USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 704 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 112 HIS : no HE2:sc= -9.5! C(o=-10!,f=-17!) USER MOD Set 2.2: A 127 SER OG : rot -53:sc= -0.529! USER MOD Set 3.1: A 57 HIS : no HE2:sc= -3.26! C(o=-4.8!,f=-4.3!) USER MOD Set 3.2: A 74 ASN : amide:sc= -1.49 K(o=-4.8,f=-3.4) USER MOD Single : A 26 GLN : amide:sc= -0.176 K(o=-0.18,f=-1.1) USER MOD Single : A 27 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.033) USER MOD Single : A 28 ASN : amide:sc= -6.33! C(o=-6.3!,f=-9.6!) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 160:sc= -1.17 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HE2:sc= -2.37 K(o=-2.4,f=-5.2) USER MOD Single : A 68 MET CE :methyl 172:sc= -10.7! (180deg=-10.7!) USER MOD Single : A 70 CYS SG : rot 100:sc= -2.01 USER MOD Single : A 71 CYS SG : rot 67:sc= 1.08 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot -64:sc= -0.92! USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 MET CE :methyl 169:sc=-0.00466 (180deg=-0.0804) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc=-0.000721 X(o=-0.00072,f=-0.034) USER MOD Single : A 102 ASN : amide:sc= -0.0681 K(o=-0.068,f=-0.77) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.00693 USER MOD Single : A 108 ASN : amide:sc= -0.102 K(o=-0.1,f=-1.3!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.126 K(o=-0.13,f=-0.68) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -3! C(o=-3!,f=-5.8!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 94:sc= 1.04 USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 60 N GLN A 26 -8.610 9.181 -6.338 1.00 0.00 N ATOM 61 CA GLN A 26 -8.748 9.155 -7.784 1.00 0.00 C ATOM 62 C GLN A 26 -7.742 10.109 -8.431 1.00 0.00 C ATOM 63 O GLN A 26 -7.299 9.879 -9.556 1.00 0.00 O ATOM 64 CB GLN A 26 -10.178 9.499 -8.205 1.00 0.00 C ATOM 65 CG GLN A 26 -11.080 8.264 -8.144 1.00 0.00 C ATOM 66 CD GLN A 26 -11.640 7.926 -9.527 1.00 0.00 C ATOM 67 OE1 GLN A 26 -11.890 8.789 -10.352 1.00 0.00 O ATOM 68 NE2 GLN A 26 -11.823 6.626 -9.734 1.00 0.00 N ATOM 0 HA GLN A 26 -8.535 8.144 -8.131 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.576 10.277 -7.553 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -10.176 9.902 -9.218 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -10.515 7.415 -7.759 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -11.901 8.442 -7.449 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -11.593 5.955 -9.001 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -12.193 6.299 -10.626 1.00 0.00 H new ATOM 75 N LYS A 27 -7.410 11.158 -7.693 1.00 0.00 N ATOM 76 CA LYS A 27 -6.464 12.147 -8.181 1.00 0.00 C ATOM 77 C LYS A 27 -5.055 11.772 -7.716 1.00 0.00 C ATOM 78 O LYS A 27 -4.362 12.587 -7.108 1.00 0.00 O ATOM 79 CB LYS A 27 -6.897 13.554 -7.763 1.00 0.00 C ATOM 80 CG LYS A 27 -7.609 14.272 -8.911 1.00 0.00 C ATOM 81 CD LYS A 27 -8.735 13.409 -9.483 1.00 0.00 C ATOM 82 CE LYS A 27 -9.751 13.045 -8.399 1.00 0.00 C ATOM 83 NZ LYS A 27 -10.535 14.236 -8.002 1.00 0.00 N ATOM 0 H LYS A 27 -7.779 11.345 -6.761 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.448 12.154 -9.271 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.560 13.493 -6.900 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -6.025 14.130 -7.454 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.016 15.219 -8.556 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.892 14.508 -9.697 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.235 13.945 -10.290 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.317 12.500 -9.915 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.421 12.267 -8.766 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -9.234 12.636 -7.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -11.286 13.953 -7.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -9.909 14.925 -7.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.961 14.668 -8.846 1.00 0.00 H new ATOM 93 N ASN A 28 -4.675 10.540 -8.019 1.00 0.00 N ATOM 94 CA ASN A 28 -3.361 10.047 -7.639 1.00 0.00 C ATOM 95 C ASN A 28 -3.168 8.638 -8.202 1.00 0.00 C ATOM 96 O ASN A 28 -2.065 8.273 -8.605 1.00 0.00 O ATOM 97 CB ASN A 28 -3.220 9.974 -6.117 1.00 0.00 C ATOM 98 CG ASN A 28 -1.857 10.504 -5.666 1.00 0.00 C ATOM 99 OD1 ASN A 28 -0.984 10.804 -6.464 1.00 0.00 O ATOM 100 ND2 ASN A 28 -1.726 10.604 -4.347 1.00 0.00 N ATOM 0 H ASN A 28 -5.253 9.868 -8.523 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.614 10.734 -8.037 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -4.014 10.554 -5.647 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -3.341 8.942 -5.786 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -0.854 10.949 -3.946 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.497 10.335 -3.736 1.00 0.00 H new ATOM 106 N ILE A 29 -4.257 7.884 -8.209 1.00 0.00 N ATOM 107 CA ILE A 29 -4.220 6.522 -8.715 1.00 0.00 C ATOM 108 C ILE A 29 -3.777 6.538 -10.179 1.00 0.00 C ATOM 109 O ILE A 29 -3.037 7.428 -10.597 1.00 0.00 O ATOM 110 CB ILE A 29 -5.566 5.829 -8.488 1.00 0.00 C ATOM 111 CG1 ILE A 29 -6.722 6.711 -8.964 1.00 0.00 C ATOM 112 CG2 ILE A 29 -5.728 5.412 -7.025 1.00 0.00 C ATOM 113 CD1 ILE A 29 -6.689 6.888 -10.484 1.00 0.00 C ATOM 0 H ILE A 29 -5.170 8.190 -7.873 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.486 5.932 -8.166 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.587 4.918 -9.086 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -7.671 6.264 -8.667 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.663 7.686 -8.480 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.692 4.922 -6.891 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.929 4.722 -6.753 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.678 6.295 -6.387 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.522 7.519 -10.795 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.749 7.357 -10.775 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.773 5.914 -10.966 1.00 0.00 H new ATOM 124 N ASP A 30 -4.246 5.544 -10.918 1.00 0.00 N ATOM 125 CA ASP A 30 -3.907 5.432 -12.326 1.00 0.00 C ATOM 126 C ASP A 30 -5.113 4.891 -13.096 1.00 0.00 C ATOM 127 O ASP A 30 -5.786 5.637 -13.807 1.00 0.00 O ATOM 128 CB ASP A 30 -2.740 4.466 -12.537 1.00 0.00 C ATOM 129 CG ASP A 30 -2.779 3.680 -13.849 1.00 0.00 C ATOM 130 OD1 ASP A 30 -2.878 4.343 -14.905 1.00 0.00 O ATOM 131 OD2 ASP A 30 -2.709 2.435 -13.767 1.00 0.00 O ATOM 0 H ASP A 30 -4.859 4.808 -10.568 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.625 6.422 -12.684 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.809 5.031 -12.497 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.719 3.759 -11.708 1.00 0.00 H new ATOM 135 N GLY A 31 -5.350 3.599 -12.928 1.00 0.00 N ATOM 136 CA GLY A 31 -6.464 2.949 -13.599 1.00 0.00 C ATOM 137 C GLY A 31 -7.541 2.534 -12.595 1.00 0.00 C ATOM 138 O GLY A 31 -8.428 1.747 -12.921 1.00 0.00 O ATOM 0 H GLY A 31 -4.790 2.984 -12.337 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -6.892 3.625 -14.339 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.107 2.072 -14.138 1.00 0.00 H new ATOM 142 N TRP A 32 -7.429 3.082 -11.394 1.00 0.00 N ATOM 143 CA TRP A 32 -8.382 2.778 -10.340 1.00 0.00 C ATOM 144 C TRP A 32 -8.789 1.311 -10.479 1.00 0.00 C ATOM 145 O TRP A 32 -8.115 0.424 -9.957 1.00 0.00 O ATOM 146 CB TRP A 32 -9.574 3.736 -10.387 1.00 0.00 C ATOM 147 CG TRP A 32 -10.755 3.303 -9.515 1.00 0.00 C ATOM 148 CD1 TRP A 32 -11.887 2.701 -9.901 1.00 0.00 C ATOM 149 CD2 TRP A 32 -10.874 3.465 -8.086 1.00 0.00 C ATOM 150 NE1 TRP A 32 -12.725 2.463 -8.829 1.00 0.00 N ATOM 151 CE2 TRP A 32 -12.088 2.942 -7.690 1.00 0.00 C ATOM 152 CE3 TRP A 32 -9.983 4.034 -7.159 1.00 0.00 C ATOM 153 CZ2 TRP A 32 -12.523 2.937 -6.361 1.00 0.00 C ATOM 154 CZ3 TRP A 32 -10.433 4.021 -5.832 1.00 0.00 C ATOM 155 CH2 TRP A 32 -11.654 3.499 -5.418 1.00 0.00 C ATOM 0 H TRP A 32 -6.692 3.735 -11.127 1.00 0.00 H new ATOM 0 HA TRP A 32 -7.931 2.922 -9.358 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -9.245 4.725 -10.070 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -9.912 3.829 -11.419 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -12.116 2.435 -10.922 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -13.642 2.018 -8.866 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -9.028 4.448 -7.447 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -13.479 2.522 -6.077 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -9.787 4.446 -5.078 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -11.930 3.527 -4.374 1.00 0.00 H new ATOM 300 N PHE A 44 -11.751 1.845 3.083 1.00 0.00 N ATOM 301 CA PHE A 44 -10.482 2.379 3.549 1.00 0.00 C ATOM 302 C PHE A 44 -10.166 1.884 4.962 1.00 0.00 C ATOM 303 O PHE A 44 -10.622 2.467 5.944 1.00 0.00 O ATOM 304 CB PHE A 44 -10.620 3.902 3.574 1.00 0.00 C ATOM 305 CG PHE A 44 -9.849 4.578 4.710 1.00 0.00 C ATOM 306 CD1 PHE A 44 -8.623 4.112 5.071 1.00 0.00 C ATOM 307 CD2 PHE A 44 -10.389 5.645 5.358 1.00 0.00 C ATOM 308 CE1 PHE A 44 -7.908 4.740 6.125 1.00 0.00 C ATOM 309 CE2 PHE A 44 -9.674 6.272 6.412 1.00 0.00 C ATOM 310 CZ PHE A 44 -8.449 5.806 6.773 1.00 0.00 C ATOM 0 HA PHE A 44 -9.677 2.055 2.890 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.271 4.304 2.623 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.676 4.160 3.661 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -8.194 3.265 4.556 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.362 6.015 5.071 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -6.934 4.371 6.412 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -10.103 7.119 6.927 1.00 0.00 H new ATOM 0 HZ PHE A 44 -7.905 6.283 7.575 1.00 0.00 H new ATOM 319 N ILE A 45 -9.388 0.813 5.019 1.00 0.00 N ATOM 320 CA ILE A 45 -9.006 0.233 6.295 1.00 0.00 C ATOM 321 C ILE A 45 -7.933 1.108 6.948 1.00 0.00 C ATOM 322 O ILE A 45 -8.177 1.728 7.981 1.00 0.00 O ATOM 323 CB ILE A 45 -8.583 -1.226 6.116 1.00 0.00 C ATOM 324 CG1 ILE A 45 -9.785 -2.107 5.767 1.00 0.00 C ATOM 325 CG2 ILE A 45 -7.837 -1.738 7.350 1.00 0.00 C ATOM 326 CD1 ILE A 45 -9.533 -3.562 6.165 1.00 0.00 C ATOM 0 H ILE A 45 -9.012 0.332 4.202 1.00 0.00 H new ATOM 0 HA ILE A 45 -9.859 0.213 6.974 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.890 -1.279 5.277 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -10.673 -1.735 6.278 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -9.985 -2.048 4.697 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -7.548 -2.778 7.195 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -6.944 -1.134 7.512 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.486 -1.668 8.223 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -10.403 -4.166 5.906 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -8.659 -3.938 5.634 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -9.358 -3.620 7.239 1.00 0.00 H new ATOM 337 N MET A 46 -6.769 1.130 6.316 1.00 0.00 N ATOM 338 CA MET A 46 -5.658 1.919 6.822 1.00 0.00 C ATOM 339 C MET A 46 -4.917 2.618 5.680 1.00 0.00 C ATOM 340 O MET A 46 -4.559 1.985 4.688 1.00 0.00 O ATOM 341 CB MET A 46 -4.688 1.009 7.579 1.00 0.00 C ATOM 342 CG MET A 46 -5.442 0.065 8.518 1.00 0.00 C ATOM 343 SD MET A 46 -4.571 -0.075 10.069 1.00 0.00 S ATOM 344 CE MET A 46 -5.623 -1.247 10.910 1.00 0.00 C ATOM 0 H MET A 46 -6.571 0.615 5.458 1.00 0.00 H new ATOM 0 HA MET A 46 -6.054 2.681 7.493 1.00 0.00 H new ATOM 0 HB2 MET A 46 -4.099 0.428 6.869 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.987 1.616 8.153 1.00 0.00 H new ATOM 0 HG2 MET A 46 -6.451 0.439 8.690 1.00 0.00 H new ATOM 0 HG3 MET A 46 -5.541 -0.918 8.057 1.00 0.00 H new ATOM 0 HE1 MET A 46 -5.222 -1.449 11.903 1.00 0.00 H new ATOM 0 HE2 MET A 46 -6.627 -0.834 11.002 1.00 0.00 H new ATOM 0 HE3 MET A 46 -5.663 -2.175 10.339 1.00 0.00 H new ATOM 352 N GLU A 47 -4.711 3.915 5.857 1.00 0.00 N ATOM 353 CA GLU A 47 -4.019 4.706 4.855 1.00 0.00 C ATOM 354 C GLU A 47 -2.636 5.115 5.362 1.00 0.00 C ATOM 355 O GLU A 47 -2.485 5.503 6.520 1.00 0.00 O ATOM 356 CB GLU A 47 -4.844 5.934 4.460 1.00 0.00 C ATOM 357 CG GLU A 47 -4.681 7.056 5.489 1.00 0.00 C ATOM 358 CD GLU A 47 -5.600 8.236 5.162 1.00 0.00 C ATOM 359 OE1 GLU A 47 -5.476 8.755 4.031 1.00 0.00 O ATOM 360 OE2 GLU A 47 -6.403 8.593 6.051 1.00 0.00 O ATOM 0 H GLU A 47 -5.012 4.437 6.680 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.890 4.093 3.963 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.530 6.287 3.478 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.896 5.660 4.379 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.910 6.677 6.485 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.644 7.391 5.506 1.00 0.00 H new ATOM 365 N GLY A 48 -1.659 5.015 4.472 1.00 0.00 N ATOM 366 CA GLY A 48 -0.293 5.369 4.816 1.00 0.00 C ATOM 367 C GLY A 48 0.604 5.359 3.575 1.00 0.00 C ATOM 368 O GLY A 48 0.249 4.777 2.552 1.00 0.00 O ATOM 0 H GLY A 48 -1.787 4.694 3.513 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.274 6.357 5.275 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.094 4.667 5.555 1.00 0.00 H new ATOM 372 N THR A 49 1.750 6.011 3.709 1.00 0.00 N ATOM 373 CA THR A 49 2.700 6.085 2.613 1.00 0.00 C ATOM 374 C THR A 49 3.966 5.294 2.950 1.00 0.00 C ATOM 375 O THR A 49 4.716 5.670 3.850 1.00 0.00 O ATOM 376 CB THR A 49 2.969 7.562 2.317 1.00 0.00 C ATOM 377 OG1 THR A 49 1.937 8.249 3.022 1.00 0.00 O ATOM 378 CG2 THR A 49 2.720 7.920 0.851 1.00 0.00 C ATOM 0 H THR A 49 2.041 6.492 4.560 1.00 0.00 H new ATOM 0 HA THR A 49 2.297 5.626 1.710 1.00 0.00 H new ATOM 0 HB THR A 49 3.999 7.804 2.579 1.00 0.00 H new ATOM 0 HG1 THR A 49 2.036 9.215 2.887 1.00 0.00 H new ATOM 0 HG21 THR A 49 2.926 8.979 0.695 1.00 0.00 H new ATOM 0 HG22 THR A 49 3.376 7.326 0.215 1.00 0.00 H new ATOM 0 HG23 THR A 49 1.681 7.711 0.597 1.00 0.00 H new ATOM 386 N LEU A 50 4.165 4.213 2.210 1.00 0.00 N ATOM 387 CA LEU A 50 5.327 3.366 2.419 1.00 0.00 C ATOM 388 C LEU A 50 6.277 3.508 1.228 1.00 0.00 C ATOM 389 O LEU A 50 5.840 3.511 0.078 1.00 0.00 O ATOM 390 CB LEU A 50 4.896 1.924 2.694 1.00 0.00 C ATOM 391 CG LEU A 50 3.980 1.717 3.903 1.00 0.00 C ATOM 392 CD1 LEU A 50 2.556 2.185 3.597 1.00 0.00 C ATOM 393 CD2 LEU A 50 4.016 0.262 4.375 1.00 0.00 C ATOM 0 H LEU A 50 3.541 3.904 1.465 1.00 0.00 H new ATOM 0 HA LEU A 50 5.876 3.684 3.305 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.388 1.542 1.808 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.791 1.318 2.834 1.00 0.00 H new ATOM 0 HG LEU A 50 4.352 2.331 4.723 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.925 2.027 4.472 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.568 3.245 3.345 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.159 1.616 2.756 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.357 0.142 5.235 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.682 -0.391 3.568 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.034 -0.003 4.659 1.00 0.00 H new ATOM 404 N THR A 51 7.559 3.620 1.545 1.00 0.00 N ATOM 405 CA THR A 51 8.574 3.760 0.515 1.00 0.00 C ATOM 406 C THR A 51 9.093 2.386 0.086 1.00 0.00 C ATOM 407 O THR A 51 9.441 1.560 0.927 1.00 0.00 O ATOM 408 CB THR A 51 9.670 4.682 1.055 1.00 0.00 C ATOM 409 OG1 THR A 51 9.389 5.943 0.454 1.00 0.00 O ATOM 410 CG2 THR A 51 11.056 4.317 0.523 1.00 0.00 C ATOM 0 H THR A 51 7.917 3.617 2.500 1.00 0.00 H new ATOM 0 HA THR A 51 8.162 4.213 -0.387 1.00 0.00 H new ATOM 0 HB THR A 51 9.676 4.639 2.144 1.00 0.00 H new ATOM 0 HG1 THR A 51 9.822 6.655 0.970 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.796 5.002 0.937 1.00 0.00 H new ATOM 0 HG22 THR A 51 11.301 3.296 0.817 1.00 0.00 H new ATOM 0 HG23 THR A 51 11.060 4.392 -0.564 1.00 0.00 H new ATOM 418 N ARG A 52 9.127 2.185 -1.223 1.00 0.00 N ATOM 419 CA ARG A 52 9.597 0.926 -1.775 1.00 0.00 C ATOM 420 C ARG A 52 11.119 0.952 -1.934 1.00 0.00 C ATOM 421 O ARG A 52 11.627 1.186 -3.029 1.00 0.00 O ATOM 422 CB ARG A 52 8.953 0.646 -3.134 1.00 0.00 C ATOM 423 CG ARG A 52 8.048 -0.587 -3.069 1.00 0.00 C ATOM 424 CD ARG A 52 8.265 -1.491 -4.283 1.00 0.00 C ATOM 425 NE ARG A 52 9.561 -2.196 -4.164 1.00 0.00 N ATOM 426 CZ ARG A 52 10.047 -3.035 -5.089 1.00 0.00 C ATOM 427 NH1 ARG A 52 9.348 -3.279 -6.206 1.00 0.00 N ATOM 428 NH2 ARG A 52 11.232 -3.631 -4.897 1.00 0.00 N ATOM 0 H ARG A 52 8.837 2.873 -1.918 1.00 0.00 H new ATOM 0 HA ARG A 52 9.314 0.133 -1.082 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.371 1.512 -3.450 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.729 0.493 -3.884 1.00 0.00 H new ATOM 0 HG2 ARG A 52 8.252 -1.145 -2.155 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.005 -0.275 -3.026 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.453 -2.215 -4.357 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.247 -0.897 -5.197 1.00 0.00 H new ATOM 0 HE ARG A 52 10.119 -2.033 -3.326 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.446 -2.826 -6.352 1.00 0.00 H new ATOM 0 HH12 ARG A 52 9.718 -3.918 -6.910 1.00 0.00 H new ATOM 0 HH21 ARG A 52 11.764 -3.446 -4.047 1.00 0.00 H new ATOM 0 HH22 ARG A 52 11.602 -4.270 -5.601 1.00 0.00 H new ATOM 439 N VAL A 53 11.802 0.707 -0.826 1.00 0.00 N ATOM 440 CA VAL A 53 13.255 0.698 -0.829 1.00 0.00 C ATOM 441 C VAL A 53 13.752 -0.410 -1.759 1.00 0.00 C ATOM 442 O VAL A 53 12.960 -1.203 -2.264 1.00 0.00 O ATOM 443 CB VAL A 53 13.781 0.558 0.601 1.00 0.00 C ATOM 444 CG1 VAL A 53 14.872 -0.511 0.683 1.00 0.00 C ATOM 445 CG2 VAL A 53 14.287 1.900 1.134 1.00 0.00 C ATOM 0 H VAL A 53 11.376 0.513 0.080 1.00 0.00 H new ATOM 0 HA VAL A 53 13.641 1.642 -1.212 1.00 0.00 H new ATOM 0 HB VAL A 53 12.952 0.238 1.232 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.228 -0.590 1.710 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.465 -1.471 0.365 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.701 -0.235 0.032 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.655 1.772 2.152 1.00 0.00 H new ATOM 0 HG22 VAL A 53 15.095 2.262 0.499 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.472 2.623 1.131 1.00 0.00 H new ATOM 455 N GLY A 54 15.062 -0.428 -1.958 1.00 0.00 N ATOM 456 CA GLY A 54 15.675 -1.425 -2.819 1.00 0.00 C ATOM 457 C GLY A 54 16.067 -0.818 -4.168 1.00 0.00 C ATOM 458 O GLY A 54 16.427 -1.540 -5.096 1.00 0.00 O ATOM 0 H GLY A 54 15.716 0.232 -1.538 1.00 0.00 H new ATOM 0 HA2 GLY A 54 16.558 -1.838 -2.332 1.00 0.00 H new ATOM 0 HA3 GLY A 54 14.982 -2.251 -2.976 1.00 0.00 H new ATOM 462 N ALA A 55 15.985 0.503 -4.233 1.00 0.00 N ATOM 463 CA ALA A 55 16.328 1.215 -5.452 1.00 0.00 C ATOM 464 C ALA A 55 15.082 1.339 -6.331 1.00 0.00 C ATOM 465 O ALA A 55 15.135 1.070 -7.531 1.00 0.00 O ATOM 466 CB ALA A 55 17.472 0.490 -6.163 1.00 0.00 C ATOM 0 H ALA A 55 15.686 1.099 -3.461 1.00 0.00 H new ATOM 0 HA ALA A 55 16.674 2.223 -5.223 1.00 0.00 H new ATOM 0 HB1 ALA A 55 17.729 1.025 -7.078 1.00 0.00 H new ATOM 0 HB2 ALA A 55 18.342 0.453 -5.508 1.00 0.00 H new ATOM 0 HB3 ALA A 55 17.161 -0.525 -6.411 1.00 0.00 H new ATOM 472 N LYS A 56 13.990 1.747 -5.702 1.00 0.00 N ATOM 473 CA LYS A 56 12.733 1.910 -6.412 1.00 0.00 C ATOM 474 C LYS A 56 12.250 3.353 -6.260 1.00 0.00 C ATOM 475 O LYS A 56 12.790 4.262 -6.887 1.00 0.00 O ATOM 476 CB LYS A 56 11.714 0.868 -5.945 1.00 0.00 C ATOM 477 CG LYS A 56 10.728 0.524 -7.064 1.00 0.00 C ATOM 478 CD LYS A 56 11.286 -0.579 -7.966 1.00 0.00 C ATOM 479 CE LYS A 56 11.530 -0.057 -9.383 1.00 0.00 C ATOM 480 NZ LYS A 56 11.899 -1.169 -10.288 1.00 0.00 N ATOM 0 H LYS A 56 13.950 1.970 -4.707 1.00 0.00 H new ATOM 0 HA LYS A 56 12.872 1.730 -7.478 1.00 0.00 H new ATOM 0 HB2 LYS A 56 12.233 -0.035 -5.623 1.00 0.00 H new ATOM 0 HB3 LYS A 56 11.170 1.248 -5.080 1.00 0.00 H new ATOM 0 HG2 LYS A 56 9.781 0.201 -6.632 1.00 0.00 H new ATOM 0 HG3 LYS A 56 10.521 1.414 -7.658 1.00 0.00 H new ATOM 0 HD2 LYS A 56 12.219 -0.958 -7.549 1.00 0.00 H new ATOM 0 HD3 LYS A 56 10.588 -1.416 -7.998 1.00 0.00 H new ATOM 0 HE2 LYS A 56 10.633 0.439 -9.754 1.00 0.00 H new ATOM 0 HE3 LYS A 56 12.325 0.689 -9.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 12.061 -0.798 -11.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 12.767 -1.625 -9.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 11.128 -1.867 -10.313 1.00 0.00 H new ATOM 490 N HIS A 57 11.236 3.519 -5.422 1.00 0.00 N ATOM 491 CA HIS A 57 10.674 4.837 -5.179 1.00 0.00 C ATOM 492 C HIS A 57 9.612 4.747 -4.082 1.00 0.00 C ATOM 493 O HIS A 57 9.402 3.684 -3.501 1.00 0.00 O ATOM 494 CB HIS A 57 10.139 5.446 -6.476 1.00 0.00 C ATOM 495 CG HIS A 57 10.983 6.574 -7.020 1.00 0.00 C ATOM 496 ND1 HIS A 57 11.938 6.387 -8.005 1.00 0.00 N ATOM 497 CD2 HIS A 57 11.007 7.901 -6.707 1.00 0.00 C ATOM 498 CE1 HIS A 57 12.504 7.556 -8.265 1.00 0.00 C ATOM 499 NE2 HIS A 57 11.926 8.493 -7.459 1.00 0.00 N ATOM 0 H HIS A 57 10.790 2.763 -4.903 1.00 0.00 H new ATOM 0 HA HIS A 57 11.454 5.511 -4.825 1.00 0.00 H new ATOM 0 HB2 HIS A 57 10.068 4.663 -7.231 1.00 0.00 H new ATOM 0 HB3 HIS A 57 9.128 5.814 -6.302 1.00 0.00 H new ATOM 0 HD1 HIS A 57 12.167 5.500 -8.454 1.00 0.00 H new ATOM 0 HD2 HIS A 57 10.384 8.388 -5.972 1.00 0.00 H new ATOM 0 HE1 HIS A 57 13.286 7.736 -8.988 1.00 0.00 H new ATOM 506 N GLU A 58 8.967 5.878 -3.833 1.00 0.00 N ATOM 507 CA GLU A 58 7.932 5.941 -2.816 1.00 0.00 C ATOM 508 C GLU A 58 6.587 5.501 -3.401 1.00 0.00 C ATOM 509 O GLU A 58 6.430 5.427 -4.618 1.00 0.00 O ATOM 510 CB GLU A 58 7.835 7.346 -2.218 1.00 0.00 C ATOM 511 CG GLU A 58 9.226 7.934 -1.974 1.00 0.00 C ATOM 512 CD GLU A 58 9.171 9.462 -1.912 1.00 0.00 C ATOM 513 OE1 GLU A 58 8.896 9.976 -0.805 1.00 0.00 O ATOM 514 OE2 GLU A 58 9.405 10.082 -2.971 1.00 0.00 O ATOM 0 H GLU A 58 9.142 6.758 -4.319 1.00 0.00 H new ATOM 0 HA GLU A 58 8.199 5.257 -2.011 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.275 7.994 -2.892 1.00 0.00 H new ATOM 0 HB3 GLU A 58 7.282 7.308 -1.279 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.632 7.543 -1.041 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.901 7.623 -2.771 1.00 0.00 H new ATOM 519 N ARG A 59 5.653 5.218 -2.505 1.00 0.00 N ATOM 520 CA ARG A 59 4.328 4.787 -2.916 1.00 0.00 C ATOM 521 C ARG A 59 3.315 5.041 -1.797 1.00 0.00 C ATOM 522 O ARG A 59 3.566 4.705 -0.641 1.00 0.00 O ATOM 523 CB ARG A 59 4.320 3.299 -3.274 1.00 0.00 C ATOM 524 CG ARG A 59 4.579 3.093 -4.768 1.00 0.00 C ATOM 525 CD ARG A 59 5.567 1.949 -4.999 1.00 0.00 C ATOM 526 NE ARG A 59 4.838 0.716 -5.370 1.00 0.00 N ATOM 527 CZ ARG A 59 5.351 -0.262 -6.127 1.00 0.00 C ATOM 528 NH1 ARG A 59 6.601 -0.158 -6.599 1.00 0.00 N ATOM 529 NH2 ARG A 59 4.614 -1.345 -6.413 1.00 0.00 N ATOM 0 H ARG A 59 5.788 5.279 -1.496 1.00 0.00 H new ATOM 0 HA ARG A 59 4.051 5.364 -3.799 1.00 0.00 H new ATOM 0 HB2 ARG A 59 5.082 2.778 -2.694 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.359 2.862 -3.004 1.00 0.00 H new ATOM 0 HG2 ARG A 59 3.640 2.876 -5.277 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.972 4.012 -5.203 1.00 0.00 H new ATOM 0 HD2 ARG A 59 6.269 2.218 -5.789 1.00 0.00 H new ATOM 0 HD3 ARG A 59 6.154 1.777 -4.097 1.00 0.00 H new ATOM 0 HE ARG A 59 3.884 0.604 -5.027 1.00 0.00 H new ATOM 0 HH11 ARG A 59 7.161 0.666 -6.382 1.00 0.00 H new ATOM 0 HH12 ARG A 59 6.992 -0.903 -7.176 1.00 0.00 H new ATOM 0 HH21 ARG A 59 3.663 -1.424 -6.054 1.00 0.00 H new ATOM 0 HH22 ARG A 59 5.005 -2.090 -6.990 1.00 0.00 H new ATOM 540 N HIS A 60 2.194 5.633 -2.181 1.00 0.00 N ATOM 541 CA HIS A 60 1.143 5.936 -1.224 1.00 0.00 C ATOM 542 C HIS A 60 0.242 4.713 -1.046 1.00 0.00 C ATOM 543 O HIS A 60 -0.719 4.531 -1.792 1.00 0.00 O ATOM 544 CB HIS A 60 0.369 7.187 -1.647 1.00 0.00 C ATOM 545 CG HIS A 60 -0.798 7.518 -0.747 1.00 0.00 C ATOM 546 ND1 HIS A 60 -0.835 7.173 0.593 1.00 0.00 N ATOM 547 CD2 HIS A 60 -1.969 8.167 -1.010 1.00 0.00 C ATOM 548 CE1 HIS A 60 -1.980 7.600 1.103 1.00 0.00 C ATOM 549 NE2 HIS A 60 -2.683 8.215 0.108 1.00 0.00 N ATOM 0 H HIS A 60 1.990 5.911 -3.141 1.00 0.00 H new ATOM 0 HA HIS A 60 1.584 6.162 -0.253 1.00 0.00 H new ATOM 0 HB2 HIS A 60 1.052 8.036 -1.666 1.00 0.00 H new ATOM 0 HB3 HIS A 60 0.003 7.049 -2.664 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -0.104 6.675 1.101 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -2.265 8.573 -1.966 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -2.301 7.482 2.127 1.00 0.00 H new ATOM 556 N ILE A 61 0.586 3.904 -0.054 1.00 0.00 N ATOM 557 CA ILE A 61 -0.179 2.702 0.231 1.00 0.00 C ATOM 558 C ILE A 61 -1.563 3.096 0.753 1.00 0.00 C ATOM 559 O ILE A 61 -1.746 4.200 1.263 1.00 0.00 O ATOM 560 CB ILE A 61 0.597 1.786 1.179 1.00 0.00 C ATOM 561 CG1 ILE A 61 2.017 1.538 0.663 1.00 0.00 C ATOM 562 CG2 ILE A 61 -0.161 0.478 1.420 1.00 0.00 C ATOM 563 CD1 ILE A 61 1.991 0.929 -0.740 1.00 0.00 C ATOM 0 H ILE A 61 1.384 4.058 0.562 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.333 2.123 -0.680 1.00 0.00 H new ATOM 0 HB ILE A 61 0.687 2.289 2.142 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.571 2.477 0.646 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.544 0.870 1.344 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.412 -0.155 2.097 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.133 0.697 1.863 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.303 -0.040 0.472 1.00 0.00 H new ATOM 0 HD11 ILE A 61 3.012 0.763 -1.083 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.457 -0.021 -0.714 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.485 1.611 -1.423 1.00 0.00 H new ATOM 574 N PHE A 62 -2.500 2.171 0.607 1.00 0.00 N ATOM 575 CA PHE A 62 -3.861 2.408 1.057 1.00 0.00 C ATOM 576 C PHE A 62 -4.687 1.121 1.006 1.00 0.00 C ATOM 577 O PHE A 62 -5.387 0.866 0.027 1.00 0.00 O ATOM 578 CB PHE A 62 -4.476 3.432 0.102 1.00 0.00 C ATOM 579 CG PHE A 62 -5.133 4.622 0.805 1.00 0.00 C ATOM 580 CD1 PHE A 62 -6.226 4.429 1.591 1.00 0.00 C ATOM 581 CD2 PHE A 62 -4.624 5.873 0.645 1.00 0.00 C ATOM 582 CE1 PHE A 62 -6.836 5.533 2.243 1.00 0.00 C ATOM 583 CE2 PHE A 62 -5.233 6.978 1.297 1.00 0.00 C ATOM 584 CZ PHE A 62 -6.327 6.784 2.083 1.00 0.00 C ATOM 0 H PHE A 62 -2.344 1.256 0.184 1.00 0.00 H new ATOM 0 HA PHE A 62 -3.855 2.764 2.087 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.699 3.802 -0.567 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -5.220 2.933 -0.519 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -6.630 3.436 1.719 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.756 6.026 0.021 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -7.705 5.379 2.866 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -4.828 7.971 1.169 1.00 0.00 H new ATOM 0 HZ PHE A 62 -6.791 7.623 2.580 1.00 0.00 H new ATOM 593 N LEU A 63 -4.578 0.343 2.073 1.00 0.00 N ATOM 594 CA LEU A 63 -5.306 -0.911 2.163 1.00 0.00 C ATOM 595 C LEU A 63 -6.798 -0.619 2.339 1.00 0.00 C ATOM 596 O LEU A 63 -7.191 0.079 3.273 1.00 0.00 O ATOM 597 CB LEU A 63 -4.718 -1.794 3.265 1.00 0.00 C ATOM 598 CG LEU A 63 -5.665 -2.153 4.413 1.00 0.00 C ATOM 599 CD1 LEU A 63 -6.865 -2.955 3.903 1.00 0.00 C ATOM 600 CD2 LEU A 63 -4.918 -2.886 5.530 1.00 0.00 C ATOM 0 H LEU A 63 -3.996 0.557 2.883 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.199 -1.480 1.240 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.362 -2.719 2.811 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.847 -1.288 3.683 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.054 -1.228 4.838 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -7.522 -3.197 4.738 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.413 -2.363 3.170 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -6.515 -3.876 3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -5.613 -3.130 6.333 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.483 -3.804 5.135 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.125 -2.247 5.918 1.00 0.00 H new ATOM 611 N PHE A 64 -7.587 -1.167 1.426 1.00 0.00 N ATOM 612 CA PHE A 64 -9.027 -0.973 1.469 1.00 0.00 C ATOM 613 C PHE A 64 -9.726 -2.193 2.072 1.00 0.00 C ATOM 614 O PHE A 64 -9.213 -3.309 1.994 1.00 0.00 O ATOM 615 CB PHE A 64 -9.497 -0.793 0.024 1.00 0.00 C ATOM 616 CG PHE A 64 -8.786 0.336 -0.726 1.00 0.00 C ATOM 617 CD1 PHE A 64 -8.244 1.375 -0.034 1.00 0.00 C ATOM 618 CD2 PHE A 64 -8.696 0.301 -2.082 1.00 0.00 C ATOM 619 CE1 PHE A 64 -7.585 2.423 -0.730 1.00 0.00 C ATOM 620 CE2 PHE A 64 -8.038 1.349 -2.778 1.00 0.00 C ATOM 621 CZ PHE A 64 -7.495 2.387 -2.087 1.00 0.00 C ATOM 0 H PHE A 64 -7.257 -1.745 0.653 1.00 0.00 H new ATOM 0 HA PHE A 64 -9.268 -0.107 2.086 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -9.343 -1.727 -0.516 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -10.569 -0.597 0.023 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -8.315 1.403 1.043 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -9.125 -0.525 -2.630 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -7.155 3.249 -0.182 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -7.969 1.322 -3.855 1.00 0.00 H new ATOM 0 HZ PHE A 64 -6.992 3.183 -2.616 1.00 0.00 H new ATOM 630 N ASP A 65 -10.886 -1.940 2.659 1.00 0.00 N ATOM 631 CA ASP A 65 -11.661 -3.003 3.275 1.00 0.00 C ATOM 632 C ASP A 65 -12.176 -3.948 2.188 1.00 0.00 C ATOM 633 O ASP A 65 -13.381 -4.167 2.070 1.00 0.00 O ATOM 634 CB ASP A 65 -12.870 -2.440 4.024 1.00 0.00 C ATOM 635 CG ASP A 65 -13.433 -3.349 5.119 1.00 0.00 C ATOM 636 OD1 ASP A 65 -12.607 -3.948 5.840 1.00 0.00 O ATOM 637 OD2 ASP A 65 -14.678 -3.425 5.211 1.00 0.00 O ATOM 0 H ASP A 65 -11.308 -1.014 2.721 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.014 -3.528 3.978 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -12.589 -1.487 4.473 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -13.661 -2.232 3.303 1.00 0.00 H new ATOM 641 N GLY A 66 -11.237 -4.484 1.421 1.00 0.00 N ATOM 642 CA GLY A 66 -11.582 -5.400 0.347 1.00 0.00 C ATOM 643 C GLY A 66 -10.350 -5.753 -0.488 1.00 0.00 C ATOM 644 O GLY A 66 -10.165 -6.906 -0.873 1.00 0.00 O ATOM 0 H GLY A 66 -10.239 -4.301 1.522 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.016 -6.309 0.764 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.341 -4.948 -0.291 1.00 0.00 H new ATOM 648 N LEU A 67 -9.537 -4.737 -0.745 1.00 0.00 N ATOM 649 CA LEU A 67 -8.328 -4.925 -1.528 1.00 0.00 C ATOM 650 C LEU A 67 -7.408 -3.718 -1.335 1.00 0.00 C ATOM 651 O LEU A 67 -7.836 -2.575 -1.490 1.00 0.00 O ATOM 652 CB LEU A 67 -8.676 -5.205 -2.992 1.00 0.00 C ATOM 653 CG LEU A 67 -9.362 -6.544 -3.274 1.00 0.00 C ATOM 654 CD1 LEU A 67 -9.618 -6.723 -4.771 1.00 0.00 C ATOM 655 CD2 LEU A 67 -8.558 -7.705 -2.686 1.00 0.00 C ATOM 0 H LEU A 67 -9.693 -3.781 -0.424 1.00 0.00 H new ATOM 0 HA LEU A 67 -7.782 -5.802 -1.181 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -9.324 -4.405 -3.350 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -7.758 -5.159 -3.578 1.00 0.00 H new ATOM 0 HG LEU A 67 -10.333 -6.543 -2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -10.106 -7.682 -4.945 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -10.261 -5.919 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.670 -6.696 -5.308 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -9.067 -8.645 -2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -7.563 -7.721 -3.131 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.470 -7.577 -1.607 1.00 0.00 H new ATOM 666 N MET A 68 -6.160 -4.013 -0.998 1.00 0.00 N ATOM 667 CA MET A 68 -5.176 -2.966 -0.781 1.00 0.00 C ATOM 668 C MET A 68 -4.476 -2.593 -2.089 1.00 0.00 C ATOM 669 O MET A 68 -4.181 -3.461 -2.909 1.00 0.00 O ATOM 670 CB MET A 68 -4.138 -3.444 0.235 1.00 0.00 C ATOM 671 CG MET A 68 -3.071 -2.373 0.474 1.00 0.00 C ATOM 672 SD MET A 68 -1.472 -2.981 -0.038 1.00 0.00 S ATOM 673 CE MET A 68 -1.165 -1.908 -1.432 1.00 0.00 C ATOM 0 H MET A 68 -5.808 -4.962 -0.870 1.00 0.00 H new ATOM 0 HA MET A 68 -5.690 -2.083 -0.401 1.00 0.00 H new ATOM 0 HB2 MET A 68 -4.631 -3.688 1.176 1.00 0.00 H new ATOM 0 HB3 MET A 68 -3.666 -4.359 -0.124 1.00 0.00 H new ATOM 0 HG2 MET A 68 -3.320 -1.469 -0.081 1.00 0.00 H new ATOM 0 HG3 MET A 68 -3.046 -2.102 1.529 1.00 0.00 H new ATOM 0 HE1 MET A 68 -0.145 -2.054 -1.786 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.865 -2.144 -2.234 1.00 0.00 H new ATOM 0 HE3 MET A 68 -1.298 -0.870 -1.128 1.00 0.00 H new ATOM 681 N ILE A 69 -4.233 -1.300 -2.245 1.00 0.00 N ATOM 682 CA ILE A 69 -3.573 -0.801 -3.439 1.00 0.00 C ATOM 683 C ILE A 69 -2.429 0.130 -3.033 1.00 0.00 C ATOM 684 O ILE A 69 -2.427 0.673 -1.931 1.00 0.00 O ATOM 685 CB ILE A 69 -4.590 -0.152 -4.381 1.00 0.00 C ATOM 686 CG1 ILE A 69 -4.336 1.351 -4.510 1.00 0.00 C ATOM 687 CG2 ILE A 69 -6.022 -0.456 -3.936 1.00 0.00 C ATOM 688 CD1 ILE A 69 -4.370 2.032 -3.140 1.00 0.00 C ATOM 0 H ILE A 69 -4.482 -0.583 -1.564 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.131 -1.623 -4.002 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.463 -0.586 -5.373 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.368 1.521 -4.981 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.089 1.796 -5.160 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.724 0.017 -4.622 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.183 -1.534 -3.938 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -6.181 -0.068 -2.930 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.187 3.100 -3.260 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.348 1.881 -2.683 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -3.600 1.601 -2.500 1.00 0.00 H new ATOM 699 N CYS A 70 -1.483 0.286 -3.948 1.00 0.00 N ATOM 700 CA CYS A 70 -0.336 1.142 -3.700 1.00 0.00 C ATOM 701 C CYS A 70 -0.205 2.121 -4.868 1.00 0.00 C ATOM 702 O CYS A 70 -0.199 1.712 -6.028 1.00 0.00 O ATOM 703 CB CYS A 70 0.943 0.328 -3.492 1.00 0.00 C ATOM 704 SG CYS A 70 1.266 -0.715 -4.961 1.00 0.00 S ATOM 0 H CYS A 70 -1.488 -0.166 -4.862 1.00 0.00 H new ATOM 0 HA CYS A 70 -0.489 1.699 -2.776 1.00 0.00 H new ATOM 0 HB2 CYS A 70 1.786 0.997 -3.318 1.00 0.00 H new ATOM 0 HB3 CYS A 70 0.845 -0.298 -2.605 1.00 0.00 H new ATOM 0 HG CYS A 70 2.164 -0.145 -5.709 1.00 0.00 H new ATOM 709 N CYS A 71 -0.104 3.396 -4.521 1.00 0.00 N ATOM 710 CA CYS A 71 0.027 4.438 -5.526 1.00 0.00 C ATOM 711 C CYS A 71 1.516 4.656 -5.802 1.00 0.00 C ATOM 712 O CYS A 71 2.292 4.902 -4.880 1.00 0.00 O ATOM 713 CB CYS A 71 -0.670 5.730 -5.095 1.00 0.00 C ATOM 714 SG CYS A 71 -2.167 5.338 -4.121 1.00 0.00 S ATOM 0 H CYS A 71 -0.110 3.731 -3.558 1.00 0.00 H new ATOM 0 HA CYS A 71 -0.469 4.125 -6.445 1.00 0.00 H new ATOM 0 HB2 CYS A 71 0.011 6.340 -4.501 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -0.941 6.317 -5.973 1.00 0.00 H new ATOM 0 HG CYS A 71 -1.820 4.798 -2.990 1.00 0.00 H new ATOM 719 N LYS A 72 1.870 4.556 -7.075 1.00 0.00 N ATOM 720 CA LYS A 72 3.253 4.740 -7.483 1.00 0.00 C ATOM 721 C LYS A 72 3.624 6.219 -7.359 1.00 0.00 C ATOM 722 O LYS A 72 3.236 7.032 -8.197 1.00 0.00 O ATOM 723 CB LYS A 72 3.480 4.164 -8.883 1.00 0.00 C ATOM 724 CG LYS A 72 4.902 3.620 -9.027 1.00 0.00 C ATOM 725 CD LYS A 72 5.082 2.907 -10.369 1.00 0.00 C ATOM 726 CE LYS A 72 6.565 2.727 -10.700 1.00 0.00 C ATOM 727 NZ LYS A 72 6.905 1.289 -10.790 1.00 0.00 N ATOM 0 H LYS A 72 1.224 4.350 -7.837 1.00 0.00 H new ATOM 0 HA LYS A 72 3.922 4.187 -6.824 1.00 0.00 H new ATOM 0 HB2 LYS A 72 2.761 3.367 -9.074 1.00 0.00 H new ATOM 0 HB3 LYS A 72 3.305 4.937 -9.631 1.00 0.00 H new ATOM 0 HG2 LYS A 72 5.618 4.438 -8.946 1.00 0.00 H new ATOM 0 HG3 LYS A 72 5.115 2.928 -8.212 1.00 0.00 H new ATOM 0 HD2 LYS A 72 4.592 1.934 -10.336 1.00 0.00 H new ATOM 0 HD3 LYS A 72 4.597 3.482 -11.158 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.796 3.221 -11.644 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.175 3.204 -9.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 7.915 1.184 -11.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 6.704 0.827 -9.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 6.336 0.844 -11.538 1.00 0.00 H new ATOM 737 N SER A 73 4.372 6.522 -6.309 1.00 0.00 N ATOM 738 CA SER A 73 4.800 7.890 -6.065 1.00 0.00 C ATOM 739 C SER A 73 6.307 8.016 -6.299 1.00 0.00 C ATOM 740 O SER A 73 7.105 7.524 -5.502 1.00 0.00 O ATOM 741 CB SER A 73 4.444 8.333 -4.645 1.00 0.00 C ATOM 742 OG SER A 73 3.038 8.472 -4.465 1.00 0.00 O ATOM 0 H SER A 73 4.693 5.845 -5.617 1.00 0.00 H new ATOM 0 HA SER A 73 4.275 8.543 -6.762 1.00 0.00 H new ATOM 0 HB2 SER A 73 4.831 7.606 -3.931 1.00 0.00 H new ATOM 0 HB3 SER A 73 4.933 9.283 -4.429 1.00 0.00 H new ATOM 0 HG SER A 73 2.702 9.183 -5.049 1.00 0.00 H new ATOM 747 N ASN A 74 6.650 8.677 -7.394 1.00 0.00 N ATOM 748 CA ASN A 74 8.047 8.874 -7.743 1.00 0.00 C ATOM 749 C ASN A 74 8.331 10.372 -7.869 1.00 0.00 C ATOM 750 O ASN A 74 7.662 11.189 -7.239 1.00 0.00 O ATOM 751 CB ASN A 74 8.379 8.214 -9.083 1.00 0.00 C ATOM 752 CG ASN A 74 7.505 6.980 -9.318 1.00 0.00 C ATOM 753 OD1 ASN A 74 6.397 7.060 -9.823 1.00 0.00 O ATOM 754 ND2 ASN A 74 8.064 5.839 -8.926 1.00 0.00 N ATOM 0 H ASN A 74 5.985 9.083 -8.052 1.00 0.00 H new ATOM 0 HA ASN A 74 8.657 8.424 -6.959 1.00 0.00 H new ATOM 0 HB2 ASN A 74 8.229 8.929 -9.892 1.00 0.00 H new ATOM 0 HB3 ASN A 74 9.431 7.928 -9.101 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.561 4.959 -9.041 1.00 0.00 H new ATOM 0 HD22 ASN A 74 8.996 5.844 -8.510 1.00 0.00 H new ATOM 899 N ALA A 86 -3.777 11.996 -11.445 1.00 0.00 N ATOM 900 CA ALA A 86 -3.290 10.730 -10.923 1.00 0.00 C ATOM 901 C ALA A 86 -1.763 10.701 -11.008 1.00 0.00 C ATOM 902 O ALA A 86 -1.185 9.752 -11.537 1.00 0.00 O ATOM 903 CB ALA A 86 -3.939 9.578 -11.693 1.00 0.00 C ATOM 0 HA ALA A 86 -3.563 10.617 -9.874 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.574 8.628 -11.302 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.022 9.627 -11.576 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.684 9.657 -12.750 1.00 0.00 H new ATOM 909 N GLU A 87 -1.153 11.751 -10.479 1.00 0.00 N ATOM 910 CA GLU A 87 0.295 11.859 -10.488 1.00 0.00 C ATOM 911 C GLU A 87 0.931 10.476 -10.330 1.00 0.00 C ATOM 912 O GLU A 87 1.812 10.101 -11.103 1.00 0.00 O ATOM 913 CB GLU A 87 0.782 12.814 -9.396 1.00 0.00 C ATOM 914 CG GLU A 87 0.046 14.153 -9.473 1.00 0.00 C ATOM 915 CD GLU A 87 0.815 15.245 -8.724 1.00 0.00 C ATOM 916 OE1 GLU A 87 1.694 15.860 -9.365 1.00 0.00 O ATOM 917 OE2 GLU A 87 0.506 15.437 -7.529 1.00 0.00 O ATOM 0 H GLU A 87 -1.636 12.535 -10.041 1.00 0.00 H new ATOM 0 HA GLU A 87 0.602 12.272 -11.449 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.624 12.363 -8.416 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.854 12.977 -9.502 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.081 14.443 -10.516 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.952 14.049 -9.047 1.00 0.00 H new ATOM 922 N TYR A 88 0.460 9.755 -9.323 1.00 0.00 N ATOM 923 CA TYR A 88 0.970 8.422 -9.053 1.00 0.00 C ATOM 924 C TYR A 88 0.189 7.366 -9.838 1.00 0.00 C ATOM 925 O TYR A 88 -0.703 7.700 -10.616 1.00 0.00 O ATOM 926 CB TYR A 88 0.762 8.185 -7.556 1.00 0.00 C ATOM 927 CG TYR A 88 1.391 9.255 -6.663 1.00 0.00 C ATOM 928 CD1 TYR A 88 2.474 9.983 -7.117 1.00 0.00 C ATOM 929 CD2 TYR A 88 0.878 9.494 -5.405 1.00 0.00 C ATOM 930 CE1 TYR A 88 3.068 10.990 -6.276 1.00 0.00 C ATOM 931 CE2 TYR A 88 1.471 10.502 -4.564 1.00 0.00 C ATOM 932 CZ TYR A 88 2.536 11.200 -5.042 1.00 0.00 C ATOM 933 OH TYR A 88 3.097 12.151 -4.248 1.00 0.00 O ATOM 0 H TYR A 88 -0.270 10.069 -8.684 1.00 0.00 H new ATOM 0 HA TYR A 88 2.017 8.346 -9.346 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.308 8.138 -7.351 1.00 0.00 H new ATOM 0 HB3 TYR A 88 1.180 7.214 -7.291 1.00 0.00 H new ATOM 0 HD1 TYR A 88 2.875 9.797 -8.102 1.00 0.00 H new ATOM 0 HD2 TYR A 88 0.031 8.925 -5.050 1.00 0.00 H new ATOM 0 HE1 TYR A 88 3.916 11.565 -6.617 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.079 10.699 -3.577 1.00 0.00 H new ATOM 0 HH TYR A 88 2.614 12.193 -3.396 1.00 0.00 H new ATOM 942 N ARG A 89 0.553 6.112 -9.606 1.00 0.00 N ATOM 943 CA ARG A 89 -0.104 5.006 -10.281 1.00 0.00 C ATOM 944 C ARG A 89 -0.494 3.925 -9.272 1.00 0.00 C ATOM 945 O ARG A 89 0.370 3.249 -8.715 1.00 0.00 O ATOM 946 CB ARG A 89 0.808 4.394 -11.347 1.00 0.00 C ATOM 947 CG ARG A 89 1.188 5.431 -12.406 1.00 0.00 C ATOM 948 CD ARG A 89 0.969 4.880 -13.817 1.00 0.00 C ATOM 949 NE ARG A 89 2.119 5.229 -14.681 1.00 0.00 N ATOM 950 CZ ARG A 89 2.142 5.052 -16.008 1.00 0.00 C ATOM 951 NH1 ARG A 89 1.078 4.529 -16.633 1.00 0.00 N ATOM 952 NH2 ARG A 89 3.229 5.397 -16.712 1.00 0.00 N ATOM 0 H ARG A 89 1.294 5.839 -8.960 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.000 5.396 -10.764 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.710 4.002 -10.877 1.00 0.00 H new ATOM 0 HB3 ARG A 89 0.304 3.552 -11.822 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.592 6.333 -12.267 1.00 0.00 H new ATOM 0 HG3 ARG A 89 2.232 5.717 -12.282 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.848 3.797 -13.779 1.00 0.00 H new ATOM 0 HD3 ARG A 89 0.050 5.289 -14.238 1.00 0.00 H new ATOM 0 HE ARG A 89 2.946 5.629 -14.238 1.00 0.00 H new ATOM 0 HH11 ARG A 89 0.251 4.266 -16.098 1.00 0.00 H new ATOM 0 HH12 ARG A 89 1.096 4.394 -17.644 1.00 0.00 H new ATOM 0 HH21 ARG A 89 4.039 5.795 -16.237 1.00 0.00 H new ATOM 0 HH22 ARG A 89 3.246 5.262 -17.723 1.00 0.00 H new ATOM 963 N LEU A 90 -1.796 3.795 -9.067 1.00 0.00 N ATOM 964 CA LEU A 90 -2.313 2.807 -8.135 1.00 0.00 C ATOM 965 C LEU A 90 -2.020 1.405 -8.671 1.00 0.00 C ATOM 966 O LEU A 90 -1.981 1.194 -9.883 1.00 0.00 O ATOM 967 CB LEU A 90 -3.795 3.060 -7.852 1.00 0.00 C ATOM 968 CG LEU A 90 -4.777 2.074 -8.487 1.00 0.00 C ATOM 969 CD1 LEU A 90 -4.466 1.869 -9.971 1.00 0.00 C ATOM 970 CD2 LEU A 90 -4.801 0.752 -7.718 1.00 0.00 C ATOM 0 H LEU A 90 -2.509 4.358 -9.531 1.00 0.00 H new ATOM 0 HA LEU A 90 -1.810 2.892 -7.172 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.946 3.048 -6.773 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.044 4.063 -8.197 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.778 2.501 -8.424 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.179 1.164 -10.398 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -4.542 2.823 -10.494 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.456 1.475 -10.080 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.507 0.069 -8.190 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.806 0.308 -7.727 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.107 0.936 -6.688 1.00 0.00 H new ATOM 981 N LYS A 91 -1.822 0.480 -7.743 1.00 0.00 N ATOM 982 CA LYS A 91 -1.534 -0.897 -8.107 1.00 0.00 C ATOM 983 C LYS A 91 -2.334 -1.836 -7.202 1.00 0.00 C ATOM 984 O LYS A 91 -2.266 -1.734 -5.979 1.00 0.00 O ATOM 985 CB LYS A 91 -0.026 -1.154 -8.080 1.00 0.00 C ATOM 986 CG LYS A 91 0.433 -1.856 -9.360 1.00 0.00 C ATOM 987 CD LYS A 91 1.587 -2.819 -9.072 1.00 0.00 C ATOM 988 CE LYS A 91 1.686 -3.895 -10.157 1.00 0.00 C ATOM 989 NZ LYS A 91 2.465 -3.396 -11.312 1.00 0.00 N ATOM 0 H LYS A 91 -1.855 0.657 -6.739 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.849 -1.095 -9.132 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.506 -0.209 -7.968 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.227 -1.766 -7.214 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.402 -2.403 -9.798 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.748 -1.114 -10.093 1.00 0.00 H new ATOM 0 HD2 LYS A 91 2.524 -2.264 -9.018 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.439 -3.290 -8.100 1.00 0.00 H new ATOM 0 HE2 LYS A 91 2.160 -4.788 -9.750 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.687 -4.185 -10.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 2.523 -4.138 -12.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.997 -2.557 -11.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 3.424 -3.142 -11.000 1.00 0.00 H new ATOM 999 N GLU A 92 -3.074 -2.731 -7.841 1.00 0.00 N ATOM 1000 CA GLU A 92 -3.886 -3.689 -7.109 1.00 0.00 C ATOM 1001 C GLU A 92 -3.004 -4.561 -6.214 1.00 0.00 C ATOM 1002 O GLU A 92 -2.025 -5.143 -6.680 1.00 0.00 O ATOM 1003 CB GLU A 92 -4.716 -4.548 -8.066 1.00 0.00 C ATOM 1004 CG GLU A 92 -6.214 -4.332 -7.839 1.00 0.00 C ATOM 1005 CD GLU A 92 -6.649 -4.888 -6.482 1.00 0.00 C ATOM 1006 OE1 GLU A 92 -6.175 -5.995 -6.145 1.00 0.00 O ATOM 1007 OE2 GLU A 92 -7.445 -4.194 -5.813 1.00 0.00 O ATOM 0 H GLU A 92 -3.128 -2.813 -8.856 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.579 -3.137 -6.474 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -4.461 -4.300 -9.096 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -4.471 -5.600 -7.921 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -6.443 -3.268 -7.890 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.780 -4.819 -8.634 1.00 0.00 H new ATOM 1012 N LYS A 93 -3.380 -4.623 -4.946 1.00 0.00 N ATOM 1013 CA LYS A 93 -2.634 -5.414 -3.982 1.00 0.00 C ATOM 1014 C LYS A 93 -3.614 -6.157 -3.072 1.00 0.00 C ATOM 1015 O LYS A 93 -3.988 -5.655 -2.014 1.00 0.00 O ATOM 1016 CB LYS A 93 -1.638 -4.534 -3.224 1.00 0.00 C ATOM 1017 CG LYS A 93 -0.196 -4.917 -3.567 1.00 0.00 C ATOM 1018 CD LYS A 93 0.313 -4.117 -4.767 1.00 0.00 C ATOM 1019 CE LYS A 93 1.823 -4.289 -4.940 1.00 0.00 C ATOM 1020 NZ LYS A 93 2.121 -5.519 -5.707 1.00 0.00 N ATOM 0 H LYS A 93 -4.192 -4.138 -4.563 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.035 -6.169 -4.491 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.809 -3.487 -3.474 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.800 -4.637 -2.151 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.447 -4.736 -2.706 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.142 -5.983 -3.787 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -0.200 -4.445 -5.671 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.077 -3.062 -4.632 1.00 0.00 H new ATOM 0 HE2 LYS A 93 2.237 -3.423 -5.456 1.00 0.00 H new ATOM 0 HE3 LYS A 93 2.304 -4.337 -3.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.150 -5.620 -5.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.743 -6.345 -5.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 1.679 -5.458 -6.646 1.00 0.00 H new ATOM 1030 N PHE A 94 -4.000 -7.344 -3.518 1.00 0.00 N ATOM 1031 CA PHE A 94 -4.929 -8.163 -2.756 1.00 0.00 C ATOM 1032 C PHE A 94 -4.374 -8.472 -1.365 1.00 0.00 C ATOM 1033 O PHE A 94 -3.678 -9.469 -1.178 1.00 0.00 O ATOM 1034 CB PHE A 94 -5.105 -9.473 -3.526 1.00 0.00 C ATOM 1035 CG PHE A 94 -5.554 -9.288 -4.977 1.00 0.00 C ATOM 1036 CD1 PHE A 94 -4.628 -9.113 -5.958 1.00 0.00 C ATOM 1037 CD2 PHE A 94 -6.879 -9.297 -5.285 1.00 0.00 C ATOM 1038 CE1 PHE A 94 -5.045 -8.941 -7.305 1.00 0.00 C ATOM 1039 CE2 PHE A 94 -7.295 -9.125 -6.631 1.00 0.00 C ATOM 1040 CZ PHE A 94 -6.370 -8.950 -7.613 1.00 0.00 C ATOM 0 H PHE A 94 -3.687 -7.758 -4.396 1.00 0.00 H new ATOM 0 HA PHE A 94 -5.874 -7.635 -2.630 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -4.161 -10.018 -3.515 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -5.836 -10.092 -3.007 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -3.576 -9.105 -5.713 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -7.614 -9.435 -4.506 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -4.310 -8.803 -8.084 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -8.347 -9.133 -6.876 1.00 0.00 H new ATOM 0 HZ PHE A 94 -6.687 -8.818 -8.637 1.00 0.00 H new ATOM 1049 N PHE A 95 -4.703 -7.600 -0.424 1.00 0.00 N ATOM 1050 CA PHE A 95 -4.246 -7.768 0.945 1.00 0.00 C ATOM 1051 C PHE A 95 -5.376 -8.277 1.842 1.00 0.00 C ATOM 1052 O PHE A 95 -5.203 -9.252 2.572 1.00 0.00 O ATOM 1053 CB PHE A 95 -3.798 -6.391 1.440 1.00 0.00 C ATOM 1054 CG PHE A 95 -2.370 -6.019 1.039 1.00 0.00 C ATOM 1055 CD1 PHE A 95 -1.911 -6.327 -0.204 1.00 0.00 C ATOM 1056 CD2 PHE A 95 -1.559 -5.382 1.924 1.00 0.00 C ATOM 1057 CE1 PHE A 95 -0.585 -5.982 -0.576 1.00 0.00 C ATOM 1058 CE2 PHE A 95 -0.233 -5.037 1.552 1.00 0.00 C ATOM 1059 CZ PHE A 95 0.226 -5.344 0.310 1.00 0.00 C ATOM 0 H PHE A 95 -5.281 -6.775 -0.582 1.00 0.00 H new ATOM 0 HA PHE A 95 -3.435 -8.496 0.980 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -4.482 -5.637 1.051 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -3.878 -6.363 2.527 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.555 -6.834 -0.908 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.923 -5.138 2.911 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -0.220 -6.226 -1.563 1.00 0.00 H new ATOM 0 HE2 PHE A 95 0.411 -4.531 2.256 1.00 0.00 H new ATOM 0 HZ PHE A 95 1.235 -5.081 0.027 1.00 0.00 H new ATOM 1068 N MET A 96 -6.509 -7.594 1.758 1.00 0.00 N ATOM 1069 CA MET A 96 -7.667 -7.965 2.553 1.00 0.00 C ATOM 1070 C MET A 96 -7.867 -9.481 2.557 1.00 0.00 C ATOM 1071 O MET A 96 -8.512 -10.023 3.453 1.00 0.00 O ATOM 1072 CB MET A 96 -8.915 -7.287 1.983 1.00 0.00 C ATOM 1073 CG MET A 96 -10.113 -7.470 2.917 1.00 0.00 C ATOM 1074 SD MET A 96 -11.263 -8.637 2.212 1.00 0.00 S ATOM 1075 CE MET A 96 -12.782 -8.064 2.956 1.00 0.00 C ATOM 0 H MET A 96 -6.649 -6.786 1.151 1.00 0.00 H new ATOM 0 HA MET A 96 -7.500 -7.637 3.579 1.00 0.00 H new ATOM 0 HB2 MET A 96 -8.722 -6.224 1.838 1.00 0.00 H new ATOM 0 HB3 MET A 96 -9.146 -7.706 1.003 1.00 0.00 H new ATOM 0 HG2 MET A 96 -9.775 -7.823 3.891 1.00 0.00 H new ATOM 0 HG3 MET A 96 -10.608 -6.512 3.080 1.00 0.00 H new ATOM 0 HE1 MET A 96 -13.629 -8.554 2.477 1.00 0.00 H new ATOM 0 HE2 MET A 96 -12.779 -8.303 4.020 1.00 0.00 H new ATOM 0 HE3 MET A 96 -12.866 -6.985 2.827 1.00 0.00 H new ATOM 1083 N ARG A 97 -7.302 -10.123 1.546 1.00 0.00 N ATOM 1084 CA ARG A 97 -7.410 -11.566 1.421 1.00 0.00 C ATOM 1085 C ARG A 97 -6.363 -12.255 2.300 1.00 0.00 C ATOM 1086 O ARG A 97 -6.697 -13.128 3.100 1.00 0.00 O ATOM 1087 CB ARG A 97 -7.218 -12.011 -0.030 1.00 0.00 C ATOM 1088 CG ARG A 97 -8.166 -13.159 -0.383 1.00 0.00 C ATOM 1089 CD ARG A 97 -9.161 -12.734 -1.464 1.00 0.00 C ATOM 1090 NE ARG A 97 -10.501 -13.290 -1.165 1.00 0.00 N ATOM 1091 CZ ARG A 97 -11.318 -12.809 -0.217 1.00 0.00 C ATOM 1092 NH1 ARG A 97 -10.938 -11.764 0.529 1.00 0.00 N ATOM 1093 NH2 ARG A 97 -12.515 -13.377 -0.015 1.00 0.00 N ATOM 0 H ARG A 97 -6.767 -9.670 0.805 1.00 0.00 H new ATOM 0 HA ARG A 97 -8.410 -11.852 1.747 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.396 -11.169 -0.699 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.186 -12.327 -0.183 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.591 -14.017 -0.730 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.706 -13.477 0.509 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -9.213 -11.646 -1.515 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -8.822 -13.083 -2.439 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.822 -14.088 -1.714 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -10.026 -11.333 0.376 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -11.560 -11.399 1.250 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -12.803 -14.174 -0.582 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -13.138 -13.012 0.706 1.00 0.00 H new ATOM 1104 N LYS A 98 -5.119 -11.837 2.121 1.00 0.00 N ATOM 1105 CA LYS A 98 -4.022 -12.402 2.889 1.00 0.00 C ATOM 1106 C LYS A 98 -2.739 -11.628 2.581 1.00 0.00 C ATOM 1107 O LYS A 98 -2.559 -11.136 1.467 1.00 0.00 O ATOM 1108 CB LYS A 98 -3.909 -13.905 2.634 1.00 0.00 C ATOM 1109 CG LYS A 98 -2.851 -14.538 3.541 1.00 0.00 C ATOM 1110 CD LYS A 98 -3.360 -15.846 4.149 1.00 0.00 C ATOM 1111 CE LYS A 98 -2.205 -16.811 4.420 1.00 0.00 C ATOM 1112 NZ LYS A 98 -1.531 -16.469 5.693 1.00 0.00 N ATOM 0 H LYS A 98 -4.846 -11.114 1.456 1.00 0.00 H new ATOM 0 HA LYS A 98 -4.210 -12.297 3.957 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -4.874 -14.381 2.809 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -3.651 -14.082 1.590 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -1.943 -14.728 2.969 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -2.586 -13.842 4.337 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -3.890 -15.637 5.078 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -4.076 -16.311 3.472 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -2.580 -17.833 4.464 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -1.488 -16.769 3.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.749 -17.134 5.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.156 -15.501 5.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -2.214 -16.532 6.475 1.00 0.00 H new ATOM 1122 N VAL A 99 -1.879 -11.545 3.586 1.00 0.00 N ATOM 1123 CA VAL A 99 -0.618 -10.840 3.436 1.00 0.00 C ATOM 1124 C VAL A 99 0.397 -11.401 4.434 1.00 0.00 C ATOM 1125 O VAL A 99 0.095 -12.339 5.170 1.00 0.00 O ATOM 1126 CB VAL A 99 -0.838 -9.334 3.591 1.00 0.00 C ATOM 1127 CG1 VAL A 99 -1.950 -8.844 2.661 1.00 0.00 C ATOM 1128 CG2 VAL A 99 -1.142 -8.972 5.047 1.00 0.00 C ATOM 0 H VAL A 99 -2.031 -11.955 4.508 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.211 -10.994 2.437 1.00 0.00 H new ATOM 0 HB VAL A 99 0.085 -8.829 3.305 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.086 -7.770 2.791 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.677 -9.053 1.626 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -2.880 -9.360 2.902 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.294 -7.896 5.130 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.044 -9.492 5.371 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.305 -9.270 5.678 1.00 0.00 H new ATOM 1138 N GLN A 100 1.580 -10.805 4.426 1.00 0.00 N ATOM 1139 CA GLN A 100 2.641 -11.234 5.321 1.00 0.00 C ATOM 1140 C GLN A 100 3.754 -10.184 5.367 1.00 0.00 C ATOM 1141 O GLN A 100 4.561 -10.090 4.442 1.00 0.00 O ATOM 1142 CB GLN A 100 3.192 -12.599 4.904 1.00 0.00 C ATOM 1143 CG GLN A 100 2.554 -13.721 5.725 1.00 0.00 C ATOM 1144 CD GLN A 100 3.605 -14.742 6.167 1.00 0.00 C ATOM 1145 OE1 GLN A 100 4.542 -14.434 6.884 1.00 0.00 O ATOM 1146 NE2 GLN A 100 3.396 -15.970 5.701 1.00 0.00 N ATOM 0 H GLN A 100 1.827 -10.028 3.813 1.00 0.00 H new ATOM 0 HA GLN A 100 2.224 -11.338 6.323 1.00 0.00 H new ATOM 0 HB2 GLN A 100 3.000 -12.765 3.844 1.00 0.00 H new ATOM 0 HB3 GLN A 100 4.274 -12.615 5.038 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.060 -13.300 6.601 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.785 -14.218 5.133 1.00 0.00 H new ATOM 0 HE21 GLN A 100 2.590 -16.159 5.105 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.041 -16.723 5.940 1.00 0.00 H new ATOM 1153 N ILE A 101 3.760 -9.422 6.450 1.00 0.00 N ATOM 1154 CA ILE A 101 4.761 -8.384 6.628 1.00 0.00 C ATOM 1155 C ILE A 101 5.974 -8.969 7.353 1.00 0.00 C ATOM 1156 O ILE A 101 5.918 -9.233 8.552 1.00 0.00 O ATOM 1157 CB ILE A 101 4.151 -7.168 7.331 1.00 0.00 C ATOM 1158 CG1 ILE A 101 5.238 -6.314 7.988 1.00 0.00 C ATOM 1159 CG2 ILE A 101 3.075 -7.596 8.330 1.00 0.00 C ATOM 1160 CD1 ILE A 101 5.969 -5.462 6.949 1.00 0.00 C ATOM 0 H ILE A 101 3.088 -9.502 7.213 1.00 0.00 H new ATOM 0 HA ILE A 101 5.112 -8.023 5.661 1.00 0.00 H new ATOM 0 HB ILE A 101 3.663 -6.547 6.580 1.00 0.00 H new ATOM 0 HG12 ILE A 101 4.791 -5.668 8.744 1.00 0.00 H new ATOM 0 HG13 ILE A 101 5.951 -6.959 8.502 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.658 -6.714 8.816 1.00 0.00 H new ATOM 0 HG22 ILE A 101 2.283 -8.130 7.805 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.516 -8.250 9.082 1.00 0.00 H new ATOM 0 HD11 ILE A 101 6.736 -4.865 7.442 1.00 0.00 H new ATOM 0 HD12 ILE A 101 6.435 -6.112 6.209 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.257 -4.801 6.454 1.00 0.00 H new ATOM 1171 N ASN A 102 7.044 -9.154 6.593 1.00 0.00 N ATOM 1172 CA ASN A 102 8.269 -9.703 7.148 1.00 0.00 C ATOM 1173 C ASN A 102 9.265 -8.569 7.396 1.00 0.00 C ATOM 1174 O ASN A 102 10.082 -8.253 6.532 1.00 0.00 O ATOM 1175 CB ASN A 102 8.916 -10.696 6.179 1.00 0.00 C ATOM 1176 CG ASN A 102 9.498 -11.895 6.931 1.00 0.00 C ATOM 1177 OD1 ASN A 102 10.701 -12.067 7.041 1.00 0.00 O ATOM 1178 ND2 ASN A 102 8.581 -12.712 7.440 1.00 0.00 N ATOM 0 H ASN A 102 7.088 -8.933 5.598 1.00 0.00 H new ATOM 0 HA ASN A 102 8.018 -10.216 8.077 1.00 0.00 H new ATOM 0 HB2 ASN A 102 8.176 -11.040 5.457 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.705 -10.198 5.615 1.00 0.00 H new ATOM 0 HD21 ASN A 102 8.869 -13.541 7.959 1.00 0.00 H new ATOM 0 HD22 ASN A 102 7.590 -12.509 7.311 1.00 0.00 H new ATOM 1184 N ASP A 103 9.166 -7.986 8.582 1.00 0.00 N ATOM 1185 CA ASP A 103 10.046 -6.892 8.955 1.00 0.00 C ATOM 1186 C ASP A 103 11.467 -7.430 9.143 1.00 0.00 C ATOM 1187 O ASP A 103 11.810 -7.927 10.215 1.00 0.00 O ATOM 1188 CB ASP A 103 9.605 -6.254 10.273 1.00 0.00 C ATOM 1189 CG ASP A 103 9.587 -7.200 11.476 1.00 0.00 C ATOM 1190 OD1 ASP A 103 8.881 -8.227 11.380 1.00 0.00 O ATOM 1191 OD2 ASP A 103 10.279 -6.874 12.464 1.00 0.00 O ATOM 0 H ASP A 103 8.489 -8.251 9.297 1.00 0.00 H new ATOM 0 HA ASP A 103 10.009 -6.144 8.163 1.00 0.00 H new ATOM 0 HB2 ASP A 103 10.270 -5.420 10.496 1.00 0.00 H new ATOM 0 HB3 ASP A 103 8.606 -5.839 10.142 1.00 0.00 H new ATOM 1195 N LYS A 104 12.254 -7.311 8.084 1.00 0.00 N ATOM 1196 CA LYS A 104 13.630 -7.780 8.119 1.00 0.00 C ATOM 1197 C LYS A 104 14.560 -6.647 7.679 1.00 0.00 C ATOM 1198 O LYS A 104 14.997 -6.609 6.529 1.00 0.00 O ATOM 1199 CB LYS A 104 13.782 -9.057 7.291 1.00 0.00 C ATOM 1200 CG LYS A 104 13.608 -10.301 8.166 1.00 0.00 C ATOM 1201 CD LYS A 104 14.858 -11.183 8.118 1.00 0.00 C ATOM 1202 CE LYS A 104 15.620 -11.125 9.443 1.00 0.00 C ATOM 1203 NZ LYS A 104 15.949 -12.489 9.912 1.00 0.00 N ATOM 0 H LYS A 104 11.966 -6.897 7.197 1.00 0.00 H new ATOM 0 HA LYS A 104 13.915 -8.052 9.135 1.00 0.00 H new ATOM 0 HB2 LYS A 104 13.043 -9.065 6.490 1.00 0.00 H new ATOM 0 HB3 LYS A 104 14.764 -9.074 6.819 1.00 0.00 H new ATOM 0 HG2 LYS A 104 13.409 -10.002 9.195 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.743 -10.871 7.827 1.00 0.00 H new ATOM 0 HD2 LYS A 104 14.573 -12.213 7.903 1.00 0.00 H new ATOM 0 HD3 LYS A 104 15.507 -10.856 7.306 1.00 0.00 H new ATOM 0 HE2 LYS A 104 16.535 -10.547 9.318 1.00 0.00 H new ATOM 0 HE3 LYS A 104 15.018 -10.611 10.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 16.466 -12.431 10.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 15.071 -13.029 10.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 16.541 -12.967 9.203 1.00 0.00 H new ATOM 1213 N ASP A 105 14.837 -5.753 8.617 1.00 0.00 N ATOM 1214 CA ASP A 105 15.708 -4.623 8.341 1.00 0.00 C ATOM 1215 C ASP A 105 16.271 -4.085 9.657 1.00 0.00 C ATOM 1216 O ASP A 105 16.480 -4.843 10.603 1.00 0.00 O ATOM 1217 CB ASP A 105 14.939 -3.490 7.656 1.00 0.00 C ATOM 1218 CG ASP A 105 15.774 -2.617 6.718 1.00 0.00 C ATOM 1219 OD1 ASP A 105 16.155 -3.138 5.648 1.00 0.00 O ATOM 1220 OD2 ASP A 105 16.012 -1.448 7.092 1.00 0.00 O ATOM 0 H ASP A 105 14.473 -5.788 9.569 1.00 0.00 H new ATOM 0 HA ASP A 105 16.507 -4.965 7.684 1.00 0.00 H new ATOM 0 HB2 ASP A 105 14.115 -3.922 7.088 1.00 0.00 H new ATOM 0 HB3 ASP A 105 14.498 -2.854 8.424 1.00 0.00 H new ATOM 1224 N ASP A 106 16.502 -2.780 9.675 1.00 0.00 N ATOM 1225 CA ASP A 106 17.038 -2.133 10.860 1.00 0.00 C ATOM 1226 C ASP A 106 17.026 -0.617 10.656 1.00 0.00 C ATOM 1227 O ASP A 106 16.257 -0.102 9.845 1.00 0.00 O ATOM 1228 CB ASP A 106 18.483 -2.563 11.119 1.00 0.00 C ATOM 1229 CG ASP A 106 18.806 -2.906 12.573 1.00 0.00 C ATOM 1230 OD1 ASP A 106 18.193 -2.267 13.457 1.00 0.00 O ATOM 1231 OD2 ASP A 106 19.659 -3.797 12.771 1.00 0.00 O ATOM 0 H ASP A 106 16.328 -2.154 8.889 1.00 0.00 H new ATOM 0 HA ASP A 106 16.419 -2.421 11.710 1.00 0.00 H new ATOM 0 HB2 ASP A 106 18.704 -3.432 10.499 1.00 0.00 H new ATOM 0 HB3 ASP A 106 19.148 -1.763 10.794 1.00 0.00 H new ATOM 1235 N THR A 107 17.886 0.056 11.406 1.00 0.00 N ATOM 1236 CA THR A 107 17.984 1.503 11.318 1.00 0.00 C ATOM 1237 C THR A 107 19.341 1.978 11.840 1.00 0.00 C ATOM 1238 O THR A 107 20.110 2.600 11.108 1.00 0.00 O ATOM 1239 CB THR A 107 16.797 2.105 12.074 1.00 0.00 C ATOM 1240 OG1 THR A 107 16.773 1.389 13.306 1.00 0.00 O ATOM 1241 CG2 THR A 107 15.455 1.768 11.422 1.00 0.00 C ATOM 0 H THR A 107 18.522 -0.374 12.078 1.00 0.00 H new ATOM 0 HA THR A 107 17.933 1.840 10.283 1.00 0.00 H new ATOM 0 HB THR A 107 16.912 3.188 12.128 1.00 0.00 H new ATOM 0 HG1 THR A 107 16.034 1.716 13.860 1.00 0.00 H new ATOM 0 HG21 THR A 107 14.647 2.219 11.998 1.00 0.00 H new ATOM 0 HG22 THR A 107 15.437 2.158 10.404 1.00 0.00 H new ATOM 0 HG23 THR A 107 15.323 0.686 11.398 1.00 0.00 H new ATOM 1249 N ASN A 108 19.595 1.669 13.103 1.00 0.00 N ATOM 1250 CA ASN A 108 20.846 2.058 13.732 1.00 0.00 C ATOM 1251 C ASN A 108 22.005 1.757 12.779 1.00 0.00 C ATOM 1252 O ASN A 108 23.070 2.365 12.880 1.00 0.00 O ATOM 1253 CB ASN A 108 21.081 1.272 15.023 1.00 0.00 C ATOM 1254 CG ASN A 108 20.579 2.053 16.239 1.00 0.00 C ATOM 1255 OD1 ASN A 108 19.874 3.042 16.127 1.00 0.00 O ATOM 1256 ND2 ASN A 108 20.980 1.555 17.405 1.00 0.00 N ATOM 0 H ASN A 108 18.956 1.154 13.708 1.00 0.00 H new ATOM 0 HA ASN A 108 20.791 3.122 13.962 1.00 0.00 H new ATOM 0 HB2 ASN A 108 20.569 0.311 14.967 1.00 0.00 H new ATOM 0 HB3 ASN A 108 22.144 1.060 15.136 1.00 0.00 H new ATOM 0 HD21 ASN A 108 20.698 2.005 18.276 1.00 0.00 H new ATOM 0 HD22 ASN A 108 21.570 0.723 17.429 1.00 0.00 H new ATOM 1262 N GLU A 109 21.759 0.821 11.875 1.00 0.00 N ATOM 1263 CA GLU A 109 22.769 0.434 10.905 1.00 0.00 C ATOM 1264 C GLU A 109 22.190 0.479 9.489 1.00 0.00 C ATOM 1265 O GLU A 109 22.926 0.368 8.509 1.00 0.00 O ATOM 1266 CB GLU A 109 23.330 -0.953 11.223 1.00 0.00 C ATOM 1267 CG GLU A 109 24.093 -1.524 10.025 1.00 0.00 C ATOM 1268 CD GLU A 109 24.928 -2.739 10.436 1.00 0.00 C ATOM 1269 OE1 GLU A 109 24.593 -3.331 11.483 1.00 0.00 O ATOM 1270 OE2 GLU A 109 25.885 -3.047 9.692 1.00 0.00 O ATOM 0 H GLU A 109 20.875 0.319 11.794 1.00 0.00 H new ATOM 0 HA GLU A 109 23.592 1.146 10.963 1.00 0.00 H new ATOM 0 HB2 GLU A 109 23.993 -0.892 12.086 1.00 0.00 H new ATOM 0 HB3 GLU A 109 22.516 -1.625 11.494 1.00 0.00 H new ATOM 0 HG2 GLU A 109 23.389 -1.809 9.243 1.00 0.00 H new ATOM 0 HG3 GLU A 109 24.743 -0.757 9.604 1.00 0.00 H new ATOM 1275 N TYR A 110 20.877 0.642 9.426 1.00 0.00 N ATOM 1276 CA TYR A 110 20.190 0.704 8.147 1.00 0.00 C ATOM 1277 C TYR A 110 19.284 1.934 8.069 1.00 0.00 C ATOM 1278 O TYR A 110 19.339 2.805 8.935 1.00 0.00 O ATOM 1279 CB TYR A 110 19.328 -0.557 8.070 1.00 0.00 C ATOM 1280 CG TYR A 110 20.126 -1.861 8.116 1.00 0.00 C ATOM 1281 CD1 TYR A 110 20.891 -2.164 9.225 1.00 0.00 C ATOM 1282 CD2 TYR A 110 20.083 -2.736 7.049 1.00 0.00 C ATOM 1283 CE1 TYR A 110 21.642 -3.391 9.269 1.00 0.00 C ATOM 1284 CE2 TYR A 110 20.834 -3.963 7.093 1.00 0.00 C ATOM 1285 CZ TYR A 110 21.576 -4.230 8.200 1.00 0.00 C ATOM 1286 OH TYR A 110 22.286 -5.390 8.242 1.00 0.00 O ATOM 0 H TYR A 110 20.270 0.733 10.241 1.00 0.00 H new ATOM 0 HA TYR A 110 20.907 0.770 7.329 1.00 0.00 H new ATOM 0 HB2 TYR A 110 18.617 -0.549 8.896 1.00 0.00 H new ATOM 0 HB3 TYR A 110 18.747 -0.531 7.148 1.00 0.00 H new ATOM 0 HD1 TYR A 110 20.926 -1.480 10.060 1.00 0.00 H new ATOM 0 HD2 TYR A 110 19.486 -2.500 6.181 1.00 0.00 H new ATOM 0 HE1 TYR A 110 22.244 -3.640 10.130 1.00 0.00 H new ATOM 0 HE2 TYR A 110 20.809 -4.656 6.265 1.00 0.00 H new ATOM 0 HH TYR A 110 22.144 -5.891 7.412 1.00 0.00 H new ATOM 1295 N LYS A 111 18.470 1.964 7.025 1.00 0.00 N ATOM 1296 CA LYS A 111 17.552 3.072 6.823 1.00 0.00 C ATOM 1297 C LYS A 111 16.322 2.878 7.710 1.00 0.00 C ATOM 1298 O LYS A 111 16.337 3.234 8.888 1.00 0.00 O ATOM 1299 CB LYS A 111 17.220 3.231 5.338 1.00 0.00 C ATOM 1300 CG LYS A 111 15.947 4.057 5.145 1.00 0.00 C ATOM 1301 CD LYS A 111 16.170 5.180 4.130 1.00 0.00 C ATOM 1302 CE LYS A 111 14.947 6.095 4.048 1.00 0.00 C ATOM 1303 NZ LYS A 111 14.822 6.672 2.691 1.00 0.00 N ATOM 0 H LYS A 111 18.427 1.239 6.309 1.00 0.00 H new ATOM 0 HA LYS A 111 18.018 4.011 7.123 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.052 3.714 4.826 1.00 0.00 H new ATOM 0 HB3 LYS A 111 17.093 2.249 4.883 1.00 0.00 H new ATOM 0 HG2 LYS A 111 15.138 3.410 4.805 1.00 0.00 H new ATOM 0 HG3 LYS A 111 15.636 4.481 6.100 1.00 0.00 H new ATOM 0 HD2 LYS A 111 17.046 5.763 4.414 1.00 0.00 H new ATOM 0 HD3 LYS A 111 16.375 4.753 3.149 1.00 0.00 H new ATOM 0 HE2 LYS A 111 14.047 5.532 4.295 1.00 0.00 H new ATOM 0 HE3 LYS A 111 15.034 6.895 4.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 13.987 7.291 2.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 15.674 7.226 2.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.717 5.905 1.996 1.00 0.00 H new ATOM 1313 N HIS A 112 15.283 2.314 7.112 1.00 0.00 N ATOM 1314 CA HIS A 112 14.046 2.067 7.833 1.00 0.00 C ATOM 1315 C HIS A 112 13.016 1.447 6.888 1.00 0.00 C ATOM 1316 O HIS A 112 12.116 2.135 6.407 1.00 0.00 O ATOM 1317 CB HIS A 112 13.542 3.348 8.501 1.00 0.00 C ATOM 1318 CG HIS A 112 13.348 4.503 7.548 1.00 0.00 C ATOM 1319 ND1 HIS A 112 12.297 4.563 6.648 1.00 0.00 N ATOM 1320 CD2 HIS A 112 14.078 5.640 7.363 1.00 0.00 C ATOM 1321 CE1 HIS A 112 12.401 5.689 5.957 1.00 0.00 C ATOM 1322 NE2 HIS A 112 13.506 6.355 6.402 1.00 0.00 N ATOM 0 H HIS A 112 15.273 2.021 6.135 1.00 0.00 H new ATOM 0 HA HIS A 112 14.226 1.353 8.637 1.00 0.00 H new ATOM 0 HB2 HIS A 112 12.595 3.138 8.998 1.00 0.00 H new ATOM 0 HB3 HIS A 112 14.250 3.644 9.275 1.00 0.00 H new ATOM 0 HD1 HIS A 112 11.567 3.860 6.536 1.00 0.00 H new ATOM 0 HD2 HIS A 112 14.971 5.913 7.907 1.00 0.00 H new ATOM 0 HE1 HIS A 112 11.730 6.021 5.179 1.00 0.00 H new ATOM 1329 N ALA A 113 13.180 0.153 6.651 1.00 0.00 N ATOM 1330 CA ALA A 113 12.275 -0.567 5.771 1.00 0.00 C ATOM 1331 C ALA A 113 12.251 -2.044 6.171 1.00 0.00 C ATOM 1332 O ALA A 113 12.826 -2.424 7.191 1.00 0.00 O ATOM 1333 CB ALA A 113 12.706 -0.364 4.317 1.00 0.00 C ATOM 0 H ALA A 113 13.926 -0.415 7.053 1.00 0.00 H new ATOM 0 HA ALA A 113 11.260 -0.182 5.866 1.00 0.00 H new ATOM 0 HB1 ALA A 113 12.027 -0.904 3.657 1.00 0.00 H new ATOM 0 HB2 ALA A 113 12.679 0.698 4.074 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.720 -0.741 4.182 1.00 0.00 H new ATOM 1339 N PHE A 114 11.581 -2.836 5.348 1.00 0.00 N ATOM 1340 CA PHE A 114 11.475 -4.263 5.602 1.00 0.00 C ATOM 1341 C PHE A 114 10.859 -4.989 4.405 1.00 0.00 C ATOM 1342 O PHE A 114 10.305 -4.356 3.509 1.00 0.00 O ATOM 1343 CB PHE A 114 10.556 -4.433 6.815 1.00 0.00 C ATOM 1344 CG PHE A 114 9.974 -3.121 7.343 1.00 0.00 C ATOM 1345 CD1 PHE A 114 9.036 -2.454 6.618 1.00 0.00 C ATOM 1346 CD2 PHE A 114 10.392 -2.622 8.537 1.00 0.00 C ATOM 1347 CE1 PHE A 114 8.495 -1.235 7.109 1.00 0.00 C ATOM 1348 CE2 PHE A 114 9.851 -1.405 9.027 1.00 0.00 C ATOM 1349 CZ PHE A 114 8.913 -0.737 8.303 1.00 0.00 C ATOM 0 H PHE A 114 11.106 -2.517 4.504 1.00 0.00 H new ATOM 0 HA PHE A 114 12.465 -4.685 5.778 1.00 0.00 H new ATOM 0 HB2 PHE A 114 9.737 -5.100 6.547 1.00 0.00 H new ATOM 0 HB3 PHE A 114 11.114 -4.919 7.615 1.00 0.00 H new ATOM 0 HD1 PHE A 114 8.703 -2.850 5.670 1.00 0.00 H new ATOM 0 HD2 PHE A 114 11.136 -3.152 9.113 1.00 0.00 H new ATOM 0 HE1 PHE A 114 7.751 -0.704 6.533 1.00 0.00 H new ATOM 0 HE2 PHE A 114 10.184 -1.009 9.975 1.00 0.00 H new ATOM 0 HZ PHE A 114 8.500 0.189 8.676 1.00 0.00 H new ATOM 1358 N GLU A 115 10.977 -6.309 4.430 1.00 0.00 N ATOM 1359 CA GLU A 115 10.439 -7.128 3.358 1.00 0.00 C ATOM 1360 C GLU A 115 8.962 -7.436 3.614 1.00 0.00 C ATOM 1361 O GLU A 115 8.617 -8.035 4.631 1.00 0.00 O ATOM 1362 CB GLU A 115 11.247 -8.417 3.195 1.00 0.00 C ATOM 1363 CG GLU A 115 12.712 -8.199 3.580 1.00 0.00 C ATOM 1364 CD GLU A 115 13.650 -8.838 2.554 1.00 0.00 C ATOM 1365 OE1 GLU A 115 13.776 -10.081 2.597 1.00 0.00 O ATOM 1366 OE2 GLU A 115 14.219 -8.070 1.749 1.00 0.00 O ATOM 0 H GLU A 115 11.437 -6.831 5.176 1.00 0.00 H new ATOM 0 HA GLU A 115 10.517 -6.568 2.426 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.817 -9.201 3.818 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.186 -8.760 2.162 1.00 0.00 H new ATOM 0 HG2 GLU A 115 12.918 -7.131 3.651 1.00 0.00 H new ATOM 0 HG3 GLU A 115 12.900 -8.626 4.565 1.00 0.00 H new ATOM 1371 N ILE A 116 8.131 -7.011 2.674 1.00 0.00 N ATOM 1372 CA ILE A 116 6.699 -7.232 2.786 1.00 0.00 C ATOM 1373 C ILE A 116 6.276 -8.313 1.788 1.00 0.00 C ATOM 1374 O ILE A 116 6.531 -8.191 0.591 1.00 0.00 O ATOM 1375 CB ILE A 116 5.938 -5.915 2.624 1.00 0.00 C ATOM 1376 CG1 ILE A 116 6.745 -4.743 3.187 1.00 0.00 C ATOM 1377 CG2 ILE A 116 4.546 -6.005 3.251 1.00 0.00 C ATOM 1378 CD1 ILE A 116 7.405 -5.120 4.515 1.00 0.00 C ATOM 0 H ILE A 116 8.422 -6.515 1.831 1.00 0.00 H new ATOM 0 HA ILE A 116 6.447 -7.598 3.781 1.00 0.00 H new ATOM 0 HB ILE A 116 5.800 -5.729 1.559 1.00 0.00 H new ATOM 0 HG12 ILE A 116 7.509 -4.444 2.469 1.00 0.00 H new ATOM 0 HG13 ILE A 116 6.091 -3.883 3.333 1.00 0.00 H new ATOM 0 HG21 ILE A 116 4.027 -5.055 3.122 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.978 -6.798 2.764 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.639 -6.226 4.314 1.00 0.00 H new ATOM 0 HD11 ILE A 116 7.972 -4.270 4.894 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.637 -5.395 5.238 1.00 0.00 H new ATOM 0 HD13 ILE A 116 8.077 -5.965 4.361 1.00 0.00 H new ATOM 1389 N ILE A 117 5.637 -9.346 2.319 1.00 0.00 N ATOM 1390 CA ILE A 117 5.176 -10.447 1.491 1.00 0.00 C ATOM 1391 C ILE A 117 3.646 -10.439 1.446 1.00 0.00 C ATOM 1392 O ILE A 117 2.992 -10.399 2.486 1.00 0.00 O ATOM 1393 CB ILE A 117 5.771 -11.769 1.978 1.00 0.00 C ATOM 1394 CG1 ILE A 117 7.245 -11.885 1.587 1.00 0.00 C ATOM 1395 CG2 ILE A 117 4.950 -12.958 1.475 1.00 0.00 C ATOM 1396 CD1 ILE A 117 8.000 -12.798 2.554 1.00 0.00 C ATOM 0 H ILE A 117 5.428 -9.443 3.313 1.00 0.00 H new ATOM 0 HA ILE A 117 5.526 -10.326 0.466 1.00 0.00 H new ATOM 0 HB ILE A 117 5.725 -11.783 3.067 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.326 -12.277 0.573 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.703 -10.896 1.583 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.395 -13.886 1.835 1.00 0.00 H new ATOM 0 HG22 ILE A 117 3.928 -12.877 1.846 1.00 0.00 H new ATOM 0 HG23 ILE A 117 4.942 -12.959 0.385 1.00 0.00 H new ATOM 0 HD11 ILE A 117 9.045 -12.862 2.252 1.00 0.00 H new ATOM 0 HD12 ILE A 117 7.938 -12.390 3.563 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.555 -13.793 2.537 1.00 0.00 H new ATOM 1407 N LEU A 118 3.122 -10.480 0.230 1.00 0.00 N ATOM 1408 CA LEU A 118 1.683 -10.478 0.036 1.00 0.00 C ATOM 1409 C LEU A 118 1.257 -11.803 -0.602 1.00 0.00 C ATOM 1410 O LEU A 118 1.942 -12.319 -1.483 1.00 0.00 O ATOM 1411 CB LEU A 118 1.250 -9.245 -0.761 1.00 0.00 C ATOM 1412 CG LEU A 118 2.346 -8.556 -1.575 1.00 0.00 C ATOM 1413 CD1 LEU A 118 2.220 -8.895 -3.062 1.00 0.00 C ATOM 1414 CD2 LEU A 118 2.342 -7.045 -1.331 1.00 0.00 C ATOM 0 H LEU A 118 3.669 -10.515 -0.630 1.00 0.00 H new ATOM 0 HA LEU A 118 1.170 -10.405 0.995 1.00 0.00 H new ATOM 0 HB2 LEU A 118 0.450 -9.538 -1.441 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.828 -8.518 -0.067 1.00 0.00 H new ATOM 0 HG LEU A 118 3.311 -8.935 -1.238 1.00 0.00 H new ATOM 0 HD11 LEU A 118 3.011 -8.392 -3.618 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.309 -9.973 -3.198 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.250 -8.562 -3.430 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.131 -6.579 -1.922 1.00 0.00 H new ATOM 0 HD22 LEU A 118 1.377 -6.632 -1.624 1.00 0.00 H new ATOM 0 HD23 LEU A 118 2.515 -6.847 -0.273 1.00 0.00 H new ATOM 1425 N LYS A 119 0.129 -12.313 -0.132 1.00 0.00 N ATOM 1426 CA LYS A 119 -0.396 -13.568 -0.646 1.00 0.00 C ATOM 1427 C LYS A 119 -0.292 -13.572 -2.172 1.00 0.00 C ATOM 1428 O LYS A 119 -0.221 -14.633 -2.790 1.00 0.00 O ATOM 1429 CB LYS A 119 -1.815 -13.808 -0.126 1.00 0.00 C ATOM 1430 CG LYS A 119 -2.851 -13.130 -1.024 1.00 0.00 C ATOM 1431 CD LYS A 119 -3.649 -14.166 -1.819 1.00 0.00 C ATOM 1432 CE LYS A 119 -3.845 -13.715 -3.267 1.00 0.00 C ATOM 1433 NZ LYS A 119 -3.609 -14.841 -4.197 1.00 0.00 N ATOM 0 H LYS A 119 -0.437 -11.881 0.599 1.00 0.00 H new ATOM 0 HA LYS A 119 0.198 -14.407 -0.283 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.013 -14.879 -0.081 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.903 -13.424 0.890 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.529 -12.532 -0.415 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.351 -12.446 -1.710 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -3.129 -15.124 -1.800 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -4.620 -14.322 -1.348 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.856 -13.331 -3.401 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -3.161 -12.898 -3.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -3.746 -14.517 -5.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -2.636 -15.189 -4.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -4.279 -15.609 -3.989 1.00 0.00 H new ATOM 1443 N ASP A 120 -0.286 -12.373 -2.736 1.00 0.00 N ATOM 1444 CA ASP A 120 -0.192 -12.226 -4.179 1.00 0.00 C ATOM 1445 C ASP A 120 1.075 -12.924 -4.677 1.00 0.00 C ATOM 1446 O ASP A 120 1.291 -13.040 -5.882 1.00 0.00 O ATOM 1447 CB ASP A 120 -0.108 -10.751 -4.578 1.00 0.00 C ATOM 1448 CG ASP A 120 -1.057 -9.821 -3.819 1.00 0.00 C ATOM 1449 OD1 ASP A 120 -1.717 -10.323 -2.883 1.00 0.00 O ATOM 1450 OD2 ASP A 120 -1.102 -8.629 -4.193 1.00 0.00 O ATOM 0 H ASP A 120 -0.345 -11.495 -2.220 1.00 0.00 H new ATOM 0 HA ASP A 120 -1.084 -12.669 -4.622 1.00 0.00 H new ATOM 0 HB2 ASP A 120 0.915 -10.406 -4.424 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -0.316 -10.666 -5.645 1.00 0.00 H new ATOM 1454 N GLU A 121 1.880 -13.369 -3.723 1.00 0.00 N ATOM 1455 CA GLU A 121 3.121 -14.052 -4.050 1.00 0.00 C ATOM 1456 C GLU A 121 4.154 -13.053 -4.576 1.00 0.00 C ATOM 1457 O GLU A 121 4.852 -13.331 -5.550 1.00 0.00 O ATOM 1458 CB GLU A 121 2.879 -15.173 -5.062 1.00 0.00 C ATOM 1459 CG GLU A 121 2.892 -16.542 -4.378 1.00 0.00 C ATOM 1460 CD GLU A 121 4.175 -17.308 -4.708 1.00 0.00 C ATOM 1461 OE1 GLU A 121 5.249 -16.820 -4.296 1.00 0.00 O ATOM 1462 OE2 GLU A 121 4.052 -18.364 -5.364 1.00 0.00 O ATOM 0 H GLU A 121 1.697 -13.270 -2.724 1.00 0.00 H new ATOM 0 HA GLU A 121 3.514 -14.506 -3.140 1.00 0.00 H new ATOM 0 HB2 GLU A 121 1.921 -15.019 -5.558 1.00 0.00 H new ATOM 0 HB3 GLU A 121 3.647 -15.142 -5.835 1.00 0.00 H new ATOM 0 HG2 GLU A 121 2.808 -16.414 -3.299 1.00 0.00 H new ATOM 0 HG3 GLU A 121 2.026 -17.121 -4.699 1.00 0.00 H new ATOM 1467 N ASN A 122 4.220 -11.911 -3.906 1.00 0.00 N ATOM 1468 CA ASN A 122 5.156 -10.870 -4.293 1.00 0.00 C ATOM 1469 C ASN A 122 5.740 -10.222 -3.037 1.00 0.00 C ATOM 1470 O ASN A 122 5.034 -10.034 -2.046 1.00 0.00 O ATOM 1471 CB ASN A 122 4.461 -9.778 -5.109 1.00 0.00 C ATOM 1472 CG ASN A 122 5.031 -9.704 -6.526 1.00 0.00 C ATOM 1473 OD1 ASN A 122 4.663 -10.458 -7.411 1.00 0.00 O ATOM 1474 ND2 ASN A 122 5.950 -8.756 -6.690 1.00 0.00 N ATOM 0 H ASN A 122 3.640 -11.685 -3.098 1.00 0.00 H new ATOM 0 HA ASN A 122 5.938 -11.329 -4.898 1.00 0.00 H new ATOM 0 HB2 ASN A 122 3.391 -9.979 -5.154 1.00 0.00 H new ATOM 0 HB3 ASN A 122 4.584 -8.815 -4.613 1.00 0.00 H new ATOM 0 HD21 ASN A 122 6.393 -8.627 -7.600 1.00 0.00 H new ATOM 0 HD22 ASN A 122 6.212 -8.159 -5.906 1.00 0.00 H new ATOM 1480 N SER A 123 7.022 -9.899 -3.117 1.00 0.00 N ATOM 1481 CA SER A 123 7.708 -9.276 -1.997 1.00 0.00 C ATOM 1482 C SER A 123 8.001 -7.808 -2.315 1.00 0.00 C ATOM 1483 O SER A 123 8.158 -7.441 -3.478 1.00 0.00 O ATOM 1484 CB SER A 123 9.006 -10.017 -1.666 1.00 0.00 C ATOM 1485 OG SER A 123 10.159 -9.242 -1.986 1.00 0.00 O ATOM 0 H SER A 123 7.604 -10.057 -3.940 1.00 0.00 H new ATOM 0 HA SER A 123 7.058 -9.329 -1.124 1.00 0.00 H new ATOM 0 HB2 SER A 123 9.020 -10.267 -0.605 1.00 0.00 H new ATOM 0 HB3 SER A 123 9.037 -10.958 -2.216 1.00 0.00 H new ATOM 0 HG SER A 123 10.967 -9.748 -1.759 1.00 0.00 H new ATOM 1490 N VAL A 124 8.066 -7.009 -1.260 1.00 0.00 N ATOM 1491 CA VAL A 124 8.337 -5.590 -1.412 1.00 0.00 C ATOM 1492 C VAL A 124 9.276 -5.132 -0.293 1.00 0.00 C ATOM 1493 O VAL A 124 9.607 -5.908 0.601 1.00 0.00 O ATOM 1494 CB VAL A 124 7.023 -4.807 -1.446 1.00 0.00 C ATOM 1495 CG1 VAL A 124 7.179 -3.510 -2.243 1.00 0.00 C ATOM 1496 CG2 VAL A 124 5.889 -5.664 -2.011 1.00 0.00 C ATOM 0 H VAL A 124 7.936 -7.318 -0.297 1.00 0.00 H new ATOM 0 HA VAL A 124 8.840 -5.397 -2.359 1.00 0.00 H new ATOM 0 HB VAL A 124 6.764 -4.542 -0.421 1.00 0.00 H new ATOM 0 HG11 VAL A 124 6.231 -2.972 -2.252 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.945 -2.888 -1.779 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.473 -3.745 -3.266 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.966 -5.084 -2.024 1.00 0.00 H new ATOM 0 HG22 VAL A 124 6.138 -5.973 -3.026 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.754 -6.547 -1.386 1.00 0.00 H new ATOM 1506 N ILE A 125 9.680 -3.874 -0.382 1.00 0.00 N ATOM 1507 CA ILE A 125 10.575 -3.304 0.611 1.00 0.00 C ATOM 1508 C ILE A 125 10.009 -1.965 1.092 1.00 0.00 C ATOM 1509 O ILE A 125 10.445 -0.906 0.643 1.00 0.00 O ATOM 1510 CB ILE A 125 11.997 -3.207 0.058 1.00 0.00 C ATOM 1511 CG1 ILE A 125 12.404 -4.506 -0.641 1.00 0.00 C ATOM 1512 CG2 ILE A 125 12.987 -2.812 1.155 1.00 0.00 C ATOM 1513 CD1 ILE A 125 13.479 -4.247 -1.699 1.00 0.00 C ATOM 0 H ILE A 125 9.404 -3.233 -1.126 1.00 0.00 H new ATOM 0 HA ILE A 125 10.641 -3.955 1.483 1.00 0.00 H new ATOM 0 HB ILE A 125 12.017 -2.417 -0.693 1.00 0.00 H new ATOM 0 HG12 ILE A 125 12.778 -5.218 0.095 1.00 0.00 H new ATOM 0 HG13 ILE A 125 11.531 -4.960 -1.109 1.00 0.00 H new ATOM 0 HG21 ILE A 125 13.991 -2.750 0.734 1.00 0.00 H new ATOM 0 HG22 ILE A 125 12.706 -1.843 1.567 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.971 -3.561 1.947 1.00 0.00 H new ATOM 0 HD11 ILE A 125 13.750 -5.187 -2.180 1.00 0.00 H new ATOM 0 HD12 ILE A 125 13.094 -3.554 -2.447 1.00 0.00 H new ATOM 0 HD13 ILE A 125 14.360 -3.815 -1.224 1.00 0.00 H new ATOM 1524 N PHE A 126 9.047 -2.056 1.998 1.00 0.00 N ATOM 1525 CA PHE A 126 8.418 -0.867 2.545 1.00 0.00 C ATOM 1526 C PHE A 126 9.347 -0.161 3.536 1.00 0.00 C ATOM 1527 O PHE A 126 9.926 -0.801 4.412 1.00 0.00 O ATOM 1528 CB PHE A 126 7.158 -1.325 3.282 1.00 0.00 C ATOM 1529 CG PHE A 126 5.983 -1.657 2.359 1.00 0.00 C ATOM 1530 CD1 PHE A 126 6.146 -1.616 1.009 1.00 0.00 C ATOM 1531 CD2 PHE A 126 4.777 -1.992 2.888 1.00 0.00 C ATOM 1532 CE1 PHE A 126 5.056 -1.924 0.153 1.00 0.00 C ATOM 1533 CE2 PHE A 126 3.686 -2.300 2.032 1.00 0.00 C ATOM 1534 CZ PHE A 126 3.850 -2.259 0.683 1.00 0.00 C ATOM 0 H PHE A 126 8.688 -2.936 2.367 1.00 0.00 H new ATOM 0 HA PHE A 126 8.187 -0.166 1.743 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.398 -2.205 3.879 1.00 0.00 H new ATOM 0 HB3 PHE A 126 6.851 -0.543 3.977 1.00 0.00 H new ATOM 0 HD1 PHE A 126 7.104 -1.349 0.589 1.00 0.00 H new ATOM 0 HD2 PHE A 126 4.648 -2.024 3.960 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.185 -1.892 -0.919 1.00 0.00 H new ATOM 0 HE2 PHE A 126 2.727 -2.566 2.452 1.00 0.00 H new ATOM 0 HZ PHE A 126 3.021 -2.493 0.032 1.00 0.00 H new ATOM 1543 N SER A 127 9.458 1.147 3.364 1.00 0.00 N ATOM 1544 CA SER A 127 10.307 1.947 4.232 1.00 0.00 C ATOM 1545 C SER A 127 9.450 2.905 5.062 1.00 0.00 C ATOM 1546 O SER A 127 8.892 3.863 4.530 1.00 0.00 O ATOM 1547 CB SER A 127 11.345 2.727 3.423 1.00 0.00 C ATOM 1548 OG SER A 127 12.610 2.768 4.078 1.00 0.00 O ATOM 0 H SER A 127 8.975 1.674 2.637 1.00 0.00 H new ATOM 0 HA SER A 127 10.842 1.274 4.902 1.00 0.00 H new ATOM 0 HB2 SER A 127 11.460 2.268 2.441 1.00 0.00 H new ATOM 0 HB3 SER A 127 10.988 3.744 3.259 1.00 0.00 H new ATOM 0 HG SER A 127 12.494 3.096 4.994 1.00 0.00 H new ATOM 1553 N ALA A 128 9.374 2.613 6.352 1.00 0.00 N ATOM 1554 CA ALA A 128 8.595 3.438 7.260 1.00 0.00 C ATOM 1555 C ALA A 128 9.543 4.247 8.149 1.00 0.00 C ATOM 1556 O ALA A 128 10.488 3.699 8.713 1.00 0.00 O ATOM 1557 CB ALA A 128 7.649 2.551 8.073 1.00 0.00 C ATOM 0 H ALA A 128 9.839 1.817 6.790 1.00 0.00 H new ATOM 0 HA ALA A 128 7.981 4.145 6.703 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.065 3.170 8.754 1.00 0.00 H new ATOM 0 HB2 ALA A 128 6.977 2.021 7.398 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.230 1.829 8.647 1.00 0.00 H new ATOM 1563 N LYS A 129 9.257 5.537 8.244 1.00 0.00 N ATOM 1564 CA LYS A 129 10.071 6.427 9.054 1.00 0.00 C ATOM 1565 C LYS A 129 9.333 6.743 10.356 1.00 0.00 C ATOM 1566 O LYS A 129 9.871 7.423 11.229 1.00 0.00 O ATOM 1567 CB LYS A 129 10.467 7.668 8.253 1.00 0.00 C ATOM 1568 CG LYS A 129 9.230 8.454 7.814 1.00 0.00 C ATOM 1569 CD LYS A 129 9.240 9.866 8.403 1.00 0.00 C ATOM 1570 CE LYS A 129 8.732 10.889 7.385 1.00 0.00 C ATOM 1571 NZ LYS A 129 9.550 12.121 7.435 1.00 0.00 N ATOM 0 H LYS A 129 8.472 5.987 7.773 1.00 0.00 H new ATOM 0 HA LYS A 129 11.008 5.942 9.329 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.112 8.305 8.858 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.044 7.371 7.377 1.00 0.00 H new ATOM 0 HG2 LYS A 129 9.198 8.510 6.726 1.00 0.00 H new ATOM 0 HG3 LYS A 129 8.329 7.929 8.133 1.00 0.00 H new ATOM 0 HD2 LYS A 129 8.616 9.896 9.296 1.00 0.00 H new ATOM 0 HD3 LYS A 129 10.252 10.127 8.713 1.00 0.00 H new ATOM 0 HE2 LYS A 129 8.768 10.462 6.383 1.00 0.00 H new ATOM 0 HE3 LYS A 129 7.689 11.129 7.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 9.191 12.804 6.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 9.495 12.536 8.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 10.540 11.890 7.215 1.00 0.00 H new ATOM 1581 N SER A 130 8.113 6.236 10.445 1.00 0.00 N ATOM 1582 CA SER A 130 7.296 6.456 11.626 1.00 0.00 C ATOM 1583 C SER A 130 7.171 5.158 12.426 1.00 0.00 C ATOM 1584 O SER A 130 6.492 4.225 12.000 1.00 0.00 O ATOM 1585 CB SER A 130 5.909 6.981 11.246 1.00 0.00 C ATOM 1586 OG SER A 130 5.826 8.399 11.362 1.00 0.00 O ATOM 0 H SER A 130 7.670 5.673 9.719 1.00 0.00 H new ATOM 0 HA SER A 130 7.784 7.210 12.244 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.678 6.687 10.222 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.158 6.520 11.888 1.00 0.00 H new ATOM 0 HG SER A 130 4.927 8.696 11.109 1.00 0.00 H new ATOM 1591 N ALA A 131 7.836 5.140 13.572 1.00 0.00 N ATOM 1592 CA ALA A 131 7.809 3.972 14.436 1.00 0.00 C ATOM 1593 C ALA A 131 6.379 3.432 14.510 1.00 0.00 C ATOM 1594 O ALA A 131 6.169 2.220 14.522 1.00 0.00 O ATOM 1595 CB ALA A 131 8.365 4.342 15.812 1.00 0.00 C ATOM 0 H ALA A 131 8.397 5.916 13.922 1.00 0.00 H new ATOM 0 HA ALA A 131 8.440 3.180 14.032 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.345 3.466 16.460 1.00 0.00 H new ATOM 0 HB2 ALA A 131 9.392 4.692 15.707 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.755 5.132 16.250 1.00 0.00 H new ATOM 1601 N GLU A 132 5.432 4.359 14.558 1.00 0.00 N ATOM 1602 CA GLU A 132 4.028 3.991 14.631 1.00 0.00 C ATOM 1603 C GLU A 132 3.581 3.341 13.319 1.00 0.00 C ATOM 1604 O GLU A 132 2.862 2.343 13.330 1.00 0.00 O ATOM 1605 CB GLU A 132 3.160 5.205 14.965 1.00 0.00 C ATOM 1606 CG GLU A 132 2.472 5.031 16.321 1.00 0.00 C ATOM 1607 CD GLU A 132 1.015 4.596 16.144 1.00 0.00 C ATOM 1608 OE1 GLU A 132 0.802 3.373 15.997 1.00 0.00 O ATOM 1609 OE2 GLU A 132 0.149 5.496 16.160 1.00 0.00 O ATOM 0 H GLU A 132 5.610 5.363 14.548 1.00 0.00 H new ATOM 0 HA GLU A 132 3.904 3.265 15.434 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.776 6.104 14.978 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.409 5.345 14.187 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.008 4.288 16.912 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.511 5.969 16.876 1.00 0.00 H new ATOM 1614 N GLU A 133 4.026 3.933 12.221 1.00 0.00 N ATOM 1615 CA GLU A 133 3.680 3.425 10.905 1.00 0.00 C ATOM 1616 C GLU A 133 4.217 2.003 10.727 1.00 0.00 C ATOM 1617 O GLU A 133 3.539 1.146 10.159 1.00 0.00 O ATOM 1618 CB GLU A 133 4.205 4.350 9.805 1.00 0.00 C ATOM 1619 CG GLU A 133 3.177 5.428 9.458 1.00 0.00 C ATOM 1620 CD GLU A 133 3.531 6.119 8.139 1.00 0.00 C ATOM 1621 OE1 GLU A 133 4.649 6.673 8.071 1.00 0.00 O ATOM 1622 OE2 GLU A 133 2.673 6.080 7.230 1.00 0.00 O ATOM 0 H GLU A 133 4.623 4.760 12.216 1.00 0.00 H new ATOM 0 HA GLU A 133 2.594 3.396 10.822 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.133 4.819 10.132 1.00 0.00 H new ATOM 0 HB3 GLU A 133 4.439 3.766 8.915 1.00 0.00 H new ATOM 0 HG2 GLU A 133 2.186 4.980 9.384 1.00 0.00 H new ATOM 0 HG3 GLU A 133 3.134 6.166 10.259 1.00 0.00 H new ATOM 1627 N LYS A 134 5.427 1.794 11.223 1.00 0.00 N ATOM 1628 CA LYS A 134 6.062 0.491 11.127 1.00 0.00 C ATOM 1629 C LYS A 134 5.212 -0.541 11.870 1.00 0.00 C ATOM 1630 O LYS A 134 5.132 -1.697 11.457 1.00 0.00 O ATOM 1631 CB LYS A 134 7.509 0.563 11.617 1.00 0.00 C ATOM 1632 CG LYS A 134 8.079 -0.838 11.850 1.00 0.00 C ATOM 1633 CD LYS A 134 9.423 -0.769 12.579 1.00 0.00 C ATOM 1634 CE LYS A 134 9.284 -1.239 14.028 1.00 0.00 C ATOM 1635 NZ LYS A 134 10.476 -2.014 14.438 1.00 0.00 N ATOM 0 H LYS A 134 5.985 2.506 11.693 1.00 0.00 H new ATOM 0 HA LYS A 134 6.118 0.170 10.087 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.119 1.091 10.884 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.555 1.137 12.542 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.374 -1.429 12.435 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.205 -1.347 10.894 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.155 -1.389 12.060 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.800 0.254 12.559 1.00 0.00 H new ATOM 0 HE2 LYS A 134 9.159 -0.378 14.685 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.390 -1.853 14.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.365 -2.325 15.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.578 -2.845 13.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 11.323 -1.417 14.357 1.00 0.00 H new ATOM 1645 N ASN A 135 4.599 -0.087 12.953 1.00 0.00 N ATOM 1646 CA ASN A 135 3.757 -0.958 13.757 1.00 0.00 C ATOM 1647 C ASN A 135 2.348 -0.990 13.161 1.00 0.00 C ATOM 1648 O ASN A 135 1.687 -2.027 13.179 1.00 0.00 O ATOM 1649 CB ASN A 135 3.650 -0.445 15.194 1.00 0.00 C ATOM 1650 CG ASN A 135 3.239 -1.569 16.148 1.00 0.00 C ATOM 1651 OD1 ASN A 135 2.079 -1.739 16.483 1.00 0.00 O ATOM 1652 ND2 ASN A 135 4.251 -2.323 16.564 1.00 0.00 N ATOM 0 H ASN A 135 4.668 0.872 13.293 1.00 0.00 H new ATOM 0 HA ASN A 135 4.205 -1.952 13.760 1.00 0.00 H new ATOM 0 HB2 ASN A 135 4.607 -0.029 15.508 1.00 0.00 H new ATOM 0 HB3 ASN A 135 2.920 0.363 15.242 1.00 0.00 H new ATOM 0 HD21 ASN A 135 4.080 -3.099 17.203 1.00 0.00 H new ATOM 0 HD22 ASN A 135 5.199 -2.126 16.244 1.00 0.00 H new ATOM 1658 N ASN A 136 1.931 0.157 12.648 1.00 0.00 N ATOM 1659 CA ASN A 136 0.613 0.273 12.047 1.00 0.00 C ATOM 1660 C ASN A 136 0.651 -0.301 10.629 1.00 0.00 C ATOM 1661 O ASN A 136 -0.380 -0.701 10.090 1.00 0.00 O ATOM 1662 CB ASN A 136 0.177 1.736 11.953 1.00 0.00 C ATOM 1663 CG ASN A 136 -1.055 1.998 12.822 1.00 0.00 C ATOM 1664 OD1 ASN A 136 -1.261 1.381 13.854 1.00 0.00 O ATOM 1665 ND2 ASN A 136 -1.861 2.945 12.348 1.00 0.00 N ATOM 0 H ASN A 136 2.482 1.015 12.636 1.00 0.00 H new ATOM 0 HA ASN A 136 -0.092 -0.274 12.673 1.00 0.00 H new ATOM 0 HB2 ASN A 136 0.994 2.384 12.270 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -0.045 1.987 10.916 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -2.710 3.193 12.856 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -1.629 3.423 11.477 1.00 0.00 H new ATOM 1671 N TRP A 137 1.850 -0.324 10.066 1.00 0.00 N ATOM 1672 CA TRP A 137 2.035 -0.842 8.722 1.00 0.00 C ATOM 1673 C TRP A 137 1.903 -2.366 8.780 1.00 0.00 C ATOM 1674 O TRP A 137 1.161 -2.959 7.998 1.00 0.00 O ATOM 1675 CB TRP A 137 3.371 -0.380 8.135 1.00 0.00 C ATOM 1676 CG TRP A 137 3.401 1.100 7.747 1.00 0.00 C ATOM 1677 CD1 TRP A 137 2.500 2.048 8.040 1.00 0.00 C ATOM 1678 CD2 TRP A 137 4.424 1.767 6.980 1.00 0.00 C ATOM 1679 NE1 TRP A 137 2.866 3.273 7.519 1.00 0.00 N ATOM 1680 CE2 TRP A 137 4.074 3.096 6.853 1.00 0.00 C ATOM 1681 CE3 TRP A 137 5.608 1.264 6.410 1.00 0.00 C ATOM 1682 CZ2 TRP A 137 4.853 4.031 6.163 1.00 0.00 C ATOM 1683 CZ3 TRP A 137 6.375 2.212 5.722 1.00 0.00 C ATOM 1684 CH2 TRP A 137 6.036 3.553 5.587 1.00 0.00 C ATOM 0 H TRP A 137 2.703 0.008 10.516 1.00 0.00 H new ATOM 0 HA TRP A 137 1.271 -0.451 8.050 1.00 0.00 H new ATOM 0 HB2 TRP A 137 4.161 -0.571 8.861 1.00 0.00 H new ATOM 0 HB3 TRP A 137 3.596 -0.981 7.254 1.00 0.00 H new ATOM 0 HD1 TRP A 137 1.600 1.875 8.612 1.00 0.00 H new ATOM 0 HE1 TRP A 137 2.346 4.146 7.606 1.00 0.00 H new ATOM 0 HE3 TRP A 137 5.902 0.228 6.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 4.557 5.066 6.079 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 7.294 1.878 5.264 1.00 0.00 H new ATOM 0 HH2 TRP A 137 6.682 4.223 5.040 1.00 0.00 H new ATOM 1694 N MET A 138 2.634 -2.955 9.714 1.00 0.00 N ATOM 1695 CA MET A 138 2.608 -4.399 9.884 1.00 0.00 C ATOM 1696 C MET A 138 1.248 -4.864 10.407 1.00 0.00 C ATOM 1697 O MET A 138 0.612 -5.731 9.808 1.00 0.00 O ATOM 1698 CB MET A 138 3.703 -4.816 10.868 1.00 0.00 C ATOM 1699 CG MET A 138 3.680 -3.938 12.121 1.00 0.00 C ATOM 1700 SD MET A 138 3.083 -4.879 13.515 1.00 0.00 S ATOM 1701 CE MET A 138 4.622 -5.183 14.365 1.00 0.00 C ATOM 0 H MET A 138 3.248 -2.460 10.361 1.00 0.00 H new ATOM 0 HA MET A 138 2.782 -4.864 8.914 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.565 -5.860 11.149 1.00 0.00 H new ATOM 0 HB3 MET A 138 4.678 -4.741 10.386 1.00 0.00 H new ATOM 0 HG2 MET A 138 4.681 -3.560 12.329 1.00 0.00 H new ATOM 0 HG3 MET A 138 3.040 -3.071 11.956 1.00 0.00 H new ATOM 0 HE1 MET A 138 4.431 -5.764 15.267 1.00 0.00 H new ATOM 0 HE2 MET A 138 5.295 -5.738 13.712 1.00 0.00 H new ATOM 0 HE3 MET A 138 5.082 -4.233 14.636 1.00 0.00 H new ATOM 1709 N ALA A 139 0.842 -4.269 11.519 1.00 0.00 N ATOM 1710 CA ALA A 139 -0.432 -4.611 12.129 1.00 0.00 C ATOM 1711 C ALA A 139 -1.538 -4.525 11.075 1.00 0.00 C ATOM 1712 O ALA A 139 -2.404 -5.396 11.006 1.00 0.00 O ATOM 1713 CB ALA A 139 -0.692 -3.690 13.323 1.00 0.00 C ATOM 0 H ALA A 139 1.373 -3.552 12.014 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.414 -5.634 12.505 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.648 -3.947 13.780 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.105 -3.811 14.056 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.719 -2.654 12.984 1.00 0.00 H new ATOM 1719 N ALA A 140 -1.472 -3.467 10.280 1.00 0.00 N ATOM 1720 CA ALA A 140 -2.457 -3.256 9.233 1.00 0.00 C ATOM 1721 C ALA A 140 -2.402 -4.422 8.245 1.00 0.00 C ATOM 1722 O ALA A 140 -3.436 -4.876 7.757 1.00 0.00 O ATOM 1723 CB ALA A 140 -2.202 -1.906 8.557 1.00 0.00 C ATOM 0 H ALA A 140 -0.752 -2.747 10.340 1.00 0.00 H new ATOM 0 HA ALA A 140 -3.463 -3.226 9.652 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -2.941 -1.747 7.771 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -2.281 -1.108 9.296 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.203 -1.900 8.122 1.00 0.00 H new ATOM 1729 N LEU A 141 -1.186 -4.875 7.979 1.00 0.00 N ATOM 1730 CA LEU A 141 -0.984 -5.979 7.057 1.00 0.00 C ATOM 1731 C LEU A 141 -1.466 -7.277 7.710 1.00 0.00 C ATOM 1732 O LEU A 141 -2.270 -8.005 7.131 1.00 0.00 O ATOM 1733 CB LEU A 141 0.473 -6.029 6.592 1.00 0.00 C ATOM 1734 CG LEU A 141 0.764 -5.403 5.227 1.00 0.00 C ATOM 1735 CD1 LEU A 141 0.572 -6.423 4.103 1.00 0.00 C ATOM 1736 CD2 LEU A 141 -0.081 -4.146 5.010 1.00 0.00 C ATOM 0 H LEU A 141 -0.330 -4.497 8.386 1.00 0.00 H new ATOM 0 HA LEU A 141 -1.578 -5.835 6.154 1.00 0.00 H new ATOM 0 HB2 LEU A 141 1.089 -5.527 7.338 1.00 0.00 H new ATOM 0 HB3 LEU A 141 0.790 -7.072 6.566 1.00 0.00 H new ATOM 0 HG LEU A 141 1.810 -5.096 5.208 1.00 0.00 H new ATOM 0 HD11 LEU A 141 0.785 -5.952 3.144 1.00 0.00 H new ATOM 0 HD12 LEU A 141 1.251 -7.263 4.254 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -0.457 -6.783 4.110 1.00 0.00 H new ATOM 0 HD21 LEU A 141 0.145 -3.720 4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -1.139 -4.406 5.057 1.00 0.00 H new ATOM 0 HD23 LEU A 141 0.148 -3.415 5.786 1.00 0.00 H new ATOM 1747 N ILE A 142 -0.953 -7.525 8.906 1.00 0.00 N ATOM 1748 CA ILE A 142 -1.322 -8.722 9.643 1.00 0.00 C ATOM 1749 C ILE A 142 -2.788 -8.624 10.067 1.00 0.00 C ATOM 1750 O ILE A 142 -3.393 -9.621 10.458 1.00 0.00 O ATOM 1751 CB ILE A 142 -0.358 -8.951 10.809 1.00 0.00 C ATOM 1752 CG1 ILE A 142 1.080 -9.112 10.309 1.00 0.00 C ATOM 1753 CG2 ILE A 142 -0.803 -10.139 11.664 1.00 0.00 C ATOM 1754 CD1 ILE A 142 1.128 -9.974 9.047 1.00 0.00 C ATOM 0 H ILE A 142 -0.286 -6.918 9.383 1.00 0.00 H new ATOM 0 HA ILE A 142 -1.233 -9.603 9.008 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.380 -8.068 11.448 1.00 0.00 H new ATOM 0 HG12 ILE A 142 1.508 -8.132 10.101 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.691 -9.568 11.088 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -0.100 -10.280 12.485 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -1.797 -9.946 12.066 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -0.829 -11.040 11.050 1.00 0.00 H new ATOM 0 HD11 ILE A 142 2.161 -10.073 8.713 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.721 -10.962 9.265 1.00 0.00 H new ATOM 0 HD13 ILE A 142 0.536 -9.503 8.262 1.00 0.00 H new ATOM 1765 N SER A 143 -3.317 -7.412 9.978 1.00 0.00 N ATOM 1766 CA SER A 143 -4.700 -7.170 10.348 1.00 0.00 C ATOM 1767 C SER A 143 -5.637 -7.834 9.336 1.00 0.00 C ATOM 1768 O SER A 143 -6.607 -8.486 9.718 1.00 0.00 O ATOM 1769 CB SER A 143 -4.993 -5.671 10.437 1.00 0.00 C ATOM 1770 OG SER A 143 -6.391 -5.398 10.426 1.00 0.00 O ATOM 0 H SER A 143 -2.812 -6.587 9.655 1.00 0.00 H new ATOM 0 HA SER A 143 -4.871 -7.605 11.333 1.00 0.00 H new ATOM 0 HB2 SER A 143 -4.553 -5.269 11.350 1.00 0.00 H new ATOM 0 HB3 SER A 143 -4.517 -5.159 9.601 1.00 0.00 H new ATOM 0 HG SER A 143 -6.536 -4.431 10.486 1.00 0.00 H new ATOM 1775 N LEU A 144 -5.313 -7.644 8.065 1.00 0.00 N ATOM 1776 CA LEU A 144 -6.113 -8.217 6.996 1.00 0.00 C ATOM 1777 C LEU A 144 -5.927 -9.735 6.982 1.00 0.00 C ATOM 1778 O LEU A 144 -6.880 -10.482 7.199 1.00 0.00 O ATOM 1779 CB LEU A 144 -5.782 -7.545 5.661 1.00 0.00 C ATOM 1780 CG LEU A 144 -6.334 -6.130 5.467 1.00 0.00 C ATOM 1781 CD1 LEU A 144 -6.066 -5.628 4.047 1.00 0.00 C ATOM 1782 CD2 LEU A 144 -7.819 -6.067 5.827 1.00 0.00 C ATOM 0 H LEU A 144 -4.508 -7.102 7.752 1.00 0.00 H new ATOM 0 HA LEU A 144 -7.172 -8.027 7.169 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -4.698 -7.509 5.554 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -6.161 -8.175 4.856 1.00 0.00 H new ATOM 0 HG LEU A 144 -5.809 -5.461 6.149 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -6.468 -4.621 3.935 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -4.992 -5.612 3.863 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -6.547 -6.292 3.329 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -8.186 -5.051 5.680 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.378 -6.751 5.188 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -7.953 -6.354 6.870 1.00 0.00 H new ATOM 1793 N GLN A 145 -4.694 -10.146 6.726 1.00 0.00 N ATOM 1794 CA GLN A 145 -4.372 -11.562 6.682 1.00 0.00 C ATOM 1795 C GLN A 145 -4.994 -12.286 7.877 1.00 0.00 C ATOM 1796 O GLN A 145 -5.230 -13.492 7.823 1.00 0.00 O ATOM 1797 CB GLN A 145 -2.857 -11.778 6.638 1.00 0.00 C ATOM 1798 CG GLN A 145 -2.270 -11.836 8.049 1.00 0.00 C ATOM 1799 CD GLN A 145 -2.138 -13.283 8.529 1.00 0.00 C ATOM 1800 OE1 GLN A 145 -3.112 -13.963 8.811 1.00 0.00 O ATOM 1801 NE2 GLN A 145 -0.883 -13.715 8.606 1.00 0.00 N ATOM 0 H GLN A 145 -3.906 -9.523 6.547 1.00 0.00 H new ATOM 0 HA GLN A 145 -4.793 -11.982 5.769 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -2.633 -12.704 6.109 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -2.387 -10.970 6.078 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -1.292 -11.355 8.060 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -2.907 -11.278 8.735 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -0.114 -13.094 8.355 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -0.690 -14.667 8.916 1.00 0.00 H new ATOM 1808 N TYR A 146 -5.242 -11.519 8.930 1.00 0.00 N ATOM 1809 CA TYR A 146 -5.832 -12.073 10.136 1.00 0.00 C ATOM 1810 C TYR A 146 -7.308 -12.414 9.918 1.00 0.00 C ATOM 1811 O TYR A 146 -7.844 -13.311 10.567 1.00 0.00 O ATOM 1812 CB TYR A 146 -5.727 -10.976 11.197 1.00 0.00 C ATOM 1813 CG TYR A 146 -4.701 -11.269 12.295 1.00 0.00 C ATOM 1814 CD1 TYR A 146 -3.487 -11.839 11.969 1.00 0.00 C ATOM 1815 CD2 TYR A 146 -4.990 -10.963 13.608 1.00 0.00 C ATOM 1816 CE1 TYR A 146 -2.521 -12.114 13.001 1.00 0.00 C ATOM 1817 CE2 TYR A 146 -4.024 -11.239 14.641 1.00 0.00 C ATOM 1818 CZ TYR A 146 -2.837 -11.801 14.286 1.00 0.00 C ATOM 1819 OH TYR A 146 -1.925 -12.061 15.261 1.00 0.00 O ATOM 0 H TYR A 146 -5.045 -10.519 8.972 1.00 0.00 H new ATOM 0 HA TYR A 146 -5.320 -12.990 10.428 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -5.464 -10.037 10.710 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -6.705 -10.834 11.656 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -3.262 -12.079 10.940 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -5.940 -10.517 13.862 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -1.567 -12.559 12.760 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -4.237 -11.005 15.674 1.00 0.00 H new ATOM 0 HH TYR A 146 -2.286 -11.784 16.129 1.00 0.00 H new ATOM 1828 N ARG A 147 -7.923 -11.680 9.001 1.00 0.00 N ATOM 1829 CA ARG A 147 -9.325 -11.895 8.689 1.00 0.00 C ATOM 1830 C ARG A 147 -9.465 -12.836 7.491 1.00 0.00 C ATOM 1831 O ARG A 147 -10.368 -12.674 6.671 1.00 0.00 O ATOM 1832 CB ARG A 147 -10.027 -10.572 8.374 1.00 0.00 C ATOM 1833 CG ARG A 147 -10.652 -9.969 9.634 1.00 0.00 C ATOM 1834 CD ARG A 147 -10.123 -8.556 9.886 1.00 0.00 C ATOM 1835 NE ARG A 147 -11.253 -7.616 10.061 1.00 0.00 N ATOM 1836 CZ ARG A 147 -11.139 -6.395 10.601 1.00 0.00 C ATOM 1837 NH1 ARG A 147 -9.944 -5.958 11.021 1.00 0.00 N ATOM 1838 NH2 ARG A 147 -12.218 -5.611 10.721 1.00 0.00 N ATOM 0 H ARG A 147 -7.476 -10.936 8.465 1.00 0.00 H new ATOM 0 HA ARG A 147 -9.794 -12.344 9.564 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -9.312 -9.869 7.947 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -10.800 -10.736 7.623 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -11.737 -9.942 9.529 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -10.431 -10.603 10.493 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -9.492 -8.548 10.775 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -9.500 -8.237 9.050 1.00 0.00 H new ATOM 0 HE ARG A 147 -12.177 -7.917 9.751 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -9.122 -6.555 10.930 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -9.857 -5.029 11.432 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -13.128 -5.943 10.401 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.130 -4.682 11.132 1.00 0.00 H new ATOM 1849 N SER A 148 -8.559 -13.800 7.427 1.00 0.00 N ATOM 1850 CA SER A 148 -8.569 -14.767 6.343 1.00 0.00 C ATOM 1851 C SER A 148 -8.887 -16.161 6.889 1.00 0.00 C ATOM 1852 O SER A 148 -8.468 -17.165 6.317 1.00 0.00 O ATOM 1853 CB SER A 148 -7.230 -14.780 5.603 1.00 0.00 C ATOM 1854 OG SER A 148 -7.379 -15.156 4.237 1.00 0.00 O ATOM 0 H SER A 148 -7.812 -13.932 8.109 1.00 0.00 H new ATOM 0 HA SER A 148 -9.343 -14.476 5.632 1.00 0.00 H new ATOM 0 HB2 SER A 148 -6.775 -13.791 5.659 1.00 0.00 H new ATOM 0 HB3 SER A 148 -6.549 -15.473 6.098 1.00 0.00 H new ATOM 0 HG SER A 148 -7.478 -14.352 3.685 1.00 0.00 H new ATOM 1859 N THR A 149 -9.625 -16.176 7.989 1.00 0.00 N ATOM 1860 CA THR A 149 -10.004 -17.430 8.619 1.00 0.00 C ATOM 1861 C THR A 149 -11.004 -17.179 9.749 1.00 0.00 C ATOM 1862 O THR A 149 -11.986 -17.907 9.888 1.00 0.00 O ATOM 1863 CB THR A 149 -8.726 -18.132 9.082 1.00 0.00 C ATOM 1864 OG1 THR A 149 -8.970 -19.511 8.815 1.00 0.00 O ATOM 1865 CG2 THR A 149 -8.543 -18.074 10.600 1.00 0.00 C ATOM 0 H THR A 149 -9.971 -15.340 8.460 1.00 0.00 H new ATOM 0 HA THR A 149 -10.516 -18.087 7.916 1.00 0.00 H new ATOM 0 HB THR A 149 -7.865 -17.675 8.594 1.00 0.00 H new ATOM 0 HG1 THR A 149 -8.190 -20.039 9.084 1.00 0.00 H new ATOM 0 HG21 THR A 149 -7.621 -18.587 10.875 1.00 0.00 H new ATOM 0 HG22 THR A 149 -8.489 -17.034 10.920 1.00 0.00 H new ATOM 0 HG23 THR A 149 -9.388 -18.560 11.087 1.00 0.00 H new ATOM 1873 N LEU A 150 -10.719 -16.146 10.529 1.00 0.00 N ATOM 1874 CA LEU A 150 -11.581 -15.789 11.643 1.00 0.00 C ATOM 1875 C LEU A 150 -12.664 -14.825 11.156 1.00 0.00 C ATOM 1876 O LEU A 150 -13.516 -14.399 11.934 1.00 0.00 O ATOM 1877 CB LEU A 150 -10.751 -15.245 12.809 1.00 0.00 C ATOM 1878 CG LEU A 150 -10.041 -13.913 12.561 1.00 0.00 C ATOM 1879 CD1 LEU A 150 -10.752 -12.769 13.289 1.00 0.00 C ATOM 1880 CD2 LEU A 150 -8.562 -14.002 12.941 1.00 0.00 C ATOM 0 H LEU A 150 -9.903 -15.545 10.411 1.00 0.00 H new ATOM 0 HA LEU A 150 -12.091 -16.672 12.029 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -11.406 -15.130 13.673 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -10.001 -15.990 13.074 1.00 0.00 H new ATOM 0 HG LEU A 150 -10.087 -13.694 11.494 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -10.227 -11.833 13.096 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -11.778 -12.691 12.929 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -10.758 -12.968 14.361 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -8.080 -13.042 12.755 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -8.472 -14.254 13.998 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -8.078 -14.773 12.341 1.00 0.00 H new