USER MOD reduce.3.24.130724 H: found=0, std=0, add=1283, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1280 hydrogens (30 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 NoAdj-H: A 93 HIS HE2 : A 93 HIS NE2 : A 154 HEMFE :(H bumps) USER MOD Set 1.1: A 116 HIS : no HE2:sc= -0.212 K(o=0.25,f=-2!) USER MOD Set 1.2: A 128 GLN : amide:sc= 0.459 K(o=0.25,f=-1.6!) USER MOD Set 2.1: A 113 HIS : no HD1:sc= -0.296 X(o=0.4,f=0.22) USER MOD Set 2.2: A 117 SER OG : rot -169:sc= 0.693 USER MOD Set 3.1: A 95 THR OG1 : rot 120:sc= 1.15 USER MOD Set 3.2: A 151 TYR OH : rot 30:sc= 0.975 USER MOD Set 4.1: A 48 HIS : no HD1:sc= -1.62 K(o=-0.014,f=-8.1!) USER MOD Set 4.2: A 58 SER OG : rot 70:sc= 1.61 USER MOD Set 5.1: A 42 LYS NZ :NH3+ -170:sc= 1.34 (180deg=0.707) USER MOD Set 5.2: A 103 TYR OH : rot 130:sc= 0.531 USER MOD Set 6.1: A 36 HIS : no HE2:sc= -1.87 K(o=-1.9,f=-8.1!) USER MOD Set 6.2: A 39 THR OG1 : rot 130:sc= 0.0113 USER MOD Set 7.1: A 24 HIS : no HE2:sc= -2.55! C(o=-1.8!,f=-12!) USER MOD Set 7.2: A 119 HIS : no HD1:sc= 0.788 K(o=-1.8,f=-11!) USER MOD Set 8.1: A 12 HIS : no HD1:sc= 0.857 K(o=1.3,f=-2.8!) USER MOD Set 8.2: A 16 LYS NZ :NH3+ 164:sc= 0.404 (180deg=0.253) USER MOD Single : A 1 VAL N :NH3+ 144:sc= -0.61 (180deg=-0.767) USER MOD Single : A 3 SER OG : rot 81:sc= 0.866 USER MOD Single : A 8 GLN : amide:sc= -0.141 X(o=-0.14,f=-0.14) USER MOD Single : A 26 GLN : amide:sc= 0.58 K(o=0.58,f=-0.04) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 70:sc= 2.08 USER MOD Single : A 47 LYS NZ :NH3+ -179:sc= 1.02 (180deg=1.02) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -43:sc= 1.19 USER MOD Single : A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 175:sc=-0.00755 (180deg=-0.0416) USER MOD Single : A 62 LYS NZ :NH3+ 160:sc= -0.0606 (180deg=-0.695) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -1.2! C(o=-1.2!,f=-5.2!) USER MOD Single : A 67 THR OG1 : rot 79:sc= 0.842 USER MOD Single : A 70 THR OG1 : rot 81:sc= 1.24 USER MOD Single : A 77 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0424) USER MOD Single : A 78 LYS NZ :NH3+ -169:sc= 1.24 (180deg=1.13) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 HIS : no HD1:sc= -0.187 X(o=-0.19,f=-0.32) USER MOD Single : A 82 HIS : no HE2:sc= -0.0628 K(o=-0.063,f=-2.5!) USER MOD Single : A 87 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0687) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 92 SER OG : rot -163:sc= 1.17 USER MOD Single : A 96 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0297) USER MOD Single : A 97 HIS : no HD1:sc= 1.24 K(o=1.2,f=-4.4!) USER MOD Single : A 98 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0552) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 SER OG : rot -56:sc= 1.21 USER MOD Single : A 131 MET CE :methyl -163:sc= -0.221 (180deg=-0.774) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 133 LYS NZ :NH3+ -121:sc= -0.461 (180deg=-0.554) USER MOD Single : A 140 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0529) USER MOD Single : A 145 LYS NZ :NH3+ 179:sc= 0.701 (180deg=0.701) USER MOD Single : A 146 TYR OH : rot -171:sc= 1.17 USER MOD Single : A 147 LYS NZ :NH3+ 178:sc= 0.121 (180deg=0.0747) USER MOD Single : A 152 GLN : amide:sc= 0.423 K(o=0.42,f=-0.5) USER MOD Single : A 154 HEM CMA :methyl 150:sc= -0.0793 (180deg=-0.0793) USER MOD Single : A 154 HEM CMB :methyl 150:sc= -0.43 (180deg=-0.43) USER MOD Single : A 154 HEM CMC :methyl -30:sc= -1.11 (180deg=-5.51!) USER MOD Single : A 154 HEM CMD :methyl -30:sc= -0.138 (180deg=-4.97!) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 18.138 1.051 2.061 1.00 0.00 N ATOM 2 CA VAL A 1 18.928 0.373 3.081 1.00 0.00 C ATOM 3 C VAL A 1 18.765 -1.152 2.970 1.00 0.00 C ATOM 4 O VAL A 1 19.006 -1.894 3.921 1.00 0.00 O ATOM 5 CB VAL A 1 18.577 0.965 4.463 1.00 0.00 C ATOM 6 CG1 VAL A 1 17.182 0.557 4.952 1.00 0.00 C ATOM 7 CG2 VAL A 1 19.629 0.640 5.533 1.00 0.00 C ATOM 0 H1 VAL A 1 17.754 1.936 2.450 1.00 0.00 H new ATOM 0 H2 VAL A 1 18.741 1.267 1.241 1.00 0.00 H new ATOM 0 H3 VAL A 1 17.355 0.435 1.762 1.00 0.00 H new ATOM 0 HA VAL A 1 19.994 0.547 2.931 1.00 0.00 H new ATOM 0 HB VAL A 1 18.573 2.044 4.312 1.00 0.00 H new ATOM 0 HG11 VAL A 1 16.993 1.004 5.928 1.00 0.00 H new ATOM 0 HG12 VAL A 1 16.431 0.905 4.242 1.00 0.00 H new ATOM 0 HG13 VAL A 1 17.128 -0.529 5.034 1.00 0.00 H new ATOM 0 HG21 VAL A 1 19.330 1.082 6.484 1.00 0.00 H new ATOM 0 HG22 VAL A 1 19.712 -0.441 5.645 1.00 0.00 H new ATOM 0 HG23 VAL A 1 20.593 1.048 5.231 1.00 0.00 H new ATOM 19 N LEU A 2 18.353 -1.631 1.792 1.00 0.00 N ATOM 20 CA LEU A 2 18.182 -3.045 1.527 1.00 0.00 C ATOM 21 C LEU A 2 19.278 -3.517 0.579 1.00 0.00 C ATOM 22 O LEU A 2 19.342 -3.076 -0.568 1.00 0.00 O ATOM 23 CB LEU A 2 16.803 -3.328 0.916 1.00 0.00 C ATOM 24 CG LEU A 2 15.677 -3.509 1.943 1.00 0.00 C ATOM 25 CD1 LEU A 2 15.157 -2.168 2.468 1.00 0.00 C ATOM 26 CD2 LEU A 2 14.524 -4.269 1.280 1.00 0.00 C ATOM 0 H LEU A 2 18.129 -1.035 0.995 1.00 0.00 H new ATOM 0 HA LEU A 2 18.251 -3.588 2.470 1.00 0.00 H new ATOM 0 HB2 LEU A 2 16.540 -2.508 0.248 1.00 0.00 H new ATOM 0 HB3 LEU A 2 16.868 -4.228 0.305 1.00 0.00 H new ATOM 0 HG LEU A 2 16.078 -4.065 2.791 1.00 0.00 H new ATOM 0 HD11 LEU A 2 14.361 -2.344 3.192 1.00 0.00 H new ATOM 0 HD12 LEU A 2 15.971 -1.625 2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 2 14.768 -1.578 1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 2 13.716 -4.405 1.999 1.00 0.00 H new ATOM 0 HD22 LEU A 2 14.157 -3.700 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 2 14.877 -5.244 0.943 1.00 0.00 H new ATOM 38 N SER A 3 20.126 -4.431 1.050 1.00 0.00 N ATOM 39 CA SER A 3 21.179 -5.029 0.249 1.00 0.00 C ATOM 40 C SER A 3 20.562 -6.087 -0.677 1.00 0.00 C ATOM 41 O SER A 3 19.381 -6.436 -0.550 1.00 0.00 O ATOM 42 CB SER A 3 22.254 -5.640 1.163 1.00 0.00 C ATOM 43 OG SER A 3 22.438 -4.855 2.327 1.00 0.00 O ATOM 0 H SER A 3 20.096 -4.777 2.009 1.00 0.00 H new ATOM 0 HA SER A 3 21.662 -4.268 -0.364 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.964 -6.652 1.445 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.196 -5.718 0.620 1.00 0.00 H new ATOM 0 HG SER A 3 21.739 -5.068 2.979 1.00 0.00 H new ATOM 49 N GLU A 4 21.365 -6.615 -1.608 1.00 0.00 N ATOM 50 CA GLU A 4 20.944 -7.645 -2.548 1.00 0.00 C ATOM 51 C GLU A 4 20.842 -9.004 -1.836 1.00 0.00 C ATOM 52 O GLU A 4 21.602 -9.929 -2.095 1.00 0.00 O ATOM 53 CB GLU A 4 21.845 -7.659 -3.798 1.00 0.00 C ATOM 54 CG GLU A 4 23.356 -7.751 -3.518 1.00 0.00 C ATOM 55 CD GLU A 4 24.138 -7.853 -4.823 1.00 0.00 C ATOM 56 OE1 GLU A 4 24.038 -8.922 -5.463 1.00 0.00 O ATOM 57 OE2 GLU A 4 24.805 -6.852 -5.167 1.00 0.00 O ATOM 0 H GLU A 4 22.337 -6.331 -1.726 1.00 0.00 H new ATOM 0 HA GLU A 4 19.944 -7.415 -2.916 1.00 0.00 H new ATOM 0 HB2 GLU A 4 21.556 -8.503 -4.425 1.00 0.00 H new ATOM 0 HB3 GLU A 4 21.653 -6.754 -4.374 1.00 0.00 H new ATOM 0 HG2 GLU A 4 23.682 -6.873 -2.960 1.00 0.00 H new ATOM 0 HG3 GLU A 4 23.564 -8.621 -2.894 1.00 0.00 H new ATOM 64 N GLY A 5 19.872 -9.096 -0.927 1.00 0.00 N ATOM 65 CA GLY A 5 19.526 -10.237 -0.087 1.00 0.00 C ATOM 66 C GLY A 5 18.155 -9.906 0.494 1.00 0.00 C ATOM 67 O GLY A 5 17.164 -10.589 0.241 1.00 0.00 O ATOM 0 H GLY A 5 19.256 -8.304 -0.746 1.00 0.00 H new ATOM 0 HA2 GLY A 5 19.495 -11.159 -0.668 1.00 0.00 H new ATOM 0 HA3 GLY A 5 20.263 -10.383 0.702 1.00 0.00 H new ATOM 71 N GLU A 6 18.075 -8.752 1.158 1.00 0.00 N ATOM 72 CA GLU A 6 16.836 -8.217 1.689 1.00 0.00 C ATOM 73 C GLU A 6 15.876 -8.025 0.505 1.00 0.00 C ATOM 74 O GLU A 6 14.711 -8.420 0.562 1.00 0.00 O ATOM 75 CB GLU A 6 17.112 -6.900 2.424 1.00 0.00 C ATOM 76 CG GLU A 6 18.072 -7.041 3.619 1.00 0.00 C ATOM 77 CD GLU A 6 19.540 -6.849 3.239 1.00 0.00 C ATOM 78 OE1 GLU A 6 20.111 -7.790 2.648 1.00 0.00 O ATOM 79 OE2 GLU A 6 20.065 -5.744 3.504 1.00 0.00 O ATOM 0 H GLU A 6 18.885 -8.160 1.341 1.00 0.00 H new ATOM 0 HA GLU A 6 16.385 -8.895 2.414 1.00 0.00 H new ATOM 0 HB2 GLU A 6 17.530 -6.182 1.718 1.00 0.00 H new ATOM 0 HB3 GLU A 6 16.167 -6.487 2.777 1.00 0.00 H new ATOM 0 HG2 GLU A 6 17.802 -6.310 4.381 1.00 0.00 H new ATOM 0 HG3 GLU A 6 17.945 -8.028 4.064 1.00 0.00 H new ATOM 86 N TRP A 7 16.383 -7.452 -0.597 1.00 0.00 N ATOM 87 CA TRP A 7 15.585 -7.338 -1.806 1.00 0.00 C ATOM 88 C TRP A 7 15.127 -8.706 -2.304 1.00 0.00 C ATOM 89 O TRP A 7 13.985 -8.827 -2.729 1.00 0.00 O ATOM 90 CB TRP A 7 16.321 -6.578 -2.913 1.00 0.00 C ATOM 91 CG TRP A 7 16.354 -5.093 -2.741 1.00 0.00 C ATOM 92 CD1 TRP A 7 17.471 -4.346 -2.628 1.00 0.00 C ATOM 93 CD2 TRP A 7 15.236 -4.159 -2.643 1.00 0.00 C ATOM 94 NE1 TRP A 7 17.122 -3.033 -2.396 1.00 0.00 N ATOM 95 CE2 TRP A 7 15.755 -2.860 -2.376 1.00 0.00 C ATOM 96 CE3 TRP A 7 13.831 -4.277 -2.730 1.00 0.00 C ATOM 97 CZ2 TRP A 7 14.926 -1.746 -2.164 1.00 0.00 C ATOM 98 CZ3 TRP A 7 12.994 -3.159 -2.566 1.00 0.00 C ATOM 99 CH2 TRP A 7 13.535 -1.897 -2.265 1.00 0.00 C ATOM 0 H TRP A 7 17.326 -7.069 -0.667 1.00 0.00 H new ATOM 0 HA TRP A 7 14.700 -6.758 -1.543 1.00 0.00 H new ATOM 0 HB2 TRP A 7 17.346 -6.946 -2.967 1.00 0.00 H new ATOM 0 HB3 TRP A 7 15.849 -6.808 -3.868 1.00 0.00 H new ATOM 0 HD1 TRP A 7 18.482 -4.719 -2.707 1.00 0.00 H new ATOM 0 HE1 TRP A 7 17.795 -2.279 -2.256 1.00 0.00 H new ATOM 0 HE3 TRP A 7 13.392 -5.244 -2.926 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 15.355 -0.784 -1.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 11.925 -3.271 -2.672 1.00 0.00 H new ATOM 0 HH2 TRP A 7 12.884 -1.049 -2.112 1.00 0.00 H new ATOM 110 N GLN A 8 15.988 -9.727 -2.254 1.00 0.00 N ATOM 111 CA GLN A 8 15.617 -11.060 -2.707 1.00 0.00 C ATOM 112 C GLN A 8 14.426 -11.564 -1.889 1.00 0.00 C ATOM 113 O GLN A 8 13.460 -12.052 -2.467 1.00 0.00 O ATOM 114 CB GLN A 8 16.819 -12.013 -2.641 1.00 0.00 C ATOM 115 CG GLN A 8 16.502 -13.413 -3.189 1.00 0.00 C ATOM 116 CD GLN A 8 16.013 -13.391 -4.633 1.00 0.00 C ATOM 117 OE1 GLN A 8 14.916 -13.848 -4.935 1.00 0.00 O ATOM 118 NE2 GLN A 8 16.822 -12.855 -5.540 1.00 0.00 N ATOM 0 H GLN A 8 16.943 -9.651 -1.904 1.00 0.00 H new ATOM 0 HA GLN A 8 15.312 -11.019 -3.753 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.647 -11.586 -3.207 1.00 0.00 H new ATOM 0 HB3 GLN A 8 17.151 -12.100 -1.607 1.00 0.00 H new ATOM 0 HG2 GLN A 8 17.396 -14.034 -3.123 1.00 0.00 H new ATOM 0 HG3 GLN A 8 15.743 -13.880 -2.561 1.00 0.00 H new ATOM 0 HE21 GLN A 8 17.729 -12.483 -5.258 1.00 0.00 H new ATOM 0 HE22 GLN A 8 16.536 -12.816 -6.518 1.00 0.00 H new ATOM 127 N LEU A 9 14.482 -11.433 -0.557 1.00 0.00 N ATOM 128 CA LEU A 9 13.367 -11.825 0.302 1.00 0.00 C ATOM 129 C LEU A 9 12.106 -11.081 -0.146 1.00 0.00 C ATOM 130 O LEU A 9 11.103 -11.704 -0.493 1.00 0.00 O ATOM 131 CB LEU A 9 13.664 -11.528 1.779 1.00 0.00 C ATOM 132 CG LEU A 9 14.893 -12.260 2.336 1.00 0.00 C ATOM 133 CD1 LEU A 9 15.134 -11.786 3.773 1.00 0.00 C ATOM 134 CD2 LEU A 9 14.704 -13.782 2.329 1.00 0.00 C ATOM 0 H LEU A 9 15.288 -11.059 -0.056 1.00 0.00 H new ATOM 0 HA LEU A 9 13.216 -12.901 0.210 1.00 0.00 H new ATOM 0 HB2 LEU A 9 13.810 -10.455 1.899 1.00 0.00 H new ATOM 0 HB3 LEU A 9 12.793 -11.800 2.375 1.00 0.00 H new ATOM 0 HG LEU A 9 15.748 -12.030 1.700 1.00 0.00 H new ATOM 0 HD11 LEU A 9 16.005 -12.297 4.184 1.00 0.00 H new ATOM 0 HD12 LEU A 9 15.310 -10.710 3.777 1.00 0.00 H new ATOM 0 HD13 LEU A 9 14.259 -12.013 4.382 1.00 0.00 H new ATOM 0 HD21 LEU A 9 15.597 -14.261 2.731 1.00 0.00 H new ATOM 0 HD22 LEU A 9 13.843 -14.045 2.944 1.00 0.00 H new ATOM 0 HD23 LEU A 9 14.538 -14.123 1.307 1.00 0.00 H new ATOM 146 N VAL A 10 12.207 -9.753 -0.259 1.00 0.00 N ATOM 147 CA VAL A 10 11.079 -8.919 -0.648 1.00 0.00 C ATOM 148 C VAL A 10 10.470 -9.414 -1.959 1.00 0.00 C ATOM 149 O VAL A 10 9.309 -9.803 -1.993 1.00 0.00 O ATOM 150 CB VAL A 10 11.515 -7.447 -0.729 1.00 0.00 C ATOM 151 CG1 VAL A 10 10.480 -6.549 -1.419 1.00 0.00 C ATOM 152 CG2 VAL A 10 11.740 -6.911 0.684 1.00 0.00 C ATOM 0 H VAL A 10 13.068 -9.235 -0.084 1.00 0.00 H new ATOM 0 HA VAL A 10 10.300 -8.991 0.111 1.00 0.00 H new ATOM 0 HB VAL A 10 12.428 -7.423 -1.323 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.847 -5.523 -1.444 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.315 -6.900 -2.438 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.541 -6.585 -0.866 1.00 0.00 H new ATOM 0 HG21 VAL A 10 12.049 -5.867 0.632 1.00 0.00 H new ATOM 0 HG22 VAL A 10 10.814 -6.987 1.254 1.00 0.00 H new ATOM 0 HG23 VAL A 10 12.517 -7.496 1.176 1.00 0.00 H new ATOM 162 N LEU A 11 11.258 -9.438 -3.033 1.00 0.00 N ATOM 163 CA LEU A 11 10.809 -9.867 -4.349 1.00 0.00 C ATOM 164 C LEU A 11 10.255 -11.294 -4.332 1.00 0.00 C ATOM 165 O LEU A 11 9.262 -11.577 -5.005 1.00 0.00 O ATOM 166 CB LEU A 11 11.938 -9.693 -5.373 1.00 0.00 C ATOM 167 CG LEU A 11 12.413 -8.231 -5.502 1.00 0.00 C ATOM 168 CD1 LEU A 11 13.620 -8.183 -6.444 1.00 0.00 C ATOM 169 CD2 LEU A 11 11.322 -7.290 -6.028 1.00 0.00 C ATOM 0 H LEU A 11 12.238 -9.156 -3.009 1.00 0.00 H new ATOM 0 HA LEU A 11 9.978 -9.229 -4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 11 12.782 -10.320 -5.085 1.00 0.00 H new ATOM 0 HB3 LEU A 11 11.596 -10.046 -6.346 1.00 0.00 H new ATOM 0 HG LEU A 11 12.677 -7.885 -4.503 1.00 0.00 H new ATOM 0 HD11 LEU A 11 13.964 -7.153 -6.542 1.00 0.00 H new ATOM 0 HD12 LEU A 11 14.424 -8.797 -6.037 1.00 0.00 H new ATOM 0 HD13 LEU A 11 13.332 -8.565 -7.424 1.00 0.00 H new ATOM 0 HD21 LEU A 11 11.718 -6.277 -6.096 1.00 0.00 H new ATOM 0 HD22 LEU A 11 11.001 -7.621 -7.015 1.00 0.00 H new ATOM 0 HD23 LEU A 11 10.471 -7.302 -5.347 1.00 0.00 H new ATOM 181 N HIS A 12 10.902 -12.205 -3.602 1.00 0.00 N ATOM 182 CA HIS A 12 10.413 -13.565 -3.467 1.00 0.00 C ATOM 183 C HIS A 12 8.992 -13.566 -2.905 1.00 0.00 C ATOM 184 O HIS A 12 8.091 -14.147 -3.511 1.00 0.00 O ATOM 185 CB HIS A 12 11.371 -14.404 -2.608 1.00 0.00 C ATOM 186 CG HIS A 12 10.763 -15.703 -2.143 1.00 0.00 C ATOM 187 ND1 HIS A 12 10.281 -16.708 -2.962 1.00 0.00 N ATOM 188 CD2 HIS A 12 10.351 -15.965 -0.865 1.00 0.00 C ATOM 189 CE1 HIS A 12 9.613 -17.581 -2.184 1.00 0.00 C ATOM 190 NE2 HIS A 12 9.641 -17.146 -0.911 1.00 0.00 N ATOM 0 H HIS A 12 11.768 -12.018 -3.097 1.00 0.00 H new ATOM 0 HA HIS A 12 10.377 -14.027 -4.454 1.00 0.00 H new ATOM 0 HB2 HIS A 12 12.273 -14.617 -3.182 1.00 0.00 H new ATOM 0 HB3 HIS A 12 11.676 -13.821 -1.739 1.00 0.00 H new ATOM 0 HD2 HIS A 12 10.544 -15.363 0.011 1.00 0.00 H new ATOM 0 HE1 HIS A 12 9.132 -18.485 -2.527 1.00 0.00 H new ATOM 0 HE2 HIS A 12 9.209 -17.612 -0.113 1.00 0.00 H new ATOM 199 N VAL A 13 8.776 -12.923 -1.756 1.00 0.00 N ATOM 200 CA VAL A 13 7.432 -12.855 -1.196 1.00 0.00 C ATOM 201 C VAL A 13 6.527 -12.069 -2.157 1.00 0.00 C ATOM 202 O VAL A 13 5.385 -12.446 -2.402 1.00 0.00 O ATOM 203 CB VAL A 13 7.455 -12.264 0.221 1.00 0.00 C ATOM 204 CG1 VAL A 13 6.033 -12.171 0.791 1.00 0.00 C ATOM 205 CG2 VAL A 13 8.284 -13.170 1.139 1.00 0.00 C ATOM 0 H VAL A 13 9.497 -12.453 -1.209 1.00 0.00 H new ATOM 0 HA VAL A 13 7.021 -13.859 -1.093 1.00 0.00 H new ATOM 0 HB VAL A 13 7.892 -11.267 0.169 1.00 0.00 H new ATOM 0 HG11 VAL A 13 6.071 -11.750 1.796 1.00 0.00 H new ATOM 0 HG12 VAL A 13 5.426 -11.530 0.151 1.00 0.00 H new ATOM 0 HG13 VAL A 13 5.591 -13.167 0.831 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.301 -12.751 2.145 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.839 -14.164 1.167 1.00 0.00 H new ATOM 0 HG23 VAL A 13 9.303 -13.240 0.758 1.00 0.00 H new ATOM 215 N TRP A 14 7.061 -11.050 -2.832 1.00 0.00 N ATOM 216 CA TRP A 14 6.266 -10.217 -3.713 1.00 0.00 C ATOM 217 C TRP A 14 5.728 -11.025 -4.885 1.00 0.00 C ATOM 218 O TRP A 14 4.627 -10.762 -5.362 1.00 0.00 O ATOM 219 CB TRP A 14 7.012 -8.976 -4.201 1.00 0.00 C ATOM 220 CG TRP A 14 6.065 -7.928 -4.685 1.00 0.00 C ATOM 221 CD1 TRP A 14 5.615 -7.782 -5.951 1.00 0.00 C ATOM 222 CD2 TRP A 14 5.314 -6.976 -3.878 1.00 0.00 C ATOM 223 NE1 TRP A 14 4.637 -6.809 -5.983 1.00 0.00 N ATOM 224 CE2 TRP A 14 4.416 -6.269 -4.730 1.00 0.00 C ATOM 225 CE3 TRP A 14 5.282 -6.669 -2.501 1.00 0.00 C ATOM 226 CZ2 TRP A 14 3.542 -5.292 -4.236 1.00 0.00 C ATOM 227 CZ3 TRP A 14 4.421 -5.676 -2.002 1.00 0.00 C ATOM 228 CH2 TRP A 14 3.554 -4.985 -2.865 1.00 0.00 C ATOM 0 H TRP A 14 8.045 -10.787 -2.780 1.00 0.00 H new ATOM 0 HA TRP A 14 5.426 -9.856 -3.120 1.00 0.00 H new ATOM 0 HB2 TRP A 14 7.620 -8.573 -3.391 1.00 0.00 H new ATOM 0 HB3 TRP A 14 7.694 -9.252 -5.005 1.00 0.00 H new ATOM 0 HD1 TRP A 14 5.967 -8.341 -6.806 1.00 0.00 H new ATOM 0 HE1 TRP A 14 4.139 -6.524 -6.826 1.00 0.00 H new ATOM 0 HE3 TRP A 14 5.928 -7.204 -1.821 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 2.865 -4.779 -4.903 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 4.426 -5.443 -0.948 1.00 0.00 H new ATOM 0 HH2 TRP A 14 2.899 -4.220 -2.476 1.00 0.00 H new ATOM 239 N ALA A 15 6.498 -11.994 -5.385 1.00 0.00 N ATOM 240 CA ALA A 15 5.970 -12.867 -6.413 1.00 0.00 C ATOM 241 C ALA A 15 4.692 -13.552 -5.921 1.00 0.00 C ATOM 242 O ALA A 15 3.784 -13.779 -6.714 1.00 0.00 O ATOM 243 CB ALA A 15 7.018 -13.885 -6.871 1.00 0.00 C ATOM 0 H ALA A 15 7.459 -12.184 -5.100 1.00 0.00 H new ATOM 0 HA ALA A 15 5.715 -12.262 -7.283 1.00 0.00 H new ATOM 0 HB1 ALA A 15 6.590 -14.525 -7.643 1.00 0.00 H new ATOM 0 HB2 ALA A 15 7.884 -13.360 -7.274 1.00 0.00 H new ATOM 0 HB3 ALA A 15 7.327 -14.496 -6.023 1.00 0.00 H new ATOM 249 N LYS A 16 4.590 -13.854 -4.621 1.00 0.00 N ATOM 250 CA LYS A 16 3.382 -14.461 -4.074 1.00 0.00 C ATOM 251 C LYS A 16 2.216 -13.468 -4.179 1.00 0.00 C ATOM 252 O LYS A 16 1.112 -13.849 -4.566 1.00 0.00 O ATOM 253 CB LYS A 16 3.587 -14.930 -2.632 1.00 0.00 C ATOM 254 CG LYS A 16 4.851 -15.762 -2.361 1.00 0.00 C ATOM 255 CD LYS A 16 4.886 -17.123 -3.077 1.00 0.00 C ATOM 256 CE LYS A 16 5.595 -17.102 -4.439 1.00 0.00 C ATOM 257 NZ LYS A 16 7.019 -16.736 -4.320 1.00 0.00 N ATOM 0 H LYS A 16 5.327 -13.687 -3.936 1.00 0.00 H new ATOM 0 HA LYS A 16 3.144 -15.349 -4.660 1.00 0.00 H new ATOM 0 HB2 LYS A 16 3.610 -14.052 -1.986 1.00 0.00 H new ATOM 0 HB3 LYS A 16 2.719 -15.520 -2.337 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.723 -15.183 -2.665 1.00 0.00 H new ATOM 0 HG3 LYS A 16 4.937 -15.929 -1.287 1.00 0.00 H new ATOM 0 HD2 LYS A 16 5.384 -17.847 -2.432 1.00 0.00 H new ATOM 0 HD3 LYS A 16 3.863 -17.473 -3.218 1.00 0.00 H new ATOM 0 HE2 LYS A 16 5.512 -18.084 -4.905 1.00 0.00 H new ATOM 0 HE3 LYS A 16 5.093 -16.393 -5.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 7.518 -16.992 -5.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 7.102 -15.712 -4.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 7.443 -17.246 -3.519 1.00 0.00 H new ATOM 271 N VAL A 17 2.484 -12.180 -3.935 1.00 0.00 N ATOM 272 CA VAL A 17 1.491 -11.116 -4.065 1.00 0.00 C ATOM 273 C VAL A 17 1.072 -11.048 -5.532 1.00 0.00 C ATOM 274 O VAL A 17 -0.083 -11.293 -5.878 1.00 0.00 O ATOM 275 CB VAL A 17 2.045 -9.776 -3.530 1.00 0.00 C ATOM 276 CG1 VAL A 17 1.098 -8.582 -3.653 1.00 0.00 C ATOM 277 CG2 VAL A 17 2.633 -9.842 -2.123 1.00 0.00 C ATOM 0 H VAL A 17 3.402 -11.848 -3.640 1.00 0.00 H new ATOM 0 HA VAL A 17 0.610 -11.327 -3.459 1.00 0.00 H new ATOM 0 HB VAL A 17 2.870 -9.596 -4.219 1.00 0.00 H new ATOM 0 HG11 VAL A 17 1.581 -7.692 -3.250 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.853 -8.418 -4.702 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.184 -8.784 -3.094 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.996 -8.856 -1.834 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.864 -10.166 -1.422 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.460 -10.552 -2.107 1.00 0.00 H new ATOM 287 N GLU A 18 2.042 -10.743 -6.396 1.00 0.00 N ATOM 288 CA GLU A 18 1.889 -10.600 -7.833 1.00 0.00 C ATOM 289 C GLU A 18 1.234 -11.826 -8.485 1.00 0.00 C ATOM 290 O GLU A 18 0.618 -11.705 -9.542 1.00 0.00 O ATOM 291 CB GLU A 18 3.256 -10.262 -8.455 1.00 0.00 C ATOM 292 CG GLU A 18 3.142 -9.326 -9.666 1.00 0.00 C ATOM 293 CD GLU A 18 2.673 -7.916 -9.298 1.00 0.00 C ATOM 294 OE1 GLU A 18 3.264 -7.338 -8.358 1.00 0.00 O ATOM 295 OE2 GLU A 18 1.737 -7.439 -9.972 1.00 0.00 O ATOM 0 H GLU A 18 3.002 -10.582 -6.090 1.00 0.00 H new ATOM 0 HA GLU A 18 1.201 -9.778 -8.028 1.00 0.00 H new ATOM 0 HB2 GLU A 18 3.889 -9.796 -7.700 1.00 0.00 H new ATOM 0 HB3 GLU A 18 3.750 -11.185 -8.760 1.00 0.00 H new ATOM 0 HG2 GLU A 18 4.112 -9.262 -10.160 1.00 0.00 H new ATOM 0 HG3 GLU A 18 2.446 -9.757 -10.386 1.00 0.00 H new ATOM 302 N ALA A 19 1.422 -13.026 -7.928 1.00 0.00 N ATOM 303 CA ALA A 19 0.751 -14.199 -8.464 1.00 0.00 C ATOM 304 C ALA A 19 -0.769 -14.020 -8.428 1.00 0.00 C ATOM 305 O ALA A 19 -1.458 -14.466 -9.342 1.00 0.00 O ATOM 306 CB ALA A 19 1.197 -15.465 -7.732 1.00 0.00 C ATOM 0 H ALA A 19 2.022 -13.203 -7.122 1.00 0.00 H new ATOM 0 HA ALA A 19 1.038 -14.314 -9.509 1.00 0.00 H new ATOM 0 HB1 ALA A 19 0.681 -16.329 -8.151 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.273 -15.593 -7.849 1.00 0.00 H new ATOM 0 HB3 ALA A 19 0.955 -15.377 -6.673 1.00 0.00 H new ATOM 312 N ASP A 20 -1.290 -13.317 -7.416 1.00 0.00 N ATOM 313 CA ASP A 20 -2.702 -12.986 -7.317 1.00 0.00 C ATOM 314 C ASP A 20 -2.822 -11.516 -6.923 1.00 0.00 C ATOM 315 O ASP A 20 -3.305 -11.182 -5.835 1.00 0.00 O ATOM 316 CB ASP A 20 -3.438 -13.951 -6.380 1.00 0.00 C ATOM 317 CG ASP A 20 -4.945 -13.687 -6.347 1.00 0.00 C ATOM 318 OD1 ASP A 20 -5.414 -12.809 -7.107 1.00 0.00 O ATOM 319 OD2 ASP A 20 -5.611 -14.366 -5.537 1.00 0.00 O ATOM 0 H ASP A 20 -0.732 -12.962 -6.639 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.198 -13.113 -8.279 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.257 -14.976 -6.702 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.032 -13.857 -5.373 1.00 0.00 H new ATOM 324 N VAL A 21 -2.438 -10.658 -7.881 1.00 0.00 N ATOM 325 CA VAL A 21 -2.423 -9.205 -7.762 1.00 0.00 C ATOM 326 C VAL A 21 -3.777 -8.752 -7.212 1.00 0.00 C ATOM 327 O VAL A 21 -3.856 -8.124 -6.165 1.00 0.00 O ATOM 328 CB VAL A 21 -2.147 -8.521 -9.128 1.00 0.00 C ATOM 329 CG1 VAL A 21 -1.529 -7.141 -8.888 1.00 0.00 C ATOM 330 CG2 VAL A 21 -1.202 -9.270 -10.073 1.00 0.00 C ATOM 0 H VAL A 21 -2.118 -10.978 -8.795 1.00 0.00 H new ATOM 0 HA VAL A 21 -1.618 -8.914 -7.087 1.00 0.00 H new ATOM 0 HB VAL A 21 -3.122 -8.488 -9.614 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -1.334 -6.658 -9.846 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -2.219 -6.529 -8.307 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.593 -7.252 -8.340 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -1.082 -8.701 -10.995 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.231 -9.393 -9.594 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -1.620 -10.250 -10.304 1.00 0.00 H new ATOM 340 N ALA A 22 -4.858 -9.099 -7.920 1.00 0.00 N ATOM 341 CA ALA A 22 -6.228 -8.759 -7.555 1.00 0.00 C ATOM 342 C ALA A 22 -6.592 -9.207 -6.141 1.00 0.00 C ATOM 343 O ALA A 22 -7.184 -8.439 -5.389 1.00 0.00 O ATOM 344 CB ALA A 22 -7.201 -9.351 -8.580 1.00 0.00 C ATOM 0 H ALA A 22 -4.797 -9.638 -8.784 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.307 -7.672 -7.563 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.223 -9.094 -8.302 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.980 -8.946 -9.567 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -7.093 -10.435 -8.601 1.00 0.00 H new ATOM 350 N GLY A 23 -6.261 -10.450 -5.787 1.00 0.00 N ATOM 351 CA GLY A 23 -6.573 -11.005 -4.480 1.00 0.00 C ATOM 352 C GLY A 23 -5.913 -10.154 -3.408 1.00 0.00 C ATOM 353 O GLY A 23 -6.587 -9.576 -2.558 1.00 0.00 O ATOM 0 H GLY A 23 -5.769 -11.097 -6.403 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.652 -11.029 -4.330 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -6.219 -12.034 -4.414 1.00 0.00 H new ATOM 357 N HIS A 24 -4.598 -9.954 -3.538 1.00 0.00 N ATOM 358 CA HIS A 24 -3.869 -9.156 -2.565 1.00 0.00 C ATOM 359 C HIS A 24 -4.452 -7.742 -2.544 1.00 0.00 C ATOM 360 O HIS A 24 -4.765 -7.206 -1.489 1.00 0.00 O ATOM 361 CB HIS A 24 -2.361 -9.169 -2.860 1.00 0.00 C ATOM 362 CG HIS A 24 -1.741 -10.513 -2.569 1.00 0.00 C ATOM 363 ND1 HIS A 24 -2.015 -11.686 -3.242 1.00 0.00 N ATOM 364 CD2 HIS A 24 -0.814 -10.793 -1.595 1.00 0.00 C ATOM 365 CE1 HIS A 24 -1.328 -12.672 -2.628 1.00 0.00 C ATOM 366 NE2 HIS A 24 -0.580 -12.180 -1.618 1.00 0.00 N ATOM 0 H HIS A 24 -4.030 -10.330 -4.297 1.00 0.00 H new ATOM 0 HA HIS A 24 -3.985 -9.587 -1.571 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -2.194 -8.911 -3.906 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -1.867 -8.404 -2.260 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -2.624 -11.789 -4.054 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.349 -10.078 -0.932 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.371 -13.714 -2.907 1.00 0.00 H new ATOM 374 N GLY A 25 -4.649 -7.155 -3.725 1.00 0.00 N ATOM 375 CA GLY A 25 -5.205 -5.822 -3.911 1.00 0.00 C ATOM 376 C GLY A 25 -6.482 -5.658 -3.096 1.00 0.00 C ATOM 377 O GLY A 25 -6.586 -4.765 -2.256 1.00 0.00 O ATOM 0 H GLY A 25 -4.417 -7.613 -4.606 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.475 -5.071 -3.609 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.416 -5.654 -4.967 1.00 0.00 H new ATOM 381 N GLN A 26 -7.421 -6.587 -3.289 1.00 0.00 N ATOM 382 CA GLN A 26 -8.681 -6.594 -2.572 1.00 0.00 C ATOM 383 C GLN A 26 -8.358 -6.650 -1.075 1.00 0.00 C ATOM 384 O GLN A 26 -8.629 -5.701 -0.341 1.00 0.00 O ATOM 385 CB GLN A 26 -9.501 -7.822 -3.010 1.00 0.00 C ATOM 386 CG GLN A 26 -10.849 -7.916 -2.283 1.00 0.00 C ATOM 387 CD GLN A 26 -11.391 -9.343 -2.277 1.00 0.00 C ATOM 388 OE1 GLN A 26 -12.435 -9.617 -2.859 1.00 0.00 O ATOM 389 NE2 GLN A 26 -10.700 -10.273 -1.618 1.00 0.00 N ATOM 0 H GLN A 26 -7.320 -7.356 -3.952 1.00 0.00 H new ATOM 0 HA GLN A 26 -9.270 -5.702 -2.785 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.674 -7.775 -4.085 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -8.925 -8.727 -2.819 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -10.734 -7.567 -1.257 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -11.569 -7.256 -2.766 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -9.834 -10.022 -1.141 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -11.037 -11.235 -1.591 1.00 0.00 H new ATOM 398 N ASP A 27 -7.740 -7.761 -0.653 1.00 0.00 N ATOM 399 CA ASP A 27 -7.379 -8.082 0.723 1.00 0.00 C ATOM 400 C ASP A 27 -6.789 -6.883 1.460 1.00 0.00 C ATOM 401 O ASP A 27 -7.237 -6.557 2.555 1.00 0.00 O ATOM 402 CB ASP A 27 -6.437 -9.297 0.780 1.00 0.00 C ATOM 403 CG ASP A 27 -7.011 -10.565 0.145 1.00 0.00 C ATOM 404 OD1 ASP A 27 -8.230 -10.578 -0.150 1.00 0.00 O ATOM 405 OD2 ASP A 27 -6.206 -11.504 -0.043 1.00 0.00 O ATOM 0 H ASP A 27 -7.466 -8.497 -1.304 1.00 0.00 H new ATOM 0 HA ASP A 27 -8.300 -8.347 1.242 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -5.504 -9.043 0.278 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -6.192 -9.504 1.822 1.00 0.00 H new ATOM 410 N ILE A 28 -5.862 -6.157 0.836 1.00 0.00 N ATOM 411 CA ILE A 28 -5.211 -5.019 1.475 1.00 0.00 C ATOM 412 C ILE A 28 -6.262 -3.984 1.892 1.00 0.00 C ATOM 413 O ILE A 28 -6.310 -3.563 3.048 1.00 0.00 O ATOM 414 CB ILE A 28 -4.130 -4.409 0.556 1.00 0.00 C ATOM 415 CG1 ILE A 28 -2.946 -5.381 0.398 1.00 0.00 C ATOM 416 CG2 ILE A 28 -3.590 -3.098 1.145 1.00 0.00 C ATOM 417 CD1 ILE A 28 -2.011 -4.982 -0.747 1.00 0.00 C ATOM 0 H ILE A 28 -5.545 -6.340 -0.116 1.00 0.00 H new ATOM 0 HA ILE A 28 -4.700 -5.362 2.375 1.00 0.00 H new ATOM 0 HB ILE A 28 -4.595 -4.219 -0.412 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -2.381 -5.415 1.329 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.327 -6.387 0.219 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.830 -2.687 0.481 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -4.406 -2.383 1.250 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.150 -3.293 2.123 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.193 -5.699 -0.816 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.567 -4.974 -1.685 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.606 -3.988 -0.557 1.00 0.00 H new ATOM 429 N LEU A 29 -7.111 -3.560 0.956 1.00 0.00 N ATOM 430 CA LEU A 29 -8.114 -2.569 1.174 1.00 0.00 C ATOM 431 C LEU A 29 -9.218 -3.131 2.064 1.00 0.00 C ATOM 432 O LEU A 29 -9.671 -2.444 2.975 1.00 0.00 O ATOM 433 CB LEU A 29 -8.603 -2.138 -0.203 1.00 0.00 C ATOM 434 CG LEU A 29 -7.567 -1.406 -1.076 1.00 0.00 C ATOM 435 CD1 LEU A 29 -8.208 -1.006 -2.412 1.00 0.00 C ATOM 436 CD2 LEU A 29 -7.037 -0.125 -0.415 1.00 0.00 C ATOM 0 H LEU A 29 -7.103 -3.921 0.002 1.00 0.00 H new ATOM 0 HA LEU A 29 -7.732 -1.696 1.703 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -8.945 -3.022 -0.741 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -9.468 -1.488 -0.075 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.736 -2.097 -1.217 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.473 -0.488 -3.028 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.552 -1.900 -2.932 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.055 -0.346 -2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.310 0.350 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.865 0.560 -0.234 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.559 -0.375 0.532 1.00 0.00 H new ATOM 448 N ILE A 30 -9.576 -4.413 1.914 1.00 0.00 N ATOM 449 CA ILE A 30 -10.580 -5.049 2.729 1.00 0.00 C ATOM 450 C ILE A 30 -10.118 -4.941 4.184 1.00 0.00 C ATOM 451 O ILE A 30 -10.869 -4.514 5.057 1.00 0.00 O ATOM 452 CB ILE A 30 -10.765 -6.499 2.210 1.00 0.00 C ATOM 453 CG1 ILE A 30 -12.159 -6.599 1.595 1.00 0.00 C ATOM 454 CG2 ILE A 30 -10.467 -7.579 3.242 1.00 0.00 C ATOM 455 CD1 ILE A 30 -12.537 -7.998 1.099 1.00 0.00 C ATOM 0 H ILE A 30 -9.164 -5.030 1.214 1.00 0.00 H new ATOM 0 HA ILE A 30 -11.561 -4.577 2.673 1.00 0.00 H new ATOM 0 HB ILE A 30 -10.015 -6.700 1.445 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -12.892 -6.280 2.335 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -12.225 -5.902 0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.621 -8.561 2.796 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -9.433 -7.490 3.574 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -11.133 -7.460 4.096 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -13.542 -7.976 0.678 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -11.830 -8.316 0.333 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -12.508 -8.700 1.933 1.00 0.00 H new ATOM 467 N ARG A 31 -8.845 -5.271 4.416 1.00 0.00 N ATOM 468 CA ARG A 31 -8.244 -5.210 5.738 1.00 0.00 C ATOM 469 C ARG A 31 -8.252 -3.777 6.246 1.00 0.00 C ATOM 470 O ARG A 31 -8.727 -3.526 7.351 1.00 0.00 O ATOM 471 CB ARG A 31 -6.814 -5.773 5.738 1.00 0.00 C ATOM 472 CG ARG A 31 -6.734 -7.306 5.804 1.00 0.00 C ATOM 473 CD ARG A 31 -7.516 -7.948 6.962 1.00 0.00 C ATOM 474 NE ARG A 31 -7.396 -7.193 8.219 1.00 0.00 N ATOM 475 CZ ARG A 31 -7.838 -7.610 9.413 1.00 0.00 C ATOM 476 NH1 ARG A 31 -8.266 -8.866 9.578 1.00 0.00 N ATOM 477 NH2 ARG A 31 -7.864 -6.755 10.440 1.00 0.00 N ATOM 0 H ARG A 31 -8.206 -5.588 3.687 1.00 0.00 H new ATOM 0 HA ARG A 31 -8.839 -5.831 6.407 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -6.303 -5.433 4.837 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -6.273 -5.356 6.588 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -7.105 -7.715 4.864 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -5.687 -7.597 5.887 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -8.568 -8.022 6.687 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -7.155 -8.965 7.118 1.00 0.00 H new ATOM 0 HE ARG A 31 -6.941 -6.281 8.178 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -8.258 -9.515 8.791 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -8.601 -9.175 10.491 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -7.549 -5.793 10.311 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -8.199 -7.064 11.353 1.00 0.00 H new ATOM 491 N LEU A 32 -7.691 -2.853 5.472 1.00 0.00 N ATOM 492 CA LEU A 32 -7.628 -1.454 5.793 1.00 0.00 C ATOM 493 C LEU A 32 -9.000 -0.924 6.254 1.00 0.00 C ATOM 494 O LEU A 32 -9.139 -0.401 7.362 1.00 0.00 O ATOM 495 CB LEU A 32 -7.085 -0.772 4.525 1.00 0.00 C ATOM 496 CG LEU A 32 -6.714 0.676 4.781 1.00 0.00 C ATOM 497 CD1 LEU A 32 -5.269 0.822 5.258 1.00 0.00 C ATOM 498 CD2 LEU A 32 -6.918 1.499 3.506 1.00 0.00 C ATOM 0 H LEU A 32 -7.257 -3.078 4.577 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.972 -1.243 6.638 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -6.210 -1.314 4.167 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.835 -0.821 3.736 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.366 1.046 5.573 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.047 1.875 5.429 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -5.135 0.268 6.187 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.594 0.427 4.499 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.650 2.538 3.697 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.287 1.101 2.711 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.963 1.444 3.201 1.00 0.00 H new ATOM 510 N PHE A 33 -9.998 -1.003 5.376 1.00 0.00 N ATOM 511 CA PHE A 33 -11.346 -0.539 5.646 1.00 0.00 C ATOM 512 C PHE A 33 -12.019 -1.284 6.797 1.00 0.00 C ATOM 513 O PHE A 33 -12.674 -0.652 7.622 1.00 0.00 O ATOM 514 CB PHE A 33 -12.182 -0.609 4.358 1.00 0.00 C ATOM 515 CG PHE A 33 -11.619 0.127 3.149 1.00 0.00 C ATOM 516 CD1 PHE A 33 -10.815 1.264 3.324 1.00 0.00 C ATOM 517 CD2 PHE A 33 -12.038 -0.224 1.851 1.00 0.00 C ATOM 518 CE1 PHE A 33 -10.409 2.018 2.219 1.00 0.00 C ATOM 519 CE2 PHE A 33 -11.659 0.564 0.748 1.00 0.00 C ATOM 520 CZ PHE A 33 -10.789 1.651 0.922 1.00 0.00 C ATOM 0 H PHE A 33 -9.885 -1.399 4.443 1.00 0.00 H new ATOM 0 HA PHE A 33 -11.279 0.498 5.975 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -12.312 -1.658 4.091 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -13.173 -0.209 4.571 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -10.509 1.558 4.317 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -12.652 -1.100 1.702 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -9.795 2.894 2.367 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -12.039 0.331 -0.236 1.00 0.00 H new ATOM 0 HZ PHE A 33 -10.418 2.197 0.068 1.00 0.00 H new ATOM 530 N LYS A 34 -11.901 -2.613 6.854 1.00 0.00 N ATOM 531 CA LYS A 34 -12.539 -3.384 7.911 1.00 0.00 C ATOM 532 C LYS A 34 -11.895 -3.094 9.271 1.00 0.00 C ATOM 533 O LYS A 34 -12.576 -3.122 10.292 1.00 0.00 O ATOM 534 CB LYS A 34 -12.510 -4.881 7.562 1.00 0.00 C ATOM 535 CG LYS A 34 -13.353 -5.718 8.533 1.00 0.00 C ATOM 536 CD LYS A 34 -13.372 -7.180 8.075 1.00 0.00 C ATOM 537 CE LYS A 34 -14.237 -8.025 9.015 1.00 0.00 C ATOM 538 NZ LYS A 34 -14.289 -9.429 8.573 1.00 0.00 N ATOM 0 H LYS A 34 -11.372 -3.170 6.183 1.00 0.00 H new ATOM 0 HA LYS A 34 -13.583 -3.081 7.989 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -12.880 -5.023 6.547 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -11.480 -5.236 7.578 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -12.942 -5.648 9.540 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -14.370 -5.327 8.576 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -13.760 -7.244 7.058 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.356 -7.574 8.054 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -13.835 -7.974 10.027 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -15.246 -7.615 9.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -14.882 -9.978 9.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -14.695 -9.477 7.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -13.327 -9.825 8.562 1.00 0.00 H new ATOM 552 N SER A 35 -10.577 -2.871 9.305 1.00 0.00 N ATOM 553 CA SER A 35 -9.863 -2.646 10.555 1.00 0.00 C ATOM 554 C SER A 35 -10.202 -1.293 11.177 1.00 0.00 C ATOM 555 O SER A 35 -10.586 -1.236 12.342 1.00 0.00 O ATOM 556 CB SER A 35 -8.347 -2.773 10.356 1.00 0.00 C ATOM 557 OG SER A 35 -8.012 -4.067 9.888 1.00 0.00 O ATOM 0 H SER A 35 -9.986 -2.843 8.474 1.00 0.00 H new ATOM 0 HA SER A 35 -10.193 -3.420 11.248 1.00 0.00 H new ATOM 0 HB2 SER A 35 -8.004 -2.023 9.643 1.00 0.00 H new ATOM 0 HB3 SER A 35 -7.834 -2.577 11.297 1.00 0.00 H new ATOM 0 HG SER A 35 -8.328 -4.173 8.966 1.00 0.00 H new ATOM 563 N HIS A 36 -9.977 -0.202 10.436 1.00 0.00 N ATOM 564 CA HIS A 36 -10.140 1.155 10.941 1.00 0.00 C ATOM 565 C HIS A 36 -11.045 1.978 9.994 1.00 0.00 C ATOM 566 O HIS A 36 -10.656 2.305 8.871 1.00 0.00 O ATOM 567 CB HIS A 36 -8.733 1.718 11.201 1.00 0.00 C ATOM 568 CG HIS A 36 -7.783 1.621 10.038 1.00 0.00 C ATOM 569 ND1 HIS A 36 -7.968 2.285 8.852 1.00 0.00 N ATOM 570 CD2 HIS A 36 -6.849 0.641 9.824 1.00 0.00 C ATOM 571 CE1 HIS A 36 -7.092 1.798 7.972 1.00 0.00 C ATOM 572 NE2 HIS A 36 -6.445 0.757 8.517 1.00 0.00 N ATOM 0 H HIS A 36 -9.675 -0.242 9.463 1.00 0.00 H new ATOM 0 HA HIS A 36 -10.672 1.195 11.892 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -8.825 2.765 11.489 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -8.299 1.191 12.050 1.00 0.00 H new ATOM 0 HD1 HIS A 36 -8.653 3.020 8.675 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -6.498 -0.083 10.545 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -6.929 2.182 6.976 1.00 0.00 H new ATOM 581 N PRO A 37 -12.287 2.298 10.396 1.00 0.00 N ATOM 582 CA PRO A 37 -13.247 2.968 9.531 1.00 0.00 C ATOM 583 C PRO A 37 -13.056 4.493 9.454 1.00 0.00 C ATOM 584 O PRO A 37 -13.894 5.247 9.946 1.00 0.00 O ATOM 585 CB PRO A 37 -14.611 2.568 10.105 1.00 0.00 C ATOM 586 CG PRO A 37 -14.332 2.505 11.607 1.00 0.00 C ATOM 587 CD PRO A 37 -12.909 1.948 11.666 1.00 0.00 C ATOM 0 HA PRO A 37 -13.127 2.663 8.492 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -15.382 3.300 9.866 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -14.950 1.608 9.715 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -14.401 3.488 12.072 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -15.041 1.858 12.123 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -12.357 2.377 12.502 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -12.919 0.868 11.811 1.00 0.00 H new ATOM 595 N GLU A 38 -11.974 4.957 8.815 1.00 0.00 N ATOM 596 CA GLU A 38 -11.757 6.388 8.555 1.00 0.00 C ATOM 597 C GLU A 38 -11.082 6.611 7.198 1.00 0.00 C ATOM 598 O GLU A 38 -11.522 7.451 6.416 1.00 0.00 O ATOM 599 CB GLU A 38 -11.104 7.153 9.718 1.00 0.00 C ATOM 600 CG GLU A 38 -9.606 6.918 9.937 1.00 0.00 C ATOM 601 CD GLU A 38 -9.309 5.471 10.279 1.00 0.00 C ATOM 602 OE1 GLU A 38 -9.129 4.697 9.313 1.00 0.00 O ATOM 603 OE2 GLU A 38 -9.278 5.166 11.489 1.00 0.00 O ATOM 0 H GLU A 38 -11.228 4.356 8.465 1.00 0.00 H new ATOM 0 HA GLU A 38 -12.746 6.843 8.490 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.262 8.219 9.556 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.628 6.889 10.637 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -9.058 7.199 9.037 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -9.250 7.562 10.741 1.00 0.00 H new ATOM 610 N THR A 39 -10.053 5.820 6.880 1.00 0.00 N ATOM 611 CA THR A 39 -9.362 5.866 5.593 1.00 0.00 C ATOM 612 C THR A 39 -10.343 5.683 4.423 1.00 0.00 C ATOM 613 O THR A 39 -10.114 6.151 3.311 1.00 0.00 O ATOM 614 CB THR A 39 -8.298 4.768 5.563 1.00 0.00 C ATOM 615 OG1 THR A 39 -8.891 3.571 6.023 1.00 0.00 O ATOM 616 CG2 THR A 39 -7.109 5.131 6.458 1.00 0.00 C ATOM 0 H THR A 39 -9.673 5.122 7.519 1.00 0.00 H new ATOM 0 HA THR A 39 -8.895 6.844 5.480 1.00 0.00 H new ATOM 0 HB THR A 39 -7.926 4.650 4.545 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.700 2.847 5.390 1.00 0.00 H new ATOM 0 HG21 THR A 39 -6.367 4.333 6.419 1.00 0.00 H new ATOM 0 HG22 THR A 39 -6.661 6.061 6.108 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.452 5.257 7.485 1.00 0.00 H new ATOM 624 N LEU A 40 -11.444 4.979 4.674 1.00 0.00 N ATOM 625 CA LEU A 40 -12.513 4.750 3.725 1.00 0.00 C ATOM 626 C LEU A 40 -13.068 6.080 3.222 1.00 0.00 C ATOM 627 O LEU A 40 -13.337 6.226 2.028 1.00 0.00 O ATOM 628 CB LEU A 40 -13.586 3.886 4.404 1.00 0.00 C ATOM 629 CG LEU A 40 -14.813 3.585 3.528 1.00 0.00 C ATOM 630 CD1 LEU A 40 -14.445 2.921 2.200 1.00 0.00 C ATOM 631 CD2 LEU A 40 -15.773 2.670 4.302 1.00 0.00 C ATOM 0 H LEU A 40 -11.616 4.540 5.578 1.00 0.00 H new ATOM 0 HA LEU A 40 -12.144 4.217 2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -13.134 2.943 4.710 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -13.919 4.389 5.312 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.286 4.539 3.293 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -15.351 2.732 1.624 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -13.786 3.580 1.634 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -13.935 1.977 2.394 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -16.645 2.453 3.685 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -15.265 1.739 4.553 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -16.091 3.168 5.218 1.00 0.00 H new ATOM 643 N GLU A 41 -13.140 7.078 4.108 1.00 0.00 N ATOM 644 CA GLU A 41 -13.630 8.398 3.755 1.00 0.00 C ATOM 645 C GLU A 41 -12.782 9.022 2.647 1.00 0.00 C ATOM 646 O GLU A 41 -13.302 9.778 1.829 1.00 0.00 O ATOM 647 CB GLU A 41 -13.719 9.298 4.995 1.00 0.00 C ATOM 648 CG GLU A 41 -14.579 8.689 6.116 1.00 0.00 C ATOM 649 CD GLU A 41 -16.002 8.383 5.659 1.00 0.00 C ATOM 650 OE1 GLU A 41 -16.778 9.355 5.537 1.00 0.00 O ATOM 651 OE2 GLU A 41 -16.285 7.183 5.448 1.00 0.00 O ATOM 0 H GLU A 41 -12.860 6.986 5.084 1.00 0.00 H new ATOM 0 HA GLU A 41 -14.641 8.295 3.360 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.715 9.485 5.375 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.136 10.263 4.708 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -14.110 7.772 6.472 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -14.612 9.378 6.960 1.00 0.00 H new ATOM 658 N LYS A 42 -11.518 8.601 2.494 1.00 0.00 N ATOM 659 CA LYS A 42 -10.699 9.205 1.445 1.00 0.00 C ATOM 660 C LYS A 42 -11.281 8.851 0.067 1.00 0.00 C ATOM 661 O LYS A 42 -11.221 9.657 -0.856 1.00 0.00 O ATOM 662 CB LYS A 42 -9.220 8.806 1.549 1.00 0.00 C ATOM 663 CG LYS A 42 -8.440 9.570 2.629 1.00 0.00 C ATOM 664 CD LYS A 42 -8.841 9.222 4.067 1.00 0.00 C ATOM 665 CE LYS A 42 -9.579 10.359 4.780 1.00 0.00 C ATOM 666 NZ LYS A 42 -9.989 9.958 6.139 1.00 0.00 N ATOM 0 H LYS A 42 -11.062 7.881 3.054 1.00 0.00 H new ATOM 0 HA LYS A 42 -10.728 10.286 1.578 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -9.156 7.738 1.757 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -8.741 8.972 0.584 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -7.376 9.368 2.503 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -8.582 10.640 2.474 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -9.476 8.336 4.056 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -7.947 8.966 4.635 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -8.934 11.236 4.836 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -10.457 10.645 4.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -10.628 10.676 6.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -10.480 9.042 6.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -9.148 9.872 6.744 1.00 0.00 H new ATOM 680 N PHE A 43 -11.912 7.675 -0.049 1.00 0.00 N ATOM 681 CA PHE A 43 -12.569 7.201 -1.264 1.00 0.00 C ATOM 682 C PHE A 43 -14.065 7.540 -1.201 1.00 0.00 C ATOM 683 O PHE A 43 -14.870 6.771 -1.731 1.00 0.00 O ATOM 684 CB PHE A 43 -12.405 5.665 -1.387 1.00 0.00 C ATOM 685 CG PHE A 43 -11.027 5.074 -1.151 1.00 0.00 C ATOM 686 CD1 PHE A 43 -10.541 4.937 0.163 1.00 0.00 C ATOM 687 CD2 PHE A 43 -10.176 4.785 -2.237 1.00 0.00 C ATOM 688 CE1 PHE A 43 -9.186 4.650 0.388 1.00 0.00 C ATOM 689 CE2 PHE A 43 -8.830 4.459 -2.007 1.00 0.00 C ATOM 690 CZ PHE A 43 -8.331 4.382 -0.695 1.00 0.00 C ATOM 0 H PHE A 43 -11.979 7.012 0.724 1.00 0.00 H new ATOM 0 HA PHE A 43 -12.114 7.686 -2.127 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -13.094 5.198 -0.683 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -12.726 5.374 -2.387 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -11.213 5.053 1.000 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -10.560 4.814 -3.246 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -8.799 4.635 1.396 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -8.174 4.266 -2.843 1.00 0.00 H new ATOM 0 HZ PHE A 43 -7.298 4.119 -0.520 1.00 0.00 H new ATOM 700 N ASP A 44 -14.456 8.586 -0.452 1.00 0.00 N ATOM 701 CA ASP A 44 -15.831 8.987 -0.139 1.00 0.00 C ATOM 702 C ASP A 44 -16.458 7.922 0.775 1.00 0.00 C ATOM 703 O ASP A 44 -16.609 8.105 1.979 1.00 0.00 O ATOM 704 CB ASP A 44 -16.616 9.280 -1.428 1.00 0.00 C ATOM 705 CG ASP A 44 -18.118 9.366 -1.172 1.00 0.00 C ATOM 706 OD1 ASP A 44 -18.558 10.439 -0.708 1.00 0.00 O ATOM 707 OD2 ASP A 44 -18.792 8.349 -1.445 1.00 0.00 O ATOM 0 H ASP A 44 -13.773 9.211 -0.024 1.00 0.00 H new ATOM 0 HA ASP A 44 -15.854 9.926 0.414 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -16.267 10.218 -1.860 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -16.417 8.498 -2.160 1.00 0.00 H new ATOM 712 N ARG A 45 -16.676 6.736 0.220 1.00 0.00 N ATOM 713 CA ARG A 45 -17.186 5.561 0.902 1.00 0.00 C ATOM 714 C ARG A 45 -16.836 4.369 0.004 1.00 0.00 C ATOM 715 O ARG A 45 -17.663 3.479 -0.201 1.00 0.00 O ATOM 716 CB ARG A 45 -18.705 5.747 1.059 1.00 0.00 C ATOM 717 CG ARG A 45 -19.330 4.727 2.022 1.00 0.00 C ATOM 718 CD ARG A 45 -20.789 5.073 2.334 1.00 0.00 C ATOM 719 NE ARG A 45 -21.578 5.316 1.117 1.00 0.00 N ATOM 720 CZ ARG A 45 -22.200 4.385 0.380 1.00 0.00 C ATOM 721 NH1 ARG A 45 -22.080 3.083 0.661 1.00 0.00 N ATOM 722 NH2 ARG A 45 -22.949 4.771 -0.657 1.00 0.00 N ATOM 0 H ARG A 45 -16.491 6.563 -0.768 1.00 0.00 H new ATOM 0 HA ARG A 45 -16.762 5.402 1.894 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -18.908 6.755 1.422 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -19.181 5.658 0.082 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -19.277 3.731 1.583 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -18.755 4.699 2.948 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -21.240 4.258 2.900 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -20.822 5.959 2.969 1.00 0.00 H new ATOM 0 HE ARG A 45 -21.660 6.284 0.804 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -21.507 2.782 1.449 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -22.562 2.391 0.087 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -23.041 5.762 -0.878 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -23.428 4.074 -1.227 1.00 0.00 H new ATOM 736 N PHE A 46 -15.669 4.471 -0.661 1.00 0.00 N ATOM 737 CA PHE A 46 -15.258 3.630 -1.781 1.00 0.00 C ATOM 738 C PHE A 46 -16.517 3.487 -2.610 1.00 0.00 C ATOM 739 O PHE A 46 -17.042 2.398 -2.776 1.00 0.00 O ATOM 740 CB PHE A 46 -14.456 2.398 -1.360 1.00 0.00 C ATOM 741 CG PHE A 46 -13.724 1.725 -2.507 1.00 0.00 C ATOM 742 CD1 PHE A 46 -14.434 1.017 -3.493 1.00 0.00 C ATOM 743 CD2 PHE A 46 -12.367 2.023 -2.720 1.00 0.00 C ATOM 744 CE1 PHE A 46 -13.844 0.763 -4.742 1.00 0.00 C ATOM 745 CE2 PHE A 46 -11.732 1.639 -3.915 1.00 0.00 C ATOM 746 CZ PHE A 46 -12.494 1.082 -4.958 1.00 0.00 C ATOM 0 H PHE A 46 -14.967 5.170 -0.417 1.00 0.00 H new ATOM 0 HA PHE A 46 -14.489 4.053 -2.428 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -13.732 2.689 -0.600 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -15.130 1.677 -0.898 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -15.435 0.668 -3.289 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.808 2.550 -1.961 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -14.429 0.322 -5.536 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -10.666 1.771 -4.031 1.00 0.00 H new ATOM 0 HZ PHE A 46 -12.042 0.900 -5.922 1.00 0.00 H new ATOM 756 N LYS A 47 -17.032 4.677 -2.962 1.00 0.00 N ATOM 757 CA LYS A 47 -18.263 5.082 -3.634 1.00 0.00 C ATOM 758 C LYS A 47 -19.553 4.272 -3.366 1.00 0.00 C ATOM 759 O LYS A 47 -20.594 4.626 -3.913 1.00 0.00 O ATOM 760 CB LYS A 47 -17.979 5.322 -5.130 1.00 0.00 C ATOM 761 CG LYS A 47 -16.735 6.201 -5.366 1.00 0.00 C ATOM 762 CD LYS A 47 -15.472 5.365 -5.645 1.00 0.00 C ATOM 763 CE LYS A 47 -14.186 6.174 -5.428 1.00 0.00 C ATOM 764 NZ LYS A 47 -14.084 7.332 -6.335 1.00 0.00 N ATOM 0 H LYS A 47 -16.492 5.513 -2.738 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.543 6.016 -3.147 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -17.840 4.362 -5.628 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -18.846 5.797 -5.589 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -16.919 6.869 -6.208 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -16.566 6.830 -4.492 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -15.465 4.491 -4.993 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -15.500 4.997 -6.671 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -14.150 6.522 -4.396 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -13.323 5.524 -5.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.190 7.834 -6.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -14.108 7.003 -7.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -14.882 7.977 -6.166 1.00 0.00 H new ATOM 778 N HIS A 48 -19.533 3.204 -2.559 1.00 0.00 N ATOM 779 CA HIS A 48 -20.652 2.282 -2.378 1.00 0.00 C ATOM 780 C HIS A 48 -20.418 1.243 -1.260 1.00 0.00 C ATOM 781 O HIS A 48 -21.321 0.443 -1.006 1.00 0.00 O ATOM 782 CB HIS A 48 -20.966 1.575 -3.726 1.00 0.00 C ATOM 783 CG HIS A 48 -19.749 1.073 -4.470 1.00 0.00 C ATOM 784 ND1 HIS A 48 -18.809 1.890 -5.063 1.00 0.00 N ATOM 785 CD2 HIS A 48 -19.176 -0.153 -4.305 1.00 0.00 C ATOM 786 CE1 HIS A 48 -17.651 1.218 -5.152 1.00 0.00 C ATOM 787 NE2 HIS A 48 -17.871 -0.043 -4.734 1.00 0.00 N ATOM 0 H HIS A 48 -18.716 2.954 -2.002 1.00 0.00 H new ATOM 0 HA HIS A 48 -21.508 2.876 -2.058 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -21.631 0.733 -3.534 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -21.508 2.269 -4.368 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -19.653 -1.039 -3.914 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -16.709 1.618 -5.498 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -17.183 -0.796 -4.735 1.00 0.00 H new ATOM 796 N LEU A 49 -19.261 1.201 -0.581 1.00 0.00 N ATOM 797 CA LEU A 49 -19.038 0.211 0.475 1.00 0.00 C ATOM 798 C LEU A 49 -19.947 0.409 1.685 1.00 0.00 C ATOM 799 O LEU A 49 -20.340 1.528 2.009 1.00 0.00 O ATOM 800 CB LEU A 49 -17.564 0.122 0.917 1.00 0.00 C ATOM 801 CG LEU A 49 -16.777 -0.979 0.185 1.00 0.00 C ATOM 802 CD1 LEU A 49 -16.831 -0.792 -1.328 1.00 0.00 C ATOM 803 CD2 LEU A 49 -15.320 -0.959 0.664 1.00 0.00 C ATOM 0 H LEU A 49 -18.477 1.833 -0.744 1.00 0.00 H new ATOM 0 HA LEU A 49 -19.304 -0.742 0.018 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -17.080 1.083 0.742 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -17.524 -0.064 1.990 1.00 0.00 H new ATOM 0 HG LEU A 49 -17.233 -1.942 0.416 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -16.265 -1.587 -1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -17.868 -0.829 -1.662 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -16.399 0.174 -1.591 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -14.757 -1.737 0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -14.878 0.013 0.446 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -15.288 -1.139 1.739 1.00 0.00 H new ATOM 815 N LYS A 50 -20.250 -0.704 2.360 1.00 0.00 N ATOM 816 CA LYS A 50 -21.035 -0.733 3.586 1.00 0.00 C ATOM 817 C LYS A 50 -20.600 -1.946 4.411 1.00 0.00 C ATOM 818 O LYS A 50 -20.103 -1.787 5.523 1.00 0.00 O ATOM 819 CB LYS A 50 -22.536 -0.722 3.269 1.00 0.00 C ATOM 820 CG LYS A 50 -23.381 -0.531 4.536 1.00 0.00 C ATOM 821 CD LYS A 50 -24.887 -0.612 4.248 1.00 0.00 C ATOM 822 CE LYS A 50 -25.369 0.520 3.335 1.00 0.00 C ATOM 823 NZ LYS A 50 -26.837 0.512 3.201 1.00 0.00 N ATOM 0 H LYS A 50 -19.946 -1.629 2.057 1.00 0.00 H new ATOM 0 HA LYS A 50 -20.854 0.162 4.181 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -22.753 0.079 2.562 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -22.813 -1.658 2.784 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -23.112 -1.292 5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -23.150 0.436 4.982 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -25.114 -1.571 3.783 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -25.436 -0.575 5.189 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -25.044 1.479 3.738 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -24.911 0.416 2.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -27.133 1.290 2.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -27.143 -0.394 2.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -27.272 0.635 4.138 1.00 0.00 H new ATOM 837 N THR A 51 -20.760 -3.152 3.859 1.00 0.00 N ATOM 838 CA THR A 51 -20.370 -4.400 4.502 1.00 0.00 C ATOM 839 C THR A 51 -19.411 -5.173 3.596 1.00 0.00 C ATOM 840 O THR A 51 -19.232 -4.836 2.422 1.00 0.00 O ATOM 841 CB THR A 51 -21.613 -5.252 4.822 1.00 0.00 C ATOM 842 OG1 THR A 51 -22.162 -5.801 3.641 1.00 0.00 O ATOM 843 CG2 THR A 51 -22.691 -4.459 5.565 1.00 0.00 C ATOM 0 H THR A 51 -21.172 -3.286 2.936 1.00 0.00 H new ATOM 0 HA THR A 51 -19.863 -4.171 5.439 1.00 0.00 H new ATOM 0 HB THR A 51 -21.277 -6.055 5.478 1.00 0.00 H new ATOM 0 HG1 THR A 51 -22.178 -5.117 2.939 1.00 0.00 H new ATOM 0 HG21 THR A 51 -23.545 -5.106 5.766 1.00 0.00 H new ATOM 0 HG22 THR A 51 -22.286 -4.089 6.507 1.00 0.00 H new ATOM 0 HG23 THR A 51 -23.011 -3.617 4.952 1.00 0.00 H new ATOM 851 N GLU A 52 -18.821 -6.238 4.148 1.00 0.00 N ATOM 852 CA GLU A 52 -17.903 -7.146 3.471 1.00 0.00 C ATOM 853 C GLU A 52 -18.435 -7.555 2.093 1.00 0.00 C ATOM 854 O GLU A 52 -17.661 -7.678 1.146 1.00 0.00 O ATOM 855 CB GLU A 52 -17.640 -8.376 4.354 1.00 0.00 C ATOM 856 CG GLU A 52 -16.680 -8.088 5.522 1.00 0.00 C ATOM 857 CD GLU A 52 -17.186 -7.029 6.500 1.00 0.00 C ATOM 858 OE1 GLU A 52 -18.409 -7.038 6.763 1.00 0.00 O ATOM 859 OE2 GLU A 52 -16.348 -6.216 6.946 1.00 0.00 O ATOM 0 H GLU A 52 -18.980 -6.498 5.121 1.00 0.00 H new ATOM 0 HA GLU A 52 -16.959 -6.625 3.307 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.588 -8.739 4.752 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -17.225 -9.175 3.739 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -16.501 -9.015 6.067 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -15.720 -7.765 5.118 1.00 0.00 H new ATOM 866 N ALA A 53 -19.758 -7.705 1.962 1.00 0.00 N ATOM 867 CA ALA A 53 -20.389 -8.051 0.697 1.00 0.00 C ATOM 868 C ALA A 53 -20.002 -7.032 -0.377 1.00 0.00 C ATOM 869 O ALA A 53 -19.524 -7.400 -1.449 1.00 0.00 O ATOM 870 CB ALA A 53 -21.911 -8.091 0.874 1.00 0.00 C ATOM 0 H ALA A 53 -20.415 -7.589 2.733 1.00 0.00 H new ATOM 0 HA ALA A 53 -20.045 -9.035 0.380 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -22.381 -8.350 -0.075 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -22.171 -8.838 1.624 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -22.265 -7.113 1.199 1.00 0.00 H new ATOM 876 N GLU A 54 -20.139 -5.735 -0.067 1.00 0.00 N ATOM 877 CA GLU A 54 -19.806 -4.679 -1.007 1.00 0.00 C ATOM 878 C GLU A 54 -18.301 -4.710 -1.238 1.00 0.00 C ATOM 879 O GLU A 54 -17.859 -4.600 -2.377 1.00 0.00 O ATOM 880 CB GLU A 54 -20.252 -3.293 -0.519 1.00 0.00 C ATOM 881 CG GLU A 54 -21.776 -3.103 -0.548 1.00 0.00 C ATOM 882 CD GLU A 54 -22.515 -4.013 0.425 1.00 0.00 C ATOM 883 OE1 GLU A 54 -22.150 -3.977 1.620 1.00 0.00 O ATOM 884 OE2 GLU A 54 -23.419 -4.739 -0.039 1.00 0.00 O ATOM 0 H GLU A 54 -20.480 -5.401 0.834 1.00 0.00 H new ATOM 0 HA GLU A 54 -20.343 -4.857 -1.939 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -19.893 -3.140 0.499 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -19.785 -2.529 -1.140 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -22.010 -2.065 -0.313 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -22.140 -3.291 -1.558 1.00 0.00 H new ATOM 891 N MET A 55 -17.518 -4.936 -0.176 1.00 0.00 N ATOM 892 CA MET A 55 -16.068 -4.948 -0.313 1.00 0.00 C ATOM 893 C MET A 55 -15.664 -5.983 -1.375 1.00 0.00 C ATOM 894 O MET A 55 -15.098 -5.646 -2.409 1.00 0.00 O ATOM 895 CB MET A 55 -15.357 -5.220 1.022 1.00 0.00 C ATOM 896 CG MET A 55 -15.795 -4.290 2.158 1.00 0.00 C ATOM 897 SD MET A 55 -14.933 -4.520 3.731 1.00 0.00 S ATOM 898 CE MET A 55 -15.912 -3.402 4.762 1.00 0.00 C ATOM 0 H MET A 55 -17.862 -5.109 0.769 1.00 0.00 H new ATOM 0 HA MET A 55 -15.750 -3.956 -0.633 1.00 0.00 H new ATOM 0 HB2 MET A 55 -15.543 -6.252 1.318 1.00 0.00 H new ATOM 0 HB3 MET A 55 -14.281 -5.119 0.877 1.00 0.00 H new ATOM 0 HG2 MET A 55 -15.654 -3.259 1.834 1.00 0.00 H new ATOM 0 HG3 MET A 55 -16.863 -4.428 2.326 1.00 0.00 H new ATOM 0 HE1 MET A 55 -15.523 -3.412 5.780 1.00 0.00 H new ATOM 0 HE2 MET A 55 -15.852 -2.390 4.360 1.00 0.00 H new ATOM 0 HE3 MET A 55 -16.952 -3.729 4.768 1.00 0.00 H new ATOM 908 N LYS A 56 -16.105 -7.231 -1.197 1.00 0.00 N ATOM 909 CA LYS A 56 -15.770 -8.308 -2.119 1.00 0.00 C ATOM 910 C LYS A 56 -16.374 -8.082 -3.511 1.00 0.00 C ATOM 911 O LYS A 56 -15.756 -8.411 -4.524 1.00 0.00 O ATOM 912 CB LYS A 56 -16.232 -9.649 -1.536 1.00 0.00 C ATOM 913 CG LYS A 56 -15.437 -9.998 -0.272 1.00 0.00 C ATOM 914 CD LYS A 56 -15.865 -11.362 0.280 1.00 0.00 C ATOM 915 CE LYS A 56 -14.985 -11.794 1.460 1.00 0.00 C ATOM 916 NZ LYS A 56 -15.101 -10.870 2.603 1.00 0.00 N ATOM 0 H LYS A 56 -16.697 -7.517 -0.417 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.687 -8.322 -2.243 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -17.295 -9.601 -1.300 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -16.106 -10.436 -2.279 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -14.371 -10.011 -0.499 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -15.592 -9.229 0.485 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.906 -11.316 0.599 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.807 -12.110 -0.511 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -15.269 -12.798 1.775 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -13.945 -11.843 1.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -14.558 -11.243 3.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -14.727 -9.937 2.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.101 -10.777 2.874 1.00 0.00 H new ATOM 930 N ALA A 57 -17.610 -7.574 -3.575 1.00 0.00 N ATOM 931 CA ALA A 57 -18.257 -7.314 -4.851 1.00 0.00 C ATOM 932 C ALA A 57 -17.623 -6.145 -5.606 1.00 0.00 C ATOM 933 O ALA A 57 -17.833 -6.009 -6.812 1.00 0.00 O ATOM 934 CB ALA A 57 -19.758 -7.094 -4.648 1.00 0.00 C ATOM 0 H ALA A 57 -18.174 -7.338 -2.758 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.111 -8.196 -5.475 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -20.231 -6.900 -5.611 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -20.199 -7.984 -4.200 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.915 -6.240 -3.989 1.00 0.00 H new ATOM 940 N SER A 58 -16.910 -5.255 -4.915 1.00 0.00 N ATOM 941 CA SER A 58 -16.280 -4.124 -5.567 1.00 0.00 C ATOM 942 C SER A 58 -15.122 -4.543 -6.476 1.00 0.00 C ATOM 943 O SER A 58 -13.957 -4.488 -6.093 1.00 0.00 O ATOM 944 CB SER A 58 -15.838 -3.087 -4.536 1.00 0.00 C ATOM 945 OG SER A 58 -16.974 -2.517 -3.929 1.00 0.00 O ATOM 0 H SER A 58 -16.759 -5.302 -3.907 1.00 0.00 H new ATOM 0 HA SER A 58 -17.027 -3.666 -6.215 1.00 0.00 H new ATOM 0 HB2 SER A 58 -15.205 -3.555 -3.782 1.00 0.00 H new ATOM 0 HB3 SER A 58 -15.241 -2.312 -5.017 1.00 0.00 H new ATOM 0 HG SER A 58 -17.411 -3.185 -3.361 1.00 0.00 H new ATOM 951 N GLU A 59 -15.423 -4.917 -7.716 1.00 0.00 N ATOM 952 CA GLU A 59 -14.398 -5.200 -8.711 1.00 0.00 C ATOM 953 C GLU A 59 -13.466 -3.992 -8.864 1.00 0.00 C ATOM 954 O GLU A 59 -12.278 -4.150 -9.121 1.00 0.00 O ATOM 955 CB GLU A 59 -15.037 -5.614 -10.040 1.00 0.00 C ATOM 956 CG GLU A 59 -15.870 -6.893 -9.884 1.00 0.00 C ATOM 957 CD GLU A 59 -16.275 -7.453 -11.242 1.00 0.00 C ATOM 958 OE1 GLU A 59 -17.328 -7.009 -11.749 1.00 0.00 O ATOM 959 OE2 GLU A 59 -15.515 -8.303 -11.751 1.00 0.00 O ATOM 0 H GLU A 59 -16.378 -5.031 -8.056 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.792 -6.041 -8.375 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -15.671 -4.807 -10.408 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -14.259 -5.773 -10.786 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -15.296 -7.640 -9.336 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -16.762 -6.680 -9.294 1.00 0.00 H new ATOM 966 N ASP A 60 -14.003 -2.788 -8.650 1.00 0.00 N ATOM 967 CA ASP A 60 -13.253 -1.543 -8.659 1.00 0.00 C ATOM 968 C ASP A 60 -12.285 -1.501 -7.467 1.00 0.00 C ATOM 969 O ASP A 60 -11.171 -1.011 -7.601 1.00 0.00 O ATOM 970 CB ASP A 60 -14.229 -0.360 -8.660 1.00 0.00 C ATOM 971 CG ASP A 60 -13.507 0.984 -8.617 1.00 0.00 C ATOM 972 OD1 ASP A 60 -12.578 1.159 -9.434 1.00 0.00 O ATOM 973 OD2 ASP A 60 -13.908 1.812 -7.770 1.00 0.00 O ATOM 0 H ASP A 60 -14.997 -2.656 -8.462 1.00 0.00 H new ATOM 0 HA ASP A 60 -12.649 -1.476 -9.564 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -14.853 -0.407 -9.553 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -14.895 -0.440 -7.801 1.00 0.00 H new ATOM 978 N LEU A 61 -12.676 -2.057 -6.312 1.00 0.00 N ATOM 979 CA LEU A 61 -11.800 -2.168 -5.142 1.00 0.00 C ATOM 980 C LEU A 61 -10.652 -3.091 -5.518 1.00 0.00 C ATOM 981 O LEU A 61 -9.490 -2.725 -5.363 1.00 0.00 O ATOM 982 CB LEU A 61 -12.577 -2.681 -3.924 1.00 0.00 C ATOM 983 CG LEU A 61 -11.767 -2.884 -2.638 1.00 0.00 C ATOM 984 CD1 LEU A 61 -11.770 -1.596 -1.828 1.00 0.00 C ATOM 985 CD2 LEU A 61 -12.426 -3.971 -1.781 1.00 0.00 C ATOM 0 H LEU A 61 -13.609 -2.442 -6.165 1.00 0.00 H new ATOM 0 HA LEU A 61 -11.406 -1.192 -4.859 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -13.384 -1.980 -3.713 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -13.041 -3.631 -4.189 1.00 0.00 H new ATOM 0 HG LEU A 61 -10.750 -3.170 -2.906 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -11.194 -1.740 -0.914 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -11.322 -0.795 -2.416 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -12.796 -1.329 -1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -11.849 -4.114 -0.867 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -13.441 -3.667 -1.525 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -12.457 -4.906 -2.340 1.00 0.00 H new ATOM 997 N LYS A 62 -10.970 -4.230 -6.142 1.00 0.00 N ATOM 998 CA LYS A 62 -9.934 -5.168 -6.557 1.00 0.00 C ATOM 999 C LYS A 62 -8.975 -4.473 -7.539 1.00 0.00 C ATOM 1000 O LYS A 62 -7.761 -4.440 -7.334 1.00 0.00 O ATOM 1001 CB LYS A 62 -10.557 -6.442 -7.148 1.00 0.00 C ATOM 1002 CG LYS A 62 -11.643 -7.027 -6.224 1.00 0.00 C ATOM 1003 CD LYS A 62 -11.886 -8.535 -6.404 1.00 0.00 C ATOM 1004 CE LYS A 62 -12.846 -8.880 -7.552 1.00 0.00 C ATOM 1005 NZ LYS A 62 -12.306 -8.517 -8.872 1.00 0.00 N ATOM 0 H LYS A 62 -11.923 -4.518 -6.366 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.354 -5.481 -5.689 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -10.991 -6.217 -8.122 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -9.778 -7.187 -7.311 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.362 -6.838 -5.188 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -12.579 -6.497 -6.402 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -10.930 -9.028 -6.583 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -12.286 -8.942 -5.475 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -13.060 -9.949 -7.533 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -13.793 -8.363 -7.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -12.804 -9.054 -9.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -12.441 -7.499 -9.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -11.291 -8.741 -8.906 1.00 0.00 H new ATOM 1019 N LYS A 63 -9.535 -3.871 -8.590 1.00 0.00 N ATOM 1020 CA LYS A 63 -8.802 -3.136 -9.611 1.00 0.00 C ATOM 1021 C LYS A 63 -7.951 -2.020 -8.997 1.00 0.00 C ATOM 1022 O LYS A 63 -6.836 -1.748 -9.465 1.00 0.00 O ATOM 1023 CB LYS A 63 -9.801 -2.579 -10.629 1.00 0.00 C ATOM 1024 CG LYS A 63 -9.102 -1.926 -11.827 1.00 0.00 C ATOM 1025 CD LYS A 63 -10.143 -1.460 -12.848 1.00 0.00 C ATOM 1026 CE LYS A 63 -9.454 -0.753 -14.017 1.00 0.00 C ATOM 1027 NZ LYS A 63 -10.424 -0.349 -15.049 1.00 0.00 N ATOM 0 H LYS A 63 -10.541 -3.885 -8.755 1.00 0.00 H new ATOM 0 HA LYS A 63 -8.111 -3.812 -10.114 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -10.446 -3.384 -10.981 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -10.444 -1.846 -10.141 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -8.504 -1.079 -11.492 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -8.417 -2.636 -12.291 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -10.712 -2.314 -13.214 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -10.853 -0.784 -12.372 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.923 0.126 -13.651 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.708 -1.416 -14.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -9.925 0.127 -15.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -10.912 -1.191 -15.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -11.121 0.302 -14.635 1.00 0.00 H new ATOM 1041 N HIS A 64 -8.484 -1.305 -8.001 1.00 0.00 N ATOM 1042 CA HIS A 64 -7.679 -0.285 -7.377 1.00 0.00 C ATOM 1043 C HIS A 64 -6.541 -0.940 -6.636 1.00 0.00 C ATOM 1044 O HIS A 64 -5.405 -0.546 -6.828 1.00 0.00 O ATOM 1045 CB HIS A 64 -8.430 0.638 -6.419 1.00 0.00 C ATOM 1046 CG HIS A 64 -7.818 2.009 -6.421 1.00 0.00 C ATOM 1047 ND1 HIS A 64 -7.170 2.601 -7.483 1.00 0.00 N ATOM 1048 CD2 HIS A 64 -7.645 2.807 -5.327 1.00 0.00 C ATOM 1049 CE1 HIS A 64 -6.598 3.723 -7.033 1.00 0.00 C ATOM 1050 NE2 HIS A 64 -6.869 3.896 -5.729 1.00 0.00 N ATOM 0 H HIS A 64 -9.428 -1.415 -7.632 1.00 0.00 H new ATOM 0 HA HIS A 64 -7.329 0.352 -8.189 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -9.478 0.701 -6.712 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -8.405 0.224 -5.411 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -8.035 2.629 -4.336 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -6.002 4.395 -7.633 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -6.566 4.674 -5.144 1.00 0.00 H new ATOM 1058 N GLY A 65 -6.840 -1.953 -5.828 1.00 0.00 N ATOM 1059 CA GLY A 65 -5.848 -2.709 -5.094 1.00 0.00 C ATOM 1060 C GLY A 65 -4.716 -3.125 -6.040 1.00 0.00 C ATOM 1061 O GLY A 65 -3.545 -2.968 -5.706 1.00 0.00 O ATOM 0 H GLY A 65 -7.796 -2.271 -5.667 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.450 -2.108 -4.276 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -6.306 -3.592 -4.648 1.00 0.00 H new ATOM 1065 N VAL A 66 -5.065 -3.561 -7.260 1.00 0.00 N ATOM 1066 CA VAL A 66 -4.101 -3.924 -8.295 1.00 0.00 C ATOM 1067 C VAL A 66 -3.243 -2.690 -8.584 1.00 0.00 C ATOM 1068 O VAL A 66 -2.037 -2.724 -8.366 1.00 0.00 O ATOM 1069 CB VAL A 66 -4.797 -4.446 -9.573 1.00 0.00 C ATOM 1070 CG1 VAL A 66 -3.844 -4.537 -10.771 1.00 0.00 C ATOM 1071 CG2 VAL A 66 -5.409 -5.825 -9.339 1.00 0.00 C ATOM 0 H VAL A 66 -6.036 -3.671 -7.553 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.473 -4.743 -7.945 1.00 0.00 H new ATOM 0 HB VAL A 66 -5.576 -3.720 -9.804 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.387 -4.909 -11.640 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.441 -3.549 -10.991 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.026 -5.218 -10.535 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.892 -6.169 -10.254 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.625 -6.528 -9.057 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.147 -5.764 -8.539 1.00 0.00 H new ATOM 1081 N THR A 67 -3.867 -1.591 -9.024 1.00 0.00 N ATOM 1082 CA THR A 67 -3.203 -0.319 -9.321 1.00 0.00 C ATOM 1083 C THR A 67 -2.216 0.069 -8.211 1.00 0.00 C ATOM 1084 O THR A 67 -1.051 0.384 -8.447 1.00 0.00 O ATOM 1085 CB THR A 67 -4.285 0.769 -9.516 1.00 0.00 C ATOM 1086 OG1 THR A 67 -5.258 0.346 -10.455 1.00 0.00 O ATOM 1087 CG2 THR A 67 -3.728 2.119 -9.981 1.00 0.00 C ATOM 0 H THR A 67 -4.873 -1.562 -9.187 1.00 0.00 H new ATOM 0 HA THR A 67 -2.620 -0.420 -10.236 1.00 0.00 H new ATOM 0 HB THR A 67 -4.727 0.911 -8.530 1.00 0.00 H new ATOM 0 HG1 THR A 67 -5.885 -0.270 -10.021 1.00 0.00 H new ATOM 0 HG21 THR A 67 -4.546 2.830 -10.095 1.00 0.00 H new ATOM 0 HG22 THR A 67 -3.021 2.495 -9.242 1.00 0.00 H new ATOM 0 HG23 THR A 67 -3.220 1.993 -10.937 1.00 0.00 H new ATOM 1095 N VAL A 68 -2.727 0.023 -6.989 1.00 0.00 N ATOM 1096 CA VAL A 68 -2.100 0.399 -5.741 1.00 0.00 C ATOM 1097 C VAL A 68 -0.875 -0.462 -5.475 1.00 0.00 C ATOM 1098 O VAL A 68 0.256 0.021 -5.565 1.00 0.00 O ATOM 1099 CB VAL A 68 -3.228 0.326 -4.694 1.00 0.00 C ATOM 1100 CG1 VAL A 68 -2.892 0.228 -3.211 1.00 0.00 C ATOM 1101 CG2 VAL A 68 -4.091 1.571 -4.879 1.00 0.00 C ATOM 0 H VAL A 68 -3.679 -0.310 -6.838 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.685 1.407 -5.731 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.695 -0.637 -4.902 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.814 0.187 -2.631 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.308 -0.674 -3.029 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.313 1.101 -2.911 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.905 1.560 -4.155 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.482 2.462 -4.727 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.503 1.581 -5.888 1.00 0.00 H new ATOM 1111 N LEU A 69 -1.067 -1.746 -5.179 1.00 0.00 N ATOM 1112 CA LEU A 69 0.083 -2.587 -4.904 1.00 0.00 C ATOM 1113 C LEU A 69 1.015 -2.679 -6.110 1.00 0.00 C ATOM 1114 O LEU A 69 2.216 -2.752 -5.915 1.00 0.00 O ATOM 1115 CB LEU A 69 -0.305 -3.911 -4.236 1.00 0.00 C ATOM 1116 CG LEU A 69 -0.836 -4.993 -5.177 1.00 0.00 C ATOM 1117 CD1 LEU A 69 0.265 -5.773 -5.909 1.00 0.00 C ATOM 1118 CD2 LEU A 69 -1.598 -6.019 -4.340 1.00 0.00 C ATOM 0 H LEU A 69 -1.974 -2.209 -5.126 1.00 0.00 H new ATOM 0 HA LEU A 69 0.694 -2.104 -4.141 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.568 -4.304 -3.715 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.063 -3.708 -3.480 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.448 -4.482 -5.920 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.189 -6.522 -6.557 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.860 -5.085 -6.510 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.908 -6.266 -5.180 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.987 -6.802 -4.990 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -0.926 -6.459 -3.604 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.426 -5.528 -3.828 1.00 0.00 H new ATOM 1130 N THR A 70 0.526 -2.595 -7.351 1.00 0.00 N ATOM 1131 CA THR A 70 1.411 -2.640 -8.517 1.00 0.00 C ATOM 1132 C THR A 70 2.290 -1.380 -8.562 1.00 0.00 C ATOM 1133 O THR A 70 3.450 -1.452 -8.976 1.00 0.00 O ATOM 1134 CB THR A 70 0.620 -2.854 -9.817 1.00 0.00 C ATOM 1135 OG1 THR A 70 -0.149 -4.032 -9.708 1.00 0.00 O ATOM 1136 CG2 THR A 70 1.549 -3.049 -11.018 1.00 0.00 C ATOM 0 H THR A 70 -0.465 -2.497 -7.572 1.00 0.00 H new ATOM 0 HA THR A 70 2.073 -3.501 -8.421 1.00 0.00 H new ATOM 0 HB THR A 70 0.000 -1.970 -9.966 1.00 0.00 H new ATOM 0 HG1 THR A 70 -0.967 -3.843 -9.202 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.953 -3.197 -11.919 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.177 -2.166 -11.140 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.180 -3.923 -10.852 1.00 0.00 H new ATOM 1144 N ALA A 71 1.760 -0.215 -8.167 1.00 0.00 N ATOM 1145 CA ALA A 71 2.578 0.984 -8.086 1.00 0.00 C ATOM 1146 C ALA A 71 3.702 0.757 -7.078 1.00 0.00 C ATOM 1147 O ALA A 71 4.882 0.870 -7.425 1.00 0.00 O ATOM 1148 CB ALA A 71 1.719 2.213 -7.765 1.00 0.00 C ATOM 0 H ALA A 71 0.783 -0.086 -7.904 1.00 0.00 H new ATOM 0 HA ALA A 71 3.037 1.188 -9.053 1.00 0.00 H new ATOM 0 HB1 ALA A 71 2.355 3.097 -7.710 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.973 2.350 -8.548 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.217 2.067 -6.808 1.00 0.00 H new ATOM 1154 N LEU A 72 3.337 0.384 -5.848 1.00 0.00 N ATOM 1155 CA LEU A 72 4.319 0.031 -4.828 1.00 0.00 C ATOM 1156 C LEU A 72 5.261 -1.066 -5.363 1.00 0.00 C ATOM 1157 O LEU A 72 6.455 -1.081 -5.087 1.00 0.00 O ATOM 1158 CB LEU A 72 3.591 -0.391 -3.541 1.00 0.00 C ATOM 1159 CG LEU A 72 4.496 -1.000 -2.459 1.00 0.00 C ATOM 1160 CD1 LEU A 72 5.540 0.003 -1.956 1.00 0.00 C ATOM 1161 CD2 LEU A 72 3.634 -1.448 -1.277 1.00 0.00 C ATOM 0 H LEU A 72 2.367 0.320 -5.538 1.00 0.00 H new ATOM 0 HA LEU A 72 4.940 0.894 -4.586 1.00 0.00 H new ATOM 0 HB2 LEU A 72 3.085 0.480 -3.124 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.818 -1.115 -3.798 1.00 0.00 H new ATOM 0 HG LEU A 72 5.022 -1.846 -2.902 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.159 -0.468 -1.192 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.169 0.321 -2.787 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.036 0.870 -1.530 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.271 -1.881 -0.506 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.102 -0.589 -0.868 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.914 -2.194 -1.614 1.00 0.00 H new ATOM 1173 N GLY A 73 4.725 -2.002 -6.141 1.00 0.00 N ATOM 1174 CA GLY A 73 5.425 -3.121 -6.741 1.00 0.00 C ATOM 1175 C GLY A 73 6.551 -2.610 -7.624 1.00 0.00 C ATOM 1176 O GLY A 73 7.692 -3.022 -7.460 1.00 0.00 O ATOM 0 H GLY A 73 3.733 -1.994 -6.380 1.00 0.00 H new ATOM 0 HA2 GLY A 73 5.827 -3.770 -5.963 1.00 0.00 H new ATOM 0 HA3 GLY A 73 4.732 -3.721 -7.331 1.00 0.00 H new ATOM 1180 N ALA A 74 6.243 -1.691 -8.539 1.00 0.00 N ATOM 1181 CA ALA A 74 7.234 -1.076 -9.414 1.00 0.00 C ATOM 1182 C ALA A 74 8.300 -0.374 -8.571 1.00 0.00 C ATOM 1183 O ALA A 74 9.499 -0.552 -8.776 1.00 0.00 O ATOM 1184 CB ALA A 74 6.551 -0.098 -10.375 1.00 0.00 C ATOM 0 H ALA A 74 5.293 -1.352 -8.693 1.00 0.00 H new ATOM 0 HA ALA A 74 7.723 -1.846 -10.011 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.299 0.356 -11.024 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.821 -0.634 -10.982 1.00 0.00 H new ATOM 0 HB3 ALA A 74 6.046 0.681 -9.804 1.00 0.00 H new ATOM 1190 N ILE A 75 7.850 0.364 -7.557 1.00 0.00 N ATOM 1191 CA ILE A 75 8.718 1.075 -6.626 1.00 0.00 C ATOM 1192 C ILE A 75 9.726 0.080 -6.024 1.00 0.00 C ATOM 1193 O ILE A 75 10.940 0.271 -6.124 1.00 0.00 O ATOM 1194 CB ILE A 75 7.818 1.821 -5.617 1.00 0.00 C ATOM 1195 CG1 ILE A 75 7.490 3.218 -6.178 1.00 0.00 C ATOM 1196 CG2 ILE A 75 8.344 1.879 -4.177 1.00 0.00 C ATOM 1197 CD1 ILE A 75 6.152 3.754 -5.663 1.00 0.00 C ATOM 0 H ILE A 75 6.857 0.485 -7.358 1.00 0.00 H new ATOM 0 HA ILE A 75 9.332 1.839 -7.103 1.00 0.00 H new ATOM 0 HB ILE A 75 6.907 1.231 -5.516 1.00 0.00 H new ATOM 0 HG12 ILE A 75 8.285 3.912 -5.906 1.00 0.00 H new ATOM 0 HG13 ILE A 75 7.465 3.173 -7.267 1.00 0.00 H new ATOM 0 HG21 ILE A 75 7.636 2.424 -3.553 1.00 0.00 H new ATOM 0 HG22 ILE A 75 8.462 0.866 -3.792 1.00 0.00 H new ATOM 0 HG23 ILE A 75 9.308 2.388 -4.162 1.00 0.00 H new ATOM 0 HD11 ILE A 75 5.968 4.741 -6.088 1.00 0.00 H new ATOM 0 HD12 ILE A 75 5.351 3.076 -5.958 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.183 3.827 -4.576 1.00 0.00 H new ATOM 1209 N LEU A 76 9.224 -1.015 -5.453 1.00 0.00 N ATOM 1210 CA LEU A 76 10.023 -2.086 -4.881 1.00 0.00 C ATOM 1211 C LEU A 76 10.939 -2.710 -5.942 1.00 0.00 C ATOM 1212 O LEU A 76 12.115 -2.964 -5.684 1.00 0.00 O ATOM 1213 CB LEU A 76 9.077 -3.159 -4.316 1.00 0.00 C ATOM 1214 CG LEU A 76 8.284 -2.780 -3.049 1.00 0.00 C ATOM 1215 CD1 LEU A 76 7.277 -3.895 -2.747 1.00 0.00 C ATOM 1216 CD2 LEU A 76 9.194 -2.593 -1.836 1.00 0.00 C ATOM 0 H LEU A 76 8.221 -1.181 -5.376 1.00 0.00 H new ATOM 0 HA LEU A 76 10.651 -1.680 -4.088 1.00 0.00 H new ATOM 0 HB2 LEU A 76 8.365 -3.430 -5.095 1.00 0.00 H new ATOM 0 HB3 LEU A 76 9.665 -4.050 -4.097 1.00 0.00 H new ATOM 0 HG LEU A 76 7.780 -1.832 -3.238 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.709 -3.640 -1.852 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.595 -4.008 -3.590 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.810 -4.832 -2.583 1.00 0.00 H new ATOM 0 HD21 LEU A 76 8.592 -2.327 -0.967 1.00 0.00 H new ATOM 0 HD22 LEU A 76 9.729 -3.521 -1.636 1.00 0.00 H new ATOM 0 HD23 LEU A 76 9.911 -1.797 -2.038 1.00 0.00 H new ATOM 1228 N LYS A 77 10.401 -2.981 -7.134 1.00 0.00 N ATOM 1229 CA LYS A 77 11.122 -3.619 -8.227 1.00 0.00 C ATOM 1230 C LYS A 77 12.385 -2.840 -8.576 1.00 0.00 C ATOM 1231 O LYS A 77 13.414 -3.448 -8.862 1.00 0.00 O ATOM 1232 CB LYS A 77 10.204 -3.833 -9.443 1.00 0.00 C ATOM 1233 CG LYS A 77 10.912 -4.608 -10.564 1.00 0.00 C ATOM 1234 CD LYS A 77 9.937 -4.878 -11.719 1.00 0.00 C ATOM 1235 CE LYS A 77 10.640 -5.498 -12.933 1.00 0.00 C ATOM 1236 NZ LYS A 77 11.277 -6.787 -12.608 1.00 0.00 N ATOM 0 H LYS A 77 9.433 -2.757 -7.366 1.00 0.00 H new ATOM 0 HA LYS A 77 11.443 -4.608 -7.899 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.311 -4.377 -9.133 1.00 0.00 H new ATOM 0 HB3 LYS A 77 9.873 -2.866 -9.823 1.00 0.00 H new ATOM 0 HG2 LYS A 77 11.767 -4.038 -10.926 1.00 0.00 H new ATOM 0 HG3 LYS A 77 11.298 -5.551 -10.177 1.00 0.00 H new ATOM 0 HD2 LYS A 77 9.147 -5.547 -11.377 1.00 0.00 H new ATOM 0 HD3 LYS A 77 9.459 -3.944 -12.015 1.00 0.00 H new ATOM 0 HE2 LYS A 77 9.916 -5.644 -13.735 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.394 -4.806 -13.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 11.696 -7.194 -13.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 12.022 -6.637 -11.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 10.563 -7.441 -12.228 1.00 0.00 H new ATOM 1250 N LYS A 78 12.330 -1.506 -8.547 1.00 0.00 N ATOM 1251 CA LYS A 78 13.510 -0.699 -8.841 1.00 0.00 C ATOM 1252 C LYS A 78 14.548 -0.701 -7.702 1.00 0.00 C ATOM 1253 O LYS A 78 15.534 0.029 -7.790 1.00 0.00 O ATOM 1254 CB LYS A 78 13.099 0.711 -9.281 1.00 0.00 C ATOM 1255 CG LYS A 78 12.246 0.649 -10.558 1.00 0.00 C ATOM 1256 CD LYS A 78 12.026 2.038 -11.173 1.00 0.00 C ATOM 1257 CE LYS A 78 12.983 2.347 -12.333 1.00 0.00 C ATOM 1258 NZ LYS A 78 14.395 2.307 -11.922 1.00 0.00 N ATOM 0 H LYS A 78 11.491 -0.970 -8.326 1.00 0.00 H new ATOM 0 HA LYS A 78 14.027 -1.167 -9.679 1.00 0.00 H new ATOM 0 HB2 LYS A 78 12.537 1.198 -8.484 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.988 1.316 -9.459 1.00 0.00 H new ATOM 0 HG2 LYS A 78 12.733 0.003 -11.288 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.281 0.198 -10.327 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.999 2.111 -11.529 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.149 2.795 -10.398 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.821 1.628 -13.136 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.753 3.333 -12.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 14.989 2.700 -12.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 14.521 2.870 -11.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.675 1.323 -11.738 1.00 0.00 H new ATOM 1272 N LYS A 79 14.370 -1.521 -6.656 1.00 0.00 N ATOM 1273 CA LYS A 79 15.311 -1.702 -5.554 1.00 0.00 C ATOM 1274 C LYS A 79 15.821 -0.378 -4.967 1.00 0.00 C ATOM 1275 O LYS A 79 17.009 -0.247 -4.681 1.00 0.00 O ATOM 1276 CB LYS A 79 16.477 -2.598 -6.010 1.00 0.00 C ATOM 1277 CG LYS A 79 16.013 -3.996 -6.436 1.00 0.00 C ATOM 1278 CD LYS A 79 17.227 -4.848 -6.830 1.00 0.00 C ATOM 1279 CE LYS A 79 16.788 -6.259 -7.231 1.00 0.00 C ATOM 1280 NZ LYS A 79 17.930 -7.064 -7.694 1.00 0.00 N ATOM 0 H LYS A 79 13.533 -2.096 -6.556 1.00 0.00 H new ATOM 0 HA LYS A 79 14.771 -2.192 -4.744 1.00 0.00 H new ATOM 0 HB2 LYS A 79 16.993 -2.121 -6.843 1.00 0.00 H new ATOM 0 HB3 LYS A 79 17.199 -2.690 -5.198 1.00 0.00 H new ATOM 0 HG2 LYS A 79 15.471 -4.474 -5.620 1.00 0.00 H new ATOM 0 HG3 LYS A 79 15.322 -3.920 -7.276 1.00 0.00 H new ATOM 0 HD2 LYS A 79 17.755 -4.377 -7.659 1.00 0.00 H new ATOM 0 HD3 LYS A 79 17.926 -4.902 -5.996 1.00 0.00 H new ATOM 0 HE2 LYS A 79 16.315 -6.750 -6.381 1.00 0.00 H new ATOM 0 HE3 LYS A 79 16.039 -6.198 -8.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 17.600 -8.014 -7.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 18.365 -6.606 -8.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 18.632 -7.141 -6.931 1.00 0.00 H new ATOM 1294 N GLY A 80 14.933 0.603 -4.775 1.00 0.00 N ATOM 1295 CA GLY A 80 15.293 1.896 -4.202 1.00 0.00 C ATOM 1296 C GLY A 80 15.659 2.951 -5.240 1.00 0.00 C ATOM 1297 O GLY A 80 16.033 4.063 -4.861 1.00 0.00 O ATOM 0 H GLY A 80 13.945 0.519 -5.014 1.00 0.00 H new ATOM 0 HA2 GLY A 80 14.458 2.263 -3.604 1.00 0.00 H new ATOM 0 HA3 GLY A 80 16.135 1.760 -3.524 1.00 0.00 H new ATOM 1301 N HIS A 81 15.621 2.617 -6.535 1.00 0.00 N ATOM 1302 CA HIS A 81 16.033 3.545 -7.569 1.00 0.00 C ATOM 1303 C HIS A 81 14.829 4.045 -8.358 1.00 0.00 C ATOM 1304 O HIS A 81 14.711 3.816 -9.564 1.00 0.00 O ATOM 1305 CB HIS A 81 17.106 2.877 -8.432 1.00 0.00 C ATOM 1306 CG HIS A 81 18.151 2.174 -7.601 1.00 0.00 C ATOM 1307 ND1 HIS A 81 18.350 0.806 -7.569 1.00 0.00 N ATOM 1308 CD2 HIS A 81 18.831 2.723 -6.548 1.00 0.00 C ATOM 1309 CE1 HIS A 81 19.185 0.539 -6.548 1.00 0.00 C ATOM 1310 NE2 HIS A 81 19.490 1.688 -5.918 1.00 0.00 N ATOM 0 H HIS A 81 15.308 1.710 -6.881 1.00 0.00 H new ATOM 0 HA HIS A 81 16.478 4.438 -7.130 1.00 0.00 H new ATOM 0 HB2 HIS A 81 16.635 2.159 -9.103 1.00 0.00 H new ATOM 0 HB3 HIS A 81 17.587 3.629 -9.057 1.00 0.00 H new ATOM 0 HD2 HIS A 81 18.848 3.765 -6.265 1.00 0.00 H new ATOM 0 HE1 HIS A 81 19.551 -0.440 -6.278 1.00 0.00 H new ATOM 0 HE2 HIS A 81 20.106 1.779 -5.110 1.00 0.00 H new ATOM 1319 N HIS A 82 13.933 4.757 -7.676 1.00 0.00 N ATOM 1320 CA HIS A 82 12.747 5.316 -8.238 1.00 0.00 C ATOM 1321 C HIS A 82 12.730 6.783 -7.816 1.00 0.00 C ATOM 1322 O HIS A 82 13.506 7.196 -6.957 1.00 0.00 O ATOM 1323 CB HIS A 82 11.519 4.535 -7.745 1.00 0.00 C ATOM 1324 CG HIS A 82 11.619 4.104 -6.304 1.00 0.00 C ATOM 1325 ND1 HIS A 82 11.802 2.818 -5.856 1.00 0.00 N ATOM 1326 CD2 HIS A 82 11.674 4.931 -5.215 1.00 0.00 C ATOM 1327 CE1 HIS A 82 11.925 2.870 -4.522 1.00 0.00 C ATOM 1328 NE2 HIS A 82 11.867 4.135 -4.084 1.00 0.00 N ATOM 0 H HIS A 82 14.035 4.957 -6.681 1.00 0.00 H new ATOM 0 HA HIS A 82 12.724 5.249 -9.326 1.00 0.00 H new ATOM 0 HB2 HIS A 82 10.631 5.154 -7.870 1.00 0.00 H new ATOM 0 HB3 HIS A 82 11.384 3.653 -8.371 1.00 0.00 H new ATOM 0 HD1 HIS A 82 11.838 1.978 -6.433 1.00 0.00 H new ATOM 0 HD2 HIS A 82 11.584 6.007 -5.228 1.00 0.00 H new ATOM 0 HE1 HIS A 82 12.054 2.007 -3.885 1.00 0.00 H new ATOM 1336 N GLU A 83 11.854 7.553 -8.445 1.00 0.00 N ATOM 1337 CA GLU A 83 11.609 8.972 -8.191 1.00 0.00 C ATOM 1338 C GLU A 83 10.392 9.423 -9.005 1.00 0.00 C ATOM 1339 O GLU A 83 9.370 9.815 -8.444 1.00 0.00 O ATOM 1340 CB GLU A 83 12.859 9.816 -8.526 1.00 0.00 C ATOM 1341 CG GLU A 83 12.857 11.196 -7.850 1.00 0.00 C ATOM 1342 CD GLU A 83 11.757 12.131 -8.348 1.00 0.00 C ATOM 1343 OE1 GLU A 83 11.601 12.224 -9.585 1.00 0.00 O ATOM 1344 OE2 GLU A 83 11.092 12.736 -7.479 1.00 0.00 O ATOM 0 H GLU A 83 11.260 7.187 -9.189 1.00 0.00 H new ATOM 0 HA GLU A 83 11.400 9.121 -7.132 1.00 0.00 H new ATOM 0 HB2 GLU A 83 13.751 9.270 -8.219 1.00 0.00 H new ATOM 0 HB3 GLU A 83 12.922 9.948 -9.606 1.00 0.00 H new ATOM 0 HG2 GLU A 83 12.746 11.062 -6.774 1.00 0.00 H new ATOM 0 HG3 GLU A 83 13.825 11.671 -8.014 1.00 0.00 H new ATOM 1351 N ALA A 84 10.494 9.331 -10.337 1.00 0.00 N ATOM 1352 CA ALA A 84 9.440 9.753 -11.254 1.00 0.00 C ATOM 1353 C ALA A 84 8.138 9.037 -10.893 1.00 0.00 C ATOM 1354 O ALA A 84 7.110 9.663 -10.653 1.00 0.00 O ATOM 1355 CB ALA A 84 9.857 9.448 -12.699 1.00 0.00 C ATOM 0 H ALA A 84 11.319 8.958 -10.807 1.00 0.00 H new ATOM 0 HA ALA A 84 9.280 10.828 -11.167 1.00 0.00 H new ATOM 0 HB1 ALA A 84 9.067 9.765 -13.380 1.00 0.00 H new ATOM 0 HB2 ALA A 84 10.776 9.986 -12.934 1.00 0.00 H new ATOM 0 HB3 ALA A 84 10.025 8.377 -12.811 1.00 0.00 H new ATOM 1361 N GLU A 85 8.226 7.714 -10.734 1.00 0.00 N ATOM 1362 CA GLU A 85 7.126 6.836 -10.353 1.00 0.00 C ATOM 1363 C GLU A 85 6.925 6.906 -8.832 1.00 0.00 C ATOM 1364 O GLU A 85 6.950 5.880 -8.159 1.00 0.00 O ATOM 1365 CB GLU A 85 7.386 5.403 -10.876 1.00 0.00 C ATOM 1366 CG GLU A 85 8.656 4.672 -10.392 1.00 0.00 C ATOM 1367 CD GLU A 85 9.943 5.183 -11.032 1.00 0.00 C ATOM 1368 OE1 GLU A 85 10.509 6.149 -10.472 1.00 0.00 O ATOM 1369 OE2 GLU A 85 10.327 4.619 -12.078 1.00 0.00 O ATOM 0 H GLU A 85 9.101 7.209 -10.874 1.00 0.00 H new ATOM 0 HA GLU A 85 6.194 7.164 -10.813 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.526 4.789 -10.609 1.00 0.00 H new ATOM 0 HB3 GLU A 85 7.421 5.446 -11.965 1.00 0.00 H new ATOM 0 HG2 GLU A 85 8.733 4.776 -9.310 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.554 3.608 -10.603 1.00 0.00 H new ATOM 1376 N LEU A 86 6.789 8.119 -8.291 1.00 0.00 N ATOM 1377 CA LEU A 86 6.589 8.376 -6.868 1.00 0.00 C ATOM 1378 C LEU A 86 6.129 9.824 -6.714 1.00 0.00 C ATOM 1379 O LEU A 86 5.036 10.063 -6.215 1.00 0.00 O ATOM 1380 CB LEU A 86 7.854 8.043 -6.054 1.00 0.00 C ATOM 1381 CG LEU A 86 7.739 8.115 -4.520 1.00 0.00 C ATOM 1382 CD1 LEU A 86 7.628 9.537 -3.961 1.00 0.00 C ATOM 1383 CD2 LEU A 86 6.616 7.234 -3.970 1.00 0.00 C ATOM 0 H LEU A 86 6.816 8.972 -8.849 1.00 0.00 H new ATOM 0 HA LEU A 86 5.817 7.722 -6.462 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.174 7.036 -6.323 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.646 8.723 -6.366 1.00 0.00 H new ATOM 0 HG LEU A 86 8.691 7.718 -4.167 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.551 9.496 -2.874 1.00 0.00 H new ATOM 0 HD12 LEU A 86 8.513 10.108 -4.241 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.740 10.020 -4.369 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.581 7.324 -2.884 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.663 7.554 -4.391 1.00 0.00 H new ATOM 0 HD23 LEU A 86 6.802 6.195 -4.242 1.00 0.00 H new ATOM 1395 N LYS A 87 6.928 10.791 -7.180 1.00 0.00 N ATOM 1396 CA LYS A 87 6.615 12.223 -7.134 1.00 0.00 C ATOM 1397 C LYS A 87 5.110 12.586 -7.220 1.00 0.00 C ATOM 1398 O LYS A 87 4.586 13.209 -6.292 1.00 0.00 O ATOM 1399 CB LYS A 87 7.494 12.950 -8.169 1.00 0.00 C ATOM 1400 CG LYS A 87 7.150 14.427 -8.406 1.00 0.00 C ATOM 1401 CD LYS A 87 7.291 15.267 -7.129 1.00 0.00 C ATOM 1402 CE LYS A 87 7.039 16.752 -7.416 1.00 0.00 C ATOM 1403 NZ LYS A 87 5.653 17.005 -7.854 1.00 0.00 N ATOM 0 H LYS A 87 7.832 10.594 -7.610 1.00 0.00 H new ATOM 0 HA LYS A 87 6.861 12.579 -6.134 1.00 0.00 H new ATOM 0 HB2 LYS A 87 8.533 12.884 -7.848 1.00 0.00 H new ATOM 0 HB3 LYS A 87 7.420 12.421 -9.119 1.00 0.00 H new ATOM 0 HG2 LYS A 87 7.804 14.831 -9.179 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.129 14.505 -8.779 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.585 14.914 -6.377 1.00 0.00 H new ATOM 0 HD3 LYS A 87 8.290 15.138 -6.713 1.00 0.00 H new ATOM 0 HE2 LYS A 87 7.247 17.335 -6.519 1.00 0.00 H new ATOM 0 HE3 LYS A 87 7.730 17.094 -8.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 5.487 18.030 -7.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 5.503 16.582 -8.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 4.991 16.582 -7.173 1.00 0.00 H new ATOM 1417 N PRO A 88 4.384 12.225 -8.295 1.00 0.00 N ATOM 1418 CA PRO A 88 2.977 12.573 -8.442 1.00 0.00 C ATOM 1419 C PRO A 88 2.082 11.753 -7.507 1.00 0.00 C ATOM 1420 O PRO A 88 0.962 12.166 -7.206 1.00 0.00 O ATOM 1421 CB PRO A 88 2.646 12.290 -9.909 1.00 0.00 C ATOM 1422 CG PRO A 88 3.581 11.132 -10.257 1.00 0.00 C ATOM 1423 CD PRO A 88 4.834 11.456 -9.443 1.00 0.00 C ATOM 0 HA PRO A 88 2.797 13.614 -8.173 1.00 0.00 H new ATOM 0 HB2 PRO A 88 1.599 12.017 -10.041 1.00 0.00 H new ATOM 0 HB3 PRO A 88 2.830 13.160 -10.539 1.00 0.00 H new ATOM 0 HG2 PRO A 88 3.154 10.169 -9.977 1.00 0.00 H new ATOM 0 HG3 PRO A 88 3.792 11.089 -11.325 1.00 0.00 H new ATOM 0 HD2 PRO A 88 5.339 10.544 -9.126 1.00 0.00 H new ATOM 0 HD3 PRO A 88 5.548 12.026 -10.038 1.00 0.00 H new ATOM 1431 N LEU A 89 2.541 10.569 -7.099 1.00 0.00 N ATOM 1432 CA LEU A 89 1.819 9.712 -6.183 1.00 0.00 C ATOM 1433 C LEU A 89 1.849 10.368 -4.805 1.00 0.00 C ATOM 1434 O LEU A 89 0.826 10.480 -4.136 1.00 0.00 O ATOM 1435 CB LEU A 89 2.432 8.302 -6.228 1.00 0.00 C ATOM 1436 CG LEU A 89 1.477 7.184 -5.791 1.00 0.00 C ATOM 1437 CD1 LEU A 89 1.779 5.916 -6.605 1.00 0.00 C ATOM 1438 CD2 LEU A 89 1.666 6.880 -4.301 1.00 0.00 C ATOM 0 H LEU A 89 3.434 10.182 -7.403 1.00 0.00 H new ATOM 0 HA LEU A 89 0.771 9.592 -6.458 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.771 8.098 -7.244 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.314 8.281 -5.588 1.00 0.00 H new ATOM 0 HG LEU A 89 0.450 7.505 -5.963 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.103 5.117 -6.299 1.00 0.00 H new ATOM 0 HD12 LEU A 89 1.639 6.123 -7.666 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.809 5.607 -6.428 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.983 6.085 -4.002 1.00 0.00 H new ATOM 0 HD22 LEU A 89 2.693 6.562 -4.122 1.00 0.00 H new ATOM 0 HD23 LEU A 89 1.457 7.776 -3.717 1.00 0.00 H new ATOM 1450 N ALA A 90 3.018 10.866 -4.395 1.00 0.00 N ATOM 1451 CA ALA A 90 3.125 11.623 -3.158 1.00 0.00 C ATOM 1452 C ALA A 90 2.200 12.834 -3.270 1.00 0.00 C ATOM 1453 O ALA A 90 1.358 13.059 -2.407 1.00 0.00 O ATOM 1454 CB ALA A 90 4.570 12.050 -2.922 1.00 0.00 C ATOM 0 H ALA A 90 3.896 10.756 -4.902 1.00 0.00 H new ATOM 0 HA ALA A 90 2.828 11.012 -2.306 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.635 12.616 -1.993 1.00 0.00 H new ATOM 0 HB2 ALA A 90 5.204 11.166 -2.854 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.905 12.674 -3.751 1.00 0.00 H new ATOM 1460 N GLN A 91 2.332 13.603 -4.355 1.00 0.00 N ATOM 1461 CA GLN A 91 1.510 14.783 -4.583 1.00 0.00 C ATOM 1462 C GLN A 91 0.007 14.493 -4.447 1.00 0.00 C ATOM 1463 O GLN A 91 -0.699 15.234 -3.757 1.00 0.00 O ATOM 1464 CB GLN A 91 1.867 15.387 -5.944 1.00 0.00 C ATOM 1465 CG GLN A 91 1.371 16.831 -6.089 1.00 0.00 C ATOM 1466 CD GLN A 91 1.896 17.440 -7.384 1.00 0.00 C ATOM 1467 OE1 GLN A 91 2.829 18.236 -7.373 1.00 0.00 O ATOM 1468 NE2 GLN A 91 1.319 17.057 -8.519 1.00 0.00 N ATOM 0 H GLN A 91 3.011 13.421 -5.094 1.00 0.00 H new ATOM 0 HA GLN A 91 1.728 15.514 -3.805 1.00 0.00 H new ATOM 0 HB2 GLN A 91 2.948 15.362 -6.078 1.00 0.00 H new ATOM 0 HB3 GLN A 91 1.434 14.775 -6.735 1.00 0.00 H new ATOM 0 HG2 GLN A 91 0.281 16.851 -6.085 1.00 0.00 H new ATOM 0 HG3 GLN A 91 1.704 17.425 -5.238 1.00 0.00 H new ATOM 0 HE21 GLN A 91 0.545 16.393 -8.499 1.00 0.00 H new ATOM 0 HE22 GLN A 91 1.651 17.427 -9.410 1.00 0.00 H new ATOM 1477 N SER A 92 -0.493 13.440 -5.106 1.00 0.00 N ATOM 1478 CA SER A 92 -1.900 13.070 -5.028 1.00 0.00 C ATOM 1479 C SER A 92 -2.262 12.718 -3.584 1.00 0.00 C ATOM 1480 O SER A 92 -3.159 13.328 -2.995 1.00 0.00 O ATOM 1481 CB SER A 92 -2.191 11.916 -5.992 1.00 0.00 C ATOM 1482 OG SER A 92 -1.440 10.776 -5.629 1.00 0.00 O ATOM 0 H SER A 92 0.066 12.829 -5.702 1.00 0.00 H new ATOM 0 HA SER A 92 -2.522 13.912 -5.329 1.00 0.00 H new ATOM 0 HB2 SER A 92 -3.255 11.679 -5.977 1.00 0.00 H new ATOM 0 HB3 SER A 92 -1.945 12.213 -7.011 1.00 0.00 H new ATOM 0 HG SER A 92 -1.422 10.144 -6.378 1.00 0.00 H new ATOM 1488 N HIS A 93 -1.557 11.735 -3.017 1.00 0.00 N ATOM 1489 CA HIS A 93 -1.764 11.291 -1.642 1.00 0.00 C ATOM 1490 C HIS A 93 -1.652 12.426 -0.624 1.00 0.00 C ATOM 1491 O HIS A 93 -2.243 12.370 0.453 1.00 0.00 O ATOM 1492 CB HIS A 93 -0.921 10.053 -1.322 1.00 0.00 C ATOM 1493 CG HIS A 93 -1.362 8.884 -2.170 1.00 0.00 C ATOM 1494 ND1 HIS A 93 -1.195 8.790 -3.532 1.00 0.00 N ATOM 1495 CD2 HIS A 93 -2.236 7.893 -1.803 1.00 0.00 C ATOM 1496 CE1 HIS A 93 -1.952 7.778 -3.967 1.00 0.00 C ATOM 1497 NE2 HIS A 93 -2.600 7.184 -2.953 1.00 0.00 N ATOM 0 H HIS A 93 -0.822 11.223 -3.505 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.801 10.968 -1.551 1.00 0.00 H new ATOM 0 HB2 HIS A 93 0.133 10.265 -1.504 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.018 9.802 -0.266 1.00 0.00 H new ATOM 0 HD1 HIS A 93 -0.600 9.386 -4.107 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -2.583 7.694 -0.800 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -2.032 7.477 -5.001 1.00 0.00 H new ATOM 1505 N ALA A 94 -0.900 13.466 -0.973 1.00 0.00 N ATOM 1506 CA ALA A 94 -0.716 14.652 -0.162 1.00 0.00 C ATOM 1507 C ALA A 94 -1.947 15.548 -0.244 1.00 0.00 C ATOM 1508 O ALA A 94 -2.727 15.634 0.703 1.00 0.00 O ATOM 1509 CB ALA A 94 0.538 15.433 -0.589 1.00 0.00 C ATOM 0 H ALA A 94 -0.389 13.502 -1.855 1.00 0.00 H new ATOM 0 HA ALA A 94 -0.578 14.331 0.871 1.00 0.00 H new ATOM 0 HB1 ALA A 94 0.647 16.317 0.039 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.417 14.798 -0.478 1.00 0.00 H new ATOM 0 HB3 ALA A 94 0.439 15.738 -1.631 1.00 0.00 H new ATOM 1515 N THR A 95 -2.106 16.230 -1.381 1.00 0.00 N ATOM 1516 CA THR A 95 -3.101 17.284 -1.515 1.00 0.00 C ATOM 1517 C THR A 95 -4.508 16.813 -1.878 1.00 0.00 C ATOM 1518 O THR A 95 -5.458 17.535 -1.593 1.00 0.00 O ATOM 1519 CB THR A 95 -2.577 18.368 -2.473 1.00 0.00 C ATOM 1520 OG1 THR A 95 -3.137 19.618 -2.121 1.00 0.00 O ATOM 1521 CG2 THR A 95 -2.833 18.088 -3.956 1.00 0.00 C ATOM 0 H THR A 95 -1.553 16.066 -2.222 1.00 0.00 H new ATOM 0 HA THR A 95 -3.234 17.709 -0.520 1.00 0.00 H new ATOM 0 HB THR A 95 -1.493 18.372 -2.356 1.00 0.00 H new ATOM 0 HG1 THR A 95 -2.419 20.245 -1.893 1.00 0.00 H new ATOM 0 HG21 THR A 95 -2.430 18.904 -4.555 1.00 0.00 H new ATOM 0 HG22 THR A 95 -2.346 17.155 -4.239 1.00 0.00 H new ATOM 0 HG23 THR A 95 -3.906 18.005 -4.131 1.00 0.00 H new ATOM 1529 N LYS A 96 -4.657 15.652 -2.525 1.00 0.00 N ATOM 1530 CA LYS A 96 -5.964 15.171 -2.960 1.00 0.00 C ATOM 1531 C LYS A 96 -6.512 14.144 -1.973 1.00 0.00 C ATOM 1532 O LYS A 96 -7.599 14.323 -1.430 1.00 0.00 O ATOM 1533 CB LYS A 96 -5.886 14.586 -4.376 1.00 0.00 C ATOM 1534 CG LYS A 96 -5.321 15.571 -5.405 1.00 0.00 C ATOM 1535 CD LYS A 96 -5.379 14.932 -6.801 1.00 0.00 C ATOM 1536 CE LYS A 96 -4.710 15.815 -7.859 1.00 0.00 C ATOM 1537 NZ LYS A 96 -5.406 17.105 -8.018 1.00 0.00 N ATOM 0 H LYS A 96 -3.883 15.029 -2.757 1.00 0.00 H new ATOM 0 HA LYS A 96 -6.650 16.017 -2.985 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.264 13.691 -4.359 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -6.883 14.275 -4.689 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -5.895 16.498 -5.392 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -4.293 15.829 -5.153 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -4.888 13.959 -6.776 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -6.419 14.757 -7.078 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -3.672 15.995 -7.579 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -4.696 15.290 -8.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -4.975 17.638 -8.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -6.410 16.934 -8.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -5.324 17.654 -7.139 1.00 0.00 H new ATOM 1551 N HIS A 97 -5.764 13.064 -1.732 1.00 0.00 N ATOM 1552 CA HIS A 97 -6.239 11.975 -0.881 1.00 0.00 C ATOM 1553 C HIS A 97 -6.066 12.222 0.621 1.00 0.00 C ATOM 1554 O HIS A 97 -6.234 11.293 1.402 1.00 0.00 O ATOM 1555 CB HIS A 97 -5.643 10.640 -1.328 1.00 0.00 C ATOM 1556 CG HIS A 97 -5.720 10.422 -2.824 1.00 0.00 C ATOM 1557 ND1 HIS A 97 -6.834 10.627 -3.615 1.00 0.00 N ATOM 1558 CD2 HIS A 97 -4.680 10.105 -3.651 1.00 0.00 C ATOM 1559 CE1 HIS A 97 -6.470 10.420 -4.894 1.00 0.00 C ATOM 1560 NE2 HIS A 97 -5.175 10.070 -4.938 1.00 0.00 N ATOM 0 H HIS A 97 -4.829 12.922 -2.114 1.00 0.00 H new ATOM 0 HA HIS A 97 -7.319 11.932 -1.019 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.600 10.592 -1.014 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -6.166 9.829 -0.822 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -3.659 9.917 -3.352 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.119 10.520 -5.752 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -4.649 9.822 -5.776 1.00 0.00 H new ATOM 1569 N LYS A 98 -5.773 13.463 1.027 1.00 0.00 N ATOM 1570 CA LYS A 98 -5.717 13.904 2.416 1.00 0.00 C ATOM 1571 C LYS A 98 -4.508 13.350 3.178 1.00 0.00 C ATOM 1572 O LYS A 98 -4.600 12.403 3.956 1.00 0.00 O ATOM 1573 CB LYS A 98 -7.060 13.677 3.135 1.00 0.00 C ATOM 1574 CG LYS A 98 -8.237 14.199 2.294 1.00 0.00 C ATOM 1575 CD LYS A 98 -9.540 14.194 3.103 1.00 0.00 C ATOM 1576 CE LYS A 98 -10.760 14.457 2.209 1.00 0.00 C ATOM 1577 NZ LYS A 98 -10.653 15.734 1.480 1.00 0.00 N ATOM 0 H LYS A 98 -5.561 14.212 0.368 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.555 14.982 2.401 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -7.194 12.614 3.333 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.048 14.182 4.101 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.022 15.211 1.951 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -8.355 13.580 1.405 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.655 13.232 3.603 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.488 14.954 3.882 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -10.867 13.641 1.494 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -11.662 14.465 2.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.558 15.943 1.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -10.425 16.497 2.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -9.901 15.664 0.765 1.00 0.00 H new ATOM 1591 N ILE A 99 -3.388 14.027 2.948 1.00 0.00 N ATOM 1592 CA ILE A 99 -2.054 13.876 3.502 1.00 0.00 C ATOM 1593 C ILE A 99 -1.680 12.753 4.494 1.00 0.00 C ATOM 1594 O ILE A 99 -0.891 11.898 4.094 1.00 0.00 O ATOM 1595 CB ILE A 99 -1.385 15.266 3.750 1.00 0.00 C ATOM 1596 CG1 ILE A 99 -0.319 15.325 4.868 1.00 0.00 C ATOM 1597 CG2 ILE A 99 -2.401 16.411 3.943 1.00 0.00 C ATOM 1598 CD1 ILE A 99 0.732 16.406 4.605 1.00 0.00 C ATOM 0 H ILE A 99 -3.402 14.796 2.278 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.567 13.353 2.679 1.00 0.00 H new ATOM 0 HB ILE A 99 -0.846 15.414 2.814 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -0.807 15.519 5.823 1.00 0.00 H new ATOM 0 HG13 ILE A 99 0.172 14.355 4.952 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -1.867 17.347 4.111 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -3.021 16.502 3.051 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -3.034 16.195 4.804 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.460 16.411 5.416 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.240 16.198 3.663 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.246 17.380 4.548 1.00 0.00 H new ATOM 1610 N PRO A 100 -2.068 12.798 5.781 1.00 0.00 N ATOM 1611 CA PRO A 100 -1.567 11.913 6.830 1.00 0.00 C ATOM 1612 C PRO A 100 -1.034 10.504 6.511 1.00 0.00 C ATOM 1613 O PRO A 100 -1.767 9.519 6.497 1.00 0.00 O ATOM 1614 CB PRO A 100 -2.634 11.917 7.920 1.00 0.00 C ATOM 1615 CG PRO A 100 -3.097 13.372 7.876 1.00 0.00 C ATOM 1616 CD PRO A 100 -3.004 13.740 6.391 1.00 0.00 C ATOM 0 HA PRO A 100 -0.606 12.336 7.121 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -3.444 11.221 7.705 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -2.228 11.643 8.894 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -4.114 13.480 8.252 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -2.462 14.013 8.488 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -3.982 13.676 5.915 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -2.656 14.766 6.268 1.00 0.00 H new ATOM 1624 N ILE A 101 0.301 10.415 6.432 1.00 0.00 N ATOM 1625 CA ILE A 101 1.129 9.228 6.197 1.00 0.00 C ATOM 1626 C ILE A 101 0.809 8.081 7.160 1.00 0.00 C ATOM 1627 O ILE A 101 1.074 6.918 6.863 1.00 0.00 O ATOM 1628 CB ILE A 101 2.609 9.644 6.319 1.00 0.00 C ATOM 1629 CG1 ILE A 101 2.842 10.836 5.379 1.00 0.00 C ATOM 1630 CG2 ILE A 101 3.553 8.480 6.002 1.00 0.00 C ATOM 1631 CD1 ILE A 101 4.294 11.066 4.956 1.00 0.00 C ATOM 0 H ILE A 101 0.879 11.248 6.541 1.00 0.00 H new ATOM 0 HA ILE A 101 0.915 8.848 5.198 1.00 0.00 H new ATOM 0 HB ILE A 101 2.828 9.934 7.347 1.00 0.00 H new ATOM 0 HG12 ILE A 101 2.239 10.693 4.482 1.00 0.00 H new ATOM 0 HG13 ILE A 101 2.477 11.739 5.868 1.00 0.00 H new ATOM 0 HG21 ILE A 101 4.586 8.813 6.099 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.368 7.662 6.698 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.377 8.136 4.983 1.00 0.00 H new ATOM 0 HD11 ILE A 101 4.348 11.930 4.294 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.906 11.247 5.840 1.00 0.00 H new ATOM 0 HD13 ILE A 101 4.664 10.185 4.432 1.00 0.00 H new ATOM 1643 N LYS A 102 0.234 8.400 8.315 1.00 0.00 N ATOM 1644 CA LYS A 102 -0.222 7.407 9.274 1.00 0.00 C ATOM 1645 C LYS A 102 -1.145 6.404 8.576 1.00 0.00 C ATOM 1646 O LYS A 102 -1.139 5.216 8.886 1.00 0.00 O ATOM 1647 CB LYS A 102 -0.917 8.119 10.441 1.00 0.00 C ATOM 1648 CG LYS A 102 -1.381 7.138 11.528 1.00 0.00 C ATOM 1649 CD LYS A 102 -2.014 7.851 12.731 1.00 0.00 C ATOM 1650 CE LYS A 102 -3.331 8.549 12.365 1.00 0.00 C ATOM 1651 NZ LYS A 102 -3.986 9.112 13.559 1.00 0.00 N ATOM 0 H LYS A 102 0.071 9.362 8.611 1.00 0.00 H new ATOM 0 HA LYS A 102 0.622 6.847 9.677 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -0.234 8.847 10.879 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -1.776 8.675 10.065 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -2.103 6.442 11.101 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.530 6.547 11.866 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -2.197 7.127 13.525 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -1.313 8.586 13.126 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -3.136 9.344 11.645 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -4.000 7.838 11.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -4.874 9.577 13.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.192 8.348 14.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -3.355 9.808 14.005 1.00 0.00 H new ATOM 1665 N TYR A 103 -1.946 6.874 7.624 1.00 0.00 N ATOM 1666 CA TYR A 103 -2.774 5.987 6.843 1.00 0.00 C ATOM 1667 C TYR A 103 -1.929 5.056 5.969 1.00 0.00 C ATOM 1668 O TYR A 103 -2.260 3.879 5.835 1.00 0.00 O ATOM 1669 CB TYR A 103 -3.757 6.822 6.040 1.00 0.00 C ATOM 1670 CG TYR A 103 -4.604 7.813 6.821 1.00 0.00 C ATOM 1671 CD1 TYR A 103 -5.028 7.521 8.132 1.00 0.00 C ATOM 1672 CD2 TYR A 103 -5.220 8.859 6.113 1.00 0.00 C ATOM 1673 CE1 TYR A 103 -6.184 8.131 8.652 1.00 0.00 C ATOM 1674 CE2 TYR A 103 -6.349 9.498 6.648 1.00 0.00 C ATOM 1675 CZ TYR A 103 -6.865 9.098 7.890 1.00 0.00 C ATOM 1676 OH TYR A 103 -8.015 9.665 8.349 1.00 0.00 O ATOM 0 H TYR A 103 -2.033 7.861 7.382 1.00 0.00 H new ATOM 0 HA TYR A 103 -3.340 5.329 7.503 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -3.198 7.373 5.284 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -4.427 6.144 5.510 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -4.465 6.828 8.739 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -4.825 9.171 5.158 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -6.547 7.858 9.632 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -6.822 10.301 6.102 1.00 0.00 H new ATOM 0 HH TYR A 103 -7.950 10.640 8.279 1.00 0.00 H new ATOM 1686 N LEU A 104 -0.809 5.538 5.424 1.00 0.00 N ATOM 1687 CA LEU A 104 0.091 4.662 4.680 1.00 0.00 C ATOM 1688 C LEU A 104 0.714 3.662 5.667 1.00 0.00 C ATOM 1689 O LEU A 104 0.875 2.489 5.339 1.00 0.00 O ATOM 1690 CB LEU A 104 1.132 5.443 3.863 1.00 0.00 C ATOM 1691 CG LEU A 104 0.509 6.272 2.723 1.00 0.00 C ATOM 1692 CD1 LEU A 104 1.487 7.359 2.261 1.00 0.00 C ATOM 1693 CD2 LEU A 104 0.127 5.438 1.502 1.00 0.00 C ATOM 0 H LEU A 104 -0.510 6.511 5.483 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.473 4.108 3.930 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.683 6.108 4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.854 4.743 3.442 1.00 0.00 H new ATOM 0 HG LEU A 104 -0.402 6.703 3.138 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.034 7.937 1.455 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.718 8.020 3.097 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.405 6.894 1.902 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.305 6.086 0.740 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.016 4.950 1.102 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -0.603 4.682 1.792 1.00 0.00 H new ATOM 1705 N GLU A 105 0.975 4.071 6.914 1.00 0.00 N ATOM 1706 CA GLU A 105 1.412 3.112 7.926 1.00 0.00 C ATOM 1707 C GLU A 105 0.310 2.058 8.097 1.00 0.00 C ATOM 1708 O GLU A 105 0.593 0.862 8.161 1.00 0.00 O ATOM 1709 CB GLU A 105 1.775 3.785 9.259 1.00 0.00 C ATOM 1710 CG GLU A 105 2.963 4.738 9.089 1.00 0.00 C ATOM 1711 CD GLU A 105 3.310 5.461 10.385 1.00 0.00 C ATOM 1712 OE1 GLU A 105 3.638 4.752 11.361 1.00 0.00 O ATOM 1713 OE2 GLU A 105 3.236 6.709 10.377 1.00 0.00 O ATOM 0 H GLU A 105 0.893 5.035 7.238 1.00 0.00 H new ATOM 0 HA GLU A 105 2.331 2.633 7.589 1.00 0.00 H new ATOM 0 HB2 GLU A 105 0.914 4.336 9.638 1.00 0.00 H new ATOM 0 HB3 GLU A 105 2.018 3.024 10.000 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.831 4.176 8.745 1.00 0.00 H new ATOM 0 HG3 GLU A 105 2.731 5.471 8.317 1.00 0.00 H new ATOM 1720 N PHE A 106 -0.950 2.482 8.198 1.00 0.00 N ATOM 1721 CA PHE A 106 -2.040 1.525 8.256 1.00 0.00 C ATOM 1722 C PHE A 106 -2.071 0.601 7.030 1.00 0.00 C ATOM 1723 O PHE A 106 -2.284 -0.598 7.202 1.00 0.00 O ATOM 1724 CB PHE A 106 -3.392 2.197 8.495 1.00 0.00 C ATOM 1725 CG PHE A 106 -3.566 3.085 9.719 1.00 0.00 C ATOM 1726 CD1 PHE A 106 -2.857 2.846 10.912 1.00 0.00 C ATOM 1727 CD2 PHE A 106 -4.606 4.028 9.712 1.00 0.00 C ATOM 1728 CE1 PHE A 106 -3.180 3.567 12.074 1.00 0.00 C ATOM 1729 CE2 PHE A 106 -4.873 4.807 10.846 1.00 0.00 C ATOM 1730 CZ PHE A 106 -4.170 4.564 12.037 1.00 0.00 C ATOM 0 H PHE A 106 -1.231 3.462 8.240 1.00 0.00 H new ATOM 0 HA PHE A 106 -1.845 0.893 9.123 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.621 2.799 7.616 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.146 1.411 8.548 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -2.067 2.110 10.934 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.207 4.154 8.823 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -2.665 3.354 12.999 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -5.616 5.590 10.804 1.00 0.00 H new ATOM 0 HZ PHE A 106 -4.390 5.142 12.923 1.00 0.00 H new ATOM 1740 N ILE A 107 -1.882 1.097 5.800 1.00 0.00 N ATOM 1741 CA ILE A 107 -1.883 0.188 4.647 1.00 0.00 C ATOM 1742 C ILE A 107 -0.651 -0.721 4.674 1.00 0.00 C ATOM 1743 O ILE A 107 -0.709 -1.843 4.173 1.00 0.00 O ATOM 1744 CB ILE A 107 -2.111 0.878 3.281 1.00 0.00 C ATOM 1745 CG1 ILE A 107 -2.795 -0.102 2.306 1.00 0.00 C ATOM 1746 CG2 ILE A 107 -0.788 1.311 2.634 1.00 0.00 C ATOM 1747 CD1 ILE A 107 -3.382 0.561 1.049 1.00 0.00 C ATOM 0 H ILE A 107 -1.732 2.082 5.582 1.00 0.00 H new ATOM 0 HA ILE A 107 -2.765 -0.444 4.754 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.731 1.754 3.468 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -2.070 -0.856 2.000 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.594 -0.623 2.834 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.991 1.791 1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -0.275 2.013 3.291 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -0.158 0.436 2.474 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -3.844 -0.199 0.419 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -4.133 1.295 1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -2.586 1.058 0.494 1.00 0.00 H new ATOM 1759 N SER A 108 0.471 -0.251 5.236 1.00 0.00 N ATOM 1760 CA SER A 108 1.653 -1.093 5.356 1.00 0.00 C ATOM 1761 C SER A 108 1.289 -2.254 6.293 1.00 0.00 C ATOM 1762 O SER A 108 1.510 -3.419 5.967 1.00 0.00 O ATOM 1763 CB SER A 108 2.896 -0.286 5.773 1.00 0.00 C ATOM 1764 OG SER A 108 2.971 -0.030 7.159 1.00 0.00 O ATOM 0 H SER A 108 0.578 0.693 5.607 1.00 0.00 H new ATOM 0 HA SER A 108 1.944 -1.511 4.392 1.00 0.00 H new ATOM 0 HB2 SER A 108 3.790 -0.828 5.464 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.898 0.663 5.237 1.00 0.00 H new ATOM 0 HG SER A 108 2.152 0.422 7.453 1.00 0.00 H new ATOM 1770 N GLU A 109 0.679 -1.929 7.437 1.00 0.00 N ATOM 1771 CA GLU A 109 0.165 -2.913 8.379 1.00 0.00 C ATOM 1772 C GLU A 109 -0.819 -3.850 7.670 1.00 0.00 C ATOM 1773 O GLU A 109 -0.771 -5.059 7.876 1.00 0.00 O ATOM 1774 CB GLU A 109 -0.482 -2.201 9.571 1.00 0.00 C ATOM 1775 CG GLU A 109 0.550 -1.436 10.414 1.00 0.00 C ATOM 1776 CD GLU A 109 -0.109 -0.333 11.239 1.00 0.00 C ATOM 1777 OE1 GLU A 109 -1.177 -0.619 11.823 1.00 0.00 O ATOM 1778 OE2 GLU A 109 0.454 0.782 11.262 1.00 0.00 O ATOM 0 H GLU A 109 0.529 -0.964 7.733 1.00 0.00 H new ATOM 0 HA GLU A 109 0.984 -3.522 8.761 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -1.241 -1.507 9.210 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -0.991 -2.933 10.198 1.00 0.00 H new ATOM 0 HG2 GLU A 109 1.065 -2.130 11.078 1.00 0.00 H new ATOM 0 HG3 GLU A 109 1.305 -1.001 9.760 1.00 0.00 H new ATOM 1785 N ALA A 110 -1.694 -3.313 6.814 1.00 0.00 N ATOM 1786 CA ALA A 110 -2.628 -4.128 6.049 1.00 0.00 C ATOM 1787 C ALA A 110 -1.866 -5.131 5.175 1.00 0.00 C ATOM 1788 O ALA A 110 -1.998 -6.333 5.382 1.00 0.00 O ATOM 1789 CB ALA A 110 -3.586 -3.259 5.233 1.00 0.00 C ATOM 0 H ALA A 110 -1.771 -2.311 6.637 1.00 0.00 H new ATOM 0 HA ALA A 110 -3.244 -4.698 6.745 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -4.270 -3.898 4.674 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -4.156 -2.617 5.904 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -3.016 -2.642 4.538 1.00 0.00 H new ATOM 1795 N ILE A 111 -0.958 -4.686 4.296 1.00 0.00 N ATOM 1796 CA ILE A 111 -0.278 -5.658 3.437 1.00 0.00 C ATOM 1797 C ILE A 111 0.528 -6.658 4.276 1.00 0.00 C ATOM 1798 O ILE A 111 0.488 -7.859 4.011 1.00 0.00 O ATOM 1799 CB ILE A 111 0.514 -5.000 2.291 1.00 0.00 C ATOM 1800 CG1 ILE A 111 0.957 -6.084 1.292 1.00 0.00 C ATOM 1801 CG2 ILE A 111 1.711 -4.190 2.797 1.00 0.00 C ATOM 1802 CD1 ILE A 111 1.571 -5.503 0.015 1.00 0.00 C ATOM 0 H ILE A 111 -0.688 -3.711 4.165 1.00 0.00 H new ATOM 0 HA ILE A 111 -1.041 -6.240 2.920 1.00 0.00 H new ATOM 0 HB ILE A 111 -0.142 -4.289 1.789 1.00 0.00 H new ATOM 0 HG12 ILE A 111 1.684 -6.739 1.773 1.00 0.00 H new ATOM 0 HG13 ILE A 111 0.098 -6.701 1.028 1.00 0.00 H new ATOM 0 HG21 ILE A 111 2.235 -3.747 1.950 1.00 0.00 H new ATOM 0 HG22 ILE A 111 1.361 -3.399 3.461 1.00 0.00 H new ATOM 0 HG23 ILE A 111 2.390 -4.846 3.341 1.00 0.00 H new ATOM 0 HD11 ILE A 111 1.864 -6.315 -0.650 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.838 -4.870 -0.486 1.00 0.00 H new ATOM 0 HD13 ILE A 111 2.449 -4.909 0.271 1.00 0.00 H new ATOM 1814 N ILE A 112 1.168 -6.194 5.357 1.00 0.00 N ATOM 1815 CA ILE A 112 1.896 -7.073 6.268 1.00 0.00 C ATOM 1816 C ILE A 112 0.910 -8.120 6.815 1.00 0.00 C ATOM 1817 O ILE A 112 1.212 -9.313 6.835 1.00 0.00 O ATOM 1818 CB ILE A 112 2.595 -6.222 7.355 1.00 0.00 C ATOM 1819 CG1 ILE A 112 3.770 -5.455 6.714 1.00 0.00 C ATOM 1820 CG2 ILE A 112 3.122 -7.051 8.536 1.00 0.00 C ATOM 1821 CD1 ILE A 112 4.341 -4.367 7.627 1.00 0.00 C ATOM 0 H ILE A 112 1.193 -5.209 5.619 1.00 0.00 H new ATOM 0 HA ILE A 112 2.693 -7.620 5.765 1.00 0.00 H new ATOM 0 HB ILE A 112 1.844 -5.541 7.756 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.561 -6.160 6.459 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.435 -5.001 5.782 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.600 -6.391 9.260 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.292 -7.573 9.013 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.848 -7.779 8.174 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.164 -3.863 7.121 1.00 0.00 H new ATOM 0 HD12 ILE A 112 3.561 -3.643 7.862 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.705 -4.820 8.549 1.00 0.00 H new ATOM 1833 N HIS A 113 -0.286 -7.690 7.232 1.00 0.00 N ATOM 1834 CA HIS A 113 -1.338 -8.574 7.718 1.00 0.00 C ATOM 1835 C HIS A 113 -1.721 -9.593 6.638 1.00 0.00 C ATOM 1836 O HIS A 113 -1.762 -10.788 6.930 1.00 0.00 O ATOM 1837 CB HIS A 113 -2.555 -7.779 8.222 1.00 0.00 C ATOM 1838 CG HIS A 113 -3.628 -8.665 8.794 1.00 0.00 C ATOM 1839 ND1 HIS A 113 -3.816 -8.948 10.133 1.00 0.00 N ATOM 1840 CD2 HIS A 113 -4.472 -9.457 8.065 1.00 0.00 C ATOM 1841 CE1 HIS A 113 -4.769 -9.893 10.218 1.00 0.00 C ATOM 1842 NE2 HIS A 113 -5.179 -10.217 8.975 1.00 0.00 N ATOM 0 H HIS A 113 -0.549 -6.704 7.239 1.00 0.00 H new ATOM 0 HA HIS A 113 -0.953 -9.127 8.575 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -2.231 -7.069 8.983 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -2.970 -7.197 7.399 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -4.567 -9.483 6.989 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -5.145 -10.323 11.134 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -5.893 -10.909 8.745 1.00 0.00 H new ATOM 1851 N VAL A 114 -1.960 -9.153 5.392 1.00 0.00 N ATOM 1852 CA VAL A 114 -2.335 -10.070 4.309 1.00 0.00 C ATOM 1853 C VAL A 114 -1.241 -11.124 4.164 1.00 0.00 C ATOM 1854 O VAL A 114 -1.530 -12.316 4.150 1.00 0.00 O ATOM 1855 CB VAL A 114 -2.590 -9.374 2.950 1.00 0.00 C ATOM 1856 CG1 VAL A 114 -3.105 -10.392 1.922 1.00 0.00 C ATOM 1857 CG2 VAL A 114 -3.651 -8.275 3.071 1.00 0.00 C ATOM 0 H VAL A 114 -1.900 -8.174 5.113 1.00 0.00 H new ATOM 0 HA VAL A 114 -3.287 -10.522 4.586 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.642 -8.940 2.634 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -3.281 -9.891 0.970 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -2.363 -11.179 1.786 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -4.037 -10.830 2.279 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.804 -7.808 2.098 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.589 -8.711 3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.316 -7.523 3.785 1.00 0.00 H new ATOM 1867 N LEU A 115 0.014 -10.685 4.050 1.00 0.00 N ATOM 1868 CA LEU A 115 1.151 -11.580 3.906 1.00 0.00 C ATOM 1869 C LEU A 115 1.203 -12.576 5.061 1.00 0.00 C ATOM 1870 O LEU A 115 1.243 -13.780 4.835 1.00 0.00 O ATOM 1871 CB LEU A 115 2.449 -10.771 3.809 1.00 0.00 C ATOM 1872 CG LEU A 115 2.509 -9.908 2.543 1.00 0.00 C ATOM 1873 CD1 LEU A 115 3.717 -8.975 2.618 1.00 0.00 C ATOM 1874 CD2 LEU A 115 2.630 -10.776 1.289 1.00 0.00 C ATOM 0 H LEU A 115 0.265 -9.696 4.056 1.00 0.00 H new ATOM 0 HA LEU A 115 1.036 -12.151 2.984 1.00 0.00 H new ATOM 0 HB2 LEU A 115 2.541 -10.131 4.686 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.300 -11.452 3.821 1.00 0.00 H new ATOM 0 HG LEU A 115 1.586 -9.331 2.482 1.00 0.00 H new ATOM 0 HD11 LEU A 115 3.759 -8.362 1.718 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.625 -8.331 3.492 1.00 0.00 H new ATOM 0 HD13 LEU A 115 4.629 -9.566 2.697 1.00 0.00 H new ATOM 0 HD21 LEU A 115 2.670 -10.137 0.407 1.00 0.00 H new ATOM 0 HD22 LEU A 115 3.540 -11.373 1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.766 -11.437 1.219 1.00 0.00 H new ATOM 1886 N HIS A 116 1.186 -12.098 6.305 1.00 0.00 N ATOM 1887 CA HIS A 116 1.239 -12.979 7.463 1.00 0.00 C ATOM 1888 C HIS A 116 0.092 -13.991 7.472 1.00 0.00 C ATOM 1889 O HIS A 116 0.318 -15.177 7.715 1.00 0.00 O ATOM 1890 CB HIS A 116 1.254 -12.157 8.759 1.00 0.00 C ATOM 1891 CG HIS A 116 1.726 -12.956 9.946 1.00 0.00 C ATOM 1892 ND1 HIS A 116 1.626 -14.327 10.096 1.00 0.00 N ATOM 1893 CD2 HIS A 116 2.351 -12.450 11.052 1.00 0.00 C ATOM 1894 CE1 HIS A 116 2.172 -14.645 11.283 1.00 0.00 C ATOM 1895 NE2 HIS A 116 2.618 -13.523 11.879 1.00 0.00 N ATOM 0 H HIS A 116 1.136 -11.105 6.533 1.00 0.00 H new ATOM 0 HA HIS A 116 2.165 -13.550 7.397 1.00 0.00 H new ATOM 0 HB2 HIS A 116 1.902 -11.291 8.628 1.00 0.00 H new ATOM 0 HB3 HIS A 116 0.251 -11.778 8.956 1.00 0.00 H new ATOM 0 HD1 HIS A 116 1.213 -14.978 9.428 1.00 0.00 H new ATOM 0 HD2 HIS A 116 2.589 -11.414 11.242 1.00 0.00 H new ATOM 0 HE1 HIS A 116 2.242 -15.642 11.693 1.00 0.00 H new ATOM 1904 N SER A 117 -1.129 -13.530 7.202 1.00 0.00 N ATOM 1905 CA SER A 117 -2.322 -14.363 7.283 1.00 0.00 C ATOM 1906 C SER A 117 -2.375 -15.384 6.143 1.00 0.00 C ATOM 1907 O SER A 117 -2.643 -16.562 6.358 1.00 0.00 O ATOM 1908 CB SER A 117 -3.565 -13.470 7.236 1.00 0.00 C ATOM 1909 OG SER A 117 -3.495 -12.494 8.254 1.00 0.00 O ATOM 0 H SER A 117 -1.316 -12.567 6.921 1.00 0.00 H new ATOM 0 HA SER A 117 -2.291 -14.915 8.222 1.00 0.00 H new ATOM 0 HB2 SER A 117 -3.640 -12.987 6.262 1.00 0.00 H new ATOM 0 HB3 SER A 117 -4.463 -14.075 7.361 1.00 0.00 H new ATOM 0 HG SER A 117 -4.361 -12.043 8.335 1.00 0.00 H new ATOM 1915 N ARG A 118 -2.146 -14.907 4.919 1.00 0.00 N ATOM 1916 CA ARG A 118 -2.251 -15.671 3.685 1.00 0.00 C ATOM 1917 C ARG A 118 -1.019 -16.546 3.442 1.00 0.00 C ATOM 1918 O ARG A 118 -1.126 -17.650 2.897 1.00 0.00 O ATOM 1919 CB ARG A 118 -2.474 -14.676 2.537 1.00 0.00 C ATOM 1920 CG ARG A 118 -3.042 -15.342 1.283 1.00 0.00 C ATOM 1921 CD ARG A 118 -3.273 -14.279 0.204 1.00 0.00 C ATOM 1922 NE ARG A 118 -3.550 -14.917 -1.089 1.00 0.00 N ATOM 1923 CZ ARG A 118 -4.381 -14.478 -2.045 1.00 0.00 C ATOM 1924 NH1 ARG A 118 -5.100 -13.357 -1.907 1.00 0.00 N ATOM 1925 NH2 ARG A 118 -4.491 -15.202 -3.163 1.00 0.00 N ATOM 0 H ARG A 118 -1.871 -13.938 4.759 1.00 0.00 H new ATOM 0 HA ARG A 118 -3.092 -16.362 3.752 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -3.155 -13.892 2.868 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -1.528 -14.193 2.291 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -2.353 -16.103 0.918 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -3.979 -15.847 1.518 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -4.108 -13.639 0.488 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -2.395 -13.639 0.121 1.00 0.00 H new ATOM 0 HE ARG A 118 -3.057 -15.789 -1.281 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -5.026 -12.805 -1.052 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -5.722 -13.055 -2.657 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -3.951 -16.061 -3.270 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -5.115 -14.896 -3.910 1.00 0.00 H new ATOM 1939 N HIS A 119 0.170 -16.062 3.825 1.00 0.00 N ATOM 1940 CA HIS A 119 1.411 -16.762 3.579 1.00 0.00 C ATOM 1941 C HIS A 119 2.250 -16.942 4.852 1.00 0.00 C ATOM 1942 O HIS A 119 3.388 -16.470 4.906 1.00 0.00 O ATOM 1943 CB HIS A 119 2.187 -16.034 2.469 1.00 0.00 C ATOM 1944 CG HIS A 119 1.348 -15.683 1.266 1.00 0.00 C ATOM 1945 ND1 HIS A 119 0.455 -16.514 0.617 1.00 0.00 N ATOM 1946 CD2 HIS A 119 1.351 -14.479 0.625 1.00 0.00 C ATOM 1947 CE1 HIS A 119 -0.045 -15.828 -0.428 1.00 0.00 C ATOM 1948 NE2 HIS A 119 0.482 -14.589 -0.438 1.00 0.00 N ATOM 0 H HIS A 119 0.285 -15.174 4.313 1.00 0.00 H new ATOM 0 HA HIS A 119 1.179 -17.773 3.245 1.00 0.00 H new ATOM 0 HB2 HIS A 119 2.617 -15.120 2.879 1.00 0.00 H new ATOM 0 HB3 HIS A 119 3.019 -16.662 2.149 1.00 0.00 H new ATOM 0 HD2 HIS A 119 1.925 -13.606 0.899 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -0.756 -16.211 -1.145 1.00 0.00 H new ATOM 0 HE2 HIS A 119 0.273 -13.857 -1.117 1.00 0.00 H new ATOM 1957 N PRO A 120 1.733 -17.622 5.888 1.00 0.00 N ATOM 1958 CA PRO A 120 2.484 -17.854 7.110 1.00 0.00 C ATOM 1959 C PRO A 120 3.683 -18.751 6.796 1.00 0.00 C ATOM 1960 O PRO A 120 3.652 -19.529 5.841 1.00 0.00 O ATOM 1961 CB PRO A 120 1.499 -18.517 8.078 1.00 0.00 C ATOM 1962 CG PRO A 120 0.499 -19.207 7.149 1.00 0.00 C ATOM 1963 CD PRO A 120 0.425 -18.248 5.962 1.00 0.00 C ATOM 0 HA PRO A 120 2.884 -16.941 7.550 1.00 0.00 H new ATOM 0 HB2 PRO A 120 1.998 -19.231 8.733 1.00 0.00 H new ATOM 0 HB3 PRO A 120 1.011 -17.783 8.720 1.00 0.00 H new ATOM 0 HG2 PRO A 120 0.842 -20.197 6.849 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -0.473 -19.337 7.625 1.00 0.00 H new ATOM 0 HD2 PRO A 120 0.192 -18.781 5.040 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -0.359 -17.504 6.106 1.00 0.00 H new ATOM 1971 N GLY A 121 4.767 -18.625 7.565 1.00 0.00 N ATOM 1972 CA GLY A 121 5.980 -19.405 7.347 1.00 0.00 C ATOM 1973 C GLY A 121 6.798 -18.816 6.199 1.00 0.00 C ATOM 1974 O GLY A 121 7.986 -18.536 6.359 1.00 0.00 O ATOM 0 H GLY A 121 4.825 -17.980 8.353 1.00 0.00 H new ATOM 0 HA2 GLY A 121 6.579 -19.419 8.258 1.00 0.00 H new ATOM 0 HA3 GLY A 121 5.719 -20.439 7.122 1.00 0.00 H new ATOM 1978 N ASP A 122 6.182 -18.657 5.024 1.00 0.00 N ATOM 1979 CA ASP A 122 6.848 -17.993 3.919 1.00 0.00 C ATOM 1980 C ASP A 122 7.100 -16.534 4.290 1.00 0.00 C ATOM 1981 O ASP A 122 8.167 -15.986 3.994 1.00 0.00 O ATOM 1982 CB ASP A 122 6.054 -18.143 2.615 1.00 0.00 C ATOM 1983 CG ASP A 122 6.734 -17.399 1.470 1.00 0.00 C ATOM 1984 OD1 ASP A 122 7.776 -17.910 1.003 1.00 0.00 O ATOM 1985 OD2 ASP A 122 6.199 -16.340 1.076 1.00 0.00 O ATOM 0 H ASP A 122 5.235 -18.977 4.822 1.00 0.00 H new ATOM 0 HA ASP A 122 7.811 -18.468 3.735 1.00 0.00 H new ATOM 0 HB2 ASP A 122 5.960 -19.199 2.362 1.00 0.00 H new ATOM 0 HB3 ASP A 122 5.044 -17.758 2.754 1.00 0.00 H new ATOM 1990 N PHE A 123 6.119 -15.877 4.917 1.00 0.00 N ATOM 1991 CA PHE A 123 6.342 -14.538 5.407 1.00 0.00 C ATOM 1992 C PHE A 123 7.021 -14.632 6.776 1.00 0.00 C ATOM 1993 O PHE A 123 6.431 -14.309 7.809 1.00 0.00 O ATOM 1994 CB PHE A 123 5.036 -13.731 5.401 1.00 0.00 C ATOM 1995 CG PHE A 123 5.225 -12.248 5.650 1.00 0.00 C ATOM 1996 CD1 PHE A 123 6.064 -11.496 4.810 1.00 0.00 C ATOM 1997 CD2 PHE A 123 4.514 -11.605 6.676 1.00 0.00 C ATOM 1998 CE1 PHE A 123 6.146 -10.104 4.963 1.00 0.00 C ATOM 1999 CE2 PHE A 123 4.598 -10.215 6.831 1.00 0.00 C ATOM 2000 CZ PHE A 123 5.390 -9.457 5.954 1.00 0.00 C ATOM 0 H PHE A 123 5.186 -16.251 5.089 1.00 0.00 H new ATOM 0 HA PHE A 123 7.013 -13.985 4.750 1.00 0.00 H new ATOM 0 HB2 PHE A 123 4.542 -13.867 4.439 1.00 0.00 H new ATOM 0 HB3 PHE A 123 4.368 -14.134 6.162 1.00 0.00 H new ATOM 0 HD1 PHE A 123 6.646 -11.990 4.046 1.00 0.00 H new ATOM 0 HD2 PHE A 123 3.899 -12.185 7.349 1.00 0.00 H new ATOM 0 HE1 PHE A 123 6.792 -9.528 4.317 1.00 0.00 H new ATOM 0 HE2 PHE A 123 4.053 -9.727 7.625 1.00 0.00 H new ATOM 0 HZ PHE A 123 5.418 -8.381 6.041 1.00 0.00 H new ATOM 2010 N GLY A 124 8.242 -15.172 6.784 1.00 0.00 N ATOM 2011 CA GLY A 124 9.018 -15.343 7.997 1.00 0.00 C ATOM 2012 C GLY A 124 9.572 -14.006 8.480 1.00 0.00 C ATOM 2013 O GLY A 124 9.683 -13.062 7.698 1.00 0.00 O ATOM 0 H GLY A 124 8.715 -15.501 5.942 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.394 -15.785 8.774 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.839 -16.037 7.814 1.00 0.00 H new ATOM 2017 N ALA A 125 9.896 -13.919 9.777 1.00 0.00 N ATOM 2018 CA ALA A 125 10.396 -12.722 10.453 1.00 0.00 C ATOM 2019 C ALA A 125 11.382 -11.920 9.596 1.00 0.00 C ATOM 2020 O ALA A 125 11.238 -10.711 9.441 1.00 0.00 O ATOM 2021 CB ALA A 125 11.038 -13.121 11.784 1.00 0.00 C ATOM 0 H ALA A 125 9.812 -14.716 10.407 1.00 0.00 H new ATOM 0 HA ALA A 125 9.545 -12.065 10.632 1.00 0.00 H new ATOM 0 HB1 ALA A 125 11.411 -12.230 12.289 1.00 0.00 H new ATOM 0 HB2 ALA A 125 10.295 -13.611 12.414 1.00 0.00 H new ATOM 0 HB3 ALA A 125 11.865 -13.806 11.598 1.00 0.00 H new ATOM 2027 N ASP A 126 12.339 -12.609 8.971 1.00 0.00 N ATOM 2028 CA ASP A 126 13.343 -11.996 8.110 1.00 0.00 C ATOM 2029 C ASP A 126 12.678 -11.244 6.951 1.00 0.00 C ATOM 2030 O ASP A 126 13.021 -10.097 6.661 1.00 0.00 O ATOM 2031 CB ASP A 126 14.324 -13.065 7.597 1.00 0.00 C ATOM 2032 CG ASP A 126 13.685 -14.123 6.695 1.00 0.00 C ATOM 2033 OD1 ASP A 126 12.591 -14.609 7.060 1.00 0.00 O ATOM 2034 OD2 ASP A 126 14.304 -14.423 5.654 1.00 0.00 O ATOM 0 H ASP A 126 12.437 -13.621 9.052 1.00 0.00 H new ATOM 0 HA ASP A 126 13.908 -11.268 8.691 1.00 0.00 H new ATOM 0 HB2 ASP A 126 15.126 -12.572 7.048 1.00 0.00 H new ATOM 0 HB3 ASP A 126 14.782 -13.562 8.452 1.00 0.00 H new ATOM 2039 N ALA A 127 11.712 -11.893 6.296 1.00 0.00 N ATOM 2040 CA ALA A 127 10.963 -11.307 5.200 1.00 0.00 C ATOM 2041 C ALA A 127 10.162 -10.125 5.736 1.00 0.00 C ATOM 2042 O ALA A 127 10.228 -9.043 5.162 1.00 0.00 O ATOM 2043 CB ALA A 127 10.063 -12.352 4.536 1.00 0.00 C ATOM 0 H ALA A 127 11.431 -12.848 6.519 1.00 0.00 H new ATOM 0 HA ALA A 127 11.647 -10.950 4.430 1.00 0.00 H new ATOM 0 HB1 ALA A 127 9.511 -11.890 3.717 1.00 0.00 H new ATOM 0 HB2 ALA A 127 10.676 -13.165 4.147 1.00 0.00 H new ATOM 0 HB3 ALA A 127 9.360 -12.746 5.270 1.00 0.00 H new ATOM 2049 N GLN A 128 9.463 -10.310 6.864 1.00 0.00 N ATOM 2050 CA GLN A 128 8.700 -9.233 7.489 1.00 0.00 C ATOM 2051 C GLN A 128 9.584 -8.001 7.692 1.00 0.00 C ATOM 2052 O GLN A 128 9.231 -6.910 7.257 1.00 0.00 O ATOM 2053 CB GLN A 128 8.020 -9.662 8.801 1.00 0.00 C ATOM 2054 CG GLN A 128 7.301 -11.015 8.688 1.00 0.00 C ATOM 2055 CD GLN A 128 6.116 -11.185 9.639 1.00 0.00 C ATOM 2056 OE1 GLN A 128 5.727 -10.270 10.358 1.00 0.00 O ATOM 2057 NE2 GLN A 128 5.518 -12.372 9.650 1.00 0.00 N ATOM 0 H GLN A 128 9.413 -11.200 7.360 1.00 0.00 H new ATOM 0 HA GLN A 128 7.892 -8.974 6.805 1.00 0.00 H new ATOM 0 HB2 GLN A 128 8.769 -9.719 9.591 1.00 0.00 H new ATOM 0 HB3 GLN A 128 7.301 -8.898 9.098 1.00 0.00 H new ATOM 0 HG2 GLN A 128 6.950 -11.141 7.664 1.00 0.00 H new ATOM 0 HG3 GLN A 128 8.020 -11.811 8.878 1.00 0.00 H new ATOM 0 HE21 GLN A 128 5.857 -13.119 9.044 1.00 0.00 H new ATOM 0 HE22 GLN A 128 4.720 -12.535 10.264 1.00 0.00 H new ATOM 2066 N GLY A 129 10.750 -8.176 8.314 1.00 0.00 N ATOM 2067 CA GLY A 129 11.699 -7.094 8.518 1.00 0.00 C ATOM 2068 C GLY A 129 12.118 -6.444 7.199 1.00 0.00 C ATOM 2069 O GLY A 129 12.107 -5.220 7.071 1.00 0.00 O ATOM 0 H GLY A 129 11.058 -9.073 8.689 1.00 0.00 H new ATOM 0 HA2 GLY A 129 11.255 -6.340 9.169 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.582 -7.477 9.030 1.00 0.00 H new ATOM 2073 N ALA A 130 12.497 -7.260 6.213 1.00 0.00 N ATOM 2074 CA ALA A 130 12.925 -6.763 4.917 1.00 0.00 C ATOM 2075 C ALA A 130 11.827 -5.922 4.253 1.00 0.00 C ATOM 2076 O ALA A 130 12.074 -4.793 3.816 1.00 0.00 O ATOM 2077 CB ALA A 130 13.358 -7.944 4.046 1.00 0.00 C ATOM 0 H ALA A 130 12.514 -8.276 6.296 1.00 0.00 H new ATOM 0 HA ALA A 130 13.779 -6.098 5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 130 13.681 -7.578 3.071 1.00 0.00 H new ATOM 0 HB2 ALA A 130 14.183 -8.468 4.528 1.00 0.00 H new ATOM 0 HB3 ALA A 130 12.519 -8.628 3.917 1.00 0.00 H new ATOM 2083 N MET A 131 10.625 -6.483 4.100 1.00 0.00 N ATOM 2084 CA MET A 131 9.538 -5.746 3.502 1.00 0.00 C ATOM 2085 C MET A 131 9.130 -4.552 4.352 1.00 0.00 C ATOM 2086 O MET A 131 8.817 -3.514 3.785 1.00 0.00 O ATOM 2087 CB MET A 131 8.380 -6.678 3.150 1.00 0.00 C ATOM 2088 CG MET A 131 7.553 -6.063 2.014 1.00 0.00 C ATOM 2089 SD MET A 131 6.227 -7.103 1.372 1.00 0.00 S ATOM 2090 CE MET A 131 7.162 -8.585 0.938 1.00 0.00 C ATOM 0 H MET A 131 10.393 -7.435 4.382 1.00 0.00 H new ATOM 0 HA MET A 131 9.884 -5.320 2.560 1.00 0.00 H new ATOM 0 HB2 MET A 131 8.763 -7.653 2.848 1.00 0.00 H new ATOM 0 HB3 MET A 131 7.751 -6.840 4.025 1.00 0.00 H new ATOM 0 HG2 MET A 131 7.119 -5.128 2.368 1.00 0.00 H new ATOM 0 HG3 MET A 131 8.225 -5.812 1.193 1.00 0.00 H new ATOM 0 HE1 MET A 131 6.571 -9.203 0.262 1.00 0.00 H new ATOM 0 HE2 MET A 131 8.092 -8.298 0.447 1.00 0.00 H new ATOM 0 HE3 MET A 131 7.388 -9.150 1.842 1.00 0.00 H new ATOM 2100 N ASN A 132 9.137 -4.662 5.681 1.00 0.00 N ATOM 2101 CA ASN A 132 8.820 -3.531 6.548 1.00 0.00 C ATOM 2102 C ASN A 132 9.790 -2.390 6.234 1.00 0.00 C ATOM 2103 O ASN A 132 9.380 -1.244 6.047 1.00 0.00 O ATOM 2104 CB ASN A 132 8.879 -3.922 8.030 1.00 0.00 C ATOM 2105 CG ASN A 132 8.629 -2.695 8.900 1.00 0.00 C ATOM 2106 OD1 ASN A 132 9.565 -2.029 9.330 1.00 0.00 O ATOM 2107 ND2 ASN A 132 7.364 -2.377 9.162 1.00 0.00 N ATOM 0 H ASN A 132 9.359 -5.524 6.179 1.00 0.00 H new ATOM 0 HA ASN A 132 7.798 -3.205 6.356 1.00 0.00 H new ATOM 0 HB2 ASN A 132 8.133 -4.688 8.243 1.00 0.00 H new ATOM 0 HB3 ASN A 132 9.853 -4.352 8.263 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.152 -1.560 9.735 1.00 0.00 H new ATOM 0 HD22 ASN A 132 6.607 -2.950 8.790 1.00 0.00 H new ATOM 2114 N LYS A 133 11.085 -2.703 6.132 1.00 0.00 N ATOM 2115 CA LYS A 133 12.076 -1.700 5.782 1.00 0.00 C ATOM 2116 C LYS A 133 11.772 -1.127 4.391 1.00 0.00 C ATOM 2117 O LYS A 133 11.758 0.090 4.218 1.00 0.00 O ATOM 2118 CB LYS A 133 13.485 -2.289 5.882 1.00 0.00 C ATOM 2119 CG LYS A 133 13.890 -2.596 7.333 1.00 0.00 C ATOM 2120 CD LYS A 133 14.757 -1.510 7.994 1.00 0.00 C ATOM 2121 CE LYS A 133 14.032 -0.184 8.264 1.00 0.00 C ATOM 2122 NZ LYS A 133 14.034 0.720 7.099 1.00 0.00 N ATOM 0 H LYS A 133 11.463 -3.638 6.287 1.00 0.00 H new ATOM 0 HA LYS A 133 12.028 -0.872 6.490 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.536 -3.204 5.292 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.200 -1.590 5.448 1.00 0.00 H new ATOM 0 HG2 LYS A 133 12.987 -2.735 7.928 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.434 -3.540 7.354 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.142 -1.896 8.938 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.618 -1.314 7.355 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.002 -0.392 8.554 1.00 0.00 H new ATOM 0 HE3 LYS A 133 14.506 0.318 9.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 14.496 1.616 7.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 14.552 0.275 6.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 13.055 0.908 6.804 1.00 0.00 H new ATOM 2136 N ALA A 134 11.463 -1.971 3.404 1.00 0.00 N ATOM 2137 CA ALA A 134 11.129 -1.489 2.064 1.00 0.00 C ATOM 2138 C ALA A 134 9.899 -0.562 2.082 1.00 0.00 C ATOM 2139 O ALA A 134 9.873 0.487 1.436 1.00 0.00 O ATOM 2140 CB ALA A 134 10.928 -2.674 1.120 1.00 0.00 C ATOM 0 H ALA A 134 11.437 -2.985 3.507 1.00 0.00 H new ATOM 0 HA ALA A 134 11.963 -0.891 1.696 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.680 -2.308 0.124 1.00 0.00 H new ATOM 0 HB2 ALA A 134 11.845 -3.261 1.072 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.116 -3.300 1.489 1.00 0.00 H new ATOM 2146 N LEU A 135 8.862 -0.947 2.826 1.00 0.00 N ATOM 2147 CA LEU A 135 7.664 -0.145 3.012 1.00 0.00 C ATOM 2148 C LEU A 135 8.066 1.175 3.668 1.00 0.00 C ATOM 2149 O LEU A 135 7.610 2.239 3.258 1.00 0.00 O ATOM 2150 CB LEU A 135 6.620 -0.910 3.847 1.00 0.00 C ATOM 2151 CG LEU A 135 5.992 -2.080 3.062 1.00 0.00 C ATOM 2152 CD1 LEU A 135 5.431 -3.158 4.000 1.00 0.00 C ATOM 2153 CD2 LEU A 135 4.860 -1.583 2.157 1.00 0.00 C ATOM 0 H LEU A 135 8.835 -1.838 3.321 1.00 0.00 H new ATOM 0 HA LEU A 135 7.197 0.065 2.050 1.00 0.00 H new ATOM 0 HB2 LEU A 135 7.091 -1.293 4.752 1.00 0.00 H new ATOM 0 HB3 LEU A 135 5.835 -0.223 4.162 1.00 0.00 H new ATOM 0 HG LEU A 135 6.788 -2.515 2.458 1.00 0.00 H new ATOM 0 HD11 LEU A 135 4.997 -3.965 3.409 1.00 0.00 H new ATOM 0 HD12 LEU A 135 6.235 -3.554 4.621 1.00 0.00 H new ATOM 0 HD13 LEU A 135 4.662 -2.721 4.637 1.00 0.00 H new ATOM 0 HD21 LEU A 135 4.432 -2.425 1.613 1.00 0.00 H new ATOM 0 HD22 LEU A 135 4.087 -1.114 2.766 1.00 0.00 H new ATOM 0 HD23 LEU A 135 5.254 -0.856 1.447 1.00 0.00 H new ATOM 2165 N GLU A 136 9.004 1.124 4.619 1.00 0.00 N ATOM 2166 CA GLU A 136 9.493 2.308 5.301 1.00 0.00 C ATOM 2167 C GLU A 136 10.200 3.210 4.289 1.00 0.00 C ATOM 2168 O GLU A 136 9.973 4.413 4.303 1.00 0.00 O ATOM 2169 CB GLU A 136 10.364 1.953 6.513 1.00 0.00 C ATOM 2170 CG GLU A 136 10.817 3.231 7.234 1.00 0.00 C ATOM 2171 CD GLU A 136 11.238 2.937 8.665 1.00 0.00 C ATOM 2172 OE1 GLU A 136 12.413 2.549 8.840 1.00 0.00 O ATOM 2173 OE2 GLU A 136 10.369 3.095 9.551 1.00 0.00 O ATOM 0 H GLU A 136 9.440 0.257 4.932 1.00 0.00 H new ATOM 0 HA GLU A 136 8.652 2.863 5.716 1.00 0.00 H new ATOM 0 HB2 GLU A 136 9.803 1.319 7.200 1.00 0.00 H new ATOM 0 HB3 GLU A 136 11.234 1.381 6.190 1.00 0.00 H new ATOM 0 HG2 GLU A 136 11.649 3.681 6.693 1.00 0.00 H new ATOM 0 HG3 GLU A 136 10.006 3.959 7.233 1.00 0.00 H new ATOM 2180 N LEU A 137 11.023 2.656 3.386 1.00 0.00 N ATOM 2181 CA LEU A 137 11.651 3.460 2.339 1.00 0.00 C ATOM 2182 C LEU A 137 10.551 4.147 1.527 1.00 0.00 C ATOM 2183 O LEU A 137 10.577 5.364 1.354 1.00 0.00 O ATOM 2184 CB LEU A 137 12.531 2.632 1.382 1.00 0.00 C ATOM 2185 CG LEU A 137 13.799 2.011 1.989 1.00 0.00 C ATOM 2186 CD1 LEU A 137 14.541 1.255 0.877 1.00 0.00 C ATOM 2187 CD2 LEU A 137 14.734 3.077 2.575 1.00 0.00 C ATOM 0 H LEU A 137 11.264 1.665 3.363 1.00 0.00 H new ATOM 0 HA LEU A 137 12.304 4.181 2.831 1.00 0.00 H new ATOM 0 HB2 LEU A 137 11.922 1.829 0.966 1.00 0.00 H new ATOM 0 HB3 LEU A 137 12.827 3.271 0.550 1.00 0.00 H new ATOM 0 HG LEU A 137 13.505 1.344 2.799 1.00 0.00 H new ATOM 0 HD11 LEU A 137 15.446 0.805 1.285 1.00 0.00 H new ATOM 0 HD12 LEU A 137 13.896 0.473 0.476 1.00 0.00 H new ATOM 0 HD13 LEU A 137 14.808 1.950 0.081 1.00 0.00 H new ATOM 0 HD21 LEU A 137 15.618 2.595 2.994 1.00 0.00 H new ATOM 0 HD22 LEU A 137 15.036 3.768 1.788 1.00 0.00 H new ATOM 0 HD23 LEU A 137 14.214 3.626 3.360 1.00 0.00 H new ATOM 2199 N PHE A 138 9.523 3.389 1.117 1.00 0.00 N ATOM 2200 CA PHE A 138 8.445 3.945 0.308 1.00 0.00 C ATOM 2201 C PHE A 138 7.816 5.132 1.057 1.00 0.00 C ATOM 2202 O PHE A 138 7.794 6.260 0.566 1.00 0.00 O ATOM 2203 CB PHE A 138 7.449 2.827 -0.038 1.00 0.00 C ATOM 2204 CG PHE A 138 6.066 3.293 -0.436 1.00 0.00 C ATOM 2205 CD1 PHE A 138 5.831 3.798 -1.725 1.00 0.00 C ATOM 2206 CD2 PHE A 138 5.068 3.401 0.548 1.00 0.00 C ATOM 2207 CE1 PHE A 138 4.558 4.291 -2.071 1.00 0.00 C ATOM 2208 CE2 PHE A 138 3.854 4.046 0.246 1.00 0.00 C ATOM 2209 CZ PHE A 138 3.583 4.465 -1.072 1.00 0.00 C ATOM 0 H PHE A 138 9.422 2.397 1.334 1.00 0.00 H new ATOM 0 HA PHE A 138 8.814 4.336 -0.640 1.00 0.00 H new ATOM 0 HB2 PHE A 138 7.863 2.234 -0.853 1.00 0.00 H new ATOM 0 HB3 PHE A 138 7.358 2.165 0.823 1.00 0.00 H new ATOM 0 HD1 PHE A 138 6.629 3.808 -2.453 1.00 0.00 H new ATOM 0 HD2 PHE A 138 5.232 2.990 1.533 1.00 0.00 H new ATOM 0 HE1 PHE A 138 4.331 4.534 -3.099 1.00 0.00 H new ATOM 0 HE2 PHE A 138 3.128 4.220 1.026 1.00 0.00 H new ATOM 0 HZ PHE A 138 2.632 4.917 -1.314 1.00 0.00 H new ATOM 2219 N ARG A 139 7.395 4.888 2.299 1.00 0.00 N ATOM 2220 CA ARG A 139 6.793 5.880 3.179 1.00 0.00 C ATOM 2221 C ARG A 139 7.707 7.103 3.354 1.00 0.00 C ATOM 2222 O ARG A 139 7.264 8.247 3.295 1.00 0.00 O ATOM 2223 CB ARG A 139 6.499 5.176 4.510 1.00 0.00 C ATOM 2224 CG ARG A 139 6.036 6.138 5.602 1.00 0.00 C ATOM 2225 CD ARG A 139 5.350 5.384 6.748 1.00 0.00 C ATOM 2226 NE ARG A 139 6.136 4.237 7.229 1.00 0.00 N ATOM 2227 CZ ARG A 139 7.167 4.294 8.085 1.00 0.00 C ATOM 2228 NH1 ARG A 139 7.637 5.470 8.509 1.00 0.00 N ATOM 2229 NH2 ARG A 139 7.726 3.158 8.515 1.00 0.00 N ATOM 0 H ARG A 139 7.468 3.966 2.729 1.00 0.00 H new ATOM 0 HA ARG A 139 5.869 6.270 2.752 1.00 0.00 H new ATOM 0 HB2 ARG A 139 5.732 4.417 4.352 1.00 0.00 H new ATOM 0 HB3 ARG A 139 7.396 4.657 4.847 1.00 0.00 H new ATOM 0 HG2 ARG A 139 6.891 6.693 5.988 1.00 0.00 H new ATOM 0 HG3 ARG A 139 5.346 6.868 5.179 1.00 0.00 H new ATOM 0 HD2 ARG A 139 5.176 6.071 7.576 1.00 0.00 H new ATOM 0 HD3 ARG A 139 4.373 5.034 6.413 1.00 0.00 H new ATOM 0 HE ARG A 139 5.873 3.315 6.880 1.00 0.00 H new ATOM 0 HH11 ARG A 139 7.211 6.337 8.182 1.00 0.00 H new ATOM 0 HH12 ARG A 139 8.422 5.501 9.160 1.00 0.00 H new ATOM 0 HH21 ARG A 139 7.368 2.259 8.192 1.00 0.00 H new ATOM 0 HH22 ARG A 139 8.511 3.190 9.166 1.00 0.00 H new ATOM 2243 N LYS A 140 9.003 6.872 3.557 1.00 0.00 N ATOM 2244 CA LYS A 140 9.982 7.932 3.707 1.00 0.00 C ATOM 2245 C LYS A 140 10.064 8.751 2.419 1.00 0.00 C ATOM 2246 O LYS A 140 10.242 9.966 2.480 1.00 0.00 O ATOM 2247 CB LYS A 140 11.337 7.328 4.094 1.00 0.00 C ATOM 2248 CG LYS A 140 12.413 8.403 4.305 1.00 0.00 C ATOM 2249 CD LYS A 140 13.706 7.832 4.906 1.00 0.00 C ATOM 2250 CE LYS A 140 14.294 6.669 4.095 1.00 0.00 C ATOM 2251 NZ LYS A 140 14.482 7.021 2.677 1.00 0.00 N ATOM 0 H LYS A 140 9.400 5.935 3.622 1.00 0.00 H new ATOM 0 HA LYS A 140 9.680 8.610 4.505 1.00 0.00 H new ATOM 0 HB2 LYS A 140 11.225 6.744 5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 140 11.662 6.639 3.314 1.00 0.00 H new ATOM 0 HG2 LYS A 140 12.639 8.878 3.350 1.00 0.00 H new ATOM 0 HG3 LYS A 140 12.022 9.179 4.963 1.00 0.00 H new ATOM 0 HD2 LYS A 140 14.448 8.628 4.976 1.00 0.00 H new ATOM 0 HD3 LYS A 140 13.506 7.492 5.922 1.00 0.00 H new ATOM 0 HE2 LYS A 140 15.252 6.375 4.525 1.00 0.00 H new ATOM 0 HE3 LYS A 140 13.633 5.805 4.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 14.974 6.245 2.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 13.555 7.178 2.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 15.050 7.889 2.607 1.00 0.00 H new ATOM 2265 N ASP A 141 9.925 8.111 1.253 1.00 0.00 N ATOM 2266 CA ASP A 141 9.973 8.828 -0.010 1.00 0.00 C ATOM 2267 C ASP A 141 8.772 9.769 -0.066 1.00 0.00 C ATOM 2268 O ASP A 141 8.908 10.952 -0.370 1.00 0.00 O ATOM 2269 CB ASP A 141 10.003 7.846 -1.194 1.00 0.00 C ATOM 2270 CG ASP A 141 10.683 8.436 -2.428 1.00 0.00 C ATOM 2271 OD1 ASP A 141 10.684 9.678 -2.564 1.00 0.00 O ATOM 2272 OD2 ASP A 141 11.196 7.626 -3.228 1.00 0.00 O ATOM 0 H ASP A 141 9.780 7.105 1.165 1.00 0.00 H new ATOM 0 HA ASP A 141 10.887 9.417 -0.082 1.00 0.00 H new ATOM 0 HB2 ASP A 141 10.526 6.938 -0.895 1.00 0.00 H new ATOM 0 HB3 ASP A 141 8.983 7.558 -1.448 1.00 0.00 H new ATOM 2277 N ILE A 142 7.587 9.237 0.252 1.00 0.00 N ATOM 2278 CA ILE A 142 6.361 10.027 0.301 1.00 0.00 C ATOM 2279 C ILE A 142 6.570 11.221 1.244 1.00 0.00 C ATOM 2280 O ILE A 142 6.284 12.356 0.880 1.00 0.00 O ATOM 2281 CB ILE A 142 5.152 9.168 0.727 1.00 0.00 C ATOM 2282 CG1 ILE A 142 4.963 7.909 -0.125 1.00 0.00 C ATOM 2283 CG2 ILE A 142 3.869 9.994 0.733 1.00 0.00 C ATOM 2284 CD1 ILE A 142 4.356 8.149 -1.508 1.00 0.00 C ATOM 0 H ILE A 142 7.455 8.252 0.481 1.00 0.00 H new ATOM 0 HA ILE A 142 6.136 10.401 -0.698 1.00 0.00 H new ATOM 0 HB ILE A 142 5.373 8.830 1.740 1.00 0.00 H new ATOM 0 HG12 ILE A 142 5.931 7.424 -0.249 1.00 0.00 H new ATOM 0 HG13 ILE A 142 4.325 7.213 0.419 1.00 0.00 H new ATOM 0 HG21 ILE A 142 3.032 9.365 1.037 1.00 0.00 H new ATOM 0 HG22 ILE A 142 3.973 10.822 1.434 1.00 0.00 H new ATOM 0 HG23 ILE A 142 3.684 10.386 -0.267 1.00 0.00 H new ATOM 0 HD11 ILE A 142 4.262 7.199 -2.034 1.00 0.00 H new ATOM 0 HD12 ILE A 142 3.371 8.603 -1.399 1.00 0.00 H new ATOM 0 HD13 ILE A 142 5.002 8.817 -2.078 1.00 0.00 H new ATOM 2296 N ALA A 143 7.094 10.970 2.444 1.00 0.00 N ATOM 2297 CA ALA A 143 7.359 11.986 3.459 1.00 0.00 C ATOM 2298 C ALA A 143 8.303 13.066 2.935 1.00 0.00 C ATOM 2299 O ALA A 143 8.067 14.262 3.119 1.00 0.00 O ATOM 2300 CB ALA A 143 7.927 11.321 4.713 1.00 0.00 C ATOM 0 H ALA A 143 7.352 10.030 2.743 1.00 0.00 H new ATOM 0 HA ALA A 143 6.420 12.478 3.712 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.124 12.080 5.470 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.207 10.601 5.101 1.00 0.00 H new ATOM 0 HB3 ALA A 143 8.855 10.807 4.464 1.00 0.00 H new ATOM 2306 N ALA A 144 9.395 12.647 2.301 1.00 0.00 N ATOM 2307 CA ALA A 144 10.328 13.576 1.699 1.00 0.00 C ATOM 2308 C ALA A 144 9.607 14.418 0.652 1.00 0.00 C ATOM 2309 O ALA A 144 9.802 15.632 0.589 1.00 0.00 O ATOM 2310 CB ALA A 144 11.506 12.805 1.102 1.00 0.00 C ATOM 0 H ALA A 144 9.650 11.665 2.194 1.00 0.00 H new ATOM 0 HA ALA A 144 10.724 14.254 2.455 1.00 0.00 H new ATOM 0 HB1 ALA A 144 12.207 13.506 0.649 1.00 0.00 H new ATOM 0 HB2 ALA A 144 12.010 12.244 1.889 1.00 0.00 H new ATOM 0 HB3 ALA A 144 11.141 12.115 0.342 1.00 0.00 H new ATOM 2316 N LYS A 145 8.783 13.781 -0.179 1.00 0.00 N ATOM 2317 CA LYS A 145 8.029 14.519 -1.176 1.00 0.00 C ATOM 2318 C LYS A 145 7.054 15.494 -0.518 1.00 0.00 C ATOM 2319 O LYS A 145 6.987 16.639 -0.953 1.00 0.00 O ATOM 2320 CB LYS A 145 7.367 13.582 -2.184 1.00 0.00 C ATOM 2321 CG LYS A 145 8.242 13.370 -3.427 1.00 0.00 C ATOM 2322 CD LYS A 145 9.631 12.825 -3.084 1.00 0.00 C ATOM 2323 CE LYS A 145 10.470 12.609 -4.345 1.00 0.00 C ATOM 2324 NZ LYS A 145 11.760 11.988 -4.001 1.00 0.00 N ATOM 0 H LYS A 145 8.626 12.773 -0.179 1.00 0.00 H new ATOM 0 HA LYS A 145 8.725 15.129 -1.752 1.00 0.00 H new ATOM 0 HB2 LYS A 145 7.169 12.620 -1.711 1.00 0.00 H new ATOM 0 HB3 LYS A 145 6.403 13.994 -2.484 1.00 0.00 H new ATOM 0 HG2 LYS A 145 7.742 12.678 -4.105 1.00 0.00 H new ATOM 0 HG3 LYS A 145 8.348 14.316 -3.958 1.00 0.00 H new ATOM 0 HD2 LYS A 145 10.143 13.520 -2.419 1.00 0.00 H new ATOM 0 HD3 LYS A 145 9.531 11.883 -2.545 1.00 0.00 H new ATOM 0 HE2 LYS A 145 9.928 11.974 -5.046 1.00 0.00 H new ATOM 0 HE3 LYS A 145 10.640 13.563 -4.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 12.312 11.832 -4.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 12.288 12.616 -3.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 11.592 11.077 -3.529 1.00 0.00 H new ATOM 2338 N TYR A 146 6.368 15.095 0.556 1.00 0.00 N ATOM 2339 CA TYR A 146 5.453 15.975 1.275 1.00 0.00 C ATOM 2340 C TYR A 146 6.223 17.221 1.722 1.00 0.00 C ATOM 2341 O TYR A 146 5.789 18.352 1.500 1.00 0.00 O ATOM 2342 CB TYR A 146 4.859 15.257 2.499 1.00 0.00 C ATOM 2343 CG TYR A 146 3.726 14.268 2.267 1.00 0.00 C ATOM 2344 CD1 TYR A 146 3.461 13.715 0.994 1.00 0.00 C ATOM 2345 CD2 TYR A 146 2.866 13.947 3.342 1.00 0.00 C ATOM 2346 CE1 TYR A 146 2.369 12.845 0.815 1.00 0.00 C ATOM 2347 CE2 TYR A 146 1.791 13.075 3.149 1.00 0.00 C ATOM 2348 CZ TYR A 146 1.526 12.532 1.887 1.00 0.00 C ATOM 2349 OH TYR A 146 0.523 11.624 1.732 1.00 0.00 O ATOM 0 H TYR A 146 6.433 14.156 0.948 1.00 0.00 H new ATOM 0 HA TYR A 146 4.631 16.258 0.618 1.00 0.00 H new ATOM 0 HB2 TYR A 146 5.668 14.726 3.000 1.00 0.00 H new ATOM 0 HB3 TYR A 146 4.501 16.019 3.192 1.00 0.00 H new ATOM 0 HD1 TYR A 146 4.098 13.960 0.157 1.00 0.00 H new ATOM 0 HD2 TYR A 146 3.040 14.378 4.317 1.00 0.00 H new ATOM 0 HE1 TYR A 146 2.180 12.416 -0.158 1.00 0.00 H new ATOM 0 HE2 TYR A 146 1.157 12.817 3.984 1.00 0.00 H new ATOM 0 HH TYR A 146 -0.047 11.627 2.529 1.00 0.00 H new ATOM 2359 N LYS A 147 7.353 17.021 2.400 1.00 0.00 N ATOM 2360 CA LYS A 147 8.163 18.142 2.832 1.00 0.00 C ATOM 2361 C LYS A 147 8.614 19.018 1.660 1.00 0.00 C ATOM 2362 O LYS A 147 8.476 20.241 1.735 1.00 0.00 O ATOM 2363 CB LYS A 147 9.314 17.648 3.710 1.00 0.00 C ATOM 2364 CG LYS A 147 8.761 17.071 5.021 1.00 0.00 C ATOM 2365 CD LYS A 147 9.869 16.774 6.037 1.00 0.00 C ATOM 2366 CE LYS A 147 10.859 15.703 5.566 1.00 0.00 C ATOM 2367 NZ LYS A 147 10.182 14.431 5.270 1.00 0.00 N ATOM 0 H LYS A 147 7.718 16.104 2.656 1.00 0.00 H new ATOM 0 HA LYS A 147 7.550 18.801 3.447 1.00 0.00 H new ATOM 0 HB2 LYS A 147 9.886 16.886 3.180 1.00 0.00 H new ATOM 0 HB3 LYS A 147 9.998 18.469 3.924 1.00 0.00 H new ATOM 0 HG2 LYS A 147 8.052 17.776 5.455 1.00 0.00 H new ATOM 0 HG3 LYS A 147 8.210 16.155 4.809 1.00 0.00 H new ATOM 0 HD2 LYS A 147 10.414 17.694 6.248 1.00 0.00 H new ATOM 0 HD3 LYS A 147 9.415 16.451 6.974 1.00 0.00 H new ATOM 0 HE2 LYS A 147 11.379 16.055 4.675 1.00 0.00 H new ATOM 0 HE3 LYS A 147 11.615 15.543 6.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 10.877 13.740 4.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 9.735 14.066 6.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 9.454 14.586 4.543 1.00 0.00 H new ATOM 2381 N GLU A 148 9.133 18.416 0.587 1.00 0.00 N ATOM 2382 CA GLU A 148 9.545 19.145 -0.607 1.00 0.00 C ATOM 2383 C GLU A 148 8.401 19.983 -1.185 1.00 0.00 C ATOM 2384 O GLU A 148 8.603 21.139 -1.549 1.00 0.00 O ATOM 2385 CB GLU A 148 10.064 18.158 -1.657 1.00 0.00 C ATOM 2386 CG GLU A 148 11.411 17.523 -1.281 1.00 0.00 C ATOM 2387 CD GLU A 148 11.670 16.241 -2.074 1.00 0.00 C ATOM 2388 OE1 GLU A 148 11.312 16.228 -3.272 1.00 0.00 O ATOM 2389 OE2 GLU A 148 12.210 15.289 -1.468 1.00 0.00 O ATOM 0 H GLU A 148 9.278 17.408 0.525 1.00 0.00 H new ATOM 0 HA GLU A 148 10.342 19.834 -0.325 1.00 0.00 H new ATOM 0 HB2 GLU A 148 9.326 17.369 -1.800 1.00 0.00 H new ATOM 0 HB3 GLU A 148 10.168 18.675 -2.611 1.00 0.00 H new ATOM 0 HG2 GLU A 148 12.214 18.236 -1.468 1.00 0.00 H new ATOM 0 HG3 GLU A 148 11.424 17.300 -0.214 1.00 0.00 H new ATOM 2396 N LEU A 149 7.203 19.401 -1.279 1.00 0.00 N ATOM 2397 CA LEU A 149 6.016 20.079 -1.779 1.00 0.00 C ATOM 2398 C LEU A 149 5.541 21.196 -0.844 1.00 0.00 C ATOM 2399 O LEU A 149 4.647 21.949 -1.220 1.00 0.00 O ATOM 2400 CB LEU A 149 4.887 19.059 -2.017 1.00 0.00 C ATOM 2401 CG LEU A 149 5.199 18.068 -3.149 1.00 0.00 C ATOM 2402 CD1 LEU A 149 4.178 16.925 -3.116 1.00 0.00 C ATOM 2403 CD2 LEU A 149 5.147 18.748 -4.523 1.00 0.00 C ATOM 0 H LEU A 149 7.033 18.433 -1.005 1.00 0.00 H new ATOM 0 HA LEU A 149 6.285 20.551 -2.724 1.00 0.00 H new ATOM 0 HB2 LEU A 149 4.706 18.504 -1.096 1.00 0.00 H new ATOM 0 HB3 LEU A 149 3.967 19.593 -2.253 1.00 0.00 H new ATOM 0 HG LEU A 149 6.208 17.685 -2.995 1.00 0.00 H new ATOM 0 HD11 LEU A 149 4.396 16.219 -3.918 1.00 0.00 H new ATOM 0 HD12 LEU A 149 4.236 16.413 -2.156 1.00 0.00 H new ATOM 0 HD13 LEU A 149 3.175 17.329 -3.251 1.00 0.00 H new ATOM 0 HD21 LEU A 149 5.373 18.017 -5.299 1.00 0.00 H new ATOM 0 HD22 LEU A 149 4.151 19.158 -4.689 1.00 0.00 H new ATOM 0 HD23 LEU A 149 5.881 19.553 -4.558 1.00 0.00 H new ATOM 2415 N GLY A 150 6.092 21.301 0.370 1.00 0.00 N ATOM 2416 CA GLY A 150 5.719 22.342 1.318 1.00 0.00 C ATOM 2417 C GLY A 150 4.613 21.880 2.269 1.00 0.00 C ATOM 2418 O GLY A 150 3.909 22.706 2.842 1.00 0.00 O ATOM 0 H GLY A 150 6.809 20.664 0.718 1.00 0.00 H new ATOM 0 HA2 GLY A 150 6.595 22.637 1.896 1.00 0.00 H new ATOM 0 HA3 GLY A 150 5.384 23.225 0.774 1.00 0.00 H new ATOM 2422 N TYR A 151 4.465 20.567 2.462 1.00 0.00 N ATOM 2423 CA TYR A 151 3.481 19.955 3.340 1.00 0.00 C ATOM 2424 C TYR A 151 4.283 19.363 4.496 1.00 0.00 C ATOM 2425 O TYR A 151 4.640 18.188 4.485 1.00 0.00 O ATOM 2426 CB TYR A 151 2.653 18.889 2.593 1.00 0.00 C ATOM 2427 CG TYR A 151 1.747 19.402 1.483 1.00 0.00 C ATOM 2428 CD1 TYR A 151 2.294 20.034 0.351 1.00 0.00 C ATOM 2429 CD2 TYR A 151 0.359 19.171 1.538 1.00 0.00 C ATOM 2430 CE1 TYR A 151 1.456 20.511 -0.670 1.00 0.00 C ATOM 2431 CE2 TYR A 151 -0.477 19.618 0.499 1.00 0.00 C ATOM 2432 CZ TYR A 151 0.069 20.320 -0.591 1.00 0.00 C ATOM 2433 OH TYR A 151 -0.723 20.795 -1.594 1.00 0.00 O ATOM 0 H TYR A 151 5.053 19.880 1.990 1.00 0.00 H new ATOM 0 HA TYR A 151 2.750 20.677 3.703 1.00 0.00 H new ATOM 0 HB2 TYR A 151 3.340 18.159 2.165 1.00 0.00 H new ATOM 0 HB3 TYR A 151 2.038 18.360 3.321 1.00 0.00 H new ATOM 0 HD1 TYR A 151 3.364 20.153 0.267 1.00 0.00 H new ATOM 0 HD2 TYR A 151 -0.066 18.648 2.382 1.00 0.00 H new ATOM 0 HE1 TYR A 151 1.881 21.026 -1.519 1.00 0.00 H new ATOM 0 HE2 TYR A 151 -1.538 19.422 0.538 1.00 0.00 H new ATOM 0 HH TYR A 151 -0.223 20.788 -2.437 1.00 0.00 H new ATOM 2443 N GLN A 152 4.599 20.191 5.496 1.00 0.00 N ATOM 2444 CA GLN A 152 5.423 19.768 6.621 1.00 0.00 C ATOM 2445 C GLN A 152 4.618 18.882 7.576 1.00 0.00 C ATOM 2446 O GLN A 152 4.214 19.313 8.652 1.00 0.00 O ATOM 2447 CB GLN A 152 6.066 20.981 7.315 1.00 0.00 C ATOM 2448 CG GLN A 152 6.783 21.934 6.343 1.00 0.00 C ATOM 2449 CD GLN A 152 7.702 21.215 5.354 1.00 0.00 C ATOM 2450 OE1 GLN A 152 8.484 20.348 5.729 1.00 0.00 O ATOM 2451 NE2 GLN A 152 7.612 21.581 4.080 1.00 0.00 N ATOM 0 H GLN A 152 4.292 21.163 5.545 1.00 0.00 H new ATOM 0 HA GLN A 152 6.246 19.156 6.251 1.00 0.00 H new ATOM 0 HB2 GLN A 152 5.295 21.534 7.851 1.00 0.00 H new ATOM 0 HB3 GLN A 152 6.780 20.628 8.059 1.00 0.00 H new ATOM 0 HG2 GLN A 152 6.037 22.503 5.787 1.00 0.00 H new ATOM 0 HG3 GLN A 152 7.369 22.652 6.916 1.00 0.00 H new ATOM 0 HE21 GLN A 152 6.950 22.306 3.803 1.00 0.00 H new ATOM 0 HE22 GLN A 152 8.205 21.137 3.379 1.00 0.00 H new ATOM 2460 N GLY A 153 4.384 17.633 7.170 1.00 0.00 N ATOM 2461 CA GLY A 153 3.655 16.646 7.948 1.00 0.00 C ATOM 2462 C GLY A 153 3.828 15.270 7.315 1.00 0.00 C ATOM 2463 O GLY A 153 4.489 15.137 6.285 1.00 0.00 O ATOM 0 H GLY A 153 4.706 17.277 6.270 1.00 0.00 H new ATOM 0 HA2 GLY A 153 4.021 16.634 8.975 1.00 0.00 H new ATOM 0 HA3 GLY A 153 2.598 16.909 7.989 1.00 0.00 H new TER 2467 GLY A 153 HETATM 2468 FE HEM A 154 -3.799 5.568 -3.048 1.00 0.00 FE HETATM 2469 CHA HEM A 154 -5.607 6.659 -5.743 1.00 0.00 C HETATM 2470 CHB HEM A 154 -1.438 4.200 -5.188 1.00 0.00 C HETATM 2471 CHC HEM A 154 -2.171 4.203 -0.420 1.00 0.00 C HETATM 2472 CHD HEM A 154 -6.185 6.870 -0.949 1.00 0.00 C HETATM 2473 NA HEM A 154 -3.580 5.435 -5.060 1.00 0.00 N HETATM 2474 C1A HEM A 154 -4.373 6.059 -6.007 1.00 0.00 C HETATM 2475 C2A HEM A 154 -3.750 5.952 -7.314 1.00 0.00 C HETATM 2476 C3A HEM A 154 -2.660 5.152 -7.172 1.00 0.00 C HETATM 2477 C4A HEM A 154 -2.536 4.848 -5.763 1.00 0.00 C HETATM 2478 CMA HEM A 154 -1.644 4.782 -8.222 1.00 0.00 C HETATM 2479 CAA HEM A 154 -4.185 6.687 -8.561 1.00 0.00 C HETATM 2480 CBA HEM A 154 -3.261 7.848 -8.948 1.00 0.00 C HETATM 2481 CGA HEM A 154 -2.968 8.763 -7.765 1.00 0.00 C HETATM 2482 O1A HEM A 154 -1.788 8.791 -7.355 1.00 0.00 O HETATM 2483 O2A HEM A 154 -3.902 9.470 -7.326 1.00 0.00 O HETATM 2484 NB HEM A 154 -2.109 4.484 -2.842 1.00 0.00 N HETATM 2485 C1B HEM A 154 -1.222 4.070 -3.819 1.00 0.00 C HETATM 2486 C2B HEM A 154 -0.086 3.409 -3.203 1.00 0.00 C HETATM 2487 C3B HEM A 154 -0.408 3.219 -1.899 1.00 0.00 C HETATM 2488 C4B HEM A 154 -1.610 3.984 -1.664 1.00 0.00 C HETATM 2489 CMB HEM A 154 1.145 2.926 -3.916 1.00 0.00 C HETATM 2490 CAB HEM A 154 0.319 2.389 -0.873 1.00 0.00 C HETATM 2491 CBB HEM A 154 0.505 1.091 -1.155 1.00 0.00 C HETATM 2492 NC HEM A 154 -4.060 5.624 -1.074 1.00 0.00 N HETATM 2493 C1C HEM A 154 -3.297 4.965 -0.134 1.00 0.00 C HETATM 2494 C2C HEM A 154 -3.897 5.091 1.173 1.00 0.00 C HETATM 2495 C3C HEM A 154 -5.006 5.863 1.022 1.00 0.00 C HETATM 2496 C4C HEM A 154 -5.111 6.193 -0.377 1.00 0.00 C HETATM 2497 CMC HEM A 154 -3.366 4.445 2.431 1.00 0.00 C HETATM 2498 CAC HEM A 154 -5.990 6.292 2.072 1.00 0.00 C HETATM 2499 CBC HEM A 154 -5.532 6.630 3.279 1.00 0.00 C HETATM 2500 ND HEM A 154 -5.507 6.615 -3.294 1.00 0.00 N HETATM 2501 C1D HEM A 154 -6.383 7.046 -2.313 1.00 0.00 C HETATM 2502 C2D HEM A 154 -7.634 7.470 -2.904 1.00 0.00 C HETATM 2503 C3D HEM A 154 -7.556 7.175 -4.225 1.00 0.00 C HETATM 2504 C4D HEM A 154 -6.179 6.802 -4.484 1.00 0.00 C HETATM 2505 CMD HEM A 154 -8.843 7.931 -2.131 1.00 0.00 C HETATM 2506 CAD HEM A 154 -8.694 7.126 -5.218 1.00 0.00 C HETATM 2507 CBD HEM A 154 -9.263 8.476 -5.661 1.00 0.00 C HETATM 2508 CGD HEM A 154 -10.674 8.313 -6.209 1.00 0.00 C HETATM 2509 O1D HEM A 154 -10.759 7.901 -7.385 1.00 0.00 O HETATM 2510 O2D HEM A 154 -11.581 8.216 -5.354 1.00 0.00 O HETATM 0 HMA1 HEM A 154 -2.147 4.624 -9.176 1.00 0.00 H new HETATM 0 HMA2 HEM A 154 -1.132 3.867 -7.926 1.00 0.00 H new HETATM 0 HMA3 HEM A 154 -0.917 5.588 -8.325 1.00 0.00 H new HETATM 0 HMB1 HEM A 154 1.999 2.972 -3.240 1.00 0.00 H new HETATM 0 HMB2 HEM A 154 1.335 3.558 -4.783 1.00 0.00 H new HETATM 0 HMB3 HEM A 154 0.996 1.897 -4.243 1.00 0.00 H new HETATM 0 HMC1 HEM A 154 -2.858 3.515 2.176 1.00 0.00 H new HETATM 0 HMC2 HEM A 154 -4.193 4.233 3.108 1.00 0.00 H new HETATM 0 HMC3 HEM A 154 -2.663 5.121 2.918 1.00 0.00 H new HETATM 0 HMD1 HEM A 154 -8.868 7.431 -1.163 1.00 0.00 H new HETATM 0 HMD2 HEM A 154 -9.747 7.686 -2.689 1.00 0.00 H new HETATM 0 HMD3 HEM A 154 -8.790 9.009 -1.981 1.00 0.00 H new HETATM 0 HBB1 HEM A 154 1.025 0.448 -0.445 1.00 0.00 H new HETATM 0 HBB2 HEM A 154 0.136 0.679 -2.094 1.00 0.00 H new HETATM 0 HBC1 HEM A 154 -6.227 6.945 4.057 1.00 0.00 H new HETATM 0 HBC2 HEM A 154 -4.463 6.591 3.487 1.00 0.00 H new HETATM 0 HBA1 HEM A 154 -3.722 8.427 -9.749 1.00 0.00 H new HETATM 0 HBA2 HEM A 154 -2.325 7.451 -9.340 1.00 0.00 H new HETATM 0 HAA1 HEM A 154 -5.194 7.072 -8.412 1.00 0.00 H new HETATM 0 HAA2 HEM A 154 -4.233 5.981 -9.390 1.00 0.00 H new HETATM 0 HBD1 HEM A 154 -8.620 8.914 -6.424 1.00 0.00 H new HETATM 0 HBD2 HEM A 154 -9.273 9.166 -4.817 1.00 0.00 H new HETATM 0 HAD1 HEM A 154 -9.503 6.539 -4.783 1.00 0.00 H new HETATM 0 HAD2 HEM A 154 -8.353 6.591 -6.104 1.00 0.00 H new HETATM 0 HHA HEM A 154 -6.162 7.043 -6.586 1.00 0.00 H new HETATM 0 HHB HEM A 154 -0.705 3.769 -5.854 1.00 0.00 H new HETATM 0 HHC HEM A 154 -1.682 3.731 0.419 1.00 0.00 H new HETATM 0 HHD HEM A 154 -6.921 7.291 -0.280 1.00 0.00 H new HETATM 0 HAB HEM A 154 0.679 2.825 0.059 1.00 0.00 H new HETATM 0 HAC HEM A 154 -7.057 6.327 1.853 1.00 0.00 H new HETATM 2541 C CMO A 155 -4.823 4.160 -2.961 1.00 0.00 C HETATM 2542 O CMO A 155 -5.521 3.292 -2.842 1.00 0.00 O