USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=20 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=-2.63e-05 X(o=-5.4,f=-5.7) USER MOD Set 1.2: A 138 MET CE :methyl -159:sc= -5.36! (180deg=-6.16!) USER MOD Set 2.1: A 57 HIS : no HD1:sc= -3.8! C(o=-4.3!,f=-6.5!) USER MOD Set 2.2: A 72 LYS NZ :NH3+ -148:sc= -0.0416 (180deg=0) USER MOD Set 2.3: A 74 ASN :FLIP amide:sc= -0.477 F(o=-6.1,f=-4.3) USER MOD Set 3.1: A 71 CYS SG : rot 116:sc= -2.72! USER MOD Set 3.2: A 73 SER OG : rot -88:sc= 1.8 USER MOD Set 4.1: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 60 HIS : no HD1:sc= -2.98! C(o=-3!,f=-13!) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -1.3 K(o=-1.3,f=-4.3!) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc=-0.00776 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl -151:sc= -0.454 (180deg=-0.964) USER MOD Single : A 70 CYS SG : rot -172:sc= -2.04 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 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 102 ASN : amide:sc=-0.00179 K(o=-0.0018,f=-1.1) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -0.443 K(o=-0.44,f=-3.1!) 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 112 HIS : no HD1:sc= -1.84 X(o=-1.8,f=-2.1) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= -0.374 K(o=-0.37,f=-2.9!) USER MOD Single : A 123 SER OG : rot 180:sc= -0.206 USER MOD Single : A 127 SER OG : rot -77:sc= -9.11! 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= -0.254 K(o=-0.25,f=-1.2!) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN :FLIP amide:sc=-0.00633 F(o=-0.97,f=-0.0063) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 95:sc= 0.741 USER MOD Single : A 149 THR OG1 : rot 45:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 60 N GLN A 26 -8.412 9.688 -5.422 1.00 0.00 N ATOM 61 CA GLN A 26 -8.866 9.775 -6.800 1.00 0.00 C ATOM 62 C GLN A 26 -7.885 10.606 -7.630 1.00 0.00 C ATOM 63 O GLN A 26 -7.646 10.305 -8.798 1.00 0.00 O ATOM 64 CB GLN A 26 -10.278 10.357 -6.876 1.00 0.00 C ATOM 65 CG GLN A 26 -11.331 9.277 -6.617 1.00 0.00 C ATOM 66 CD GLN A 26 -12.240 9.094 -7.834 1.00 0.00 C ATOM 67 OE1 GLN A 26 -12.107 8.159 -8.606 1.00 0.00 O ATOM 68 NE2 GLN A 26 -13.169 10.037 -7.961 1.00 0.00 N ATOM 0 HA GLN A 26 -8.901 8.768 -7.215 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.385 11.157 -6.144 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -10.440 10.800 -7.859 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -10.839 8.333 -6.381 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -11.931 9.550 -5.749 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -13.225 10.793 -7.278 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -13.825 10.004 -8.741 1.00 0.00 H new ATOM 75 N LYS A 27 -7.345 11.635 -6.995 1.00 0.00 N ATOM 76 CA LYS A 27 -6.396 12.512 -7.660 1.00 0.00 C ATOM 77 C LYS A 27 -4.973 12.059 -7.330 1.00 0.00 C ATOM 78 O LYS A 27 -4.040 12.862 -7.357 1.00 0.00 O ATOM 79 CB LYS A 27 -6.675 13.973 -7.304 1.00 0.00 C ATOM 80 CG LYS A 27 -8.178 14.228 -7.172 1.00 0.00 C ATOM 81 CD LYS A 27 -8.893 13.996 -8.504 1.00 0.00 C ATOM 82 CE LYS A 27 -10.356 13.604 -8.282 1.00 0.00 C ATOM 83 NZ LYS A 27 -11.204 14.812 -8.171 1.00 0.00 N ATOM 0 H LYS A 27 -7.547 11.882 -6.026 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.509 12.446 -8.742 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.176 14.225 -6.368 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -6.258 14.624 -8.072 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.597 13.569 -6.411 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -8.349 15.251 -6.837 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -8.843 14.901 -9.110 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.383 13.211 -9.062 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.702 12.984 -9.109 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.445 13.005 -7.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.193 14.529 -8.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -10.883 15.389 -7.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.132 15.368 -9.047 1.00 0.00 H new ATOM 93 N ASN A 28 -4.849 10.776 -7.025 1.00 0.00 N ATOM 94 CA ASN A 28 -3.554 10.208 -6.690 1.00 0.00 C ATOM 95 C ASN A 28 -3.507 8.751 -7.154 1.00 0.00 C ATOM 96 O ASN A 28 -2.646 7.985 -6.722 1.00 0.00 O ATOM 97 CB ASN A 28 -3.318 10.229 -5.179 1.00 0.00 C ATOM 98 CG ASN A 28 -2.106 11.094 -4.826 1.00 0.00 C ATOM 99 OD1 ASN A 28 -1.274 10.739 -4.008 1.00 0.00 O ATOM 100 ND2 ASN A 28 -2.053 12.247 -5.487 1.00 0.00 N ATOM 0 H ASN A 28 -5.624 10.113 -7.003 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.786 10.804 -7.184 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -4.204 10.614 -4.674 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -3.162 9.213 -4.817 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -1.283 12.895 -5.322 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.783 12.484 -6.159 1.00 0.00 H new ATOM 106 N ILE A 29 -4.442 8.411 -8.030 1.00 0.00 N ATOM 107 CA ILE A 29 -4.516 7.059 -8.558 1.00 0.00 C ATOM 108 C ILE A 29 -4.078 7.064 -10.024 1.00 0.00 C ATOM 109 O ILE A 29 -3.152 7.783 -10.396 1.00 0.00 O ATOM 110 CB ILE A 29 -5.913 6.473 -8.335 1.00 0.00 C ATOM 111 CG1 ILE A 29 -6.996 7.518 -8.613 1.00 0.00 C ATOM 112 CG2 ILE A 29 -6.039 5.875 -6.932 1.00 0.00 C ATOM 113 CD1 ILE A 29 -7.071 7.847 -10.104 1.00 0.00 C ATOM 0 H ILE A 29 -5.154 9.048 -8.387 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.830 6.402 -8.022 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.060 5.660 -9.046 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -7.962 7.146 -8.270 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.785 8.425 -8.047 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.041 5.466 -6.800 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.303 5.081 -6.808 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.863 6.652 -6.188 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.848 8.592 -10.274 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -6.111 8.241 -10.438 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.307 6.943 -10.665 1.00 0.00 H new ATOM 124 N ASP A 30 -4.765 6.253 -10.816 1.00 0.00 N ATOM 125 CA ASP A 30 -4.458 6.155 -12.232 1.00 0.00 C ATOM 126 C ASP A 30 -5.644 5.526 -12.965 1.00 0.00 C ATOM 127 O ASP A 30 -6.422 6.227 -13.612 1.00 0.00 O ATOM 128 CB ASP A 30 -3.233 5.270 -12.470 1.00 0.00 C ATOM 129 CG ASP A 30 -3.263 4.459 -13.768 1.00 0.00 C ATOM 130 OD1 ASP A 30 -3.401 5.098 -14.833 1.00 0.00 O ATOM 131 OD2 ASP A 30 -3.148 3.219 -13.665 1.00 0.00 O ATOM 0 H ASP A 30 -5.533 5.658 -10.503 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.255 7.160 -12.603 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -2.344 5.900 -12.473 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -3.133 4.581 -11.631 1.00 0.00 H new ATOM 135 N GLY A 31 -5.748 4.211 -12.838 1.00 0.00 N ATOM 136 CA GLY A 31 -6.828 3.480 -13.480 1.00 0.00 C ATOM 137 C GLY A 31 -7.919 3.117 -12.471 1.00 0.00 C ATOM 138 O GLY A 31 -8.766 2.268 -12.746 1.00 0.00 O ATOM 0 H GLY A 31 -5.102 3.633 -12.300 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -7.255 4.084 -14.281 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.435 2.573 -13.939 1.00 0.00 H new ATOM 142 N TRP A 32 -7.865 3.778 -11.325 1.00 0.00 N ATOM 143 CA TRP A 32 -8.838 3.536 -10.273 1.00 0.00 C ATOM 144 C TRP A 32 -9.320 2.089 -10.400 1.00 0.00 C ATOM 145 O TRP A 32 -8.643 1.165 -9.949 1.00 0.00 O ATOM 146 CB TRP A 32 -9.979 4.554 -10.337 1.00 0.00 C ATOM 147 CG TRP A 32 -11.196 4.178 -9.491 1.00 0.00 C ATOM 148 CD1 TRP A 32 -12.392 3.745 -9.912 1.00 0.00 C ATOM 149 CD2 TRP A 32 -11.289 4.218 -8.052 1.00 0.00 C ATOM 150 NE1 TRP A 32 -13.246 3.505 -8.855 1.00 0.00 N ATOM 151 CE2 TRP A 32 -12.553 3.801 -7.687 1.00 0.00 C ATOM 152 CE3 TRP A 32 -10.335 4.593 -7.089 1.00 0.00 C ATOM 153 CZ2 TRP A 32 -12.979 3.721 -6.356 1.00 0.00 C ATOM 154 CZ3 TRP A 32 -10.776 4.507 -5.764 1.00 0.00 C ATOM 155 CH2 TRP A 32 -12.046 4.090 -5.379 1.00 0.00 C ATOM 0 H TRP A 32 -7.162 4.482 -11.101 1.00 0.00 H new ATOM 0 HA TRP A 32 -8.385 3.668 -9.290 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -9.606 5.524 -10.008 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -10.292 4.669 -11.375 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -12.655 3.602 -10.950 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -14.208 3.172 -8.919 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -9.340 4.922 -7.352 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -13.974 3.392 -6.096 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -10.081 4.784 -4.985 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -12.311 4.051 -4.333 1.00 0.00 H new ATOM 300 N PHE A 44 -11.855 1.546 2.554 1.00 0.00 N ATOM 301 CA PHE A 44 -10.554 1.996 3.016 1.00 0.00 C ATOM 302 C PHE A 44 -10.255 1.461 4.418 1.00 0.00 C ATOM 303 O PHE A 44 -11.004 1.723 5.358 1.00 0.00 O ATOM 304 CB PHE A 44 -10.601 3.524 3.065 1.00 0.00 C ATOM 305 CG PHE A 44 -9.911 4.129 4.290 1.00 0.00 C ATOM 306 CD1 PHE A 44 -8.582 3.928 4.492 1.00 0.00 C ATOM 307 CD2 PHE A 44 -10.629 4.868 5.179 1.00 0.00 C ATOM 308 CE1 PHE A 44 -7.942 4.489 5.629 1.00 0.00 C ATOM 309 CE2 PHE A 44 -9.990 5.429 6.315 1.00 0.00 C ATOM 310 CZ PHE A 44 -8.660 5.228 6.516 1.00 0.00 C ATOM 0 HA PHE A 44 -9.775 1.634 2.345 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.133 3.921 2.164 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.642 3.846 3.051 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -8.012 3.341 3.787 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -11.685 5.028 5.020 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -6.886 4.329 5.789 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -10.560 6.016 7.020 1.00 0.00 H new ATOM 0 HZ PHE A 44 -8.174 5.656 7.381 1.00 0.00 H new ATOM 319 N ILE A 45 -9.159 0.723 4.514 1.00 0.00 N ATOM 320 CA ILE A 45 -8.752 0.149 5.786 1.00 0.00 C ATOM 321 C ILE A 45 -7.834 1.133 6.514 1.00 0.00 C ATOM 322 O ILE A 45 -8.201 1.674 7.556 1.00 0.00 O ATOM 323 CB ILE A 45 -8.130 -1.233 5.576 1.00 0.00 C ATOM 324 CG1 ILE A 45 -9.172 -2.233 5.074 1.00 0.00 C ATOM 325 CG2 ILE A 45 -7.434 -1.720 6.848 1.00 0.00 C ATOM 326 CD1 ILE A 45 -9.710 -3.088 6.222 1.00 0.00 C ATOM 0 H ILE A 45 -8.540 0.509 3.732 1.00 0.00 H new ATOM 0 HA ILE A 45 -9.619 -0.012 6.426 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.366 -1.150 4.803 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -9.994 -1.699 4.598 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.727 -2.876 4.314 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -7.001 -2.704 6.671 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -6.645 -1.020 7.122 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.160 -1.783 7.659 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -10.449 -3.790 5.837 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -8.889 -3.640 6.680 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -10.176 -2.444 6.968 1.00 0.00 H new ATOM 337 N MET A 46 -6.659 1.335 5.936 1.00 0.00 N ATOM 338 CA MET A 46 -5.687 2.245 6.516 1.00 0.00 C ATOM 339 C MET A 46 -4.905 2.980 5.427 1.00 0.00 C ATOM 340 O MET A 46 -4.572 2.398 4.396 1.00 0.00 O ATOM 341 CB MET A 46 -4.716 1.458 7.399 1.00 0.00 C ATOM 342 CG MET A 46 -3.938 0.428 6.577 1.00 0.00 C ATOM 343 SD MET A 46 -2.194 0.553 6.934 1.00 0.00 S ATOM 344 CE MET A 46 -1.522 -0.225 5.474 1.00 0.00 C ATOM 0 H MET A 46 -6.358 0.884 5.072 1.00 0.00 H new ATOM 0 HA MET A 46 -6.220 2.984 7.114 1.00 0.00 H new ATOM 0 HB2 MET A 46 -4.020 2.144 7.881 1.00 0.00 H new ATOM 0 HB3 MET A 46 -5.268 0.954 8.192 1.00 0.00 H new ATOM 0 HG2 MET A 46 -4.294 -0.576 6.807 1.00 0.00 H new ATOM 0 HG3 MET A 46 -4.113 0.592 5.514 1.00 0.00 H new ATOM 0 HE1 MET A 46 -0.434 -0.231 5.533 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.888 -1.250 5.407 1.00 0.00 H new ATOM 0 HE3 MET A 46 -1.834 0.330 4.590 1.00 0.00 H new ATOM 352 N GLU A 47 -4.634 4.250 5.692 1.00 0.00 N ATOM 353 CA GLU A 47 -3.897 5.071 4.747 1.00 0.00 C ATOM 354 C GLU A 47 -2.504 5.392 5.294 1.00 0.00 C ATOM 355 O GLU A 47 -2.353 5.691 6.477 1.00 0.00 O ATOM 356 CB GLU A 47 -4.665 6.353 4.418 1.00 0.00 C ATOM 357 CG GLU A 47 -4.744 7.273 5.638 1.00 0.00 C ATOM 358 CD GLU A 47 -6.199 7.567 6.009 1.00 0.00 C ATOM 359 OE1 GLU A 47 -6.969 7.882 5.077 1.00 0.00 O ATOM 360 OE2 GLU A 47 -6.507 7.472 7.217 1.00 0.00 O ATOM 0 H GLU A 47 -4.912 4.730 6.548 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.781 4.508 3.821 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.174 6.874 3.596 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.671 6.102 4.081 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.236 6.807 6.483 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.222 8.207 5.428 1.00 0.00 H new ATOM 365 N GLY A 48 -1.523 5.317 4.406 1.00 0.00 N ATOM 366 CA GLY A 48 -0.149 5.596 4.785 1.00 0.00 C ATOM 367 C GLY A 48 0.761 5.644 3.556 1.00 0.00 C ATOM 368 O GLY A 48 0.380 5.185 2.480 1.00 0.00 O ATOM 0 H GLY A 48 -1.653 5.067 3.426 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.100 6.547 5.315 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.205 4.829 5.474 1.00 0.00 H new ATOM 372 N THR A 49 1.945 6.203 3.757 1.00 0.00 N ATOM 373 CA THR A 49 2.911 6.317 2.678 1.00 0.00 C ATOM 374 C THR A 49 4.149 5.468 2.978 1.00 0.00 C ATOM 375 O THR A 49 4.872 5.737 3.936 1.00 0.00 O ATOM 376 CB THR A 49 3.226 7.800 2.479 1.00 0.00 C ATOM 377 OG1 THR A 49 2.175 8.473 3.167 1.00 0.00 O ATOM 378 CG2 THR A 49 3.062 8.243 1.024 1.00 0.00 C ATOM 0 H THR A 49 2.257 6.582 4.651 1.00 0.00 H new ATOM 0 HA THR A 49 2.507 5.928 1.744 1.00 0.00 H new ATOM 0 HB THR A 49 4.246 8.002 2.807 1.00 0.00 H new ATOM 0 HG1 THR A 49 2.302 9.442 3.091 1.00 0.00 H new ATOM 0 HG21 THR A 49 3.298 9.304 0.938 1.00 0.00 H new ATOM 0 HG22 THR A 49 3.738 7.669 0.390 1.00 0.00 H new ATOM 0 HG23 THR A 49 2.034 8.073 0.706 1.00 0.00 H new ATOM 386 N LEU A 50 4.353 4.461 2.144 1.00 0.00 N ATOM 387 CA LEU A 50 5.491 3.571 2.308 1.00 0.00 C ATOM 388 C LEU A 50 6.450 3.755 1.130 1.00 0.00 C ATOM 389 O LEU A 50 6.017 3.908 -0.011 1.00 0.00 O ATOM 390 CB LEU A 50 5.019 2.128 2.497 1.00 0.00 C ATOM 391 CG LEU A 50 4.129 1.868 3.714 1.00 0.00 C ATOM 392 CD1 LEU A 50 2.684 2.287 3.435 1.00 0.00 C ATOM 393 CD2 LEU A 50 4.226 0.409 4.164 1.00 0.00 C ATOM 0 H LEU A 50 3.750 4.240 1.352 1.00 0.00 H new ATOM 0 HA LEU A 50 6.045 3.822 3.213 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.475 1.824 1.602 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.897 1.486 2.570 1.00 0.00 H new ATOM 0 HG LEU A 50 4.490 2.483 4.538 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.072 2.092 4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.653 3.351 3.200 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.297 1.717 2.590 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.584 0.252 5.030 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.906 -0.244 3.352 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.257 0.178 4.431 1.00 0.00 H new ATOM 404 N THR A 51 7.736 3.733 1.447 1.00 0.00 N ATOM 405 CA THR A 51 8.761 3.894 0.431 1.00 0.00 C ATOM 406 C THR A 51 9.363 2.538 0.059 1.00 0.00 C ATOM 407 O THR A 51 9.504 1.663 0.912 1.00 0.00 O ATOM 408 CB THR A 51 9.794 4.895 0.954 1.00 0.00 C ATOM 409 OG1 THR A 51 9.514 6.092 0.234 1.00 0.00 O ATOM 410 CG2 THR A 51 11.221 4.535 0.537 1.00 0.00 C ATOM 0 H THR A 51 8.092 3.606 2.395 1.00 0.00 H new ATOM 0 HA THR A 51 8.341 4.292 -0.493 1.00 0.00 H new ATOM 0 HB THR A 51 9.734 4.943 2.041 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.137 6.795 0.513 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.914 5.277 0.934 1.00 0.00 H new ATOM 0 HG22 THR A 51 11.478 3.551 0.930 1.00 0.00 H new ATOM 0 HG23 THR A 51 11.289 4.520 -0.551 1.00 0.00 H new ATOM 418 N ARG A 52 9.703 2.406 -1.214 1.00 0.00 N ATOM 419 CA ARG A 52 10.287 1.170 -1.709 1.00 0.00 C ATOM 420 C ARG A 52 11.814 1.263 -1.695 1.00 0.00 C ATOM 421 O ARG A 52 12.404 1.974 -2.507 1.00 0.00 O ATOM 422 CB ARG A 52 9.814 0.868 -3.132 1.00 0.00 C ATOM 423 CG ARG A 52 10.330 1.919 -4.116 1.00 0.00 C ATOM 424 CD ARG A 52 11.403 1.330 -5.035 1.00 0.00 C ATOM 425 NE ARG A 52 10.767 0.616 -6.164 1.00 0.00 N ATOM 426 CZ ARG A 52 11.346 -0.382 -6.843 1.00 0.00 C ATOM 427 NH1 ARG A 52 12.579 -0.791 -6.513 1.00 0.00 N ATOM 428 NH2 ARG A 52 10.694 -0.973 -7.853 1.00 0.00 N ATOM 0 H ARG A 52 9.586 3.134 -1.918 1.00 0.00 H new ATOM 0 HA ARG A 52 9.962 0.363 -1.052 1.00 0.00 H new ATOM 0 HB2 ARG A 52 10.163 -0.120 -3.433 1.00 0.00 H new ATOM 0 HB3 ARG A 52 8.725 0.843 -3.159 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.502 2.299 -4.715 1.00 0.00 H new ATOM 0 HG3 ARG A 52 10.741 2.766 -3.567 1.00 0.00 H new ATOM 0 HD2 ARG A 52 12.046 2.125 -5.413 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.039 0.646 -4.473 1.00 0.00 H new ATOM 0 HE ARG A 52 9.828 0.902 -6.443 1.00 0.00 H new ATOM 0 HH11 ARG A 52 13.077 -0.342 -5.744 1.00 0.00 H new ATOM 0 HH12 ARG A 52 13.020 -1.551 -7.031 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.756 -0.663 -8.105 1.00 0.00 H new ATOM 0 HH22 ARG A 52 11.136 -1.733 -8.370 1.00 0.00 H new ATOM 439 N VAL A 53 12.412 0.533 -0.764 1.00 0.00 N ATOM 440 CA VAL A 53 13.858 0.524 -0.634 1.00 0.00 C ATOM 441 C VAL A 53 14.442 -0.554 -1.551 1.00 0.00 C ATOM 442 O VAL A 53 14.916 -1.585 -1.078 1.00 0.00 O ATOM 443 CB VAL A 53 14.251 0.337 0.833 1.00 0.00 C ATOM 444 CG1 VAL A 53 15.616 -0.344 0.953 1.00 0.00 C ATOM 445 CG2 VAL A 53 14.237 1.673 1.578 1.00 0.00 C ATOM 0 H VAL A 53 11.920 -0.056 -0.093 1.00 0.00 H new ATOM 0 HA VAL A 53 14.275 1.480 -0.949 1.00 0.00 H new ATOM 0 HB VAL A 53 13.511 -0.314 1.298 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.871 -0.465 2.006 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.578 -1.323 0.474 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.373 0.270 0.464 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.520 1.512 2.618 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.945 2.357 1.111 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.236 2.102 1.536 1.00 0.00 H new ATOM 455 N GLY A 54 14.386 -0.278 -2.846 1.00 0.00 N ATOM 456 CA GLY A 54 14.903 -1.211 -3.832 1.00 0.00 C ATOM 457 C GLY A 54 15.294 -0.485 -5.121 1.00 0.00 C ATOM 458 O GLY A 54 15.388 -1.102 -6.181 1.00 0.00 O ATOM 0 H GLY A 54 13.991 0.578 -3.235 1.00 0.00 H new ATOM 0 HA2 GLY A 54 15.770 -1.731 -3.426 1.00 0.00 H new ATOM 0 HA3 GLY A 54 14.150 -1.969 -4.051 1.00 0.00 H new ATOM 462 N ALA A 55 15.510 0.815 -4.988 1.00 0.00 N ATOM 463 CA ALA A 55 15.889 1.631 -6.129 1.00 0.00 C ATOM 464 C ALA A 55 15.836 3.109 -5.734 1.00 0.00 C ATOM 465 O ALA A 55 16.510 3.941 -6.337 1.00 0.00 O ATOM 466 CB ALA A 55 14.973 1.312 -7.312 1.00 0.00 C ATOM 0 H ALA A 55 15.430 1.324 -4.108 1.00 0.00 H new ATOM 0 HA ALA A 55 16.910 1.408 -6.437 1.00 0.00 H new ATOM 0 HB1 ALA A 55 15.257 1.924 -8.168 1.00 0.00 H new ATOM 0 HB2 ALA A 55 15.068 0.258 -7.572 1.00 0.00 H new ATOM 0 HB3 ALA A 55 13.939 1.526 -7.040 1.00 0.00 H new ATOM 472 N LYS A 56 15.026 3.389 -4.723 1.00 0.00 N ATOM 473 CA LYS A 56 14.876 4.751 -4.240 1.00 0.00 C ATOM 474 C LYS A 56 13.606 5.362 -4.837 1.00 0.00 C ATOM 475 O LYS A 56 13.679 6.190 -5.744 1.00 0.00 O ATOM 476 CB LYS A 56 16.141 5.563 -4.523 1.00 0.00 C ATOM 477 CG LYS A 56 16.279 6.726 -3.539 1.00 0.00 C ATOM 478 CD LYS A 56 17.527 7.557 -3.844 1.00 0.00 C ATOM 479 CE LYS A 56 18.061 8.228 -2.577 1.00 0.00 C ATOM 480 NZ LYS A 56 17.705 9.665 -2.562 1.00 0.00 N ATOM 0 H LYS A 56 14.467 2.696 -4.225 1.00 0.00 H new ATOM 0 HA LYS A 56 14.756 4.760 -3.157 1.00 0.00 H new ATOM 0 HB2 LYS A 56 17.016 4.916 -4.452 1.00 0.00 H new ATOM 0 HB3 LYS A 56 16.110 5.947 -5.543 1.00 0.00 H new ATOM 0 HG2 LYS A 56 15.394 7.360 -3.593 1.00 0.00 H new ATOM 0 HG3 LYS A 56 16.334 6.341 -2.521 1.00 0.00 H new ATOM 0 HD2 LYS A 56 18.298 6.918 -4.274 1.00 0.00 H new ATOM 0 HD3 LYS A 56 17.290 8.316 -4.590 1.00 0.00 H new ATOM 0 HE2 LYS A 56 17.648 7.736 -1.696 1.00 0.00 H new ATOM 0 HE3 LYS A 56 19.144 8.115 -2.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 18.075 10.105 -1.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 18.119 10.134 -3.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 16.670 9.767 -2.587 1.00 0.00 H new ATOM 490 N HIS A 57 12.473 4.931 -4.304 1.00 0.00 N ATOM 491 CA HIS A 57 11.190 5.425 -4.773 1.00 0.00 C ATOM 492 C HIS A 57 10.184 5.416 -3.619 1.00 0.00 C ATOM 493 O HIS A 57 10.362 4.693 -2.641 1.00 0.00 O ATOM 494 CB HIS A 57 10.709 4.625 -5.985 1.00 0.00 C ATOM 495 CG HIS A 57 11.526 4.853 -7.234 1.00 0.00 C ATOM 496 ND1 HIS A 57 12.836 4.424 -7.361 1.00 0.00 N ATOM 497 CD2 HIS A 57 11.206 5.468 -8.409 1.00 0.00 C ATOM 498 CE1 HIS A 57 13.274 4.770 -8.562 1.00 0.00 C ATOM 499 NE2 HIS A 57 12.263 5.417 -9.210 1.00 0.00 N ATOM 0 H HIS A 57 12.417 4.245 -3.551 1.00 0.00 H new ATOM 0 HA HIS A 57 11.295 6.456 -5.110 1.00 0.00 H new ATOM 0 HB2 HIS A 57 10.730 3.563 -5.738 1.00 0.00 H new ATOM 0 HB3 HIS A 57 9.670 4.885 -6.190 1.00 0.00 H new ATOM 0 HD2 HIS A 57 10.254 5.920 -8.647 1.00 0.00 H new ATOM 0 HE1 HIS A 57 14.259 4.574 -8.959 1.00 0.00 H new ATOM 0 HE2 HIS A 57 12.311 5.799 -10.155 1.00 0.00 H new ATOM 506 N GLU A 58 9.148 6.229 -3.774 1.00 0.00 N ATOM 507 CA GLU A 58 8.114 6.323 -2.757 1.00 0.00 C ATOM 508 C GLU A 58 6.738 6.069 -3.376 1.00 0.00 C ATOM 509 O GLU A 58 6.583 6.115 -4.594 1.00 0.00 O ATOM 510 CB GLU A 58 8.157 7.682 -2.056 1.00 0.00 C ATOM 511 CG GLU A 58 7.888 8.818 -3.045 1.00 0.00 C ATOM 512 CD GLU A 58 8.592 10.104 -2.606 1.00 0.00 C ATOM 513 OE1 GLU A 58 9.825 10.039 -2.414 1.00 0.00 O ATOM 514 OE2 GLU A 58 7.880 11.123 -2.473 1.00 0.00 O ATOM 0 H GLU A 58 9.003 6.827 -4.587 1.00 0.00 H new ATOM 0 HA GLU A 58 8.300 5.557 -2.004 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.415 7.707 -1.258 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.132 7.824 -1.590 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.234 8.530 -4.038 1.00 0.00 H new ATOM 0 HG3 GLU A 58 6.815 8.994 -3.120 1.00 0.00 H new ATOM 519 N ARG A 59 5.773 5.805 -2.506 1.00 0.00 N ATOM 520 CA ARG A 59 4.415 5.543 -2.952 1.00 0.00 C ATOM 521 C ARG A 59 3.441 5.652 -1.776 1.00 0.00 C ATOM 522 O ARG A 59 3.757 5.237 -0.662 1.00 0.00 O ATOM 523 CB ARG A 59 4.299 4.151 -3.575 1.00 0.00 C ATOM 524 CG ARG A 59 5.263 3.169 -2.906 1.00 0.00 C ATOM 525 CD ARG A 59 5.138 1.773 -3.521 1.00 0.00 C ATOM 526 NE ARG A 59 6.148 1.600 -4.590 1.00 0.00 N ATOM 527 CZ ARG A 59 6.530 0.411 -5.077 1.00 0.00 C ATOM 528 NH1 ARG A 59 5.989 -0.715 -4.593 1.00 0.00 N ATOM 529 NH2 ARG A 59 7.453 0.350 -6.046 1.00 0.00 N ATOM 0 H ARG A 59 5.905 5.767 -1.495 1.00 0.00 H new ATOM 0 HA ARG A 59 4.163 6.288 -3.707 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.276 3.788 -3.474 1.00 0.00 H new ATOM 0 HB3 ARG A 59 4.514 4.207 -4.642 1.00 0.00 H new ATOM 0 HG2 ARG A 59 6.287 3.528 -3.014 1.00 0.00 H new ATOM 0 HG3 ARG A 59 5.054 3.120 -1.837 1.00 0.00 H new ATOM 0 HD2 ARG A 59 5.277 1.014 -2.752 1.00 0.00 H new ATOM 0 HD3 ARG A 59 4.137 1.634 -3.929 1.00 0.00 H new ATOM 0 HE ARG A 59 6.580 2.438 -4.980 1.00 0.00 H new ATOM 0 HH11 ARG A 59 5.287 -0.667 -3.855 1.00 0.00 H new ATOM 0 HH12 ARG A 59 6.279 -1.620 -4.963 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.865 1.208 -6.413 1.00 0.00 H new ATOM 0 HH22 ARG A 59 7.744 -0.555 -6.417 1.00 0.00 H new ATOM 540 N HIS A 60 2.276 6.212 -2.065 1.00 0.00 N ATOM 541 CA HIS A 60 1.253 6.379 -1.046 1.00 0.00 C ATOM 542 C HIS A 60 0.383 5.123 -0.981 1.00 0.00 C ATOM 543 O HIS A 60 -0.559 4.974 -1.757 1.00 0.00 O ATOM 544 CB HIS A 60 0.440 7.651 -1.297 1.00 0.00 C ATOM 545 CG HIS A 60 -0.748 7.812 -0.379 1.00 0.00 C ATOM 546 ND1 HIS A 60 -0.621 8.125 0.963 1.00 0.00 N ATOM 547 CD2 HIS A 60 -2.085 7.700 -0.624 1.00 0.00 C ATOM 548 CE1 HIS A 60 -1.834 8.195 1.492 1.00 0.00 C ATOM 549 NE2 HIS A 60 -2.740 7.931 0.507 1.00 0.00 N ATOM 0 H HIS A 60 2.017 6.556 -2.990 1.00 0.00 H new ATOM 0 HA HIS A 60 1.723 6.504 -0.070 1.00 0.00 H new ATOM 0 HB2 HIS A 60 1.094 8.516 -1.184 1.00 0.00 H new ATOM 0 HB3 HIS A 60 0.091 7.649 -2.329 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -2.535 7.463 -1.577 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -2.065 8.421 2.522 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -3.753 7.914 0.621 1.00 0.00 H new ATOM 556 N ILE A 61 0.730 4.251 -0.045 1.00 0.00 N ATOM 557 CA ILE A 61 -0.008 3.012 0.134 1.00 0.00 C ATOM 558 C ILE A 61 -1.419 3.330 0.631 1.00 0.00 C ATOM 559 O ILE A 61 -1.652 4.388 1.213 1.00 0.00 O ATOM 560 CB ILE A 61 0.763 2.055 1.045 1.00 0.00 C ATOM 561 CG1 ILE A 61 2.215 1.908 0.582 1.00 0.00 C ATOM 562 CG2 ILE A 61 0.054 0.703 1.147 1.00 0.00 C ATOM 563 CD1 ILE A 61 2.282 1.540 -0.902 1.00 0.00 C ATOM 0 H ILE A 61 1.512 4.378 0.597 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.115 2.493 -0.818 1.00 0.00 H new ATOM 0 HB ILE A 61 0.786 2.482 2.048 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.752 2.841 0.754 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.713 1.140 1.174 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.623 0.042 1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.945 0.846 1.558 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.022 0.256 0.156 1.00 0.00 H new ATOM 0 HD11 ILE A 61 3.324 1.442 -1.206 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.765 0.594 -1.066 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.804 2.322 -1.493 1.00 0.00 H new ATOM 574 N PHE A 62 -2.325 2.396 0.383 1.00 0.00 N ATOM 575 CA PHE A 62 -3.708 2.564 0.797 1.00 0.00 C ATOM 576 C PHE A 62 -4.475 1.244 0.694 1.00 0.00 C ATOM 577 O PHE A 62 -5.035 0.929 -0.355 1.00 0.00 O ATOM 578 CB PHE A 62 -4.339 3.583 -0.152 1.00 0.00 C ATOM 579 CG PHE A 62 -5.079 4.718 0.556 1.00 0.00 C ATOM 580 CD1 PHE A 62 -6.075 4.435 1.437 1.00 0.00 C ATOM 581 CD2 PHE A 62 -4.741 6.012 0.305 1.00 0.00 C ATOM 582 CE1 PHE A 62 -6.762 5.489 2.095 1.00 0.00 C ATOM 583 CE2 PHE A 62 -5.428 7.066 0.963 1.00 0.00 C ATOM 584 CZ PHE A 62 -6.424 6.782 1.844 1.00 0.00 C ATOM 0 H PHE A 62 -2.128 1.519 -0.100 1.00 0.00 H new ATOM 0 HA PHE A 62 -3.748 2.896 1.834 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.558 4.009 -0.782 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -5.035 3.066 -0.813 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -6.344 3.408 1.636 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.950 6.237 -0.395 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -7.553 5.264 2.795 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -5.160 8.093 0.764 1.00 0.00 H new ATOM 0 HZ PHE A 62 -6.947 7.584 2.345 1.00 0.00 H new ATOM 593 N LEU A 63 -4.475 0.509 1.796 1.00 0.00 N ATOM 594 CA LEU A 63 -5.165 -0.769 1.843 1.00 0.00 C ATOM 595 C LEU A 63 -6.658 -0.530 2.070 1.00 0.00 C ATOM 596 O LEU A 63 -7.042 0.208 2.977 1.00 0.00 O ATOM 597 CB LEU A 63 -4.523 -1.687 2.886 1.00 0.00 C ATOM 598 CG LEU A 63 -5.423 -2.783 3.459 1.00 0.00 C ATOM 599 CD1 LEU A 63 -5.528 -3.966 2.495 1.00 0.00 C ATOM 600 CD2 LEU A 63 -4.945 -3.215 4.846 1.00 0.00 C ATOM 0 H LEU A 63 -4.008 0.774 2.663 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.067 -1.290 0.890 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -3.650 -2.160 2.437 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.163 -1.072 3.711 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.426 -2.374 3.577 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.173 -4.731 2.927 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -5.949 -3.628 1.548 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.536 -4.384 2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -5.602 -3.995 5.231 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.927 -3.599 4.777 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.964 -2.359 5.520 1.00 0.00 H new ATOM 611 N PHE A 64 -7.462 -1.168 1.231 1.00 0.00 N ATOM 612 CA PHE A 64 -8.906 -1.033 1.329 1.00 0.00 C ATOM 613 C PHE A 64 -9.533 -2.288 1.938 1.00 0.00 C ATOM 614 O PHE A 64 -8.962 -3.375 1.855 1.00 0.00 O ATOM 615 CB PHE A 64 -9.436 -0.851 -0.095 1.00 0.00 C ATOM 616 CG PHE A 64 -8.877 0.378 -0.815 1.00 0.00 C ATOM 617 CD1 PHE A 64 -8.121 1.280 -0.133 1.00 0.00 C ATOM 618 CD2 PHE A 64 -9.135 0.568 -2.136 1.00 0.00 C ATOM 619 CE1 PHE A 64 -7.602 2.421 -0.802 1.00 0.00 C ATOM 620 CE2 PHE A 64 -8.617 1.709 -2.804 1.00 0.00 C ATOM 621 CZ PHE A 64 -7.861 2.611 -2.123 1.00 0.00 C ATOM 0 H PHE A 64 -7.141 -1.780 0.481 1.00 0.00 H new ATOM 0 HA PHE A 64 -9.159 -0.187 1.968 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -9.196 -1.741 -0.677 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -10.523 -0.776 -0.060 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -7.915 1.129 0.916 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -9.734 -0.149 -2.678 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -7.002 3.137 -0.261 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -8.824 1.860 -3.853 1.00 0.00 H new ATOM 0 HZ PHE A 64 -7.466 3.478 -2.631 1.00 0.00 H new ATOM 630 N ASP A 65 -10.700 -2.098 2.535 1.00 0.00 N ATOM 631 CA ASP A 65 -11.411 -3.201 3.158 1.00 0.00 C ATOM 632 C ASP A 65 -11.924 -4.149 2.072 1.00 0.00 C ATOM 633 O ASP A 65 -12.587 -5.141 2.371 1.00 0.00 O ATOM 634 CB ASP A 65 -12.617 -2.700 3.955 1.00 0.00 C ATOM 635 CG ASP A 65 -12.273 -1.929 5.231 1.00 0.00 C ATOM 636 OD1 ASP A 65 -11.909 -0.741 5.096 1.00 0.00 O ATOM 637 OD2 ASP A 65 -12.382 -2.546 6.313 1.00 0.00 O ATOM 0 H ASP A 65 -11.171 -1.196 2.601 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.720 -3.710 3.831 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -13.218 -2.058 3.311 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -13.238 -3.555 4.221 1.00 0.00 H new ATOM 641 N GLY A 66 -11.597 -3.810 0.833 1.00 0.00 N ATOM 642 CA GLY A 66 -12.016 -4.619 -0.299 1.00 0.00 C ATOM 643 C GLY A 66 -10.810 -5.241 -1.005 1.00 0.00 C ATOM 644 O GLY A 66 -10.888 -6.362 -1.504 1.00 0.00 O ATOM 0 H GLY A 66 -11.047 -2.986 0.589 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.688 -5.406 0.041 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.576 -4.003 -1.003 1.00 0.00 H new ATOM 648 N LEU A 67 -9.721 -4.487 -1.024 1.00 0.00 N ATOM 649 CA LEU A 67 -8.500 -4.950 -1.661 1.00 0.00 C ATOM 650 C LEU A 67 -7.397 -3.908 -1.459 1.00 0.00 C ATOM 651 O LEU A 67 -7.648 -2.707 -1.553 1.00 0.00 O ATOM 652 CB LEU A 67 -8.758 -5.295 -3.129 1.00 0.00 C ATOM 653 CG LEU A 67 -7.987 -4.467 -4.158 1.00 0.00 C ATOM 654 CD1 LEU A 67 -6.609 -5.075 -4.430 1.00 0.00 C ATOM 655 CD2 LEU A 67 -8.800 -4.292 -5.442 1.00 0.00 C ATOM 0 H LEU A 67 -9.659 -3.558 -0.608 1.00 0.00 H new ATOM 0 HA LEU A 67 -8.156 -5.874 -1.196 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.515 -6.346 -3.283 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.824 -5.182 -3.326 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.824 -3.473 -3.743 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.082 -4.467 -5.165 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -6.035 -5.104 -3.504 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -6.728 -6.088 -4.815 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -8.229 -3.700 -6.157 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.016 -5.270 -5.872 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -9.736 -3.782 -5.214 1.00 0.00 H new ATOM 666 N MET A 68 -6.201 -4.405 -1.184 1.00 0.00 N ATOM 667 CA MET A 68 -5.059 -3.533 -0.968 1.00 0.00 C ATOM 668 C MET A 68 -4.602 -2.893 -2.280 1.00 0.00 C ATOM 669 O MET A 68 -4.595 -3.545 -3.324 1.00 0.00 O ATOM 670 CB MET A 68 -3.908 -4.338 -0.363 1.00 0.00 C ATOM 671 CG MET A 68 -2.816 -3.413 0.176 1.00 0.00 C ATOM 672 SD MET A 68 -1.231 -3.878 -0.501 1.00 0.00 S ATOM 673 CE MET A 68 -0.494 -2.265 -0.703 1.00 0.00 C ATOM 0 H MET A 68 -5.997 -5.401 -1.106 1.00 0.00 H new ATOM 0 HA MET A 68 -5.357 -2.739 -0.283 1.00 0.00 H new ATOM 0 HB2 MET A 68 -4.285 -4.969 0.442 1.00 0.00 H new ATOM 0 HB3 MET A 68 -3.487 -5.002 -1.118 1.00 0.00 H new ATOM 0 HG2 MET A 68 -3.043 -2.379 -0.085 1.00 0.00 H new ATOM 0 HG3 MET A 68 -2.786 -3.468 1.264 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.213 -2.289 -1.533 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.274 -1.532 -0.911 1.00 0.00 H new ATOM 0 HE3 MET A 68 0.030 -1.987 0.212 1.00 0.00 H new ATOM 681 N ILE A 69 -4.230 -1.625 -2.185 1.00 0.00 N ATOM 682 CA ILE A 69 -3.772 -0.890 -3.352 1.00 0.00 C ATOM 683 C ILE A 69 -2.658 0.074 -2.938 1.00 0.00 C ATOM 684 O ILE A 69 -2.586 0.483 -1.779 1.00 0.00 O ATOM 685 CB ILE A 69 -4.950 -0.206 -4.051 1.00 0.00 C ATOM 686 CG1 ILE A 69 -4.504 1.088 -4.735 1.00 0.00 C ATOM 687 CG2 ILE A 69 -6.105 0.028 -3.076 1.00 0.00 C ATOM 688 CD1 ILE A 69 -4.302 2.207 -3.711 1.00 0.00 C ATOM 0 H ILE A 69 -4.236 -1.088 -1.318 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.346 -1.572 -4.089 1.00 0.00 H new ATOM 0 HB ILE A 69 -5.319 -0.872 -4.831 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.575 0.915 -5.278 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.251 1.392 -5.469 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.929 0.515 -3.598 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.443 -0.928 -2.676 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.767 0.664 -2.258 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -3.985 3.116 -4.223 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.239 2.394 -3.187 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -3.538 1.910 -2.993 1.00 0.00 H new ATOM 699 N CYS A 70 -1.819 0.409 -3.906 1.00 0.00 N ATOM 700 CA CYS A 70 -0.713 1.318 -3.656 1.00 0.00 C ATOM 701 C CYS A 70 -0.512 2.184 -4.902 1.00 0.00 C ATOM 702 O CYS A 70 -0.629 1.697 -6.025 1.00 0.00 O ATOM 703 CB CYS A 70 0.563 0.564 -3.273 1.00 0.00 C ATOM 704 SG CYS A 70 1.042 -0.579 -4.619 1.00 0.00 S ATOM 0 H CYS A 70 -1.882 0.068 -4.865 1.00 0.00 H new ATOM 0 HA CYS A 70 -0.949 1.957 -2.805 1.00 0.00 H new ATOM 0 HB2 CYS A 70 1.370 1.272 -3.081 1.00 0.00 H new ATOM 0 HB3 CYS A 70 0.403 0.006 -2.351 1.00 0.00 H new ATOM 0 HG CYS A 70 2.024 -1.332 -4.220 1.00 0.00 H new ATOM 709 N CYS A 71 -0.212 3.451 -4.661 1.00 0.00 N ATOM 710 CA CYS A 71 0.007 4.389 -5.748 1.00 0.00 C ATOM 711 C CYS A 71 1.511 4.645 -5.867 1.00 0.00 C ATOM 712 O CYS A 71 2.164 4.993 -4.885 1.00 0.00 O ATOM 713 CB CYS A 71 -0.778 5.686 -5.544 1.00 0.00 C ATOM 714 SG CYS A 71 0.284 6.939 -4.737 1.00 0.00 S ATOM 0 H CYS A 71 -0.115 3.851 -3.727 1.00 0.00 H new ATOM 0 HA CYS A 71 -0.363 3.961 -6.680 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -1.132 6.061 -6.504 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.659 5.495 -4.932 1.00 0.00 H new ATOM 0 HG CYS A 71 0.468 7.939 -5.547 1.00 0.00 H new ATOM 719 N LYS A 72 2.016 4.462 -7.078 1.00 0.00 N ATOM 720 CA LYS A 72 3.430 4.668 -7.338 1.00 0.00 C ATOM 721 C LYS A 72 3.710 6.168 -7.452 1.00 0.00 C ATOM 722 O LYS A 72 3.196 6.833 -8.351 1.00 0.00 O ATOM 723 CB LYS A 72 3.873 3.865 -8.564 1.00 0.00 C ATOM 724 CG LYS A 72 5.378 3.592 -8.526 1.00 0.00 C ATOM 725 CD LYS A 72 5.834 2.857 -9.787 1.00 0.00 C ATOM 726 CE LYS A 72 7.277 2.369 -9.647 1.00 0.00 C ATOM 727 NZ LYS A 72 8.127 2.954 -10.707 1.00 0.00 N ATOM 0 H LYS A 72 1.471 4.173 -7.890 1.00 0.00 H new ATOM 0 HA LYS A 72 4.028 4.293 -6.507 1.00 0.00 H new ATOM 0 HB2 LYS A 72 3.329 2.921 -8.601 1.00 0.00 H new ATOM 0 HB3 LYS A 72 3.622 4.413 -9.472 1.00 0.00 H new ATOM 0 HG2 LYS A 72 5.920 4.533 -8.434 1.00 0.00 H new ATOM 0 HG3 LYS A 72 5.621 2.997 -7.646 1.00 0.00 H new ATOM 0 HD2 LYS A 72 5.176 2.008 -9.975 1.00 0.00 H new ATOM 0 HD3 LYS A 72 5.753 3.520 -10.648 1.00 0.00 H new ATOM 0 HE2 LYS A 72 7.667 2.644 -8.667 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.307 1.281 -9.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 8.878 2.281 -10.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 7.546 3.156 -11.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 8.555 3.837 -10.361 1.00 0.00 H new ATOM 737 N SER A 73 4.524 6.658 -6.528 1.00 0.00 N ATOM 738 CA SER A 73 4.878 8.067 -6.515 1.00 0.00 C ATOM 739 C SER A 73 6.381 8.231 -6.749 1.00 0.00 C ATOM 740 O SER A 73 7.187 7.924 -5.872 1.00 0.00 O ATOM 741 CB SER A 73 4.472 8.723 -5.194 1.00 0.00 C ATOM 742 OG SER A 73 3.082 8.561 -4.922 1.00 0.00 O ATOM 0 H SER A 73 4.948 6.104 -5.784 1.00 0.00 H new ATOM 0 HA SER A 73 4.336 8.564 -7.319 1.00 0.00 H new ATOM 0 HB2 SER A 73 5.053 8.290 -4.380 1.00 0.00 H new ATOM 0 HB3 SER A 73 4.713 9.785 -5.228 1.00 0.00 H new ATOM 0 HG SER A 73 2.580 9.296 -5.333 1.00 0.00 H new ATOM 747 N ASN A 74 6.712 8.716 -7.936 1.00 0.00 N ATOM 748 CA ASN A 74 8.104 8.924 -8.297 1.00 0.00 C ATOM 749 C ASN A 74 8.311 10.388 -8.692 1.00 0.00 C ATOM 750 O ASN A 74 8.535 10.694 -9.862 1.00 0.00 O ATOM 751 CB ASN A 74 8.502 8.052 -9.490 1.00 0.00 C ATOM 752 CG ASN A 74 7.907 6.649 -9.365 1.00 0.00 C ATOM 753 OD1 ASN A 74 8.033 6.114 -8.153 1.00 0.00 O flip ATOM 754 ND2 ASN A 74 7.370 6.088 -10.305 1.00 0.00 N flip ATOM 0 H ASN A 74 6.041 8.971 -8.660 1.00 0.00 H new ATOM 0 HA ASN A 74 8.718 8.658 -7.436 1.00 0.00 H new ATOM 0 HB2 ASN A 74 8.158 8.516 -10.415 1.00 0.00 H new ATOM 0 HB3 ASN A 74 9.588 7.986 -9.551 1.00 0.00 H new ATOM 0 HD21 ASN A 74 7.307 6.555 -11.209 1.00 0.00 H new ATOM 0 HD22 ASN A 74 6.984 5.151 -10.187 1.00 0.00 H new ATOM 899 N ALA A 86 -4.093 12.650 -10.156 1.00 0.00 N ATOM 900 CA ALA A 86 -3.594 11.294 -10.002 1.00 0.00 C ATOM 901 C ALA A 86 -2.148 11.227 -10.499 1.00 0.00 C ATOM 902 O ALA A 86 -1.775 10.294 -11.208 1.00 0.00 O ATOM 903 CB ALA A 86 -4.512 10.323 -10.748 1.00 0.00 C ATOM 0 HA ALA A 86 -3.596 11.002 -8.952 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -4.137 9.306 -10.632 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.520 10.387 -10.338 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.534 10.583 -11.806 1.00 0.00 H new ATOM 909 N GLU A 87 -1.375 12.229 -10.108 1.00 0.00 N ATOM 910 CA GLU A 87 0.021 12.295 -10.505 1.00 0.00 C ATOM 911 C GLU A 87 0.645 10.899 -10.489 1.00 0.00 C ATOM 912 O GLU A 87 1.356 10.521 -11.419 1.00 0.00 O ATOM 913 CB GLU A 87 0.802 13.255 -9.605 1.00 0.00 C ATOM 914 CG GLU A 87 0.201 14.662 -9.651 1.00 0.00 C ATOM 915 CD GLU A 87 1.280 15.726 -9.449 1.00 0.00 C ATOM 916 OE1 GLU A 87 2.304 15.638 -10.159 1.00 0.00 O ATOM 917 OE2 GLU A 87 1.056 16.605 -8.589 1.00 0.00 O ATOM 0 H GLU A 87 -1.689 13.002 -9.521 1.00 0.00 H new ATOM 0 HA GLU A 87 0.071 12.681 -11.523 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.794 12.886 -8.580 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.844 13.290 -9.923 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.294 14.819 -10.609 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.561 14.761 -8.878 1.00 0.00 H new ATOM 922 N TYR A 88 0.356 10.168 -9.422 1.00 0.00 N ATOM 923 CA TYR A 88 0.880 8.822 -9.272 1.00 0.00 C ATOM 924 C TYR A 88 0.013 7.810 -10.025 1.00 0.00 C ATOM 925 O TYR A 88 -0.845 8.192 -10.818 1.00 0.00 O ATOM 926 CB TYR A 88 0.823 8.511 -7.775 1.00 0.00 C ATOM 927 CG TYR A 88 1.458 9.585 -6.891 1.00 0.00 C ATOM 928 CD1 TYR A 88 2.632 10.198 -7.285 1.00 0.00 C ATOM 929 CD2 TYR A 88 0.860 9.942 -5.700 1.00 0.00 C ATOM 930 CE1 TYR A 88 3.230 11.209 -6.453 1.00 0.00 C ATOM 931 CE2 TYR A 88 1.460 10.955 -4.868 1.00 0.00 C ATOM 932 CZ TYR A 88 2.615 11.537 -5.287 1.00 0.00 C ATOM 933 OH TYR A 88 3.180 12.492 -4.500 1.00 0.00 O ATOM 0 H TYR A 88 -0.235 10.483 -8.653 1.00 0.00 H new ATOM 0 HA TYR A 88 1.891 8.757 -9.674 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.219 8.382 -7.481 1.00 0.00 H new ATOM 0 HB3 TYR A 88 1.326 7.561 -7.592 1.00 0.00 H new ATOM 0 HD1 TYR A 88 3.101 9.919 -8.217 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -0.057 9.463 -5.391 1.00 0.00 H new ATOM 0 HE1 TYR A 88 4.147 11.696 -6.749 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.003 11.245 -3.934 1.00 0.00 H new ATOM 0 HH TYR A 88 2.630 12.623 -3.699 1.00 0.00 H new ATOM 942 N ARG A 89 0.270 6.539 -9.750 1.00 0.00 N ATOM 943 CA ARG A 89 -0.475 5.470 -10.391 1.00 0.00 C ATOM 944 C ARG A 89 -0.877 4.412 -9.361 1.00 0.00 C ATOM 945 O ARG A 89 -0.019 3.761 -8.767 1.00 0.00 O ATOM 946 CB ARG A 89 0.350 4.808 -11.497 1.00 0.00 C ATOM 947 CG ARG A 89 -0.262 3.468 -11.911 1.00 0.00 C ATOM 948 CD ARG A 89 0.115 3.116 -13.351 1.00 0.00 C ATOM 949 NE ARG A 89 1.080 1.994 -13.362 1.00 0.00 N ATOM 950 CZ ARG A 89 0.735 0.706 -13.230 1.00 0.00 C ATOM 951 NH1 ARG A 89 -0.552 0.369 -13.078 1.00 0.00 N ATOM 952 NH2 ARG A 89 1.679 -0.246 -13.252 1.00 0.00 N ATOM 0 H ARG A 89 0.984 6.226 -9.092 1.00 0.00 H new ATOM 0 HA ARG A 89 -1.369 5.909 -10.835 1.00 0.00 H new ATOM 0 HB2 ARG A 89 0.403 5.470 -12.361 1.00 0.00 H new ATOM 0 HB3 ARG A 89 1.372 4.653 -11.150 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.083 2.683 -11.238 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -1.347 3.515 -11.816 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -0.778 2.844 -13.913 1.00 0.00 H new ATOM 0 HD3 ARG A 89 0.550 3.985 -13.845 1.00 0.00 H new ATOM 0 HE ARG A 89 2.069 2.215 -13.477 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -1.270 1.093 -13.063 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -0.814 -0.612 -12.978 1.00 0.00 H new ATOM 0 HH21 ARG A 89 2.659 0.010 -13.369 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.417 -1.227 -13.152 1.00 0.00 H new ATOM 963 N LEU A 90 -2.183 4.272 -9.182 1.00 0.00 N ATOM 964 CA LEU A 90 -2.709 3.304 -8.236 1.00 0.00 C ATOM 965 C LEU A 90 -2.436 1.891 -8.753 1.00 0.00 C ATOM 966 O LEU A 90 -2.517 1.638 -9.955 1.00 0.00 O ATOM 967 CB LEU A 90 -4.187 3.580 -7.951 1.00 0.00 C ATOM 968 CG LEU A 90 -5.187 2.655 -8.647 1.00 0.00 C ATOM 969 CD1 LEU A 90 -4.924 2.595 -10.153 1.00 0.00 C ATOM 970 CD2 LEU A 90 -5.185 1.265 -8.008 1.00 0.00 C ATOM 0 H LEU A 90 -2.892 4.813 -9.677 1.00 0.00 H new ATOM 0 HA LEU A 90 -2.201 3.396 -7.276 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.348 3.513 -6.875 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.408 4.607 -8.243 1.00 0.00 H new ATOM 0 HG LEU A 90 -6.186 3.070 -8.512 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.649 1.930 -10.623 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -5.018 3.594 -10.579 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.917 2.218 -10.332 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.905 0.627 -8.522 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.190 0.828 -8.090 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.459 1.348 -6.956 1.00 0.00 H new ATOM 981 N LYS A 91 -2.119 1.004 -7.821 1.00 0.00 N ATOM 982 CA LYS A 91 -1.833 -0.379 -8.168 1.00 0.00 C ATOM 983 C LYS A 91 -2.835 -1.294 -7.462 1.00 0.00 C ATOM 984 O LYS A 91 -3.399 -0.926 -6.433 1.00 0.00 O ATOM 985 CB LYS A 91 -0.373 -0.716 -7.865 1.00 0.00 C ATOM 986 CG LYS A 91 0.517 -0.441 -9.079 1.00 0.00 C ATOM 987 CD LYS A 91 1.687 -1.425 -9.138 1.00 0.00 C ATOM 988 CE LYS A 91 1.653 -2.240 -10.432 1.00 0.00 C ATOM 989 NZ LYS A 91 1.563 -3.687 -10.131 1.00 0.00 N ATOM 0 H LYS A 91 -2.054 1.216 -6.825 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.956 -0.537 -9.239 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -0.029 -0.126 -7.016 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -0.290 -1.764 -7.579 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.074 -0.518 -9.992 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.898 0.579 -9.031 1.00 0.00 H new ATOM 0 HD2 LYS A 91 2.629 -0.880 -9.072 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.646 -2.096 -8.280 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.800 -1.935 -11.039 1.00 0.00 H new ATOM 0 HE3 LYS A 91 2.550 -2.040 -11.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.541 -4.226 -11.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 2.390 -3.977 -9.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.695 -3.876 -9.590 1.00 0.00 H new ATOM 999 N GLU A 92 -3.026 -2.469 -8.043 1.00 0.00 N ATOM 1000 CA GLU A 92 -3.949 -3.440 -7.483 1.00 0.00 C ATOM 1001 C GLU A 92 -3.194 -4.465 -6.634 1.00 0.00 C ATOM 1002 O GLU A 92 -2.317 -5.166 -7.137 1.00 0.00 O ATOM 1003 CB GLU A 92 -4.756 -4.130 -8.585 1.00 0.00 C ATOM 1004 CG GLU A 92 -6.233 -3.736 -8.512 1.00 0.00 C ATOM 1005 CD GLU A 92 -6.611 -2.806 -9.666 1.00 0.00 C ATOM 1006 OE1 GLU A 92 -6.120 -1.657 -9.652 1.00 0.00 O ATOM 1007 OE2 GLU A 92 -7.383 -3.264 -10.535 1.00 0.00 O ATOM 0 H GLU A 92 -2.556 -2.770 -8.897 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.652 -2.912 -6.839 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -4.352 -3.859 -9.560 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -4.659 -5.211 -8.489 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -6.854 -4.631 -8.544 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.435 -3.242 -7.561 1.00 0.00 H new ATOM 1012 N LYS A 93 -3.560 -4.518 -5.362 1.00 0.00 N ATOM 1013 CA LYS A 93 -2.928 -5.445 -4.439 1.00 0.00 C ATOM 1014 C LYS A 93 -4.003 -6.297 -3.762 1.00 0.00 C ATOM 1015 O LYS A 93 -4.312 -6.095 -2.589 1.00 0.00 O ATOM 1016 CB LYS A 93 -2.029 -4.693 -3.456 1.00 0.00 C ATOM 1017 CG LYS A 93 -1.180 -3.646 -4.180 1.00 0.00 C ATOM 1018 CD LYS A 93 0.313 -3.919 -3.982 1.00 0.00 C ATOM 1019 CE LYS A 93 0.957 -4.406 -5.281 1.00 0.00 C ATOM 1020 NZ LYS A 93 2.372 -4.777 -5.051 1.00 0.00 N ATOM 0 H LYS A 93 -4.287 -3.934 -4.949 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.271 -6.129 -4.976 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.641 -4.208 -2.696 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.379 -5.399 -2.939 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.417 -3.653 -5.244 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.424 -2.652 -3.806 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.811 -3.010 -3.643 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.449 -4.667 -3.201 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.408 -5.265 -5.666 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.898 -3.624 -6.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.794 -5.105 -5.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.896 -3.948 -4.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.421 -5.538 -4.344 1.00 0.00 H new ATOM 1030 N PHE A 94 -4.541 -7.233 -4.529 1.00 0.00 N ATOM 1031 CA PHE A 94 -5.575 -8.118 -4.018 1.00 0.00 C ATOM 1032 C PHE A 94 -5.003 -9.086 -2.982 1.00 0.00 C ATOM 1033 O PHE A 94 -4.847 -10.275 -3.258 1.00 0.00 O ATOM 1034 CB PHE A 94 -6.107 -8.918 -5.208 1.00 0.00 C ATOM 1035 CG PHE A 94 -7.077 -8.137 -6.098 1.00 0.00 C ATOM 1036 CD1 PHE A 94 -8.348 -7.900 -5.674 1.00 0.00 C ATOM 1037 CD2 PHE A 94 -6.669 -7.683 -7.313 1.00 0.00 C ATOM 1038 CE1 PHE A 94 -9.247 -7.175 -6.501 1.00 0.00 C ATOM 1039 CE2 PHE A 94 -7.569 -6.959 -8.140 1.00 0.00 C ATOM 1040 CZ PHE A 94 -8.839 -6.721 -7.715 1.00 0.00 C ATOM 0 H PHE A 94 -4.281 -7.398 -5.501 1.00 0.00 H new ATOM 0 HA PHE A 94 -6.360 -7.535 -3.537 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.265 -9.254 -5.813 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.609 -9.811 -4.837 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -8.673 -8.263 -4.710 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -5.660 -7.873 -7.649 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -10.255 -6.984 -6.165 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -7.245 -6.598 -9.105 1.00 0.00 H new ATOM 0 HZ PHE A 94 -9.524 -6.171 -8.343 1.00 0.00 H new ATOM 1049 N PHE A 95 -4.707 -8.543 -1.810 1.00 0.00 N ATOM 1050 CA PHE A 95 -4.155 -9.346 -0.732 1.00 0.00 C ATOM 1051 C PHE A 95 -4.841 -9.022 0.598 1.00 0.00 C ATOM 1052 O PHE A 95 -4.538 -9.632 1.622 1.00 0.00 O ATOM 1053 CB PHE A 95 -2.670 -8.992 -0.624 1.00 0.00 C ATOM 1054 CG PHE A 95 -1.983 -8.774 -1.974 1.00 0.00 C ATOM 1055 CD1 PHE A 95 -2.146 -9.682 -2.974 1.00 0.00 C ATOM 1056 CD2 PHE A 95 -1.212 -7.673 -2.174 1.00 0.00 C ATOM 1057 CE1 PHE A 95 -1.509 -9.480 -4.226 1.00 0.00 C ATOM 1058 CE2 PHE A 95 -0.574 -7.471 -3.427 1.00 0.00 C ATOM 1059 CZ PHE A 95 -0.736 -8.378 -4.426 1.00 0.00 C ATOM 0 H PHE A 95 -4.839 -7.557 -1.583 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.306 -10.405 -0.942 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -2.565 -8.088 -0.024 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -2.154 -9.790 -0.090 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.760 -10.556 -2.815 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.084 -6.952 -1.380 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -1.638 -10.201 -5.020 1.00 0.00 H new ATOM 0 HE2 PHE A 95 0.040 -6.597 -3.586 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.251 -8.224 -5.379 1.00 0.00 H new ATOM 1068 N MET A 96 -5.755 -8.063 0.537 1.00 0.00 N ATOM 1069 CA MET A 96 -6.486 -7.652 1.724 1.00 0.00 C ATOM 1070 C MET A 96 -7.164 -8.849 2.393 1.00 0.00 C ATOM 1071 O MET A 96 -7.557 -8.775 3.555 1.00 0.00 O ATOM 1072 CB MET A 96 -7.543 -6.616 1.337 1.00 0.00 C ATOM 1073 CG MET A 96 -8.858 -7.294 0.947 1.00 0.00 C ATOM 1074 SD MET A 96 -9.935 -7.399 2.368 1.00 0.00 S ATOM 1075 CE MET A 96 -11.057 -8.673 1.812 1.00 0.00 C ATOM 0 H MET A 96 -6.005 -7.560 -0.314 1.00 0.00 H new ATOM 0 HA MET A 96 -5.780 -7.218 2.432 1.00 0.00 H new ATOM 0 HB2 MET A 96 -7.714 -5.936 2.172 1.00 0.00 H new ATOM 0 HB3 MET A 96 -7.179 -6.014 0.505 1.00 0.00 H new ATOM 0 HG2 MET A 96 -9.346 -6.730 0.152 1.00 0.00 H new ATOM 0 HG3 MET A 96 -8.660 -8.292 0.556 1.00 0.00 H new ATOM 0 HE1 MET A 96 -11.801 -8.865 2.585 1.00 0.00 H new ATOM 0 HE2 MET A 96 -11.557 -8.345 0.900 1.00 0.00 H new ATOM 0 HE3 MET A 96 -10.499 -9.587 1.611 1.00 0.00 H new ATOM 1083 N ARG A 97 -7.281 -9.926 1.629 1.00 0.00 N ATOM 1084 CA ARG A 97 -7.904 -11.137 2.133 1.00 0.00 C ATOM 1085 C ARG A 97 -6.859 -12.037 2.792 1.00 0.00 C ATOM 1086 O ARG A 97 -7.205 -12.984 3.497 1.00 0.00 O ATOM 1087 CB ARG A 97 -8.597 -11.909 1.008 1.00 0.00 C ATOM 1088 CG ARG A 97 -9.576 -12.941 1.573 1.00 0.00 C ATOM 1089 CD ARG A 97 -11.022 -12.460 1.433 1.00 0.00 C ATOM 1090 NE ARG A 97 -11.929 -13.619 1.285 1.00 0.00 N ATOM 1091 CZ ARG A 97 -12.262 -14.445 2.286 1.00 0.00 C ATOM 1092 NH1 ARG A 97 -11.765 -14.245 3.513 1.00 0.00 N ATOM 1093 NH2 ARG A 97 -13.093 -15.472 2.058 1.00 0.00 N ATOM 0 H ARG A 97 -6.954 -9.984 0.664 1.00 0.00 H new ATOM 0 HA ARG A 97 -8.651 -10.843 2.870 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -9.130 -11.214 0.360 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -7.850 -12.410 0.392 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.452 -13.889 1.050 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.350 -13.125 2.623 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -11.306 -11.875 2.308 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -11.113 -11.804 0.568 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.326 -13.801 0.363 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.133 -13.464 3.686 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.019 -14.874 4.275 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -13.471 -15.624 1.123 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -13.347 -16.101 2.820 1.00 0.00 H new ATOM 1104 N LYS A 98 -5.600 -11.712 2.538 1.00 0.00 N ATOM 1105 CA LYS A 98 -4.501 -12.480 3.099 1.00 0.00 C ATOM 1106 C LYS A 98 -3.175 -11.820 2.715 1.00 0.00 C ATOM 1107 O LYS A 98 -2.946 -11.512 1.547 1.00 0.00 O ATOM 1108 CB LYS A 98 -4.602 -13.947 2.675 1.00 0.00 C ATOM 1109 CG LYS A 98 -4.047 -14.871 3.761 1.00 0.00 C ATOM 1110 CD LYS A 98 -2.517 -14.907 3.722 1.00 0.00 C ATOM 1111 CE LYS A 98 -1.949 -15.503 5.011 1.00 0.00 C ATOM 1112 NZ LYS A 98 -0.847 -16.443 4.705 1.00 0.00 N ATOM 0 H LYS A 98 -5.316 -10.927 1.951 1.00 0.00 H new ATOM 0 HA LYS A 98 -4.554 -12.481 4.188 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -5.643 -14.200 2.474 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -4.052 -14.100 1.747 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -4.381 -14.529 4.740 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -4.442 -15.878 3.623 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -2.185 -15.497 2.868 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.130 -13.898 3.582 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.585 -14.705 5.658 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -2.737 -16.022 5.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.472 -16.839 5.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -1.205 -17.214 4.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -0.089 -15.938 4.204 1.00 0.00 H new ATOM 1122 N VAL A 99 -2.337 -11.621 3.722 1.00 0.00 N ATOM 1123 CA VAL A 99 -1.040 -11.003 3.505 1.00 0.00 C ATOM 1124 C VAL A 99 -0.024 -11.605 4.476 1.00 0.00 C ATOM 1125 O VAL A 99 -0.359 -12.491 5.262 1.00 0.00 O ATOM 1126 CB VAL A 99 -1.157 -9.482 3.630 1.00 0.00 C ATOM 1127 CG1 VAL A 99 -2.380 -8.963 2.870 1.00 0.00 C ATOM 1128 CG2 VAL A 99 -1.202 -9.054 5.098 1.00 0.00 C ATOM 0 H VAL A 99 -2.531 -11.877 4.690 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.685 -11.207 2.495 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.269 -9.039 3.179 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.441 -7.880 2.974 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.289 -9.221 1.815 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.282 -9.418 3.279 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.285 -7.969 5.158 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.064 -9.512 5.584 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.289 -9.376 5.599 1.00 0.00 H new ATOM 1138 N GLN A 100 1.200 -11.102 4.391 1.00 0.00 N ATOM 1139 CA GLN A 100 2.267 -11.578 5.254 1.00 0.00 C ATOM 1140 C GLN A 100 3.419 -10.572 5.279 1.00 0.00 C ATOM 1141 O GLN A 100 4.323 -10.636 4.448 1.00 0.00 O ATOM 1142 CB GLN A 100 2.755 -12.959 4.808 1.00 0.00 C ATOM 1143 CG GLN A 100 2.258 -14.049 5.759 1.00 0.00 C ATOM 1144 CD GLN A 100 2.894 -15.401 5.425 1.00 0.00 C ATOM 1145 OE1 GLN A 100 3.287 -15.669 4.301 1.00 0.00 O ATOM 1146 NE2 GLN A 100 2.974 -16.232 6.460 1.00 0.00 N ATOM 0 H GLN A 100 1.476 -10.369 3.737 1.00 0.00 H new ATOM 0 HA GLN A 100 1.874 -11.675 6.266 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.402 -13.164 3.797 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.844 -12.970 4.774 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.496 -13.776 6.787 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.173 -14.127 5.693 1.00 0.00 H new ATOM 0 HE21 GLN A 100 2.625 -15.943 7.374 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.384 -17.158 6.340 1.00 0.00 H new ATOM 1153 N ILE A 101 3.347 -9.665 6.243 1.00 0.00 N ATOM 1154 CA ILE A 101 4.373 -8.646 6.388 1.00 0.00 C ATOM 1155 C ILE A 101 5.544 -9.218 7.191 1.00 0.00 C ATOM 1156 O ILE A 101 5.339 -9.910 8.187 1.00 0.00 O ATOM 1157 CB ILE A 101 3.780 -7.370 6.991 1.00 0.00 C ATOM 1158 CG1 ILE A 101 4.878 -6.468 7.555 1.00 0.00 C ATOM 1159 CG2 ILE A 101 2.716 -7.703 8.039 1.00 0.00 C ATOM 1160 CD1 ILE A 101 4.769 -5.051 6.988 1.00 0.00 C ATOM 0 H ILE A 101 2.595 -9.615 6.930 1.00 0.00 H new ATOM 0 HA ILE A 101 4.764 -8.358 5.412 1.00 0.00 H new ATOM 0 HB ILE A 101 3.285 -6.814 6.195 1.00 0.00 H new ATOM 0 HG12 ILE A 101 4.804 -6.435 8.642 1.00 0.00 H new ATOM 0 HG13 ILE A 101 5.856 -6.886 7.315 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.311 -6.779 8.452 1.00 0.00 H new ATOM 0 HG22 ILE A 101 1.914 -8.275 7.574 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.165 -8.292 8.839 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.562 -4.430 7.405 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.868 -5.085 5.903 1.00 0.00 H new ATOM 0 HD13 ILE A 101 3.800 -4.627 7.251 1.00 0.00 H new ATOM 1171 N ASN A 102 6.745 -8.906 6.727 1.00 0.00 N ATOM 1172 CA ASN A 102 7.949 -9.380 7.388 1.00 0.00 C ATOM 1173 C ASN A 102 8.886 -8.197 7.642 1.00 0.00 C ATOM 1174 O ASN A 102 9.823 -7.968 6.879 1.00 0.00 O ATOM 1175 CB ASN A 102 8.694 -10.394 6.516 1.00 0.00 C ATOM 1176 CG ASN A 102 9.548 -11.330 7.373 1.00 0.00 C ATOM 1177 OD1 ASN A 102 9.833 -11.069 8.530 1.00 0.00 O ATOM 1178 ND2 ASN A 102 9.940 -12.434 6.742 1.00 0.00 N ATOM 0 H ASN A 102 6.910 -8.331 5.901 1.00 0.00 H new ATOM 0 HA ASN A 102 7.655 -9.856 8.323 1.00 0.00 H new ATOM 0 HB2 ASN A 102 7.978 -10.977 5.937 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.328 -9.869 5.802 1.00 0.00 H new ATOM 0 HD21 ASN A 102 10.514 -13.123 7.228 1.00 0.00 H new ATOM 0 HD22 ASN A 102 9.666 -12.592 5.772 1.00 0.00 H new ATOM 1184 N ASP A 103 8.599 -7.478 8.717 1.00 0.00 N ATOM 1185 CA ASP A 103 9.405 -6.324 9.080 1.00 0.00 C ATOM 1186 C ASP A 103 10.816 -6.787 9.446 1.00 0.00 C ATOM 1187 O ASP A 103 11.157 -6.879 10.624 1.00 0.00 O ATOM 1188 CB ASP A 103 8.815 -5.602 10.295 1.00 0.00 C ATOM 1189 CG ASP A 103 8.535 -6.494 11.505 1.00 0.00 C ATOM 1190 OD1 ASP A 103 7.765 -7.463 11.329 1.00 0.00 O ATOM 1191 OD2 ASP A 103 9.098 -6.187 12.578 1.00 0.00 O ATOM 0 H ASP A 103 7.821 -7.671 9.348 1.00 0.00 H new ATOM 0 HA ASP A 103 9.424 -5.644 8.228 1.00 0.00 H new ATOM 0 HB2 ASP A 103 9.501 -4.811 10.597 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.885 -5.120 9.995 1.00 0.00 H new ATOM 1195 N LYS A 104 11.599 -7.067 8.414 1.00 0.00 N ATOM 1196 CA LYS A 104 12.965 -7.519 8.611 1.00 0.00 C ATOM 1197 C LYS A 104 13.914 -6.324 8.496 1.00 0.00 C ATOM 1198 O LYS A 104 14.508 -6.097 7.443 1.00 0.00 O ATOM 1199 CB LYS A 104 13.296 -8.661 7.649 1.00 0.00 C ATOM 1200 CG LYS A 104 13.446 -9.985 8.401 1.00 0.00 C ATOM 1201 CD LYS A 104 14.894 -10.477 8.364 1.00 0.00 C ATOM 1202 CE LYS A 104 15.651 -10.046 9.621 1.00 0.00 C ATOM 1203 NZ LYS A 104 15.628 -11.124 10.635 1.00 0.00 N ATOM 0 H LYS A 104 11.312 -6.989 7.438 1.00 0.00 H new ATOM 0 HA LYS A 104 13.089 -7.931 9.612 1.00 0.00 H new ATOM 0 HB2 LYS A 104 12.508 -8.751 6.901 1.00 0.00 H new ATOM 0 HB3 LYS A 104 14.219 -8.435 7.115 1.00 0.00 H new ATOM 0 HG2 LYS A 104 13.128 -9.857 9.436 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.792 -10.735 7.957 1.00 0.00 H new ATOM 0 HD2 LYS A 104 14.911 -11.564 8.280 1.00 0.00 H new ATOM 0 HD3 LYS A 104 15.394 -10.081 7.480 1.00 0.00 H new ATOM 0 HE2 LYS A 104 16.682 -9.801 9.366 1.00 0.00 H new ATOM 0 HE3 LYS A 104 15.201 -9.142 10.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 16.146 -10.815 11.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 14.643 -11.339 10.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 16.078 -11.977 10.245 1.00 0.00 H new ATOM 1213 N ASP A 105 14.028 -5.592 9.595 1.00 0.00 N ATOM 1214 CA ASP A 105 14.894 -4.425 9.631 1.00 0.00 C ATOM 1215 C ASP A 105 15.536 -4.315 11.015 1.00 0.00 C ATOM 1216 O ASP A 105 15.180 -5.057 11.930 1.00 0.00 O ATOM 1217 CB ASP A 105 14.101 -3.142 9.374 1.00 0.00 C ATOM 1218 CG ASP A 105 14.905 -2.001 8.747 1.00 0.00 C ATOM 1219 OD1 ASP A 105 15.884 -2.319 8.037 1.00 0.00 O ATOM 1220 OD2 ASP A 105 14.521 -0.837 8.990 1.00 0.00 O ATOM 0 H ASP A 105 13.535 -5.784 10.467 1.00 0.00 H new ATOM 0 HA ASP A 105 15.651 -4.542 8.855 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.261 -3.377 8.720 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.683 -2.795 10.319 1.00 0.00 H new ATOM 1224 N ASP A 106 16.473 -3.384 11.125 1.00 0.00 N ATOM 1225 CA ASP A 106 17.168 -3.168 12.382 1.00 0.00 C ATOM 1226 C ASP A 106 17.572 -1.696 12.490 1.00 0.00 C ATOM 1227 O ASP A 106 18.453 -1.346 13.274 1.00 0.00 O ATOM 1228 CB ASP A 106 18.441 -4.013 12.461 1.00 0.00 C ATOM 1229 CG ASP A 106 18.387 -5.173 13.457 1.00 0.00 C ATOM 1230 OD1 ASP A 106 18.087 -4.893 14.637 1.00 0.00 O ATOM 1231 OD2 ASP A 106 18.646 -6.314 13.016 1.00 0.00 O ATOM 0 H ASP A 106 16.767 -2.771 10.364 1.00 0.00 H new ATOM 0 HA ASP A 106 16.495 -3.452 13.191 1.00 0.00 H new ATOM 0 HB2 ASP A 106 18.655 -4.414 11.470 1.00 0.00 H new ATOM 0 HB3 ASP A 106 19.274 -3.363 12.728 1.00 0.00 H new ATOM 1235 N THR A 107 16.907 -0.874 11.692 1.00 0.00 N ATOM 1236 CA THR A 107 17.185 0.552 11.687 1.00 0.00 C ATOM 1237 C THR A 107 18.482 0.845 12.445 1.00 0.00 C ATOM 1238 O THR A 107 19.508 1.142 11.834 1.00 0.00 O ATOM 1239 CB THR A 107 15.967 1.273 12.268 1.00 0.00 C ATOM 1240 OG1 THR A 107 15.350 0.297 13.104 1.00 0.00 O ATOM 1241 CG2 THR A 107 14.907 1.580 11.208 1.00 0.00 C ATOM 0 H THR A 107 16.176 -1.168 11.044 1.00 0.00 H new ATOM 0 HA THR A 107 17.347 0.920 10.674 1.00 0.00 H new ATOM 0 HB THR A 107 16.287 2.202 12.740 1.00 0.00 H new ATOM 0 HG1 THR A 107 14.552 0.682 13.522 1.00 0.00 H new ATOM 0 HG21 THR A 107 14.065 2.092 11.673 1.00 0.00 H new ATOM 0 HG22 THR A 107 15.338 2.218 10.437 1.00 0.00 H new ATOM 0 HG23 THR A 107 14.562 0.649 10.758 1.00 0.00 H new ATOM 1249 N ASN A 108 18.394 0.751 13.763 1.00 0.00 N ATOM 1250 CA ASN A 108 19.548 1.002 14.610 1.00 0.00 C ATOM 1251 C ASN A 108 20.818 0.569 13.874 1.00 0.00 C ATOM 1252 O ASN A 108 21.881 1.158 14.066 1.00 0.00 O ATOM 1253 CB ASN A 108 19.460 0.204 15.911 1.00 0.00 C ATOM 1254 CG ASN A 108 19.192 1.126 17.103 1.00 0.00 C ATOM 1255 OD1 ASN A 108 19.167 2.339 16.989 1.00 0.00 O ATOM 1256 ND2 ASN A 108 18.995 0.483 18.251 1.00 0.00 N ATOM 0 H ASN A 108 17.541 0.504 14.266 1.00 0.00 H new ATOM 0 HA ASN A 108 19.572 2.067 14.842 1.00 0.00 H new ATOM 0 HB2 ASN A 108 18.665 -0.537 15.834 1.00 0.00 H new ATOM 0 HB3 ASN A 108 20.390 -0.342 16.071 1.00 0.00 H new ATOM 0 HD21 ASN A 108 18.809 1.009 19.105 1.00 0.00 H new ATOM 0 HD22 ASN A 108 19.029 -0.536 18.277 1.00 0.00 H new ATOM 1262 N GLU A 109 20.665 -0.455 13.048 1.00 0.00 N ATOM 1263 CA GLU A 109 21.787 -0.972 12.283 1.00 0.00 C ATOM 1264 C GLU A 109 21.582 -0.702 10.791 1.00 0.00 C ATOM 1265 O GLU A 109 22.548 -0.538 10.048 1.00 0.00 O ATOM 1266 CB GLU A 109 21.987 -2.466 12.547 1.00 0.00 C ATOM 1267 CG GLU A 109 23.268 -2.973 11.880 1.00 0.00 C ATOM 1268 CD GLU A 109 24.159 -3.701 12.889 1.00 0.00 C ATOM 1269 OE1 GLU A 109 24.585 -3.034 13.856 1.00 0.00 O ATOM 1270 OE2 GLU A 109 24.396 -4.909 12.670 1.00 0.00 O ATOM 0 H GLU A 109 19.782 -0.941 12.892 1.00 0.00 H new ATOM 0 HA GLU A 109 22.691 -0.455 12.605 1.00 0.00 H new ATOM 0 HB2 GLU A 109 22.036 -2.646 13.621 1.00 0.00 H new ATOM 0 HB3 GLU A 109 21.130 -3.024 12.169 1.00 0.00 H new ATOM 0 HG2 GLU A 109 23.014 -3.646 11.061 1.00 0.00 H new ATOM 0 HG3 GLU A 109 23.813 -2.135 11.446 1.00 0.00 H new ATOM 1275 N TYR A 110 20.317 -0.665 10.397 1.00 0.00 N ATOM 1276 CA TYR A 110 19.973 -0.417 9.007 1.00 0.00 C ATOM 1277 C TYR A 110 19.346 0.968 8.837 1.00 0.00 C ATOM 1278 O TYR A 110 19.407 1.798 9.742 1.00 0.00 O ATOM 1279 CB TYR A 110 18.940 -1.482 8.632 1.00 0.00 C ATOM 1280 CG TYR A 110 19.429 -2.919 8.829 1.00 0.00 C ATOM 1281 CD1 TYR A 110 20.780 -3.181 8.926 1.00 0.00 C ATOM 1282 CD2 TYR A 110 18.517 -3.952 8.906 1.00 0.00 C ATOM 1283 CE1 TYR A 110 21.240 -4.533 9.110 1.00 0.00 C ATOM 1284 CE2 TYR A 110 18.976 -5.305 9.091 1.00 0.00 C ATOM 1285 CZ TYR A 110 20.315 -5.528 9.183 1.00 0.00 C ATOM 1286 OH TYR A 110 20.749 -6.806 9.357 1.00 0.00 O ATOM 0 H TYR A 110 19.518 -0.803 11.016 1.00 0.00 H new ATOM 0 HA TYR A 110 20.862 -0.458 8.378 1.00 0.00 H new ATOM 0 HB2 TYR A 110 18.042 -1.329 9.231 1.00 0.00 H new ATOM 0 HB3 TYR A 110 18.655 -1.346 7.589 1.00 0.00 H new ATOM 0 HD1 TYR A 110 21.493 -2.372 8.864 1.00 0.00 H new ATOM 0 HD2 TYR A 110 17.460 -3.746 8.828 1.00 0.00 H new ATOM 0 HE1 TYR A 110 22.295 -4.752 9.188 1.00 0.00 H new ATOM 0 HE2 TYR A 110 18.274 -6.123 9.155 1.00 0.00 H new ATOM 0 HH TYR A 110 19.979 -7.411 9.392 1.00 0.00 H new ATOM 1295 N LYS A 111 18.757 1.175 7.668 1.00 0.00 N ATOM 1296 CA LYS A 111 18.119 2.446 7.365 1.00 0.00 C ATOM 1297 C LYS A 111 16.729 2.477 8.003 1.00 0.00 C ATOM 1298 O LYS A 111 16.584 2.849 9.167 1.00 0.00 O ATOM 1299 CB LYS A 111 18.109 2.695 5.856 1.00 0.00 C ATOM 1300 CG LYS A 111 17.235 3.901 5.505 1.00 0.00 C ATOM 1301 CD LYS A 111 17.885 5.204 5.975 1.00 0.00 C ATOM 1302 CE LYS A 111 16.881 6.075 6.734 1.00 0.00 C ATOM 1303 NZ LYS A 111 17.348 7.478 6.784 1.00 0.00 N ATOM 0 H LYS A 111 18.708 0.484 6.919 1.00 0.00 H new ATOM 0 HA LYS A 111 18.687 3.270 7.796 1.00 0.00 H new ATOM 0 HB2 LYS A 111 19.127 2.865 5.505 1.00 0.00 H new ATOM 0 HB3 LYS A 111 17.737 1.810 5.340 1.00 0.00 H new ATOM 0 HG2 LYS A 111 17.076 3.938 4.427 1.00 0.00 H new ATOM 0 HG3 LYS A 111 16.255 3.791 5.969 1.00 0.00 H new ATOM 0 HD2 LYS A 111 18.736 4.979 6.618 1.00 0.00 H new ATOM 0 HD3 LYS A 111 18.271 5.752 5.116 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.907 6.027 6.247 1.00 0.00 H new ATOM 0 HE3 LYS A 111 16.751 5.692 7.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 16.656 8.056 7.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 18.267 7.521 7.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 17.450 7.845 5.816 1.00 0.00 H new ATOM 1313 N HIS A 112 15.741 2.081 7.214 1.00 0.00 N ATOM 1314 CA HIS A 112 14.368 2.060 7.686 1.00 0.00 C ATOM 1315 C HIS A 112 13.465 1.450 6.612 1.00 0.00 C ATOM 1316 O HIS A 112 12.740 2.168 5.926 1.00 0.00 O ATOM 1317 CB HIS A 112 13.919 3.458 8.115 1.00 0.00 C ATOM 1318 CG HIS A 112 13.113 3.480 9.391 1.00 0.00 C ATOM 1319 ND1 HIS A 112 12.048 2.627 9.621 1.00 0.00 N ATOM 1320 CD2 HIS A 112 13.228 4.260 10.506 1.00 0.00 C ATOM 1321 CE1 HIS A 112 11.552 2.890 10.821 1.00 0.00 C ATOM 1322 NE2 HIS A 112 12.284 3.903 11.367 1.00 0.00 N ATOM 0 H HIS A 112 15.865 1.772 6.250 1.00 0.00 H new ATOM 0 HA HIS A 112 14.294 1.431 8.573 1.00 0.00 H new ATOM 0 HB2 HIS A 112 14.799 4.088 8.243 1.00 0.00 H new ATOM 0 HB3 HIS A 112 13.325 3.899 7.315 1.00 0.00 H new ATOM 0 HD2 HIS A 112 13.963 5.036 10.661 1.00 0.00 H new ATOM 0 HE1 HIS A 112 10.715 2.390 11.285 1.00 0.00 H new ATOM 0 HE2 HIS A 112 12.131 4.318 12.286 1.00 0.00 H new ATOM 1329 N ALA A 113 13.539 0.133 6.500 1.00 0.00 N ATOM 1330 CA ALA A 113 12.738 -0.582 5.522 1.00 0.00 C ATOM 1331 C ALA A 113 12.629 -2.052 5.932 1.00 0.00 C ATOM 1332 O ALA A 113 13.446 -2.545 6.708 1.00 0.00 O ATOM 1333 CB ALA A 113 13.355 -0.409 4.131 1.00 0.00 C ATOM 0 H ALA A 113 14.142 -0.459 7.071 1.00 0.00 H new ATOM 0 HA ALA A 113 11.727 -0.175 5.484 1.00 0.00 H new ATOM 0 HB1 ALA A 113 12.754 -0.946 3.397 1.00 0.00 H new ATOM 0 HB2 ALA A 113 13.382 0.650 3.874 1.00 0.00 H new ATOM 0 HB3 ALA A 113 14.369 -0.808 4.131 1.00 0.00 H new ATOM 1339 N PHE A 114 11.613 -2.710 5.393 1.00 0.00 N ATOM 1340 CA PHE A 114 11.388 -4.114 5.694 1.00 0.00 C ATOM 1341 C PHE A 114 10.889 -4.866 4.458 1.00 0.00 C ATOM 1342 O PHE A 114 10.524 -4.250 3.458 1.00 0.00 O ATOM 1343 CB PHE A 114 10.311 -4.171 6.780 1.00 0.00 C ATOM 1344 CG PHE A 114 9.705 -2.810 7.128 1.00 0.00 C ATOM 1345 CD1 PHE A 114 9.061 -2.088 6.172 1.00 0.00 C ATOM 1346 CD2 PHE A 114 9.811 -2.322 8.393 1.00 0.00 C ATOM 1347 CE1 PHE A 114 8.500 -0.825 6.495 1.00 0.00 C ATOM 1348 CE2 PHE A 114 9.248 -1.059 8.716 1.00 0.00 C ATOM 1349 CZ PHE A 114 8.604 -0.337 7.760 1.00 0.00 C ATOM 0 H PHE A 114 10.937 -2.297 4.750 1.00 0.00 H new ATOM 0 HA PHE A 114 12.319 -4.579 6.019 1.00 0.00 H new ATOM 0 HB2 PHE A 114 9.514 -4.839 6.452 1.00 0.00 H new ATOM 0 HB3 PHE A 114 10.742 -4.607 7.682 1.00 0.00 H new ATOM 0 HD1 PHE A 114 8.977 -2.476 5.168 1.00 0.00 H new ATOM 0 HD2 PHE A 114 10.323 -2.895 9.152 1.00 0.00 H new ATOM 0 HE1 PHE A 114 7.990 -0.251 5.735 1.00 0.00 H new ATOM 0 HE2 PHE A 114 9.331 -0.672 9.721 1.00 0.00 H new ATOM 0 HZ PHE A 114 8.175 0.623 8.005 1.00 0.00 H new ATOM 1358 N GLU A 115 10.890 -6.186 4.568 1.00 0.00 N ATOM 1359 CA GLU A 115 10.442 -7.029 3.472 1.00 0.00 C ATOM 1360 C GLU A 115 9.001 -7.485 3.708 1.00 0.00 C ATOM 1361 O GLU A 115 8.684 -8.037 4.760 1.00 0.00 O ATOM 1362 CB GLU A 115 11.373 -8.228 3.288 1.00 0.00 C ATOM 1363 CG GLU A 115 12.725 -7.982 3.958 1.00 0.00 C ATOM 1364 CD GLU A 115 13.842 -8.739 3.237 1.00 0.00 C ATOM 1365 OE1 GLU A 115 13.644 -9.950 2.997 1.00 0.00 O ATOM 1366 OE2 GLU A 115 14.869 -8.091 2.941 1.00 0.00 O ATOM 0 H GLU A 115 11.194 -6.693 5.399 1.00 0.00 H new ATOM 0 HA GLU A 115 10.471 -6.443 2.553 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.911 -9.120 3.711 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.520 -8.419 2.225 1.00 0.00 H new ATOM 0 HG2 GLU A 115 12.946 -6.915 3.958 1.00 0.00 H new ATOM 0 HG3 GLU A 115 12.681 -8.298 5.000 1.00 0.00 H new ATOM 1371 N ILE A 116 8.164 -7.234 2.711 1.00 0.00 N ATOM 1372 CA ILE A 116 6.764 -7.612 2.796 1.00 0.00 C ATOM 1373 C ILE A 116 6.530 -8.879 1.970 1.00 0.00 C ATOM 1374 O ILE A 116 7.384 -9.273 1.177 1.00 0.00 O ATOM 1375 CB ILE A 116 5.867 -6.440 2.392 1.00 0.00 C ATOM 1376 CG1 ILE A 116 6.481 -5.106 2.822 1.00 0.00 C ATOM 1377 CG2 ILE A 116 4.450 -6.621 2.936 1.00 0.00 C ATOM 1378 CD1 ILE A 116 6.344 -4.901 4.331 1.00 0.00 C ATOM 0 H ILE A 116 8.429 -6.773 1.840 1.00 0.00 H new ATOM 0 HA ILE A 116 6.496 -7.849 3.826 1.00 0.00 H new ATOM 0 HB ILE A 116 5.794 -6.425 1.305 1.00 0.00 H new ATOM 0 HG12 ILE A 116 7.534 -5.079 2.542 1.00 0.00 H new ATOM 0 HG13 ILE A 116 5.990 -4.289 2.294 1.00 0.00 H new ATOM 0 HG21 ILE A 116 3.834 -5.774 2.634 1.00 0.00 H new ATOM 0 HG22 ILE A 116 4.022 -7.541 2.538 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.482 -6.677 4.024 1.00 0.00 H new ATOM 0 HD11 ILE A 116 6.788 -3.946 4.610 1.00 0.00 H new ATOM 0 HD12 ILE A 116 5.289 -4.904 4.604 1.00 0.00 H new ATOM 0 HD13 ILE A 116 6.857 -5.707 4.856 1.00 0.00 H new ATOM 1389 N ILE A 117 5.370 -9.481 2.184 1.00 0.00 N ATOM 1390 CA ILE A 117 5.014 -10.694 1.469 1.00 0.00 C ATOM 1391 C ILE A 117 3.489 -10.822 1.419 1.00 0.00 C ATOM 1392 O ILE A 117 2.851 -11.086 2.436 1.00 0.00 O ATOM 1393 CB ILE A 117 5.712 -11.906 2.089 1.00 0.00 C ATOM 1394 CG1 ILE A 117 7.233 -11.769 1.996 1.00 0.00 C ATOM 1395 CG2 ILE A 117 5.215 -13.208 1.458 1.00 0.00 C ATOM 1396 CD1 ILE A 117 7.929 -13.038 2.492 1.00 0.00 C ATOM 0 H ILE A 117 4.664 -9.151 2.843 1.00 0.00 H new ATOM 0 HA ILE A 117 5.365 -10.646 0.438 1.00 0.00 H new ATOM 0 HB ILE A 117 5.455 -11.943 3.148 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.521 -11.572 0.964 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.562 -10.915 2.588 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.727 -14.054 1.917 1.00 0.00 H new ATOM 0 HG22 ILE A 117 4.141 -13.304 1.619 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.422 -13.196 0.388 1.00 0.00 H new ATOM 0 HD11 ILE A 117 9.009 -12.914 2.415 1.00 0.00 H new ATOM 0 HD12 ILE A 117 7.658 -13.219 3.532 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.617 -13.886 1.883 1.00 0.00 H new ATOM 1407 N LEU A 118 2.950 -10.629 0.224 1.00 0.00 N ATOM 1408 CA LEU A 118 1.514 -10.719 0.027 1.00 0.00 C ATOM 1409 C LEU A 118 1.129 -12.177 -0.227 1.00 0.00 C ATOM 1410 O LEU A 118 1.896 -12.930 -0.825 1.00 0.00 O ATOM 1411 CB LEU A 118 1.062 -9.762 -1.077 1.00 0.00 C ATOM 1412 CG LEU A 118 1.905 -8.496 -1.254 1.00 0.00 C ATOM 1413 CD1 LEU A 118 2.287 -8.292 -2.721 1.00 0.00 C ATOM 1414 CD2 LEU A 118 1.187 -7.276 -0.673 1.00 0.00 C ATOM 0 H LEU A 118 3.483 -10.411 -0.618 1.00 0.00 H new ATOM 0 HA LEU A 118 0.986 -10.401 0.926 1.00 0.00 H new ATOM 0 HB2 LEU A 118 1.056 -10.306 -2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.033 -9.464 -0.874 1.00 0.00 H new ATOM 0 HG LEU A 118 2.833 -8.621 -0.695 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.885 -7.386 -2.819 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.865 -9.148 -3.069 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.383 -8.196 -3.322 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.806 -6.390 -0.811 1.00 0.00 H new ATOM 0 HD22 LEU A 118 0.235 -7.137 -1.184 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.008 -7.432 0.391 1.00 0.00 H new ATOM 1425 N LYS A 119 -0.060 -12.533 0.239 1.00 0.00 N ATOM 1426 CA LYS A 119 -0.555 -13.888 0.069 1.00 0.00 C ATOM 1427 C LYS A 119 -0.344 -14.326 -1.381 1.00 0.00 C ATOM 1428 O LYS A 119 -0.139 -15.507 -1.653 1.00 0.00 O ATOM 1429 CB LYS A 119 -2.009 -13.989 0.536 1.00 0.00 C ATOM 1430 CG LYS A 119 -2.611 -15.346 0.166 1.00 0.00 C ATOM 1431 CD LYS A 119 -3.742 -15.185 -0.851 1.00 0.00 C ATOM 1432 CE LYS A 119 -3.706 -16.304 -1.893 1.00 0.00 C ATOM 1433 NZ LYS A 119 -4.972 -16.339 -2.661 1.00 0.00 N ATOM 0 H LYS A 119 -0.694 -11.906 0.734 1.00 0.00 H new ATOM 0 HA LYS A 119 0.007 -14.580 0.696 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.059 -13.847 1.616 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.597 -13.191 0.083 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -1.836 -15.992 -0.246 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.990 -15.836 1.063 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.703 -15.194 -0.336 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -3.655 -14.218 -1.347 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -2.867 -16.150 -2.571 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -3.546 -17.263 -1.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.931 -17.104 -3.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.767 -16.507 -2.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -5.108 -15.430 -3.147 1.00 0.00 H new ATOM 1443 N ASP A 120 -0.400 -13.349 -2.274 1.00 0.00 N ATOM 1444 CA ASP A 120 -0.217 -13.619 -3.691 1.00 0.00 C ATOM 1445 C ASP A 120 1.105 -14.360 -3.897 1.00 0.00 C ATOM 1446 O ASP A 120 1.339 -14.934 -4.961 1.00 0.00 O ATOM 1447 CB ASP A 120 -0.162 -12.319 -4.497 1.00 0.00 C ATOM 1448 CG ASP A 120 -0.821 -12.384 -5.876 1.00 0.00 C ATOM 1449 OD1 ASP A 120 -1.673 -13.281 -6.056 1.00 0.00 O ATOM 1450 OD2 ASP A 120 -0.459 -11.536 -6.719 1.00 0.00 O ATOM 0 H ASP A 120 -0.569 -12.370 -2.045 1.00 0.00 H new ATOM 0 HA ASP A 120 -1.061 -14.219 -4.032 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -0.642 -11.530 -3.918 1.00 0.00 H new ATOM 0 HB3 ASP A 120 0.882 -12.031 -4.623 1.00 0.00 H new ATOM 1454 N GLU A 121 1.934 -14.325 -2.866 1.00 0.00 N ATOM 1455 CA GLU A 121 3.226 -14.986 -2.920 1.00 0.00 C ATOM 1456 C GLU A 121 4.297 -14.018 -3.430 1.00 0.00 C ATOM 1457 O GLU A 121 5.338 -14.445 -3.928 1.00 0.00 O ATOM 1458 CB GLU A 121 3.163 -16.242 -3.793 1.00 0.00 C ATOM 1459 CG GLU A 121 4.091 -17.332 -3.253 1.00 0.00 C ATOM 1460 CD GLU A 121 3.845 -18.663 -3.965 1.00 0.00 C ATOM 1461 OE1 GLU A 121 2.887 -18.710 -4.766 1.00 0.00 O ATOM 1462 OE2 GLU A 121 4.622 -19.605 -3.694 1.00 0.00 O ATOM 0 H GLU A 121 1.736 -13.848 -1.986 1.00 0.00 H new ATOM 0 HA GLU A 121 3.495 -15.297 -1.911 1.00 0.00 H new ATOM 0 HB2 GLU A 121 2.139 -16.615 -3.827 1.00 0.00 H new ATOM 0 HB3 GLU A 121 3.445 -15.993 -4.816 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.130 -17.030 -3.388 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.931 -17.453 -2.182 1.00 0.00 H new ATOM 1467 N ASN A 122 4.005 -12.734 -3.286 1.00 0.00 N ATOM 1468 CA ASN A 122 4.929 -11.703 -3.725 1.00 0.00 C ATOM 1469 C ASN A 122 5.627 -11.097 -2.506 1.00 0.00 C ATOM 1470 O ASN A 122 5.382 -11.514 -1.376 1.00 0.00 O ATOM 1471 CB ASN A 122 4.192 -10.578 -4.456 1.00 0.00 C ATOM 1472 CG ASN A 122 5.002 -10.080 -5.655 1.00 0.00 C ATOM 1473 OD1 ASN A 122 5.991 -10.671 -6.057 1.00 0.00 O ATOM 1474 ND2 ASN A 122 4.529 -8.965 -6.202 1.00 0.00 N ATOM 0 H ASN A 122 3.141 -12.384 -2.871 1.00 0.00 H new ATOM 0 HA ASN A 122 5.650 -12.162 -4.402 1.00 0.00 H new ATOM 0 HB2 ASN A 122 3.219 -10.935 -4.793 1.00 0.00 H new ATOM 0 HB3 ASN A 122 4.008 -9.752 -3.769 1.00 0.00 H new ATOM 0 HD21 ASN A 122 4.999 -8.553 -7.008 1.00 0.00 H new ATOM 0 HD22 ASN A 122 3.696 -8.521 -5.816 1.00 0.00 H new ATOM 1480 N SER A 123 6.484 -10.123 -2.777 1.00 0.00 N ATOM 1481 CA SER A 123 7.219 -9.456 -1.718 1.00 0.00 C ATOM 1482 C SER A 123 7.444 -7.987 -2.081 1.00 0.00 C ATOM 1483 O SER A 123 7.333 -7.608 -3.246 1.00 0.00 O ATOM 1484 CB SER A 123 8.557 -10.149 -1.455 1.00 0.00 C ATOM 1485 OG SER A 123 9.564 -9.228 -1.043 1.00 0.00 O ATOM 0 H SER A 123 6.685 -9.780 -3.716 1.00 0.00 H new ATOM 0 HA SER A 123 6.627 -9.511 -0.805 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.426 -10.910 -0.686 1.00 0.00 H new ATOM 0 HB3 SER A 123 8.883 -10.662 -2.360 1.00 0.00 H new ATOM 0 HG SER A 123 10.402 -9.710 -0.883 1.00 0.00 H new ATOM 1490 N VAL A 124 7.759 -7.200 -1.062 1.00 0.00 N ATOM 1491 CA VAL A 124 8.000 -5.781 -1.260 1.00 0.00 C ATOM 1492 C VAL A 124 9.054 -5.303 -0.258 1.00 0.00 C ATOM 1493 O VAL A 124 9.495 -6.070 0.597 1.00 0.00 O ATOM 1494 CB VAL A 124 6.685 -5.007 -1.159 1.00 0.00 C ATOM 1495 CG1 VAL A 124 6.704 -3.773 -2.064 1.00 0.00 C ATOM 1496 CG2 VAL A 124 5.492 -5.907 -1.483 1.00 0.00 C ATOM 0 H VAL A 124 7.853 -7.518 -0.097 1.00 0.00 H new ATOM 0 HA VAL A 124 8.393 -5.596 -2.260 1.00 0.00 H new ATOM 0 HB VAL A 124 6.576 -4.666 -0.130 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.757 -3.241 -1.973 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.520 -3.115 -1.765 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.848 -4.083 -3.099 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.570 -5.331 -1.404 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.592 -6.293 -2.497 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.462 -6.739 -0.779 1.00 0.00 H new ATOM 1506 N ILE A 125 9.427 -4.040 -0.398 1.00 0.00 N ATOM 1507 CA ILE A 125 10.421 -3.450 0.484 1.00 0.00 C ATOM 1508 C ILE A 125 9.953 -2.059 0.915 1.00 0.00 C ATOM 1509 O ILE A 125 10.398 -1.053 0.364 1.00 0.00 O ATOM 1510 CB ILE A 125 11.798 -3.459 -0.180 1.00 0.00 C ATOM 1511 CG1 ILE A 125 12.241 -4.887 -0.508 1.00 0.00 C ATOM 1512 CG2 ILE A 125 12.827 -2.723 0.682 1.00 0.00 C ATOM 1513 CD1 ILE A 125 12.536 -5.040 -2.001 1.00 0.00 C ATOM 0 H ILE A 125 9.059 -3.408 -1.109 1.00 0.00 H new ATOM 0 HA ILE A 125 10.527 -4.045 1.391 1.00 0.00 H new ATOM 0 HB ILE A 125 11.725 -2.921 -1.125 1.00 0.00 H new ATOM 0 HG12 ILE A 125 13.131 -5.137 0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 125 11.462 -5.590 -0.214 1.00 0.00 H new ATOM 0 HG21 ILE A 125 13.798 -2.744 0.187 1.00 0.00 H new ATOM 0 HG22 ILE A 125 12.513 -1.689 0.820 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.904 -3.212 1.653 1.00 0.00 H new ATOM 0 HD11 ILE A 125 12.849 -6.064 -2.207 1.00 0.00 H new ATOM 0 HD12 ILE A 125 11.637 -4.813 -2.575 1.00 0.00 H new ATOM 0 HD13 ILE A 125 13.332 -4.353 -2.287 1.00 0.00 H new ATOM 1524 N PHE A 126 9.063 -2.045 1.895 1.00 0.00 N ATOM 1525 CA PHE A 126 8.530 -0.794 2.406 1.00 0.00 C ATOM 1526 C PHE A 126 9.544 -0.097 3.314 1.00 0.00 C ATOM 1527 O PHE A 126 10.466 -0.732 3.826 1.00 0.00 O ATOM 1528 CB PHE A 126 7.284 -1.138 3.224 1.00 0.00 C ATOM 1529 CG PHE A 126 6.013 -1.292 2.387 1.00 0.00 C ATOM 1530 CD1 PHE A 126 5.812 -0.496 1.303 1.00 0.00 C ATOM 1531 CD2 PHE A 126 5.084 -2.226 2.725 1.00 0.00 C ATOM 1532 CE1 PHE A 126 4.632 -0.638 0.526 1.00 0.00 C ATOM 1533 CE2 PHE A 126 3.905 -2.369 1.948 1.00 0.00 C ATOM 1534 CZ PHE A 126 3.703 -1.573 0.864 1.00 0.00 C ATOM 0 H PHE A 126 8.697 -2.881 2.350 1.00 0.00 H new ATOM 0 HA PHE A 126 8.300 -0.123 1.579 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.463 -2.066 3.767 1.00 0.00 H new ATOM 0 HB3 PHE A 126 7.124 -0.358 3.969 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.550 0.245 1.033 1.00 0.00 H new ATOM 0 HD2 PHE A 126 5.244 -2.859 3.585 1.00 0.00 H new ATOM 0 HE1 PHE A 126 4.472 -0.004 -0.333 1.00 0.00 H new ATOM 0 HE2 PHE A 126 3.168 -3.111 2.218 1.00 0.00 H new ATOM 0 HZ PHE A 126 2.806 -1.683 0.272 1.00 0.00 H new ATOM 1543 N SER A 127 9.343 1.201 3.486 1.00 0.00 N ATOM 1544 CA SER A 127 10.228 1.992 4.324 1.00 0.00 C ATOM 1545 C SER A 127 9.425 3.049 5.084 1.00 0.00 C ATOM 1546 O SER A 127 8.891 3.980 4.482 1.00 0.00 O ATOM 1547 CB SER A 127 11.327 2.657 3.491 1.00 0.00 C ATOM 1548 OG SER A 127 12.578 1.991 3.628 1.00 0.00 O ATOM 0 H SER A 127 8.579 1.725 3.059 1.00 0.00 H new ATOM 0 HA SER A 127 10.706 1.325 5.041 1.00 0.00 H new ATOM 0 HB2 SER A 127 11.033 2.663 2.442 1.00 0.00 H new ATOM 0 HB3 SER A 127 11.435 3.697 3.798 1.00 0.00 H new ATOM 0 HG SER A 127 12.984 2.231 4.487 1.00 0.00 H new ATOM 1553 N ALA A 128 9.364 2.871 6.395 1.00 0.00 N ATOM 1554 CA ALA A 128 8.634 3.799 7.244 1.00 0.00 C ATOM 1555 C ALA A 128 9.625 4.738 7.934 1.00 0.00 C ATOM 1556 O ALA A 128 10.837 4.579 7.796 1.00 0.00 O ATOM 1557 CB ALA A 128 7.782 3.014 8.242 1.00 0.00 C ATOM 0 H ALA A 128 9.808 2.098 6.891 1.00 0.00 H new ATOM 0 HA ALA A 128 7.957 4.413 6.650 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.235 3.709 8.879 1.00 0.00 H new ATOM 0 HB2 ALA A 128 7.076 2.384 7.701 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.428 2.389 8.859 1.00 0.00 H new ATOM 1563 N LYS A 129 9.072 5.697 8.662 1.00 0.00 N ATOM 1564 CA LYS A 129 9.891 6.663 9.373 1.00 0.00 C ATOM 1565 C LYS A 129 9.441 6.729 10.835 1.00 0.00 C ATOM 1566 O LYS A 129 10.222 7.095 11.712 1.00 0.00 O ATOM 1567 CB LYS A 129 9.865 8.017 8.662 1.00 0.00 C ATOM 1568 CG LYS A 129 11.143 8.809 8.944 1.00 0.00 C ATOM 1569 CD LYS A 129 10.848 10.308 9.046 1.00 0.00 C ATOM 1570 CE LYS A 129 10.501 10.702 10.483 1.00 0.00 C ATOM 1571 NZ LYS A 129 10.054 12.112 10.540 1.00 0.00 N ATOM 0 H LYS A 129 8.066 5.825 8.775 1.00 0.00 H new ATOM 0 HA LYS A 129 10.935 6.349 9.372 1.00 0.00 H new ATOM 0 HB2 LYS A 129 9.756 7.866 7.588 1.00 0.00 H new ATOM 0 HB3 LYS A 129 8.998 8.589 8.993 1.00 0.00 H new ATOM 0 HG2 LYS A 129 11.594 8.459 9.873 1.00 0.00 H new ATOM 0 HG3 LYS A 129 11.868 8.631 8.150 1.00 0.00 H new ATOM 0 HD2 LYS A 129 11.715 10.877 8.708 1.00 0.00 H new ATOM 0 HD3 LYS A 129 10.021 10.565 8.385 1.00 0.00 H new ATOM 0 HE2 LYS A 129 9.716 10.050 10.866 1.00 0.00 H new ATOM 0 HE3 LYS A 129 11.371 10.564 11.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 9.822 12.363 11.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 10.814 12.731 10.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 9.211 12.233 9.944 1.00 0.00 H new ATOM 1581 N SER A 130 8.185 6.367 11.051 1.00 0.00 N ATOM 1582 CA SER A 130 7.622 6.381 12.390 1.00 0.00 C ATOM 1583 C SER A 130 7.431 4.948 12.891 1.00 0.00 C ATOM 1584 O SER A 130 6.790 4.135 12.227 1.00 0.00 O ATOM 1585 CB SER A 130 6.292 7.136 12.422 1.00 0.00 C ATOM 1586 OG SER A 130 6.348 8.281 13.268 1.00 0.00 O ATOM 0 H SER A 130 7.541 6.062 10.321 1.00 0.00 H new ATOM 0 HA SER A 130 8.318 6.901 13.048 1.00 0.00 H new ATOM 0 HB2 SER A 130 6.026 7.445 11.411 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.504 6.467 12.769 1.00 0.00 H new ATOM 0 HG SER A 130 5.480 8.736 13.260 1.00 0.00 H new ATOM 1591 N ALA A 131 7.998 4.682 14.058 1.00 0.00 N ATOM 1592 CA ALA A 131 7.898 3.362 14.656 1.00 0.00 C ATOM 1593 C ALA A 131 6.434 2.917 14.657 1.00 0.00 C ATOM 1594 O ALA A 131 6.144 1.722 14.702 1.00 0.00 O ATOM 1595 CB ALA A 131 8.499 3.391 16.062 1.00 0.00 C ATOM 0 H ALA A 131 8.529 5.359 14.606 1.00 0.00 H new ATOM 0 HA ALA A 131 8.464 2.634 14.075 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.424 2.400 16.510 1.00 0.00 H new ATOM 0 HB2 ALA A 131 9.547 3.684 16.004 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.955 4.109 16.675 1.00 0.00 H new ATOM 1601 N GLU A 132 5.549 3.902 14.606 1.00 0.00 N ATOM 1602 CA GLU A 132 4.123 3.627 14.601 1.00 0.00 C ATOM 1603 C GLU A 132 3.679 3.148 13.217 1.00 0.00 C ATOM 1604 O GLU A 132 2.896 2.207 13.103 1.00 0.00 O ATOM 1605 CB GLU A 132 3.325 4.858 15.035 1.00 0.00 C ATOM 1606 CG GLU A 132 2.700 4.648 16.416 1.00 0.00 C ATOM 1607 CD GLU A 132 1.196 4.393 16.305 1.00 0.00 C ATOM 1608 OE1 GLU A 132 0.835 3.220 16.067 1.00 0.00 O ATOM 1609 OE2 GLU A 132 0.441 5.377 16.458 1.00 0.00 O ATOM 0 H GLU A 132 5.793 4.892 14.568 1.00 0.00 H new ATOM 0 HA GLU A 132 3.925 2.833 15.321 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.978 5.730 15.056 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.542 5.064 14.305 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.180 3.804 16.911 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.879 5.526 17.037 1.00 0.00 H new ATOM 1614 N GLU A 133 4.200 3.817 12.199 1.00 0.00 N ATOM 1615 CA GLU A 133 3.869 3.471 10.827 1.00 0.00 C ATOM 1616 C GLU A 133 4.229 2.011 10.547 1.00 0.00 C ATOM 1617 O GLU A 133 3.387 1.236 10.094 1.00 0.00 O ATOM 1618 CB GLU A 133 4.569 4.408 9.841 1.00 0.00 C ATOM 1619 CG GLU A 133 4.215 5.869 10.127 1.00 0.00 C ATOM 1620 CD GLU A 133 2.700 6.081 10.099 1.00 0.00 C ATOM 1621 OE1 GLU A 133 2.163 6.196 8.976 1.00 0.00 O ATOM 1622 OE2 GLU A 133 2.113 6.123 11.202 1.00 0.00 O ATOM 0 H GLU A 133 4.849 4.597 12.297 1.00 0.00 H new ATOM 0 HA GLU A 133 2.794 3.592 10.691 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.648 4.272 9.908 1.00 0.00 H new ATOM 0 HB3 GLU A 133 4.278 4.152 8.822 1.00 0.00 H new ATOM 0 HG2 GLU A 133 4.608 6.158 11.101 1.00 0.00 H new ATOM 0 HG3 GLU A 133 4.690 6.514 9.387 1.00 0.00 H new ATOM 1627 N LYS A 134 5.480 1.679 10.826 1.00 0.00 N ATOM 1628 CA LYS A 134 5.962 0.326 10.609 1.00 0.00 C ATOM 1629 C LYS A 134 5.035 -0.662 11.320 1.00 0.00 C ATOM 1630 O LYS A 134 4.662 -1.689 10.753 1.00 0.00 O ATOM 1631 CB LYS A 134 7.428 0.205 11.030 1.00 0.00 C ATOM 1632 CG LYS A 134 7.643 0.768 12.437 1.00 0.00 C ATOM 1633 CD LYS A 134 7.784 -0.358 13.463 1.00 0.00 C ATOM 1634 CE LYS A 134 8.863 -0.027 14.495 1.00 0.00 C ATOM 1635 NZ LYS A 134 9.052 -1.160 15.430 1.00 0.00 N ATOM 0 H LYS A 134 6.175 2.324 11.201 1.00 0.00 H new ATOM 0 HA LYS A 134 5.938 0.079 9.548 1.00 0.00 H new ATOM 0 HB2 LYS A 134 7.733 -0.841 11.003 1.00 0.00 H new ATOM 0 HB3 LYS A 134 8.059 0.740 10.320 1.00 0.00 H new ATOM 0 HG2 LYS A 134 8.537 1.391 12.450 1.00 0.00 H new ATOM 0 HG3 LYS A 134 6.804 1.409 12.708 1.00 0.00 H new ATOM 0 HD2 LYS A 134 6.831 -0.517 13.967 1.00 0.00 H new ATOM 0 HD3 LYS A 134 8.035 -1.289 12.955 1.00 0.00 H new ATOM 0 HE2 LYS A 134 9.803 0.195 13.989 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.581 0.867 15.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 9.788 -0.918 16.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 8.159 -1.354 15.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 9.342 -2.005 14.897 1.00 0.00 H new ATOM 1645 N ASN A 135 4.687 -0.316 12.551 1.00 0.00 N ATOM 1646 CA ASN A 135 3.809 -1.159 13.345 1.00 0.00 C ATOM 1647 C ASN A 135 2.415 -1.172 12.716 1.00 0.00 C ATOM 1648 O ASN A 135 1.779 -2.221 12.629 1.00 0.00 O ATOM 1649 CB ASN A 135 3.679 -0.626 14.773 1.00 0.00 C ATOM 1650 CG ASN A 135 3.356 -1.757 15.753 1.00 0.00 C ATOM 1651 OD1 ASN A 135 2.209 -2.034 16.065 1.00 0.00 O ATOM 1652 ND2 ASN A 135 4.428 -2.392 16.218 1.00 0.00 N ATOM 0 H ASN A 135 4.997 0.536 13.018 1.00 0.00 H new ATOM 0 HA ASN A 135 4.236 -2.161 13.371 1.00 0.00 H new ATOM 0 HB2 ASN A 135 4.608 -0.138 15.069 1.00 0.00 H new ATOM 0 HB3 ASN A 135 2.895 0.130 14.813 1.00 0.00 H new ATOM 0 HD21 ASN A 135 4.318 -3.162 16.877 1.00 0.00 H new ATOM 0 HD22 ASN A 135 5.360 -2.109 15.915 1.00 0.00 H new ATOM 1658 N ASN A 136 1.980 0.007 12.295 1.00 0.00 N ATOM 1659 CA ASN A 136 0.672 0.144 11.676 1.00 0.00 C ATOM 1660 C ASN A 136 0.740 -0.358 10.233 1.00 0.00 C ATOM 1661 O ASN A 136 -0.289 -0.647 9.623 1.00 0.00 O ATOM 1662 CB ASN A 136 0.228 1.608 11.647 1.00 0.00 C ATOM 1663 CG ASN A 136 -1.145 1.778 12.299 1.00 0.00 C ATOM 1664 OD1 ASN A 136 -1.531 1.045 13.194 1.00 0.00 O ATOM 1665 ND2 ASN A 136 -1.860 2.784 11.802 1.00 0.00 N ATOM 0 H ASN A 136 2.510 0.875 12.370 1.00 0.00 H new ATOM 0 HA ASN A 136 -0.041 -0.438 12.261 1.00 0.00 H new ATOM 0 HB2 ASN A 136 0.961 2.224 12.168 1.00 0.00 H new ATOM 0 HB3 ASN A 136 0.191 1.960 10.616 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -2.791 2.979 12.171 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -1.477 3.360 11.052 1.00 0.00 H new ATOM 1671 N TRP A 137 1.962 -0.448 9.728 1.00 0.00 N ATOM 1672 CA TRP A 137 2.177 -0.911 8.367 1.00 0.00 C ATOM 1673 C TRP A 137 2.065 -2.436 8.364 1.00 0.00 C ATOM 1674 O TRP A 137 1.478 -3.017 7.452 1.00 0.00 O ATOM 1675 CB TRP A 137 3.514 -0.408 7.822 1.00 0.00 C ATOM 1676 CG TRP A 137 3.543 1.093 7.529 1.00 0.00 C ATOM 1677 CD1 TRP A 137 2.652 2.024 7.900 1.00 0.00 C ATOM 1678 CD2 TRP A 137 4.554 1.805 6.784 1.00 0.00 C ATOM 1679 NE1 TRP A 137 3.012 3.277 7.449 1.00 0.00 N ATOM 1680 CE2 TRP A 137 4.206 3.140 6.750 1.00 0.00 C ATOM 1681 CE3 TRP A 137 5.724 1.336 6.161 1.00 0.00 C ATOM 1682 CZ2 TRP A 137 4.974 4.116 6.104 1.00 0.00 C ATOM 1683 CZ3 TRP A 137 6.481 2.324 5.519 1.00 0.00 C ATOM 1684 CH2 TRP A 137 6.144 3.672 5.475 1.00 0.00 C ATOM 0 H TRP A 137 2.813 -0.208 10.237 1.00 0.00 H new ATOM 0 HA TRP A 137 1.419 -0.505 7.697 1.00 0.00 H new ATOM 0 HB2 TRP A 137 4.299 -0.642 8.541 1.00 0.00 H new ATOM 0 HB3 TRP A 137 3.748 -0.951 6.906 1.00 0.00 H new ATOM 0 HD1 TRP A 137 1.764 1.819 8.479 1.00 0.00 H new ATOM 0 HE1 TRP A 137 2.497 4.144 7.600 1.00 0.00 H new ATOM 0 HE3 TRP A 137 6.016 0.296 6.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 4.680 5.155 6.091 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 7.390 2.017 5.023 1.00 0.00 H new ATOM 0 HH2 TRP A 137 6.782 4.374 4.958 1.00 0.00 H new ATOM 1694 N MET A 138 2.637 -3.042 9.394 1.00 0.00 N ATOM 1695 CA MET A 138 2.610 -4.489 9.521 1.00 0.00 C ATOM 1696 C MET A 138 1.345 -4.952 10.248 1.00 0.00 C ATOM 1697 O MET A 138 0.783 -5.996 9.921 1.00 0.00 O ATOM 1698 CB MET A 138 3.843 -4.958 10.295 1.00 0.00 C ATOM 1699 CG MET A 138 3.979 -4.204 11.620 1.00 0.00 C ATOM 1700 SD MET A 138 4.021 -5.362 12.979 1.00 0.00 S ATOM 1701 CE MET A 138 2.577 -4.832 13.883 1.00 0.00 C ATOM 0 H MET A 138 3.122 -2.557 10.149 1.00 0.00 H new ATOM 0 HA MET A 138 2.612 -4.922 8.521 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.770 -6.028 10.487 1.00 0.00 H new ATOM 0 HB3 MET A 138 4.737 -4.803 9.691 1.00 0.00 H new ATOM 0 HG2 MET A 138 4.889 -3.604 11.615 1.00 0.00 H new ATOM 0 HG3 MET A 138 3.143 -3.515 11.744 1.00 0.00 H new ATOM 0 HE1 MET A 138 2.650 -5.171 14.916 1.00 0.00 H new ATOM 0 HE2 MET A 138 2.513 -3.744 13.862 1.00 0.00 H new ATOM 0 HE3 MET A 138 1.684 -5.257 13.424 1.00 0.00 H new ATOM 1709 N ALA A 139 0.934 -4.151 11.221 1.00 0.00 N ATOM 1710 CA ALA A 139 -0.254 -4.465 11.997 1.00 0.00 C ATOM 1711 C ALA A 139 -1.476 -4.454 11.077 1.00 0.00 C ATOM 1712 O ALA A 139 -2.300 -5.366 11.123 1.00 0.00 O ATOM 1713 CB ALA A 139 -0.385 -3.472 13.154 1.00 0.00 C ATOM 0 H ALA A 139 1.402 -3.286 11.489 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.177 -5.462 12.431 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.276 -3.707 13.736 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.495 -3.540 13.794 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.467 -2.460 12.757 1.00 0.00 H new ATOM 1719 N ALA A 140 -1.556 -3.411 10.264 1.00 0.00 N ATOM 1720 CA ALA A 140 -2.664 -3.269 9.336 1.00 0.00 C ATOM 1721 C ALA A 140 -2.728 -4.502 8.432 1.00 0.00 C ATOM 1722 O ALA A 140 -3.803 -5.055 8.207 1.00 0.00 O ATOM 1723 CB ALA A 140 -2.501 -1.971 8.541 1.00 0.00 C ATOM 0 H ALA A 140 -0.871 -2.656 10.229 1.00 0.00 H new ATOM 0 HA ALA A 140 -3.610 -3.205 9.874 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -3.332 -1.864 7.844 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -2.491 -1.123 9.226 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.564 -2.000 7.985 1.00 0.00 H new ATOM 1729 N LEU A 141 -1.563 -4.896 7.939 1.00 0.00 N ATOM 1730 CA LEU A 141 -1.473 -6.053 7.065 1.00 0.00 C ATOM 1731 C LEU A 141 -1.742 -7.322 7.877 1.00 0.00 C ATOM 1732 O LEU A 141 -2.434 -8.226 7.412 1.00 0.00 O ATOM 1733 CB LEU A 141 -0.131 -6.067 6.331 1.00 0.00 C ATOM 1734 CG LEU A 141 -0.184 -5.759 4.833 1.00 0.00 C ATOM 1735 CD1 LEU A 141 -0.241 -4.250 4.584 1.00 0.00 C ATOM 1736 CD2 LEU A 141 0.984 -6.418 4.096 1.00 0.00 C ATOM 0 H LEU A 141 -0.673 -4.434 8.128 1.00 0.00 H new ATOM 0 HA LEU A 141 -2.235 -6.003 6.287 1.00 0.00 H new ATOM 0 HB2 LEU A 141 0.529 -5.343 6.808 1.00 0.00 H new ATOM 0 HB3 LEU A 141 0.324 -7.049 6.464 1.00 0.00 H new ATOM 0 HG LEU A 141 -1.102 -6.186 4.429 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -0.278 -4.059 3.511 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -1.132 -3.837 5.057 1.00 0.00 H new ATOM 0 HD13 LEU A 141 0.646 -3.778 5.006 1.00 0.00 H new ATOM 0 HD21 LEU A 141 0.923 -6.183 3.033 1.00 0.00 H new ATOM 0 HD22 LEU A 141 1.925 -6.042 4.497 1.00 0.00 H new ATOM 0 HD23 LEU A 141 0.937 -7.498 4.232 1.00 0.00 H new ATOM 1747 N ILE A 142 -1.182 -7.349 9.078 1.00 0.00 N ATOM 1748 CA ILE A 142 -1.353 -8.491 9.959 1.00 0.00 C ATOM 1749 C ILE A 142 -2.811 -8.564 10.415 1.00 0.00 C ATOM 1750 O ILE A 142 -3.283 -9.621 10.833 1.00 0.00 O ATOM 1751 CB ILE A 142 -0.350 -8.432 11.113 1.00 0.00 C ATOM 1752 CG1 ILE A 142 1.031 -8.914 10.664 1.00 0.00 C ATOM 1753 CG2 ILE A 142 -0.863 -9.212 12.326 1.00 0.00 C ATOM 1754 CD1 ILE A 142 0.956 -10.325 10.077 1.00 0.00 C ATOM 0 H ILE A 142 -0.609 -6.597 9.461 1.00 0.00 H new ATOM 0 HA ILE A 142 -1.138 -9.418 9.427 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.244 -7.392 11.421 1.00 0.00 H new ATOM 0 HG12 ILE A 142 1.435 -8.228 9.920 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.716 -8.905 11.511 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -0.131 -9.154 13.132 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -1.807 -8.783 12.662 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -1.016 -10.255 12.050 1.00 0.00 H new ATOM 0 HD11 ILE A 142 1.951 -10.643 9.766 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.574 -11.013 10.831 1.00 0.00 H new ATOM 0 HD13 ILE A 142 0.289 -10.325 9.215 1.00 0.00 H new ATOM 1765 N SER A 143 -3.486 -7.427 10.319 1.00 0.00 N ATOM 1766 CA SER A 143 -4.881 -7.349 10.716 1.00 0.00 C ATOM 1767 C SER A 143 -5.753 -8.113 9.718 1.00 0.00 C ATOM 1768 O SER A 143 -6.678 -8.822 10.111 1.00 0.00 O ATOM 1769 CB SER A 143 -5.345 -5.895 10.821 1.00 0.00 C ATOM 1770 OG SER A 143 -6.741 -5.797 11.083 1.00 0.00 O ATOM 0 H SER A 143 -3.092 -6.553 9.972 1.00 0.00 H new ATOM 0 HA SER A 143 -4.981 -7.805 11.701 1.00 0.00 H new ATOM 0 HB2 SER A 143 -4.791 -5.394 11.615 1.00 0.00 H new ATOM 0 HB3 SER A 143 -5.113 -5.373 9.893 1.00 0.00 H new ATOM 0 HG SER A 143 -6.997 -4.853 11.144 1.00 0.00 H new ATOM 1775 N LEU A 144 -5.427 -7.943 8.444 1.00 0.00 N ATOM 1776 CA LEU A 144 -6.169 -8.608 7.387 1.00 0.00 C ATOM 1777 C LEU A 144 -5.818 -10.097 7.381 1.00 0.00 C ATOM 1778 O LEU A 144 -6.677 -10.943 7.622 1.00 0.00 O ATOM 1779 CB LEU A 144 -5.927 -7.913 6.045 1.00 0.00 C ATOM 1780 CG LEU A 144 -6.478 -6.491 5.917 1.00 0.00 C ATOM 1781 CD1 LEU A 144 -6.514 -6.048 4.453 1.00 0.00 C ATOM 1782 CD2 LEU A 144 -7.848 -6.371 6.587 1.00 0.00 C ATOM 0 H LEU A 144 -4.659 -7.354 8.121 1.00 0.00 H new ATOM 0 HA LEU A 144 -7.241 -8.535 7.570 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -4.853 -7.883 5.862 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -6.367 -8.524 5.257 1.00 0.00 H new ATOM 0 HG LEU A 144 -5.804 -5.814 6.442 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -6.909 -5.034 4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -5.505 -6.071 4.041 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.153 -6.723 3.884 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -8.217 -5.351 6.481 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.547 -7.060 6.113 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -7.758 -6.617 7.645 1.00 0.00 H new ATOM 1793 N GLN A 145 -4.551 -10.372 7.101 1.00 0.00 N ATOM 1794 CA GLN A 145 -4.076 -11.745 7.061 1.00 0.00 C ATOM 1795 C GLN A 145 -4.558 -12.511 8.294 1.00 0.00 C ATOM 1796 O GLN A 145 -4.627 -13.739 8.279 1.00 0.00 O ATOM 1797 CB GLN A 145 -2.551 -11.793 6.948 1.00 0.00 C ATOM 1798 CG GLN A 145 -1.898 -11.798 8.332 1.00 0.00 C ATOM 1799 CD GLN A 145 -1.334 -13.180 8.666 1.00 0.00 C ATOM 1800 OE1 GLN A 145 -2.085 -13.880 9.512 1.00 0.00 O flip ATOM 1801 NE2 GLN A 145 -0.287 -13.584 8.188 1.00 0.00 N flip ATOM 0 H GLN A 145 -3.841 -9.668 6.900 1.00 0.00 H new ATOM 0 HA GLN A 145 -4.490 -12.226 6.175 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -2.252 -12.685 6.398 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -2.198 -10.933 6.378 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -1.099 -11.058 8.364 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -2.631 -11.508 9.085 1.00 0.00 H new ATOM 0 HE21 GLN A 145 0.241 -12.995 7.544 1.00 0.00 H new ATOM 0 HE22 GLN A 145 0.061 -14.511 8.432 1.00 0.00 H new ATOM 1808 N TYR A 146 -4.881 -11.753 9.332 1.00 0.00 N ATOM 1809 CA TYR A 146 -5.356 -12.346 10.571 1.00 0.00 C ATOM 1810 C TYR A 146 -6.760 -12.928 10.398 1.00 0.00 C ATOM 1811 O TYR A 146 -7.124 -13.893 11.069 1.00 0.00 O ATOM 1812 CB TYR A 146 -5.410 -11.206 11.590 1.00 0.00 C ATOM 1813 CG TYR A 146 -4.304 -11.260 12.646 1.00 0.00 C ATOM 1814 CD1 TYR A 146 -3.092 -11.850 12.346 1.00 0.00 C ATOM 1815 CD2 TYR A 146 -4.517 -10.721 13.898 1.00 0.00 C ATOM 1816 CE1 TYR A 146 -2.051 -11.902 13.339 1.00 0.00 C ATOM 1817 CE2 TYR A 146 -3.476 -10.772 14.891 1.00 0.00 C ATOM 1818 CZ TYR A 146 -2.295 -11.360 14.563 1.00 0.00 C ATOM 1819 OH TYR A 146 -1.311 -11.410 15.501 1.00 0.00 O ATOM 0 H TYR A 146 -4.823 -10.735 9.341 1.00 0.00 H new ATOM 0 HA TYR A 146 -4.699 -13.157 10.885 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -5.346 -10.256 11.060 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -6.378 -11.226 12.091 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -2.925 -12.273 11.366 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -5.465 -10.261 14.133 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -1.099 -12.361 13.118 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -3.630 -10.353 15.874 1.00 0.00 H new ATOM 0 HH TYR A 146 -1.624 -10.984 16.326 1.00 0.00 H new ATOM 1828 N ARG A 147 -7.512 -12.315 9.495 1.00 0.00 N ATOM 1829 CA ARG A 147 -8.868 -12.761 9.225 1.00 0.00 C ATOM 1830 C ARG A 147 -8.859 -13.914 8.222 1.00 0.00 C ATOM 1831 O ARG A 147 -9.913 -14.347 7.758 1.00 0.00 O ATOM 1832 CB ARG A 147 -9.723 -11.618 8.671 1.00 0.00 C ATOM 1833 CG ARG A 147 -11.149 -11.684 9.222 1.00 0.00 C ATOM 1834 CD ARG A 147 -11.986 -10.508 8.716 1.00 0.00 C ATOM 1835 NE ARG A 147 -13.423 -10.766 8.960 1.00 0.00 N ATOM 1836 CZ ARG A 147 -14.216 -11.451 8.125 1.00 0.00 C ATOM 1837 NH1 ARG A 147 -13.717 -11.949 6.985 1.00 0.00 N ATOM 1838 NH2 ARG A 147 -15.508 -11.637 8.429 1.00 0.00 N ATOM 0 H ARG A 147 -7.208 -11.514 8.942 1.00 0.00 H new ATOM 0 HA ARG A 147 -9.299 -13.100 10.167 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -9.272 -10.661 8.933 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -9.747 -11.671 7.583 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -11.615 -12.623 8.923 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -11.123 -11.674 10.312 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -11.682 -9.591 9.221 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -11.811 -10.358 7.651 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.835 -10.399 9.818 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -12.734 -11.806 6.753 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -14.320 -12.471 6.349 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -15.888 -11.257 9.296 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -16.112 -12.158 7.793 1.00 0.00 H new ATOM 1849 N SER A 148 -7.657 -14.380 7.915 1.00 0.00 N ATOM 1850 CA SER A 148 -7.496 -15.475 6.973 1.00 0.00 C ATOM 1851 C SER A 148 -7.257 -16.784 7.730 1.00 0.00 C ATOM 1852 O SER A 148 -6.563 -17.672 7.237 1.00 0.00 O ATOM 1853 CB SER A 148 -6.345 -15.204 6.004 1.00 0.00 C ATOM 1854 OG SER A 148 -6.738 -15.377 4.645 1.00 0.00 O ATOM 0 H SER A 148 -6.785 -14.019 8.302 1.00 0.00 H new ATOM 0 HA SER A 148 -8.412 -15.562 6.389 1.00 0.00 H new ATOM 0 HB2 SER A 148 -5.981 -14.187 6.149 1.00 0.00 H new ATOM 0 HB3 SER A 148 -5.516 -15.875 6.230 1.00 0.00 H new ATOM 0 HG SER A 148 -6.999 -14.511 4.267 1.00 0.00 H new ATOM 1859 N THR A 149 -7.846 -16.862 8.914 1.00 0.00 N ATOM 1860 CA THR A 149 -7.705 -18.048 9.743 1.00 0.00 C ATOM 1861 C THR A 149 -8.562 -17.920 11.005 1.00 0.00 C ATOM 1862 O THR A 149 -9.145 -18.901 11.465 1.00 0.00 O ATOM 1863 CB THR A 149 -6.217 -18.246 10.036 1.00 0.00 C ATOM 1864 OG1 THR A 149 -5.812 -19.253 9.113 1.00 0.00 O ATOM 1865 CG2 THR A 149 -5.969 -18.876 11.408 1.00 0.00 C ATOM 0 H THR A 149 -8.422 -16.124 9.319 1.00 0.00 H new ATOM 0 HA THR A 149 -8.070 -18.937 9.228 1.00 0.00 H new ATOM 0 HB THR A 149 -5.705 -17.285 9.980 1.00 0.00 H new ATOM 0 HG1 THR A 149 -6.176 -19.050 8.226 1.00 0.00 H new ATOM 0 HG21 THR A 149 -4.897 -18.995 11.566 1.00 0.00 H new ATOM 0 HG22 THR A 149 -6.381 -18.231 12.184 1.00 0.00 H new ATOM 0 HG23 THR A 149 -6.452 -19.852 11.453 1.00 0.00 H new ATOM 1873 N LEU A 150 -8.609 -16.704 11.528 1.00 0.00 N ATOM 1874 CA LEU A 150 -9.385 -16.436 12.728 1.00 0.00 C ATOM 1875 C LEU A 150 -10.649 -15.660 12.351 1.00 0.00 C ATOM 1876 O LEU A 150 -11.063 -15.667 11.193 1.00 0.00 O ATOM 1877 CB LEU A 150 -8.522 -15.733 13.778 1.00 0.00 C ATOM 1878 CG LEU A 150 -8.337 -14.225 13.593 1.00 0.00 C ATOM 1879 CD1 LEU A 150 -9.161 -13.442 14.617 1.00 0.00 C ATOM 1880 CD2 LEU A 150 -6.856 -13.845 13.640 1.00 0.00 C ATOM 0 H LEU A 150 -8.123 -15.894 11.144 1.00 0.00 H new ATOM 0 HA LEU A 150 -9.709 -17.369 13.188 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -8.964 -15.907 14.759 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -7.538 -16.202 13.784 1.00 0.00 H new ATOM 0 HG LEU A 150 -8.709 -13.954 12.605 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -9.012 -12.373 14.464 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -10.217 -13.682 14.494 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -8.842 -13.712 15.624 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -6.752 -12.768 13.506 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -6.437 -14.133 14.604 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -6.322 -14.363 12.843 1.00 0.00 H new