00 0.00 H new ATOM 0 HA3 GLY B 50 14.150 -13.299 -4.579 1.00 0.00 H new ATOM 796 N PHE B 51 13.320 -10.950 -6.588 1.00 0.00 N ATOM 797 CA PHE B 51 12.237 -10.303 -7.312 1.00 0.00 C ATOM 798 C PHE B 51 12.805 -9.411 -8.409 1.00 0.00 C ATOM 799 O PHE B 51 13.960 -8.986 -8.336 1.00 0.00 O ATOM 800 CB PHE B 51 11.317 -9.539 -6.356 1.00 0.00 C ATOM 801 CG PHE B 51 11.889 -8.265 -5.780 1.00 0.00 C ATOM 802 CD1 PHE B 51 12.775 -8.309 -4.689 1.00 0.00 C ATOM 803 CD2 PHE B 51 11.526 -7.030 -6.331 1.00 0.00 C ATOM 804 CE1 PHE B 51 13.290 -7.119 -4.160 1.00 0.00 C ATOM 805 CE2 PHE B 51 12.029 -5.841 -5.788 1.00 0.00 C ATOM 806 CZ PHE B 51 12.921 -5.889 -4.715 1.00 0.00 C ATOM 0 H PHE B 51 14.123 -10.349 -6.404 1.00 0.00 H new ATOM 0 HA PHE B 51 11.622 -11.065 -7.791 1.00 0.00 H new ATOM 0 HB2 PHE B 51 10.395 -9.296 -6.884 1.00 0.00 H new ATOM 0 HB3 PHE B 51 11.048 -10.201 -5.532 1.00 0.00 H new ATOM 0 HD1 PHE B 51 13.058 -9.259 -4.260 1.00 0.00 H new ATOM 0 HD2 PHE B 51 10.856 -6.994 -7.177 1.00 0.00 H new ATOM 0 HE1 PHE B 51 13.972 -7.151 -3.323 1.00 0.00 H new ATOM 0 HE2 PHE B 51 11.727 -4.889 -6.199 1.00 0.00 H new ATOM 0 HZ PHE B 51 13.328 -4.973 -4.312 1.00 0.00 H new ATOM 816 N ALA B 52 11.996 -9.124 -9.430 1.00 0.00 N ATOM 817 CA ALA B 52 12.444 -8.378 -10.591 1.00 0.00 C ATOM 818 C ALA B 52 11.273 -7.680 -11.281 1.00 0.00 C ATOM 819 O ALA B 52 10.137 -7.763 -10.817 1.00 0.00 O ATOM 820 CB ALA B 52 13.097 -9.369 -11.551 1.00 0.00 C ATOM 0 H ALA B 52 11.016 -9.404 -9.469 1.00 0.00 H new ATOM 0 HA ALA B 52 13.151 -7.607 -10.285 1.00 0.00 H new ATOM 0 HB1 ALA B 52 13.446 -8.840 -12.438 1.00 0.00 H new ATOM 0 HB2 ALA B 52 13.942 -9.850 -11.058 1.00 0.00 H new ATOM 0 HB3 ALA B 52 12.369 -10.126 -11.843 1.00 0.00 H new ATOM 826 N PHE B 53 11.555 -6.993 -12.391 1.00 0.00 N ATOM 827 CA PHE B 53 10.543 -6.287 -13.158 1.00 0.00 C ATOM 828 C PHE B 53 10.831 -6.400 -14.653 1.00 0.00 C ATOM 829 O PHE B 53 11.953 -6.702 -15.053 1.00 0.00 O ATOM 830 CB PHE B 53 10.483 -4.820 -12.726 1.00 0.00 C ATOM 831 CG PHE B 53 10.201 -4.627 -11.261 1.00 0.00 C ATOM 832 CD1 PHE B 53 11.250 -4.738 -10.339 1.00 0.00 C ATOM 833 CD2 PHE B 53 8.904 -4.338 -10.823 1.00 0.00 C ATOM 834 CE1 PHE B 53 10.996 -4.586 -8.974 1.00 0.00 C ATOM 835 CE2 PHE B 53 8.648 -4.183 -9.457 1.00 0.00 C ATOM 836 CZ PHE B 53 9.692 -4.317 -8.531 1.00 0.00 C ATOM 0 H PHE B 53 12.495 -6.915 -12.778 1.00 0.00 H new ATOM 0 HA PHE B 53 9.573 -6.744 -12.964 1.00 0.00 H new ATOM 0 HB2 PHE B 53 11.431 -4.341 -12.970 1.00 0.00 H new ATOM 0 HB3 PHE B 53 9.711 -4.312 -13.305 1.00 0.00 H new ATOM 0 HD1 PHE B 53 12.253 -4.941 -10.683 1.00 0.00 H new ATOM 0 HD2 PHE B 53 8.102 -4.235 -11.539 1.00 0.00 H new ATOM 0 HE1 PHE B 53 11.802 -4.675 -8.261 1.00 0.00 H new ATOM 0 HE2 PHE B 53 7.648 -3.960 -9.116 1.00 0.00 H new ATOM 0 HZ PHE B 53 9.492 -4.213 -7.475 1.00 0.00 H new ATOM 846 N VAL B 54 9.818 -6.159 -15.483 1.00 0.00 N ATOM 847 CA VAL B 54 9.979 -6.162 -16.929 1.00 0.00 C ATOM 848 C VAL B 54 8.921 -5.276 -17.560 1.00 0.00 C ATOM 849 O VAL B 54 7.769 -5.304 -17.139 1.00 0.00 O ATOM 850 CB VAL B 54 9.872 -7.591 -17.476 1.00 0.00 C ATOM 851 CG1 VAL B 54 8.637 -8.307 -17.014 1.00 0.00 C ATOM 852 CG2 VAL B 54 9.911 -7.622 -19.002 1.00 0.00 C ATOM 0 H VAL B 54 8.868 -5.957 -15.171 1.00 0.00 H new ATOM 0 HA VAL B 54 10.966 -5.773 -17.178 1.00 0.00 H new ATOM 0 HB VAL B 54 10.743 -8.110 -17.075 1.00 0.00 H new ATOM 0 HG11 VAL B 54 8.620 -9.312 -17.435 1.00 0.00 H new ATOM 0 HG12 VAL B 54 8.638 -8.370 -15.926 1.00 0.00 H new ATOM 0 HG13 VAL B 54 7.754 -7.760 -17.345 1.00 0.00 H new ATOM 0 HG21 VAL B 54 9.832 -8.653 -19.347 1.00 0.00 H new ATOM 0 HG22 VAL B 54 9.078 -7.042 -19.399 1.00 0.00 H new ATOM 0 HG23 VAL B 54 10.850 -7.193 -19.351 1.00 0.00 H new ATOM 862 N THR B 55 9.308 -4.497 -18.569 1.00 0.00 N ATOM 863 CA THR B 55 8.374 -3.657 -19.297 1.00 0.00 C ATOM 864 C THR B 55 8.179 -4.192 -20.706 1.00 0.00 C ATOM 865 O THR B 55 9.144 -4.408 -21.439 1.00 0.00 O ATOM 866 CB THR B 55 8.849 -2.204 -19.341 1.00 0.00 C ATOM 867 OG1 THR B 55 9.064 -1.735 -18.025 1.00 0.00 O ATOM 868 CG2 THR B 55 7.785 -1.333 -20.009 1.00 0.00 C ATOM 0 H THR B 55 10.271 -4.434 -18.899 1.00 0.00 H new ATOM 0 HA THR B 55 7.419 -3.680 -18.771 1.00 0.00 H new ATOM 0 HB THR B 55 9.778 -2.151 -19.909 1.00 0.00 H new ATOM 0 HG1 THR B 55 9.370 -0.804 -18.055 1.00 0.00 H new ATOM 0 HG21 THR B 55 8.127 -0.299 -20.038 1.00 0.00 H new ATOM 0 HG22 THR B 55 7.611 -1.687 -21.025 1.00 0.00 H new ATOM 0 HG23 THR B 55 6.857 -1.392 -19.440 1.00 0.00 H new ATOM 876 N PHE B 56 6.914 -4.404 -21.075 1.00 0.00 N ATOM 877 CA PHE B 56 6.535 -4.816 -22.411 1.00 0.00 C ATOM 878 C PHE B 56 6.084 -3.609 -23.233 1.00 0.00 C ATOM 879 O PHE B 56 5.754 -2.560 -22.677 1.00 0.00 O ATOM 880 CB PHE B 56 5.392 -5.820 -22.337 1.00 0.00 C ATOM 881 CG PHE B 56 5.718 -7.190 -21.782 1.00 0.00 C ATOM 882 CD1 PHE B 56 6.278 -7.358 -20.504 1.00 0.00 C ATOM 883 CD2 PHE B 56 5.430 -8.318 -22.566 1.00 0.00 C ATOM 884 CE1 PHE B 56 6.553 -8.645 -20.022 1.00 0.00 C ATOM 885 CE2 PHE B 56 5.676 -9.604 -22.071 1.00 0.00 C ATOM 886 CZ PHE B 56 6.232 -9.770 -20.797 1.00 0.00 C ATOM 0 H PHE B 56 6.122 -4.291 -20.442 1.00 0.00 H new ATOM 0 HA PHE B 56 7.401 -5.274 -22.889 1.00 0.00 H new ATOM 0 HB2 PHE B 56 4.599 -5.387 -21.727 1.00 0.00 H new ATOM 0 HB3 PHE B 56 4.988 -5.948 -23.341 1.00 0.00 H new ATOM 0 HD1 PHE B 56 6.497 -6.495 -19.893 1.00 0.00 H new ATOM 0 HD2 PHE B 56 5.017 -8.193 -23.556 1.00 0.00 H new ATOM 0 HE1 PHE B 56 7.013 -8.771 -19.053 1.00 0.00 H new ATOM 0 HE2 PHE B 56 5.437 -10.469 -22.672 1.00 0.00 H new ATOM 0 HZ PHE B 56 6.414 -10.762 -20.411 1.00 0.00 H new ATOM 896 N GLU B 57 6.066 -3.762 -24.557 1.00 0.00 N ATOM 897 CA GLU B 57 5.645 -2.719 -25.473 1.00 0.00 C ATOM 898 C GLU B 57 4.133 -2.469 -25.431 1.00 0.00 C ATOM 899 O GLU B 57 3.682 -1.418 -25.880 1.00 0.00 O ATOM 900 CB GLU B 57 6.088 -3.125 -26.876 1.00 0.00 C ATOM 901 CG GLU B 57 7.499 -2.617 -27.177 1.00 0.00 C ATOM 902 CD GLU B 57 7.809 -2.617 -28.672 1.00 0.00 C ATOM 903 OE1 GLU B 57 7.009 -3.192 -29.443 1.00 0.00 O ATOM 904 OE2 GLU B 57 8.856 -2.037 -29.039 1.00 0.00 O ATOM 0 H GLU B 57 6.348 -4.625 -25.022 1.00 0.00 H new ATOM 0 HA GLU B 57 6.109 -1.779 -25.175 1.00 0.00 H new ATOM 0 HB2 GLU B 57 6.062 -4.211 -26.969 1.00 0.00 H new ATOM 0 HB3 GLU B 57 5.390 -2.725 -27.611 1.00 0.00 H new ATOM 0 HG2 GLU B 57 7.610 -1.606 -26.785 1.00 0.00 H new ATOM 0 HG3 GLU B 57 8.226 -3.241 -26.658 1.00 0.00 H new ATOM 911 N SER B 58 3.346 -3.413 -24.903 1.00 0.00 N ATOM 912 CA SER B 58 1.908 -3.258 -24.746 1.00 0.00 C ATOM 913 C SER B 58 1.495 -3.620 -23.328 1.00 0.00 C ATOM 914 O SER B 58 2.155 -4.406 -22.652 1.00 0.00 O ATOM 915 CB SER B 58 1.209 -4.130 -25.796 1.00 0.00 C ATOM 916 OG SER B 58 -0.184 -4.183 -25.589 1.00 0.00 O ATOM 0 H SER B 58 3.699 -4.311 -24.572 1.00 0.00 H new ATOM 0 HA SER B 58 1.612 -2.221 -24.905 1.00 0.00 H new ATOM 0 HB2 SER B 58 1.414 -3.735 -26.791 1.00 0.00 H new ATOM 0 HB3 SER B 58 1.620 -5.139 -25.763 1.00 0.00 H new ATOM 0 HG SER B 58 -0.596 -4.746 -26.278 1.00 0.00 H new ATOM 922 N PRO B 59 0.388 -3.049 -22.847 1.00 0.00 N ATOM 923 CA PRO B 59 -0.202 -3.440 -21.590 1.00 0.00 C ATOM 924 C PRO B 59 -1.036 -4.700 -21.767 1.00 0.00 C ATOM 925 O PRO B 59 -1.634 -5.159 -20.799 1.00 0.00 O ATOM 926 CB PRO B 59 -1.103 -2.275 -21.223 1.00 0.00 C ATOM 927 CG PRO B 59 -1.638 -1.883 -22.588 1.00 0.00 C ATOM 928 CD PRO B 59 -0.390 -1.985 -23.461 1.00 0.00 C ATOM 0 HA PRO B 59 0.547 -3.655 -20.828 1.00 0.00 H new ATOM 0 HB2 PRO B 59 -1.898 -2.568 -20.537 1.00 0.00 H new ATOM 0 HB3 PRO B 59 -0.554 -1.463 -20.746 1.00 0.00 H new ATOM 0 HG2 PRO B 59 -2.427 -2.555 -22.925 1.00 0.00 H new ATOM 0 HG3 PRO B 59 -2.055 -0.876 -22.589 1.00 0.00 H new ATOM 0 HD2 PRO B 59 -0.645 -2.223 -24.494 1.00 0.00 H new ATOM 0 HD3 PRO B 59 0.163 -1.046 -23.477 1.00 0.00 H new ATOM 936 N ALA B 60 -1.085 -5.253 -22.986 1.00 0.00 N ATOM 937 CA ALA B 60 -1.892 -6.424 -23.291 1.00 0.00 C ATOM 938 C ALA B 60 -1.050 -7.607 -23.772 1.00 0.00 C ATOM 939 O ALA B 60 -1.545 -8.733 -23.785 1.00 0.00 O ATOM 940 CB ALA B 60 -2.962 -6.050 -24.311 1.00 0.00 C ATOM 0 H ALA B 60 -0.562 -4.894 -23.785 1.00 0.00 H new ATOM 0 HA ALA B 60 -2.373 -6.754 -22.370 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -3.568 -6.927 -24.541 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -3.599 -5.267 -23.900 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -2.485 -5.689 -25.223 1.00 0.00 H new ATOM 946 N ASP B 61 0.205 -7.376 -24.160 1.00 0.00 N ATOM 947 CA ASP B 61 1.107 -8.469 -24.507 1.00 0.00 C ATOM 948 C ASP B 61 1.812 -8.954 -23.243 1.00 0.00 C ATOM 949 O ASP B 61 2.308 -10.076 -23.176 1.00 0.00 O ATOM 950 CB ASP B 61 2.068 -8.023 -25.609 1.00 0.00 C ATOM 951 CG ASP B 61 3.183 -7.093 -25.151 1.00 0.00 C ATOM 952 OD1 ASP B 61 2.943 -6.362 -24.172 1.00 0.00 O ATOM 953 OD2 ASP B 61 4.259 -7.123 -25.786 1.00 0.00 O ATOM 0 H ASP B 61 0.616 -6.446 -24.241 1.00 0.00 H new ATOM 0 HA ASP B 61 0.554 -9.316 -24.911 1.00 0.00 H new ATOM 0 HB2 ASP B 61 2.516 -8.908 -26.060 1.00 0.00 H new ATOM 0 HB3 ASP B 61 1.495 -7.522 -26.390 1.00 0.00 H new ATOM 958 N ALA B 62 1.836 -8.074 -22.241 1.00 0.00 N ATOM 959 CA ALA B 62 2.303 -8.380 -20.898 1.00 0.00 C ATOM 960 C ALA B 62 1.296 -9.246 -20.147 1.00 0.00 C ATOM 961 O ALA B 62 1.672 -10.012 -19.263 1.00 0.00 O ATOM 962 CB ALA B 62 2.496 -7.074 -20.127 1.00 0.00 C ATOM 0 H ALA B 62 1.523 -7.109 -22.348 1.00 0.00 H new ATOM 0 HA ALA B 62 3.243 -8.926 -20.978 1.00 0.00 H new ATOM 0 HB1 ALA B 62 2.846 -7.295 -19.119 1.00 0.00 H new ATOM 0 HB2 ALA B 62 3.232 -6.455 -20.639 1.00 0.00 H new ATOM 0 HB3 ALA B 62 1.547 -6.540 -20.073 1.00 0.00 H new ATOM 968 N LYS B 63 0.013 -9.129 -20.498 1.00 0.00 N ATOM 969 CA LYS B 63 -1.045 -9.884 -19.844 1.00 0.00 C ATOM 970 C LYS B 63 -0.928 -11.355 -20.207 1.00 0.00 C ATOM 971 O LYS B 63 -1.261 -12.226 -19.410 1.00 0.00 O ATOM 972 CB LYS B 63 -2.403 -9.353 -20.305 1.00 0.00 C ATOM 973 CG LYS B 63 -2.530 -7.878 -19.915 1.00 0.00 C ATOM 974 CD LYS B 63 -3.854 -7.242 -20.359 1.00 0.00 C ATOM 975 CE LYS B 63 -5.023 -7.824 -19.564 1.00 0.00 C ATOM 976 NZ LYS B 63 -6.299 -7.193 -19.958 1.00 0.00 N ATOM 0 H LYS B 63 -0.315 -8.510 -21.240 1.00 0.00 H new ATOM 0 HA LYS B 63 -0.953 -9.773 -18.764 1.00 0.00 H new ATOM 0 HB2 LYS B 63 -2.502 -9.465 -21.385 1.00 0.00 H new ATOM 0 HB3 LYS B 63 -3.206 -9.932 -19.849 1.00 0.00 H new ATOM 0 HG2 LYS B 63 -2.437 -7.787 -18.833 1.00 0.00 H new ATOM 0 HG3 LYS B 63 -1.703 -7.321 -20.355 1.00 0.00 H new ATOM 0 HD2 LYS B 63 -3.811 -6.162 -20.216 1.00 0.00 H new ATOM 0 HD3 LYS B 63 -4.009 -7.416 -21.424 1.00 0.00 H new ATOM 0 HE2 LYS B 63 -5.079 -8.900 -19.729 1.00 0.00 H new ATOM 0 HE3 LYS B 63 -4.853 -7.673 -18.498 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 -7.076 -7.606 -19.404 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 -6.251 -6.170 -19.778 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 -6.470 -7.358 -20.970 1.00 0.00 H new ATOM 990 N ASP B 64 -0.452 -11.638 -21.417 1.00 0.00 N ATOM 991 CA ASP B 64 -0.358 -13.000 -21.899 1.00 0.00 C ATOM 992 C ASP B 64 0.757 -13.739 -21.176 1.00 0.00 C ATOM 993 O ASP B 64 0.751 -14.964 -21.113 1.00 0.00 O ATOM 994 CB ASP B 64 -0.082 -12.938 -23.394 1.00 0.00 C ATOM 995 CG ASP B 64 -0.279 -14.292 -24.070 1.00 0.00 C ATOM 996 OD1 ASP B 64 -1.412 -14.815 -23.997 1.00 0.00 O ATOM 997 OD2 ASP B 64 0.709 -14.792 -24.653 1.00 0.00 O ATOM 0 H ASP B 64 -0.126 -10.934 -22.079 1.00 0.00 H new ATOM 0 HA ASP B 64 -1.285 -13.541 -21.709 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -0.743 -12.204 -23.854 1.00 0.00 H new ATOM 0 HB3 ASP B 64 0.939 -12.595 -23.560 1.00 0.00 H new ATOM 1002 N ALA B 65 1.708 -12.984 -20.625 1.00 0.00 N ATOM 1003 CA ALA B 65 2.730 -13.543 -19.758 1.00 0.00 C ATOM 1004 C ALA B 65 2.207 -13.626 -18.328 1.00 0.00 C ATOM 1005 O ALA B 65 2.392 -14.632 -17.652 1.00 0.00 O ATOM 1006 CB ALA B 65 3.988 -12.680 -19.795 1.00 0.00 C ATOM 0 H ALA B 65 1.786 -11.977 -20.769 1.00 0.00 H new ATOM 0 HA ALA B 65 2.978 -14.544 -20.111 1.00 0.00 H new ATOM 0 HB1 ALA B 65 4.745 -13.112 -19.140 1.00 0.00 H new ATOM 0 HB2 ALA B 65 4.371 -12.639 -20.815 1.00 0.00 H new ATOM 0 HB3 ALA B 65 3.748 -11.672 -19.457 1.00 0.00 H new ATOM 1012 N ALA B 66 1.545 -12.568 -17.860 1.00 0.00 N ATOM 1013 CA ALA B 66 1.101 -12.496 -16.481 1.00 0.00 C ATOM 1014 C ALA B 66 -0.045 -13.476 -16.198 1.00 0.00 C ATOM 1015 O ALA B 66 -0.343 -13.754 -15.038 1.00 0.00 O ATOM 1016 CB ALA B 66 0.696 -11.052 -16.188 1.00 0.00 C ATOM 0 H ALA B 66 1.307 -11.751 -18.422 1.00 0.00 H new ATOM 0 HA ALA B 66 1.915 -12.792 -15.819 1.00 0.00 H new ATOM 0 HB1 ALA B 66 0.358 -10.971 -15.155 1.00 0.00 H new ATOM 0 HB2 ALA B 66 1.553 -10.396 -16.341 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -0.111 -10.757 -16.858 1.00 0.00 H new ATOM 1022 N ARG B 67 -0.688 -14.003 -17.244 1.00 0.00 N ATOM 1023 CA ARG B 67 -1.694 -15.051 -17.117 1.00 0.00 C ATOM 1024 C ARG B 67 -1.136 -16.442 -17.416 1.00 0.00 C ATOM 1025 O ARG B 67 -1.907 -17.400 -17.467 1.00 0.00 O ATOM 1026 CB ARG B 67 -2.885 -14.746 -18.025 1.00 0.00 C ATOM 1027 CG ARG B 67 -3.838 -13.739 -17.372 1.00 0.00 C ATOM 1028 CD ARG B 67 -3.375 -12.286 -17.476 1.00 0.00 C ATOM 1029 NE ARG B 67 -4.263 -11.397 -16.720 1.00 0.00 N ATOM 1030 CZ ARG B 67 -5.451 -10.963 -17.158 1.00 0.00 C ATOM 1031 NH1 ARG B 67 -5.908 -11.326 -18.354 1.00 0.00 N ATOM 1032 NH2 ARG B 67 -6.187 -10.159 -16.395 1.00 0.00 N ATOM 0 H ARG B 67 -0.521 -13.710 -18.207 1.00 0.00 H new ATOM 0 HA ARG B 67 -2.021 -15.061 -16.077 1.00 0.00 H new ATOM 0 HB2 ARG B 67 -2.528 -14.349 -18.976 1.00 0.00 H new ATOM 0 HB3 ARG B 67 -3.422 -15.668 -18.246 1.00 0.00 H new ATOM 0 HG2 ARG B 67 -4.820 -13.831 -17.836 1.00 0.00 H new ATOM 0 HG3 ARG B 67 -3.957 -13.997 -16.320 1.00 0.00 H new ATOM 0 HD2 ARG B 67 -2.357 -12.197 -17.097 1.00 0.00 H new ATOM 0 HD3 ARG B 67 -3.354 -11.981 -18.522 1.00 0.00 H new ATOM 0 HE ARG B 67 -3.954 -11.089 -15.798 1.00 0.00 H new ATOM 0 HH11 ARG B 67 -5.351 -11.941 -18.947 1.00 0.00 H new ATOM 0 HH12 ARG B 67 -6.815 -10.989 -18.677 1.00 0.00 H new ATOM 0 HH21 ARG B 67 -5.846 -9.874 -15.477 1.00 0.00 H new ATOM 0 HH22 ARG B 67 -7.092 -9.828 -16.728 1.00 0.00 H new ATOM 1046 N ASP B 68 0.178 -16.585 -17.615 1.00 0.00 N ATOM 1047 CA ASP B 68 0.756 -17.850 -18.016 1.00 0.00 C ATOM 1048 C ASP B 68 1.875 -18.216 -17.067 1.00 0.00 C ATOM 1049 O ASP B 68 1.889 -19.289 -16.473 1.00 0.00 O ATOM 1050 CB ASP B 68 1.367 -17.634 -19.395 1.00 0.00 C ATOM 1051 CG ASP B 68 0.498 -18.194 -20.517 1.00 0.00 C ATOM 1052 OD1 ASP B 68 -0.694 -17.820 -20.580 1.00 0.00 O ATOM 1053 OD2 ASP B 68 1.033 -19.002 -21.310 1.00 0.00 O ATOM 0 H ASP B 68 0.855 -15.831 -17.502 1.00 0.00 H new ATOM 0 HA ASP B 68 0.002 -18.637 -18.016 1.00 0.00 H new ATOM 0 HB2 ASP B 68 1.520 -16.567 -19.557 1.00 0.00 H new ATOM 0 HB3 ASP B 68 2.349 -18.106 -19.431 1.00 0.00 H new ATOM 1058 N MET B 69 2.813 -17.284 -16.948 1.00 0.00 N ATOM 1059 CA MET B 69 4.018 -17.412 -16.163 1.00 0.00 C ATOM 1060 C MET B 69 3.754 -17.209 -14.677 1.00 0.00 C ATOM 1061 O MET B 69 4.620 -17.505 -13.854 1.00 0.00 O ATOM 1062 CB MET B 69 4.966 -16.350 -16.702 1.00 0.00 C ATOM 1063 CG MET B 69 5.923 -16.908 -17.748 1.00 0.00 C ATOM 1064 SD MET B 69 6.928 -18.321 -17.228 1.00 0.00 S ATOM 1065 CE MET B 69 7.689 -17.552 -15.785 1.00 0.00 C ATOM 0 H MET B 69 2.744 -16.382 -17.420 1.00 0.00 H new ATOM 0 HA MET B 69 4.438 -18.414 -16.248 1.00 0.00 H new ATOM 0 HB2 MET B 69 4.387 -15.537 -17.140 1.00 0.00 H new ATOM 0 HB3 MET B 69 5.539 -15.925 -15.878 1.00 0.00 H new ATOM 0 HG2 MET B 69 5.343 -17.202 -18.623 1.00 0.00 H new ATOM 0 HG3 MET B 69 6.592 -16.108 -18.064 1.00 0.00 H new ATOM 0 HE1 MET B 69 8.722 -17.888 -15.696 1.00 0.00 H new ATOM 0 HE2 MET B 69 7.668 -16.468 -15.897 1.00 0.00 H new ATOM 0 HE3 MET B 69 7.137 -17.835 -14.889 1.00 0.00 H new ATOM 1075 N ASN B 70 2.570 -16.709 -14.316 1.00 0.00 N ATOM 1076 CA ASN B 70 2.229 -16.501 -12.921 1.00 0.00 C ATOM 1077 C ASN B 70 1.973 -17.853 -12.258 1.00 0.00 C ATOM 1078 O ASN B 70 1.214 -18.670 -12.775 1.00 0.00 O ATOM 1079 CB ASN B 70 1.008 -15.575 -12.841 1.00 0.00 C ATOM 1080 CG ASN B 70 0.636 -15.223 -11.410 1.00 0.00 C ATOM 1081 OD1 ASN B 70 1.440 -15.372 -10.494 1.00 0.00 O ATOM 1082 ND2 ASN B 70 -0.589 -14.751 -11.208 1.00 0.00 N ATOM 0 H ASN B 70 1.838 -16.443 -14.974 1.00 0.00 H new ATOM 0 HA ASN B 70 3.049 -16.022 -12.386 1.00 0.00 H new ATOM 0 HB2 ASN B 70 1.214 -14.659 -13.395 1.00 0.00 H new ATOM 0 HB3 ASN B 70 0.159 -16.057 -13.326 1.00 0.00 H new ATOM 0 HD21 ASN B 70 -0.889 -14.498 -10.267 1.00 0.00 H new ATOM 0 HD22 ASN B 70 -1.229 -14.641 -11.994 1.00 0.00 H new ATOM 1089 N GLY B 71 2.610 -18.084 -11.107 1.00 0.00 N ATOM 1090 CA GLY B 71 2.450 -19.310 -10.338 1.00 0.00 C ATOM 1091 C GLY B 71 3.370 -20.429 -10.829 1.00 0.00 C ATOM 1092 O GLY B 71 3.484 -21.460 -10.165 1.00 0.00 O ATOM 0 H GLY B 71 3.255 -17.417 -10.684 1.00 0.00 H new ATOM 0 HA2 GLY B 71 2.658 -19.107 -9.287 1.00 0.00 H new ATOM 0 HA3 GLY B 71 1.414 -19.642 -10.399 1.00 0.00 H new ATOM 1096 N LYS B 72 4.026 -20.239 -11.980 1.00 0.00 N ATOM 1097 CA LYS B 72 4.995 -21.163 -12.524 1.00 0.00 C ATOM 1098 C LYS B 72 6.348 -20.915 -11.882 1.00 0.00 C ATOM 1099 O LYS B 72 6.431 -20.312 -10.817 1.00 0.00 O ATOM 1100 CB LYS B 72 5.078 -20.930 -14.023 1.00 0.00 C ATOM 1101 CG LYS B 72 3.708 -20.915 -14.703 1.00 0.00 C ATOM 1102 CD LYS B 72 2.943 -22.208 -14.436 1.00 0.00 C ATOM 1103 CE LYS B 72 1.644 -22.198 -15.238 1.00 0.00 C ATOM 1104 NZ LYS B 72 0.706 -21.169 -14.748 1.00 0.00 N ATOM 0 H LYS B 72 3.885 -19.414 -12.564 1.00 0.00 H new ATOM 0 HA LYS B 72 4.698 -22.192 -12.322 1.00 0.00 H new ATOM 0 HB2 LYS B 72 5.581 -19.981 -14.210 1.00 0.00 H new ATOM 0 HB3 LYS B 72 5.692 -21.710 -14.473 1.00 0.00 H new ATOM 0 HG2 LYS B 72 3.129 -20.066 -14.340 1.00 0.00 H new ATOM 0 HG3 LYS B 72 3.834 -20.780 -15.777 1.00 0.00 H new ATOM 0 HD2 LYS B 72 3.551 -23.068 -14.716 1.00 0.00 H new ATOM 0 HD3 LYS B 72 2.727 -22.303 -13.372 1.00 0.00 H new ATOM 0 HE2 LYS B 72 1.867 -22.016 -16.289 1.00 0.00 H new ATOM 0 HE3 LYS B 72 1.172 -23.179 -15.178 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 -0.271 -21.467 -14.945 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 0.830 -21.046 -13.723 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 0.897 -20.268 -15.230 1.00 0.00 H new ATOM 1118 N SER B 73 7.402 -21.383 -12.543 1.00 0.00 N ATOM 1119 CA SER B 73 8.762 -21.317 -12.041 1.00 0.00 C ATOM 1120 C SER B 73 9.703 -20.807 -13.110 1.00 0.00 C ATOM 1121 O SER B 73 9.450 -20.977 -14.302 1.00 0.00 O ATOM 1122 CB SER B 73 9.127 -22.718 -11.584 1.00 0.00 C ATOM 1123 OG SER B 73 10.410 -22.746 -10.997 1.00 0.00 O ATOM 0 H SER B 73 7.329 -21.826 -13.459 1.00 0.00 H new ATOM 0 HA SER B 73 8.845 -20.618 -11.209 1.00 0.00 H new ATOM 0 HB2 SER B 73 8.388 -23.073 -10.866 1.00 0.00 H new ATOM 0 HB3 SER B 73 9.098 -23.400 -12.434 1.00 0.00 H new ATOM 0 HG SER B 73 10.619 -23.660 -10.710 1.00 0.00 H new ATOM 1129 N LEU B 74 10.794 -20.177 -12.672 1.00 0.00 N ATOM 1130 CA LEU B 74 11.705 -19.550 -13.623 1.00 0.00 C ATOM 1131 C LEU B 74 12.857 -20.476 -13.962 1.00 0.00 C ATOM 1132 O LEU B 74 13.029 -20.890 -15.107 1.00 0.00 O ATOM 1133 CB LEU B 74 12.219 -18.217 -13.065 1.00 0.00 C ATOM 1134 CG LEU B 74 12.626 -17.215 -14.153 1.00 0.00 C ATOM 1135 CD1 LEU B 74 13.740 -17.710 -15.071 1.00 0.00 C ATOM 1136 CD2 LEU B 74 11.400 -16.868 -14.991 1.00 0.00 C ATOM 0 H LEU B 74 11.062 -20.089 -11.692 1.00 0.00 H new ATOM 0 HA LEU B 74 11.158 -19.351 -14.545 1.00 0.00 H new ATOM 0 HB2 LEU B 74 11.444 -17.770 -12.442 1.00 0.00 H new ATOM 0 HB3 LEU B 74 13.076 -18.409 -12.420 1.00 0.00 H new ATOM 0 HG LEU B 74 13.022 -16.340 -13.637 1.00 0.00 H new ATOM 0 HD11 LEU B 74 13.969 -16.944 -15.812 1.00 0.00 H new ATOM 0 HD12 LEU B 74 14.631 -17.921 -14.480 1.00 0.00 H new ATOM 0 HD13 LEU B 74 13.417 -18.619 -15.578 1.00 0.00 H new ATOM 0 HD21 LEU B 74 11.680 -16.156 -15.767 1.00 0.00 H new ATOM 0 HD22 LEU B 74 11.007 -17.774 -15.454 1.00 0.00 H new ATOM 0 HD23 LEU B 74 10.636 -16.426 -14.352 1.00 0.00 H new ATOM 1148 N ASP B 75 13.644 -20.794 -12.939 1.00 0.00 N ATOM 1149 CA ASP B 75 14.841 -21.598 -13.082 1.00 0.00 C ATOM 1150 C ASP B 75 14.842 -22.718 -12.062 1.00 0.00 C ATOM 1151 O ASP B 75 15.779 -23.514 -11.993 1.00 0.00 O ATOM 1152 CB ASP B 75 16.042 -20.684 -12.888 1.00 0.00 C ATOM 1153 CG ASP B 75 17.322 -21.284 -13.470 1.00 0.00 C ATOM 1154 OD1 ASP B 75 17.352 -21.474 -14.706 1.00 0.00 O ATOM 1155 OD2 ASP B 75 18.257 -21.547 -12.682 1.00 0.00 O ATOM 0 H ASP B 75 13.462 -20.495 -11.981 1.00 0.00 H new ATOM 0 HA ASP B 75 14.881 -22.055 -14.071 1.00 0.00 H new ATOM 0 HB2 ASP B 75 15.845 -19.722 -13.362 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.183 -20.493 -11.824 1.00 0.00 H new ATOM 1160 N GLY B 76 13.777 -22.770 -11.265 1.00 0.00 N ATOM 1161 CA GLY B 76 13.661 -23.777 -10.233 1.00 0.00 C ATOM 1162 C GLY B 76 12.815 -23.293 -9.062 1.00 0.00 C ATOM 1163 O GLY B 76 12.400 -24.095 -8.226 1.00 0.00 O ATOM 0 H GLY B 76 12.989 -22.125 -11.320 1.00 0.00 H new ATOM 0 HA2 GLY B 76 13.217 -24.679 -10.654 1.00 0.00 H new ATOM 0 HA3 GLY B 76 14.655 -24.048 -9.876 1.00 0.00 H new ATOM 1167 N LYS B 77 12.563 -21.980 -9.007 1.00 0.00 N ATOM 1168 CA LYS B 77 11.792 -21.365 -7.944 1.00 0.00 C ATOM 1169 C LYS B 77 10.515 -20.785 -8.519 1.00 0.00 C ATOM 1170 O LYS B 77 10.540 -20.125 -9.556 1.00 0.00 O ATOM 1171 CB LYS B 77 12.627 -20.287 -7.248 1.00 0.00 C ATOM 1172 CG LYS B 77 13.968 -20.833 -6.753 1.00 0.00 C ATOM 1173 CD LYS B 77 13.808 -22.009 -5.785 1.00 0.00 C ATOM 1174 CE LYS B 77 15.132 -22.751 -5.622 1.00 0.00 C ATOM 1175 NZ LYS B 77 16.155 -21.905 -4.971 1.00 0.00 N ATOM 0 H LYS B 77 12.895 -21.318 -9.708 1.00 0.00 H new ATOM 0 HA LYS B 77 11.526 -22.115 -7.199 1.00 0.00 H new ATOM 0 HB2 LYS B 77 12.804 -19.463 -7.939 1.00 0.00 H new ATOM 0 HB3 LYS B 77 12.067 -19.882 -6.405 1.00 0.00 H new ATOM 0 HG2 LYS B 77 14.564 -21.151 -7.609 1.00 0.00 H new ATOM 0 HG3 LYS B 77 14.521 -20.034 -6.259 1.00 0.00 H new ATOM 0 HD2 LYS B 77 13.466 -21.646 -4.816 1.00 0.00 H new ATOM 0 HD3 LYS B 77 13.045 -22.692 -6.157 1.00 0.00 H new ATOM 0 HE2 LYS B 77 14.974 -23.652 -5.029 1.00 0.00 H new ATOM 0 HE3 LYS B 77 15.493 -23.071 -6.599 1.00 0.00 H new ATOM 0 HZ1 LYS B 77 17.013 -22.467 -4.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 77 16.385 -21.101 -5.589 1.00 0.00 H new ATOM 0 HZ3 LYS B 77 15.787 -21.551 -4.065 1.00 0.00 H new ATOM 1189 N ALA B 78 9.400 -21.039 -7.837 1.00 0.00 N ATOM 1190 CA ALA B 78 8.104 -20.615 -8.322 1.00 0.00 C ATOM 1191 C ALA B 78 7.898 -19.124 -8.083 1.00 0.00 C ATOM 1192 O ALA B 78 8.202 -18.610 -7.007 1.00 0.00 O ATOM 1193 CB ALA B 78 7.012 -21.462 -7.679 1.00 0.00 C ATOM 0 H ALA B 78 9.376 -21.537 -6.947 1.00 0.00 H new ATOM 0 HA ALA B 78 8.052 -20.768 -9.400 1.00 0.00 H new ATOM 0 HB1 ALA B 78 6.038 -21.140 -8.047 1.00 0.00 H new ATOM 0 HB2 ALA B 78 7.167 -22.510 -7.934 1.00 0.00 H new ATOM 0 HB3 ALA B 78 7.049 -21.342 -6.596 1.00 0.00 H new ATOM 1199 N ILE B 79 7.378 -18.433 -9.097 1.00 0.00 N ATOM 1200 CA ILE B 79 7.249 -16.986 -9.082 1.00 0.00 C ATOM 1201 C ILE B 79 5.806 -16.500 -9.080 1.00 0.00 C ATOM 1202 O ILE B 79 4.861 -17.279 -9.201 1.00 0.00 O ATOM 1203 CB ILE B 79 7.977 -16.387 -10.292 1.00 0.00 C ATOM 1204 CG1 ILE B 79 7.226 -16.705 -11.592 1.00 0.00 C ATOM 1205 CG2 ILE B 79 9.411 -16.903 -10.366 1.00 0.00 C ATOM 1206 CD1 ILE B 79 7.839 -15.955 -12.767 1.00 0.00 C ATOM 0 H ILE B 79 7.034 -18.868 -9.953 1.00 0.00 H new ATOM 0 HA ILE B 79 7.699 -16.651 -8.148 1.00 0.00 H new ATOM 0 HB ILE B 79 8.005 -15.304 -10.168 1.00 0.00 H new ATOM 0 HG12 ILE B 79 7.258 -17.778 -11.783 1.00 0.00 H new ATOM 0 HG13 ILE B 79 6.176 -16.431 -11.487 1.00 0.00 H new ATOM 0 HG21 ILE B 79 9.911 -16.467 -11.231 1.00 0.00 H new ATOM 0 HG22 ILE B 79 9.946 -16.623 -9.458 1.00 0.00 H new ATOM 0 HG23 ILE B 79 9.403 -17.989 -10.462 1.00 0.00 H new ATOM 0 HD11 ILE B 79 7.291 -16.195 -13.678 1.00 0.00 H new ATOM 0 HD12 ILE B 79 7.784 -14.882 -12.583 1.00 0.00 H new ATOM 0 HD13 ILE B 79 8.882 -16.250 -12.883 1.00 0.00 H new ATOM 1218 N LYS B 80 5.674 -15.181 -8.946 1.00 0.00 N ATOM 1219 CA LYS B 80 4.442 -14.435 -9.116 1.00 0.00 C ATOM 1220 C LYS B 80 4.643 -13.477 -10.278 1.00 0.00 C ATOM 1221 O LYS B 80 5.730 -12.921 -10.420 1.00 0.00 O ATOM 1222 CB LYS B 80 4.139 -13.639 -7.846 1.00 0.00 C ATOM 1223 CG LYS B 80 2.731 -13.041 -7.919 1.00 0.00 C ATOM 1224 CD LYS B 80 2.509 -12.046 -6.783 1.00 0.00 C ATOM 1225 CE LYS B 80 1.066 -11.549 -6.804 1.00 0.00 C ATOM 1226 NZ LYS B 80 0.813 -10.609 -5.694 1.00 0.00 N ATOM 0 H LYS B 80 6.463 -14.582 -8.705 1.00 0.00 H new ATOM 0 HA LYS B 80 3.610 -15.111 -9.310 1.00 0.00 H new ATOM 0 HB2 LYS B 80 4.222 -14.287 -6.974 1.00 0.00 H new ATOM 0 HB3 LYS B 80 4.874 -12.843 -7.723 1.00 0.00 H new ATOM 0 HG2 LYS B 80 2.591 -12.543 -8.878 1.00 0.00 H new ATOM 0 HG3 LYS B 80 1.989 -13.837 -7.862 1.00 0.00 H new ATOM 0 HD2 LYS B 80 2.726 -12.519 -5.825 1.00 0.00 H new ATOM 0 HD3 LYS B 80 3.194 -11.205 -6.885 1.00 0.00 H new ATOM 0 HE2 LYS B 80 0.861 -11.058 -7.755 1.00 0.00 H new ATOM 0 HE3 LYS B 80 0.385 -12.397 -6.730 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -0.175 -10.286 -5.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 0.987 -11.088 -4.787 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 1.448 -9.790 -5.781 1.00 0.00 H new ATOM 1240 N VAL B 81 3.613 -13.281 -11.102 1.00 0.00 N ATOM 1241 CA VAL B 81 3.673 -12.312 -12.187 1.00 0.00 C ATOM 1242 C VAL B 81 2.398 -11.483 -12.173 1.00 0.00 C ATOM 1243 O VAL B 81 1.296 -12.025 -12.203 1.00 0.00 O ATOM 1244 CB VAL B 81 3.894 -13.002 -13.535 1.00 0.00 C ATOM 1245 CG1 VAL B 81 4.039 -11.954 -14.637 1.00 0.00 C ATOM 1246 CG2 VAL B 81 5.168 -13.844 -13.503 1.00 0.00 C ATOM 0 H VAL B 81 2.728 -13.783 -11.035 1.00 0.00 H new ATOM 0 HA VAL B 81 4.526 -11.649 -12.040 1.00 0.00 H new ATOM 0 HB VAL B 81 3.035 -13.643 -13.733 1.00 0.00 H new ATOM 0 HG11 VAL B 81 4.196 -12.452 -15.594 1.00 0.00 H new ATOM 0 HG12 VAL B 81 3.133 -11.350 -14.686 1.00 0.00 H new ATOM 0 HG13 VAL B 81 4.892 -11.311 -14.418 1.00 0.00 H new ATOM 0 HG21 VAL B 81 5.309 -14.327 -14.470 1.00 0.00 H new ATOM 0 HG22 VAL B 81 6.023 -13.202 -13.290 1.00 0.00 H new ATOM 0 HG23 VAL B 81 5.082 -14.604 -12.727 1.00 0.00 H new ATOM 1256 N GLU B 82 2.561 -10.159 -12.127 1.00 0.00 N ATOM 1257 CA GLU B 82 1.442 -9.230 -12.020 1.00 0.00 C ATOM 1258 C GLU B 82 1.897 -7.855 -12.502 1.00 0.00 C ATOM 1259 O GLU B 82 3.097 -7.630 -12.621 1.00 0.00 O ATOM 1260 CB GLU B 82 1.015 -9.174 -10.545 1.00 0.00 C ATOM 1261 CG GLU B 82 -0.250 -8.342 -10.316 1.00 0.00 C ATOM 1262 CD GLU B 82 -1.412 -8.834 -11.176 1.00 0.00 C ATOM 1263 OE1 GLU B 82 -2.117 -9.760 -10.716 1.00 0.00 O ATOM 1264 OE2 GLU B 82 -1.584 -8.280 -12.286 1.00 0.00 O ATOM 0 H GLU B 82 3.473 -9.704 -12.163 1.00 0.00 H new ATOM 0 HA GLU B 82 0.599 -9.551 -12.631 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.846 -10.188 -10.183 1.00 0.00 H new ATOM 0 HB3 GLU B 82 1.829 -8.756 -9.953 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -0.531 -8.388 -9.264 1.00 0.00 H new ATOM 0 HG3 GLU B 82 -0.045 -7.296 -10.545 1.00 0.00 H new ATOM 1271 N GLN B 83 0.978 -6.927 -12.780 1.00 0.00 N ATOM 1272 CA GLN B 83 1.375 -5.566 -13.091 1.00 0.00 C ATOM 1273 C GLN B 83 2.065 -4.996 -11.852 1.00 0.00 C ATOM 1274 O GLN B 83 1.591 -5.175 -10.730 1.00 0.00 O ATOM 1275 CB GLN B 83 0.139 -4.757 -13.501 1.00 0.00 C ATOM 1276 CG GLN B 83 0.321 -3.241 -13.393 1.00 0.00 C ATOM 1277 CD GLN B 83 1.345 -2.643 -14.349 1.00 0.00 C ATOM 1278 OE1 GLN B 83 1.373 -2.960 -15.535 1.00 0.00 O ATOM 1279 NE2 GLN B 83 2.190 -1.764 -13.816 1.00 0.00 N ATOM 0 H GLN B 83 -0.028 -7.096 -12.794 1.00 0.00 H new ATOM 0 HA GLN B 83 2.070 -5.525 -13.929 1.00 0.00 H new ATOM 0 HB2 GLN B 83 -0.122 -5.009 -14.529 1.00 0.00 H new ATOM 0 HB3 GLN B 83 -0.702 -5.057 -12.876 1.00 0.00 H new ATOM 0 HG2 GLN B 83 -0.642 -2.762 -13.570 1.00 0.00 H new ATOM 0 HG3 GLN B 83 0.615 -2.998 -12.372 1.00 0.00 H new ATOM 0 HE21 GLN B 83 2.127 -1.533 -12.825 1.00 0.00 H new ATOM 0 HE22 GLN B 83 2.900 -1.321 -14.399 1.00 0.00 H new ATOM 1288 N ALA B 84 3.192 -4.312 -12.057 1.00 0.00 N ATOM 1289 CA ALA B 84 4.023 -3.836 -10.965 1.00 0.00 C ATOM 1290 C ALA B 84 3.449 -2.591 -10.302 1.00 0.00 C ATOM 1291 O ALA B 84 2.644 -1.869 -10.892 1.00 0.00 O ATOM 1292 CB ALA B 84 5.429 -3.555 -11.492 1.00 0.00 C ATOM 0 H ALA B 84 3.548 -4.076 -12.983 1.00 0.00 H new ATOM 0 HA ALA B 84 4.056 -4.613 -10.202 1.00 0.00 H new ATOM 0 HB1 ALA B 84 6.058 -3.197 -10.677 1.00 0.00 H new ATOM 0 HB2 ALA B 84 5.853 -4.471 -11.903 1.00 0.00 H new ATOM 0 HB3 ALA B 84 5.380 -2.796 -12.273 1.00 0.00 H new ATOM 1298 N THR B 85 3.879 -2.347 -9.061 1.00 0.00 N ATOM 1299 CA THR B 85 3.546 -1.131 -8.339 1.00 0.00 C ATOM 1300 C THR B 85 4.816 -0.356 -8.037 1.00 0.00 C ATOM 1301 O THR B 85 5.920 -0.892 -8.129 1.00 0.00 O ATOM 1302 CB THR B 85 2.801 -1.424 -7.036 1.00 0.00 C ATOM 1303 OG1 THR B 85 3.595 -2.216 -6.177 1.00 0.00 O ATOM 1304 CG2 THR B 85 1.483 -2.149 -7.298 1.00 0.00 C ATOM 0 H THR B 85 4.468 -2.992 -8.534 1.00 0.00 H new ATOM 0 HA THR B 85 2.885 -0.539 -8.972 1.00 0.00 H new ATOM 0 HB THR B 85 2.590 -0.465 -6.564 1.00 0.00 H new ATOM 0 HG1 THR B 85 3.935 -2.993 -6.669 1.00 0.00 H new ATOM 0 HG21 THR B 85 0.979 -2.342 -6.351 1.00 0.00 H new ATOM 0 HG22 THR B 85 0.846 -1.529 -7.928 1.00 0.00 H new ATOM 0 HG23 THR B 85 1.682 -3.095 -7.802 1.00 0.00 H new ATOM 1312 N LYS B 86 4.651 0.917 -7.677 1.00 0.00 N ATOM 1313 CA LYS B 86 5.763 1.797 -7.373 1.00 0.00 C ATOM 1314 C LYS B 86 6.536 1.293 -6.150 1.00 0.00 C ATOM 1315 O LYS B 86 5.949 0.660 -5.272 1.00 0.00 O ATOM 1316 CB LYS B 86 5.217 3.202 -7.146 1.00 0.00 C ATOM 1317 CG LYS B 86 4.703 3.746 -8.479 1.00 0.00 C ATOM 1318 CD LYS B 86 4.154 5.164 -8.332 1.00 0.00 C ATOM 1319 CE LYS B 86 3.578 5.584 -9.686 1.00 0.00 C ATOM 1320 NZ LYS B 86 2.941 6.913 -9.618 1.00 0.00 N ATOM 0 H LYS B 86 3.737 1.361 -7.590 1.00 0.00 H new ATOM 0 HA LYS B 86 6.465 1.813 -8.207 1.00 0.00 H new ATOM 0 HB2 LYS B 86 4.413 3.181 -6.410 1.00 0.00 H new ATOM 0 HB3 LYS B 86 5.997 3.851 -6.748 1.00 0.00 H new ATOM 0 HG2 LYS B 86 5.511 3.742 -9.210 1.00 0.00 H new ATOM 0 HG3 LYS B 86 3.922 3.090 -8.863 1.00 0.00 H new ATOM 0 HD2 LYS B 86 3.383 5.198 -7.562 1.00 0.00 H new ATOM 0 HD3 LYS B 86 4.943 5.849 -8.023 1.00 0.00 H new ATOM 0 HE2 LYS B 86 4.373 5.599 -10.431 1.00 0.00 H new ATOM 0 HE3 LYS B 86 2.847 4.846 -10.015 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 2.837 7.298 -10.579 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 2.003 6.826 -9.177 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 3.533 7.553 -9.051 1.00 0.00 H new ATOM 1334 N PRO B 87 7.846 1.569 -6.088 1.00 0.00 N ATOM 1335 CA PRO B 87 8.707 1.134 -5.003 1.00 0.00 C ATOM 1336 C PRO B 87 8.324 1.849 -3.708 1.00 0.00 C ATOM 1337 O PRO B 87 7.670 2.892 -3.730 1.00 0.00 O ATOM 1338 CB PRO B 87 10.128 1.475 -5.452 1.00 0.00 C ATOM 1339 CG PRO B 87 9.922 2.666 -6.385 1.00 0.00 C ATOM 1340 CD PRO B 87 8.595 2.335 -7.066 1.00 0.00 C ATOM 0 HA PRO B 87 8.615 0.068 -4.795 1.00 0.00 H new ATOM 0 HB2 PRO B 87 10.767 1.731 -4.607 1.00 0.00 H new ATOM 0 HB3 PRO B 87 10.600 0.638 -5.966 1.00 0.00 H new ATOM 0 HG2 PRO B 87 9.872 3.606 -5.836 1.00 0.00 H new ATOM 0 HG3 PRO B 87 10.734 2.761 -7.106 1.00 0.00 H new ATOM 0 HD2 PRO B 87 8.061 3.242 -7.349 1.00 0.00 H new ATOM 0 HD3 PRO B 87 8.753 1.761 -7.979 1.00 0.00 H new ATOM 1348 N SER B 88 8.734 1.287 -2.571 1.00 0.00 N ATOM 1349 CA SER B 88 8.336 1.766 -1.255 1.00 0.00 C ATOM 1350 C SER B 88 9.112 3.009 -0.824 1.00 0.00 C ATOM 1351 O SER B 88 8.762 3.628 0.182 1.00 0.00 O ATOM 1352 CB SER B 88 8.511 0.637 -0.241 1.00 0.00 C ATOM 1353 OG SER B 88 9.888 0.399 -0.018 1.00 0.00 O ATOM 0 H SER B 88 9.357 0.480 -2.541 1.00 0.00 H new ATOM 0 HA SER B 88 7.288 2.063 -1.304 1.00 0.00 H new ATOM 0 HB2 SER B 88 8.022 0.900 0.697 1.00 0.00 H new ATOM 0 HB3 SER B 88 8.031 -0.270 -0.607 1.00 0.00 H new ATOM 0 HG SER B 88 9.993 -0.325 0.634 1.00 0.00 H new ATOM 1359 N PHE B 89 10.158 3.378 -1.568 1.00 0.00 N ATOM 1360 CA PHE B 89 10.925 4.585 -1.295 1.00 0.00 C ATOM 1361 C PHE B 89 10.480 5.731 -2.198 1.00 0.00 C ATOM 1362 O PHE B 89 11.218 6.696 -2.393 1.00 0.00 O ATOM 1363 CB PHE B 89 12.425 4.324 -1.364 1.00 0.00 C ATOM 1364 CG PHE B 89 12.952 3.828 -2.690 1.00 0.00 C ATOM 1365 CD1 PHE B 89 12.892 2.462 -3.005 1.00 0.00 C ATOM 1366 CD2 PHE B 89 13.529 4.729 -3.599 1.00 0.00 C ATOM 1367 CE1 PHE B 89 13.431 1.998 -4.211 1.00 0.00 C ATOM 1368 CE2 PHE B 89 14.069 4.261 -4.808 1.00 0.00 C ATOM 1369 CZ PHE B 89 14.023 2.895 -5.110 1.00 0.00 C ATOM 0 H PHE B 89 10.492 2.847 -2.372 1.00 0.00 H new ATOM 0 HA PHE B 89 10.719 4.894 -0.270 1.00 0.00 H new ATOM 0 HB2 PHE B 89 12.946 5.247 -1.111 1.00 0.00 H new ATOM 0 HB3 PHE B 89 12.682 3.593 -0.597 1.00 0.00 H new ATOM 0 HD1 PHE B 89 12.430 1.769 -2.317 1.00 0.00 H new ATOM 0 HD2 PHE B 89 13.558 5.784 -3.368 1.00 0.00 H new ATOM 0 HE1 PHE B 89 13.390 0.945 -4.449 1.00 0.00 H new ATOM 0 HE2 PHE B 89 14.519 4.954 -5.504 1.00 0.00 H new ATOM 0 HZ PHE B 89 14.444 2.532 -6.036 1.00 0.00 H new ATOM 1379 N GLU B 90 9.272 5.624 -2.754 1.00 0.00 N ATOM 1380 CA GLU B 90 8.760 6.605 -3.692 1.00 0.00 C ATOM 1381 C GLU B 90 7.256 6.801 -3.521 1.00 0.00 C ATOM 1382 O GLU B 90 6.568 5.940 -2.975 1.00 0.00 O ATOM 1383 CB GLU B 90 9.105 6.119 -5.100 1.00 0.00 C ATOM 1384 CG GLU B 90 9.098 7.278 -6.090 1.00 0.00 C ATOM 1385 CD GLU B 90 9.460 6.803 -7.494 1.00 0.00 C ATOM 1386 OE1 GLU B 90 8.558 6.254 -8.168 1.00 0.00 O ATOM 1387 OE2 GLU B 90 10.632 6.990 -7.886 1.00 0.00 O ATOM 0 H GLU B 90 8.629 4.856 -2.563 1.00 0.00 H new ATOM 0 HA GLU B 90 9.217 7.578 -3.510 1.00 0.00 H new ATOM 0 HB2 GLU B 90 10.086 5.645 -5.095 1.00 0.00 H new ATOM 0 HB3 GLU B 90 8.387 5.362 -5.414 1.00 0.00 H new ATOM 0 HG2 GLU B 90 8.112 7.743 -6.103 1.00 0.00 H new ATOM 0 HG3 GLU B 90 9.806 8.041 -5.767 1.00 0.00 H new ATOM 1394 N SER B 91 6.747 7.944 -3.988 1.00 0.00 N ATOM 1395 CA SER B 91 5.344 8.288 -3.856 1.00 0.00 C ATOM 1396 C SER B 91 4.925 9.257 -4.955 1.00 0.00 C ATOM 1397 O SER B 91 5.767 9.964 -5.511 1.00 0.00 O ATOM 1398 CB SER B 91 5.131 8.946 -2.498 1.00 0.00 C ATOM 1399 OG SER B 91 3.750 8.987 -2.197 1.00 0.00 O ATOM 0 H SER B 91 7.303 8.652 -4.467 1.00 0.00 H new ATOM 0 HA SER B 91 4.742 7.383 -3.942 1.00 0.00 H new ATOM 0 HB2 SER B 91 5.664 8.390 -1.727 1.00 0.00 H new ATOM 0 HB3 SER B 91 5.541 9.956 -2.505 1.00 0.00 H new ATOM 0 HG SER B 91 3.618 9.409 -1.322 1.00 0.00 H new ATOM 1405 N GLY B 92 3.627 9.295 -5.265 1.00 0.00 N ATOM 1406 CA GLY B 92 3.088 10.231 -6.238 1.00 0.00 C ATOM 1407 C GLY B 92 3.793 10.114 -7.583 1.00 0.00 C ATOM 1408 O GLY B 92 4.009 9.013 -8.096 1.00 0.00 O ATOM 0 H GLY B 92 2.929 8.679 -4.848 1.00 0.00 H new ATOM 0 HA2 GLY B 92 2.022 10.046 -6.369 1.00 0.00 H new ATOM 0 HA3 GLY B 92 3.191 11.248 -5.860 1.00 0.00 H new ATOM 1412 N ARG B 93 4.156 11.268 -8.154 1.00 0.00 N ATOM 1413 CA ARG B 93 4.829 11.356 -9.444 1.00 0.00 C ATOM 1414 C ARG B 93 5.738 12.584 -9.479 1.00 0.00 C ATOM 1415 O ARG B 93 5.601 13.478 -8.647 1.00 0.00 O ATOM 1416 CB ARG B 93 3.793 11.394 -10.573 1.00 0.00 C ATOM 1417 CG ARG B 93 2.820 12.568 -10.424 1.00 0.00 C ATOM 1418 CD ARG B 93 1.836 12.582 -11.592 1.00 0.00 C ATOM 1419 NE ARG B 93 0.892 13.700 -11.470 1.00 0.00 N ATOM 1420 CZ ARG B 93 -0.055 13.981 -12.370 1.00 0.00 C ATOM 1421 NH1 ARG B 93 -0.194 13.240 -13.468 1.00 0.00 N ATOM 1422 NH2 ARG B 93 -0.871 15.011 -12.170 1.00 0.00 N ATOM 0 H ARG B 93 3.986 12.177 -7.723 1.00 0.00 H new ATOM 0 HA ARG B 93 5.453 10.474 -9.588 1.00 0.00 H new ATOM 0 HB2 ARG B 93 4.305 11.468 -11.532 1.00 0.00 H new ATOM 0 HB3 ARG B 93 3.233 10.459 -10.582 1.00 0.00 H new ATOM 0 HG2 ARG B 93 2.278 12.485 -9.482 1.00 0.00 H new ATOM 0 HG3 ARG B 93 3.372 13.507 -10.392 1.00 0.00 H new ATOM 0 HD2 ARG B 93 2.382 12.663 -12.532 1.00 0.00 H new ATOM 0 HD3 ARG B 93 1.288 11.640 -11.622 1.00 0.00 H new ATOM 0 HE ARG B 93 0.963 14.299 -10.648 1.00 0.00 H new ATOM 0 HH11 ARG B 93 0.427 12.447 -13.630 1.00 0.00 H new ATOM 0 HH12 ARG B 93 -0.921 13.466 -14.147 1.00 0.00 H new ATOM 0 HH21 ARG B 93 -0.773 15.584 -11.332 1.00 0.00 H new ATOM 0 HH22 ARG B 93 -1.595 15.229 -12.855 1.00 0.00 H new ATOM 1436 N ARG B 94 6.659 12.607 -10.451 1.00 0.00 N ATOM 1437 CA ARG B 94 7.646 13.664 -10.685 1.00 0.00 C ATOM 1438 C ARG B 94 8.427 14.097 -9.440 1.00 0.00 C ATOM 1439 O ARG B 94 9.051 15.159 -9.449 1.00 0.00 O ATOM 1440 CB ARG B 94 7.038 14.824 -11.492 1.00 0.00 C ATOM 1441 CG ARG B 94 5.869 15.576 -10.841 1.00 0.00 C ATOM 1442 CD ARG B 94 6.278 16.439 -9.645 1.00 0.00 C ATOM 1443 NE ARG B 94 7.136 17.555 -10.063 1.00 0.00 N ATOM 1444 CZ ARG B 94 8.024 18.172 -9.279 1.00 0.00 C ATOM 1445 NH1 ARG B 94 8.232 17.779 -8.025 1.00 0.00 N ATOM 1446 NH2 ARG B 94 8.718 19.200 -9.755 1.00 0.00 N ATOM 0 H ARG B 94 6.738 11.849 -11.129 1.00 0.00 H new ATOM 0 HA ARG B 94 8.425 13.225 -11.309 1.00 0.00 H new ATOM 0 HB2 ARG B 94 7.829 15.543 -11.704 1.00 0.00 H new ATOM 0 HB3 ARG B 94 6.699 14.431 -12.450 1.00 0.00 H new ATOM 0 HG2 ARG B 94 5.396 16.211 -11.590 1.00 0.00 H new ATOM 0 HG3 ARG B 94 5.120 14.853 -10.516 1.00 0.00 H new ATOM 0 HD2 ARG B 94 5.387 16.827 -9.152 1.00 0.00 H new ATOM 0 HD3 ARG B 94 6.805 15.826 -8.914 1.00 0.00 H new ATOM 0 HE ARG B 94 7.047 17.884 -11.024 1.00 0.00 H new ATOM 0 HH11 ARG B 94 7.708 16.991 -7.644 1.00 0.00 H new ATOM 0 HH12 ARG B 94 8.915 18.265 -7.445 1.00 0.00 H new ATOM 0 HH21 ARG B 94 8.571 19.514 -10.714 1.00 0.00 H new ATOM 0 HH22 ARG B 94 9.398 19.675 -9.161 1.00 0.00 H new ATOM 1460 N GLY B 95 8.400 13.286 -8.378 1.00 0.00 N ATOM 1461 CA GLY B 95 9.058 13.592 -7.115 1.00 0.00 C ATOM 1462 C GLY B 95 8.127 14.355 -6.182 1.00 0.00 C ATOM 1463 O GLY B 95 7.763 15.498 -6.533 1.00 0.00 O ATOM 1464 OXT GLY B 95 7.786 13.785 -5.124 1.00 0.00 O ATOM 0 H GLY B 95 7.914 12.389 -8.377 1.00 0.00 H new ATOM 0 HA2 GLY B 95 9.380 12.667 -6.636 1.00 0.00 H new ATOM 0 HA3 GLY B 95 9.954 14.183 -7.302 1.00 0.00 H new TER 1468 GLY B 95 ATOM 1469 O5' A A 96 -0.782 -4.235 6.627 1.00 0.00 O ATOM 1470 C5' A A 96 0.238 -4.351 5.652 1.00 0.00 C ATOM 1471 C4' A A 96 1.511 -3.661 6.156 1.00 0.00 C ATOM 1472 O4' A A 96 2.102 -4.415 7.205 1.00 0.00 O ATOM 1473 C3' A A 96 2.569 -3.621 5.062 1.00 0.00 C ATOM 1474 O3' A A 96 3.518 -2.632 5.435 1.00 0.00 O ATOM 1475 C2' A A 96 3.075 -5.059 5.139 1.00 0.00 C ATOM 1476 O2' A A 96 4.338 -5.240 4.546 1.00 0.00 O ATOM 1477 C1' A A 96 3.054 -5.304 6.641 1.00 0.00 C ATOM 1478 N9 A A 96 2.728 -6.710 6.927 1.00 0.00 N ATOM 1479 C8 A A 96 1.526 -7.288 7.222 1.00 0.00 C ATOM 1480 N7 A A 96 1.584 -8.582 7.409 1.00 0.00 N ATOM 1481 C5 A A 96 2.938 -8.874 7.223 1.00 0.00 C ATOM 1482 C6 A A 96 3.704 -10.058 7.271 1.00 0.00 C ATOM 1483 N6 A A 96 3.195 -11.263 7.538 1.00 0.00 N ATOM 1484 N1 A A 96 5.020 -9.973 7.034 1.00 0.00 N ATOM 1485 C2 A A 96 5.548 -8.785 6.763 1.00 0.00 C ATOM 1486 N3 A A 96 4.948 -7.614 6.682 1.00 0.00 N ATOM 1487 C4 A A 96 3.632 -7.734 6.931 1.00 0.00 C ATOM 0 H5' A A 96 -0.087 -3.898 4.715 1.00 0.00 H new ATOM 0 H5'' A A 96 0.439 -5.402 5.445 1.00 0.00 H new ATOM 0 H4' A A 96 1.217 -2.662 6.479 1.00 0.00 H new ATOM 0 H3' A A 96 2.270 -3.354 4.049 1.00 0.00 H new ATOM 0 H2' A A 96 2.472 -5.772 4.577 1.00 0.00 H new ATOM 0 HO2' A A 96 4.674 -6.135 4.759 1.00 0.00 H new ATOM 0 HO5' A A 96 -1.596 -4.675 6.303 1.00 0.00 H new ATOM 0 H1' A A 96 4.033 -5.116 7.081 1.00 0.00 H new ATOM 0 H8 A A 96 0.607 -6.726 7.295 1.00 0.00 H new ATOM 0 H61 A A 96 3.804 -12.081 7.558 1.00 0.00 H new ATOM 0 H62 A A 96 2.197 -11.366 7.722 1.00 0.00 H new ATOM 0 H2 A A 96 6.613 -8.777 6.585 1.00 0.00 H new ATOM 1500 P U A 97 4.748 -2.218 4.478 1.00 0.00 P ATOM 1501 OP1 U A 97 5.056 -0.791 4.722 1.00 0.00 O ATOM 1502 OP2 U A 97 4.445 -2.670 3.099 1.00 0.00 O ATOM 1503 O5' U A 97 5.970 -3.103 5.048 1.00 0.00 O ATOM 1504 C5' U A 97 6.678 -2.704 6.200 1.00 0.00 C ATOM 1505 C4' U A 97 7.552 -3.843 6.733 1.00 0.00 C ATOM 1506 O4' U A 97 7.978 -3.590 8.064 1.00 0.00 O ATOM 1507 C3' U A 97 6.858 -5.216 6.755 1.00 0.00 C ATOM 1508 O3' U A 97 7.745 -6.236 6.316 1.00 0.00 O ATOM 1509 C2' U A 97 6.525 -5.451 8.231 1.00 0.00 C ATOM 1510 O2' U A 97 7.144 -6.628 8.721 1.00 0.00 O ATOM 1511 C1' U A 97 7.106 -4.248 8.965 1.00 0.00 C ATOM 1512 N1 U A 97 6.059 -3.333 9.486 1.00 0.00 N ATOM 1513 C2 U A 97 6.313 -2.708 10.701 1.00 0.00 C ATOM 1514 O2 U A 97 7.370 -2.858 11.314 1.00 0.00 O ATOM 1515 N3 U A 97 5.309 -1.898 11.204 1.00 0.00 N ATOM 1516 C4 U A 97 4.091 -1.646 10.596 1.00 0.00 C ATOM 1517 O4 U A 97 3.260 -0.912 11.131 1.00 0.00 O ATOM 1518 C5 U A 97 3.920 -2.313 9.327 1.00 0.00 C ATOM 1519 C6 U A 97 4.883 -3.110 8.817 1.00 0.00 C ATOM 0 H5' U A 97 5.975 -2.389 6.972 1.00 0.00 H new ATOM 0 H5'' U A 97 7.302 -1.841 5.966 1.00 0.00 H new ATOM 0 H4' U A 97 8.388 -3.877 6.034 1.00 0.00 H new ATOM 0 H3' U A 97 5.985 -5.238 6.103 1.00 0.00 H new ATOM 0 H2' U A 97 5.451 -5.567 8.373 1.00 0.00 H new ATOM 0 HO2' U A 97 7.689 -7.030 8.013 1.00 0.00 H new ATOM 0 H1' U A 97 7.648 -4.584 9.849 1.00 0.00 H new ATOM 0 H3 U A 97 5.482 -1.447 12.102 1.00 0.00 H new ATOM 0 H5 U A 97 3.003 -2.171 8.774 1.00 0.00 H new ATOM 0 H6 U A 97 4.723 -3.583 7.859 1.00 0.00 H new ATOM 1530 P C A 98 8.162 -6.425 4.767 1.00 0.00 P ATOM 1531 OP1 C A 98 9.072 -7.589 4.692 1.00 0.00 O ATOM 1532 OP2 C A 98 8.603 -5.121 4.224 1.00 0.00 O ATOM 1533 O5' C A 98 6.771 -6.826 4.061 1.00 0.00 O ATOM 1534 C5' C A 98 6.637 -6.838 2.652 1.00 0.00 C ATOM 1535 C4' C A 98 7.334 -8.056 2.041 1.00 0.00 C ATOM 1536 O4' C A 98 6.718 -9.269 2.454 1.00 0.00 O ATOM 1537 C3' C A 98 7.169 -8.014 0.522 1.00 0.00 C ATOM 1538 O3' C A 98 8.110 -8.860 -0.111 1.00 0.00 O ATOM 1539 C2' C A 98 5.760 -8.579 0.398 1.00 0.00 C ATOM 1540 O2' C A 98 5.517 -9.105 -0.892 1.00 0.00 O ATOM 1541 C1' C A 98 5.751 -9.654 1.489 1.00 0.00 C ATOM 1542 N1 C A 98 4.412 -9.777 2.106 1.00 0.00 N ATOM 1543 C2 C A 98 3.541 -10.739 1.601 1.00 0.00 C ATOM 1544 O2 C A 98 3.887 -11.487 0.685 1.00 0.00 O ATOM 1545 N3 C A 98 2.298 -10.840 2.141 1.00 0.00 N ATOM 1546 C4 C A 98 1.928 -10.037 3.140 1.00 0.00 C ATOM 1547 N4 C A 98 0.698 -10.172 3.635 1.00 0.00 N ATOM 1548 C5 C A 98 2.807 -9.050 3.683 1.00 0.00 C ATOM 1549 C6 C A 98 4.042 -8.966 3.140 1.00 0.00 C ATOM 0 H5' C A 98 7.063 -5.925 2.236 1.00 0.00 H new ATOM 0 H5'' C A 98 5.580 -6.848 2.384 1.00 0.00 H new ATOM 0 H4' C A 98 8.376 -8.025 2.359 1.00 0.00 H new ATOM 0 H3' C A 98 7.318 -7.036 0.065 1.00 0.00 H new ATOM 0 H2' C A 98 4.971 -7.837 0.523 1.00 0.00 H new ATOM 0 HO2' C A 98 6.371 -9.294 -1.334 1.00 0.00 H new ATOM 0 H1' C A 98 5.990 -10.630 1.067 1.00 0.00 H new ATOM 0 H41 C A 98 0.387 -9.572 4.399 1.00 0.00 H new ATOM 0 H42 C A 98 0.068 -10.875 3.250 1.00 0.00 H new ATOM 0 H5 C A 98 2.499 -8.401 4.490 1.00 0.00 H new ATOM 0 H6 C A 98 4.747 -8.246 3.530 1.00 0.00 H new ATOM 1561 P A A 99 9.643 -8.421 -0.321 1.00 0.00 P ATOM 1562 OP1 A A 99 10.421 -9.650 -0.604 1.00 0.00 O ATOM 1563 OP2 A A 99 10.053 -7.547 0.803 1.00 0.00 O ATOM 1564 O5' A A 99 9.623 -7.535 -1.670 1.00 0.00 O ATOM 1565 C5' A A 99 9.189 -6.193 -1.649 1.00 0.00 C ATOM 1566 C4' A A 99 9.516 -5.521 -2.983 1.00 0.00 C ATOM 1567 O4' A A 99 8.598 -5.925 -3.988 1.00 0.00 O ATOM 1568 C3' A A 99 9.415 -3.996 -2.855 1.00 0.00 C ATOM 1569 O3' A A 99 10.561 -3.424 -3.446 1.00 0.00 O ATOM 1570 C2' A A 99 8.140 -3.682 -3.636 1.00 0.00 C ATOM 1571 O2' A A 99 8.136 -2.395 -4.219 1.00 0.00 O ATOM 1572 C1' A A 99 8.196 -4.769 -4.692 1.00 0.00 C ATOM 1573 N9 A A 99 6.907 -4.916 -5.395 1.00 0.00 N ATOM 1574 C8 A A 99 6.528 -4.271 -6.540 1.00 0.00 C ATOM 1575 N7 A A 99 5.339 -4.587 -6.974 1.00 0.00 N ATOM 1576 C5 A A 99 4.894 -5.517 -6.034 1.00 0.00 C ATOM 1577 C6 A A 99 3.701 -6.254 -5.904 1.00 0.00 C ATOM 1578 N6 A A 99 2.689 -6.180 -6.769 1.00 0.00 N ATOM 1579 N1 A A 99 3.566 -7.077 -4.856 1.00 0.00 N ATOM 1580 C2 A A 99 4.561 -7.165 -3.983 1.00 0.00 C ATOM 1581 N3 A A 99 5.727 -6.536 -3.985 1.00 0.00 N ATOM 1582 C4 A A 99 5.836 -5.712 -5.057 1.00 0.00 C ATOM 0 H5' A A 99 9.674 -5.657 -0.833 1.00 0.00 H new ATOM 0 H5'' A A 99 8.116 -6.151 -1.464 1.00 0.00 H new ATOM 0 H4' A A 99 10.529 -5.817 -3.254 1.00 0.00 H new ATOM 0 H3' A A 99 9.371 -3.611 -1.836 1.00 0.00 H new ATOM 0 H2' A A 99 7.242 -3.670 -3.018 1.00 0.00 H new ATOM 0 HO2' A A 99 8.539 -1.753 -3.598 1.00 0.00 H new ATOM 0 H1' A A 99 8.896 -4.543 -5.496 1.00 0.00 H new ATOM 0 H8 A A 99 7.162 -3.557 -7.044 1.00 0.00 H new ATOM 0 H61 A A 99 1.849 -6.740 -6.621 1.00 0.00 H new ATOM 0 H62 A A 99 2.755 -5.564 -7.579 1.00 0.00 H new ATOM 0 H2 A A 99 4.398 -7.842 -3.158 1.00 0.00 H new ATOM 1594 P A A 100 11.101 -1.993 -2.953 1.00 0.00 P ATOM 1595 OP1 A A 100 11.743 -2.168 -1.631 1.00 0.00 O ATOM 1596 OP2 A A 100 10.012 -1.008 -3.119 1.00 0.00 O ATOM 1597 O5' A A 100 12.241 -1.666 -4.034 1.00 0.00 O ATOM 1598 C5' A A 100 13.465 -2.365 -3.984 1.00 0.00 C ATOM 1599 C4' A A 100 14.067 -2.525 -5.380 1.00 0.00 C ATOM 1600 O4' A A 100 13.080 -2.897 -6.336 1.00 0.00 O ATOM 1601 C3' A A 100 14.633 -1.184 -5.819 1.00 0.00 C ATOM 1602 O3' A A 100 15.781 -1.383 -6.611 1.00 0.00 O ATOM 1603 C2' A A 100 13.486 -0.600 -6.627 1.00 0.00 C ATOM 1604 O2' A A 100 13.916 0.376 -7.557 1.00 0.00 O ATOM 1605 C1' A A 100 12.944 -1.854 -7.291 1.00 0.00 C ATOM 1606 N9 A A 100 11.543 -1.612 -7.676 1.00 0.00 N ATOM 1607 C8 A A 100 10.415 -1.680 -6.897 1.00 0.00 C ATOM 1608 N7 A A 100 9.312 -1.381 -7.531 1.00 0.00 N ATOM 1609 C5 A A 100 9.746 -1.088 -8.826 1.00 0.00 C ATOM 1610 C6 A A 100 9.088 -0.687 -10.005 1.00 0.00 C ATOM 1611 N6 A A 100 7.773 -0.511 -10.103 1.00 0.00 N ATOM 1612 N1 A A 100 9.818 -0.462 -11.106 1.00 0.00 N ATOM 1613 C2 A A 100 11.129 -0.633 -11.043 1.00 0.00 C ATOM 1614 N3 A A 100 11.872 -1.009 -10.013 1.00 0.00 N ATOM 1615 C4 A A 100 11.105 -1.227 -8.919 1.00 0.00 C ATOM 0 H5' A A 100 13.308 -3.347 -3.538 1.00 0.00 H new ATOM 0 H5'' A A 100 14.166 -1.831 -3.342 1.00 0.00 H new ATOM 0 H4' A A 100 14.831 -3.301 -5.330 1.00 0.00 H new ATOM 0 H3' A A 100 14.950 -0.536 -5.002 1.00 0.00 H new ATOM 0 H2' A A 100 12.750 -0.054 -6.037 1.00 0.00 H new ATOM 0 HO2' A A 100 13.143 0.719 -8.052 1.00 0.00 H new ATOM 0 H1' A A 100 13.479 -2.128 -8.200 1.00 0.00 H new ATOM 0 H8 A A 100 10.437 -1.956 -5.853 1.00 0.00 H new ATOM 0 H61 A A 100 7.362 -0.219 -10.990 1.00 0.00 H new ATOM 0 H62 A A 100 7.176 -0.668 -9.291 1.00 0.00 H new ATOM 0 H2 A A 100 11.668 -0.439 -11.959 1.00 0.00 H new ATOM 1627 P A A 101 17.232 -1.464 -5.932 1.00 0.00 P ATOM 1628 OP1 A A 101 18.191 -2.001 -6.923 1.00 0.00 O ATOM 1629 OP2 A A 101 17.098 -2.110 -4.608 1.00 0.00 O ATOM 1630 O5' A A 101 17.573 0.085 -5.693 1.00 0.00 O ATOM 1631 C5' A A 101 17.473 1.001 -6.759 1.00 0.00 C ATOM 1632 C4' A A 101 18.089 2.353 -6.404 1.00 0.00 C ATOM 1633 O4' A A 101 17.425 2.944 -5.296 1.00 0.00 O ATOM 1634 C3' A A 101 19.562 2.217 -6.022 1.00 0.00 C ATOM 1635 O3' A A 101 20.254 3.412 -6.337 1.00 0.00 O ATOM 1636 C2' A A 101 19.482 2.020 -4.515 1.00 0.00 C ATOM 1637 O2' A A 101 20.652 2.465 -3.858 1.00 0.00 O ATOM 1638 C1' A A 101 18.251 2.840 -4.143 1.00 0.00 C ATOM 1639 N9 A A 101 17.513 2.223 -3.021 1.00 0.00 N ATOM 1640 C8 A A 101 17.397 0.898 -2.690 1.00 0.00 C ATOM 1641 N7 A A 101 16.686 0.670 -1.619 1.00 0.00 N ATOM 1642 C5 A A 101 16.305 1.946 -1.206 1.00 0.00 C ATOM 1643 C6 A A 101 15.551 2.426 -0.117 1.00 0.00 C ATOM 1644 N6 A A 101 14.992 1.630 0.799 1.00 0.00 N ATOM 1645 N1 A A 101 15.384 3.749 0.015 1.00 0.00 N ATOM 1646 C2 A A 101 15.932 4.555 -0.885 1.00 0.00 C ATOM 1647 N3 A A 101 16.660 4.243 -1.952 1.00 0.00 N ATOM 1648 C4 A A 101 16.805 2.898 -2.057 1.00 0.00 C ATOM 0 H5' A A 101 16.425 1.137 -7.024 1.00 0.00 H new ATOM 0 H5'' A A 101 17.973 0.593 -7.637 1.00 0.00 H new ATOM 0 H4' A A 101 17.985 2.975 -7.293 1.00 0.00 H new ATOM 0 H3' A A 101 20.089 1.415 -6.539 1.00 0.00 H new ATOM 0 H2' A A 101 19.404 0.975 -4.215 1.00 0.00 H new ATOM 0 HO2' A A 101 20.560 2.322 -2.893 1.00 0.00 H new ATOM 0 HO3' A A 101 20.805 3.682 -5.573 1.00 0.00 H new ATOM 0 H1' A A 101 18.558 3.832 -3.811 1.00 0.00 H new ATOM 0 H8 A A 101 17.855 0.108 -3.267 1.00 0.00 H new ATOM 0 H61 A A 101 14.456 2.034 1.567 1.00 0.00 H new ATOM 0 H62 A A 101 15.101 0.618 0.730 1.00 0.00 H new ATOM 0 H2 A A 101 15.763 5.610 -0.729 1.00 0.00 H new TER 1661 A A 101