USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 704 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 ASN : amide:sc= -0.11 X(o=-2.3,f=-2.7) USER MOD Set 1.2: A 138 MET CE :methyl -158:sc= -2.15 (180deg=-2.48) USER MOD Set 2.1: A 57 HIS : no HD1:sc= -0.235 K(o=-0.54,f=-1.4) USER MOD Set 2.2: A 74 ASN :FLIP amide:sc= -0.303 F(o=-1.7,f=-0.54) USER MOD Set 3.1: A 70 CYS SG : rot 5:sc= -9.05! USER MOD Set 3.2: A 93 LYS NZ :NH3+ 168:sc= 0.147 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -0.0948 K(o=-0.095,f=-1.9!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= -12.1! C(o=-12!,f=-20!) USER MOD Single : A 46 MET CE :methyl -163:sc= -1.59 (180deg=-2.15!) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= -1.35 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= -2.27! C(o=-2.3!,f=-2.3!) USER MOD Single : A 68 MET CE :methyl 180:sc=-0.00353 (180deg=-0.00353) USER MOD Single : A 71 CYS SG : rot 79:sc= 0.0289 USER MOD Single : A 72 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.311) USER MOD Single : A 73 SER OG : rot -109:sc= 0.41! USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 MET CE :methyl -105:sc= -1.49 (180deg=-4.14!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc=-0.00242 X(o=-0.0024,f=-0.47) USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot -43:sc= 0.257! USER MOD Single : A 108 ASN : amide:sc= -0.198 K(o=-0.2,f=-2.1!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 HIS : no HD1:sc= -4.06! C(o=-4.1!,f=-4.7!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= -0.1 X(o=-0.1,f=-0.22) USER MOD Single : A 123 SER OG : rot 180:sc= -0.127 USER MOD Single : A 127 SER OG : rot 63:sc= -8.17! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -1.29 K(o=-1.3,f=-3.9!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 130:sc= 1.03 USER MOD Single : A 149 THR OG1 : rot 60:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 60 N GLN A 26 -8.249 9.619 -6.629 1.00 0.00 N ATOM 61 CA GLN A 26 -8.396 9.284 -8.036 1.00 0.00 C ATOM 62 C GLN A 26 -7.540 10.216 -8.896 1.00 0.00 C ATOM 63 O GLN A 26 -7.299 9.936 -10.069 1.00 0.00 O ATOM 64 CB GLN A 26 -9.865 9.341 -8.461 1.00 0.00 C ATOM 65 CG GLN A 26 -10.617 8.089 -8.003 1.00 0.00 C ATOM 66 CD GLN A 26 -11.868 7.859 -8.854 1.00 0.00 C ATOM 67 OE1 GLN A 26 -11.975 8.313 -9.982 1.00 0.00 O ATOM 68 NE2 GLN A 26 -12.804 7.131 -8.253 1.00 0.00 N ATOM 0 HA GLN A 26 -8.047 8.262 -8.185 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.336 10.228 -8.037 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.930 9.433 -9.545 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.961 7.221 -8.072 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.899 8.193 -6.955 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -12.650 6.782 -7.307 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -13.677 6.921 -8.738 1.00 0.00 H new ATOM 75 N LYS A 27 -7.104 11.304 -8.279 1.00 0.00 N ATOM 76 CA LYS A 27 -6.280 12.279 -8.973 1.00 0.00 C ATOM 77 C LYS A 27 -4.808 12.019 -8.649 1.00 0.00 C ATOM 78 O LYS A 27 -4.055 12.952 -8.373 1.00 0.00 O ATOM 79 CB LYS A 27 -6.740 13.701 -8.646 1.00 0.00 C ATOM 80 CG LYS A 27 -8.265 13.774 -8.540 1.00 0.00 C ATOM 81 CD LYS A 27 -8.924 13.432 -9.877 1.00 0.00 C ATOM 82 CE LYS A 27 -10.238 12.678 -9.665 1.00 0.00 C ATOM 83 NZ LYS A 27 -11.390 13.526 -10.045 1.00 0.00 N ATOM 0 H LYS A 27 -7.306 11.532 -7.306 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.393 12.173 -10.052 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.291 14.025 -7.707 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -6.393 14.386 -9.419 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.613 13.084 -7.772 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -8.564 14.775 -8.228 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.113 14.347 -10.438 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.245 12.825 -10.476 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.240 11.764 -10.260 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.328 12.379 -8.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.274 12.999 -9.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.396 14.386 -9.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.311 13.790 -11.048 1.00 0.00 H new ATOM 93 N ASN A 28 -4.441 10.747 -8.694 1.00 0.00 N ATOM 94 CA ASN A 28 -3.072 10.352 -8.408 1.00 0.00 C ATOM 95 C ASN A 28 -2.876 8.887 -8.802 1.00 0.00 C ATOM 96 O ASN A 28 -1.784 8.491 -9.210 1.00 0.00 O ATOM 97 CB ASN A 28 -2.760 10.486 -6.916 1.00 0.00 C ATOM 98 CG ASN A 28 -1.601 11.456 -6.683 1.00 0.00 C ATOM 99 OD1 ASN A 28 -0.750 11.663 -7.533 1.00 0.00 O ATOM 100 ND2 ASN A 28 -1.615 12.039 -5.488 1.00 0.00 N ATOM 0 H ASN A 28 -5.068 9.976 -8.924 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.408 11.004 -8.975 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -3.645 10.838 -6.386 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.509 9.508 -6.504 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -0.884 12.704 -5.237 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.357 11.821 -4.823 1.00 0.00 H new ATOM 106 N ILE A 29 -3.948 8.122 -8.667 1.00 0.00 N ATOM 107 CA ILE A 29 -3.907 6.709 -9.004 1.00 0.00 C ATOM 108 C ILE A 29 -3.503 6.550 -10.471 1.00 0.00 C ATOM 109 O ILE A 29 -2.712 7.337 -10.989 1.00 0.00 O ATOM 110 CB ILE A 29 -5.237 6.036 -8.656 1.00 0.00 C ATOM 111 CG1 ILE A 29 -6.418 6.833 -9.214 1.00 0.00 C ATOM 112 CG2 ILE A 29 -5.359 5.812 -7.146 1.00 0.00 C ATOM 113 CD1 ILE A 29 -6.458 6.753 -10.741 1.00 0.00 C ATOM 0 H ILE A 29 -4.851 8.454 -8.329 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.152 6.197 -8.408 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.258 5.055 -9.131 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -7.350 6.447 -8.801 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.339 7.874 -8.902 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.313 5.333 -6.925 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.544 5.173 -6.806 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.307 6.771 -6.631 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.306 7.327 -11.113 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.535 7.162 -11.151 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.562 5.712 -11.048 1.00 0.00 H new ATOM 124 N ASP A 30 -4.065 5.528 -11.099 1.00 0.00 N ATOM 125 CA ASP A 30 -3.774 5.257 -12.497 1.00 0.00 C ATOM 126 C ASP A 30 -4.904 4.417 -13.094 1.00 0.00 C ATOM 127 O ASP A 30 -5.465 4.771 -14.130 1.00 0.00 O ATOM 128 CB ASP A 30 -2.471 4.469 -12.644 1.00 0.00 C ATOM 129 CG ASP A 30 -1.974 4.306 -14.082 1.00 0.00 C ATOM 130 OD1 ASP A 30 -2.592 3.496 -14.807 1.00 0.00 O ATOM 131 OD2 ASP A 30 -0.989 4.993 -14.424 1.00 0.00 O ATOM 0 H ASP A 30 -4.720 4.877 -10.666 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.679 6.212 -13.014 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.695 4.966 -12.061 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.611 3.479 -12.209 1.00 0.00 H new ATOM 135 N GLY A 31 -5.205 3.318 -12.417 1.00 0.00 N ATOM 136 CA GLY A 31 -6.258 2.425 -12.869 1.00 0.00 C ATOM 137 C GLY A 31 -7.176 2.030 -11.710 1.00 0.00 C ATOM 138 O GLY A 31 -7.754 0.945 -11.713 1.00 0.00 O ATOM 0 H GLY A 31 -4.738 3.026 -11.559 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -6.842 2.911 -13.651 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.817 1.531 -13.310 1.00 0.00 H new ATOM 142 N TRP A 32 -7.283 2.935 -10.748 1.00 0.00 N ATOM 143 CA TRP A 32 -8.121 2.695 -9.585 1.00 0.00 C ATOM 144 C TRP A 32 -8.991 1.469 -9.875 1.00 0.00 C ATOM 145 O TRP A 32 -10.126 1.604 -10.332 1.00 0.00 O ATOM 146 CB TRP A 32 -8.939 3.939 -9.233 1.00 0.00 C ATOM 147 CG TRP A 32 -10.084 3.674 -8.252 1.00 0.00 C ATOM 148 CD1 TRP A 32 -11.304 3.190 -8.520 1.00 0.00 C ATOM 149 CD2 TRP A 32 -10.064 3.903 -6.828 1.00 0.00 C ATOM 150 NE1 TRP A 32 -12.070 3.088 -7.376 1.00 0.00 N ATOM 151 CE2 TRP A 32 -11.292 3.536 -6.314 1.00 0.00 C ATOM 152 CE3 TRP A 32 -9.043 4.402 -5.999 1.00 0.00 C ATOM 153 CZ2 TRP A 32 -11.613 3.629 -4.955 1.00 0.00 C ATOM 154 CZ3 TRP A 32 -9.381 4.489 -4.644 1.00 0.00 C ATOM 155 CH2 TRP A 32 -10.612 4.124 -4.111 1.00 0.00 C ATOM 0 H TRP A 32 -6.804 3.835 -10.750 1.00 0.00 H new ATOM 0 HA TRP A 32 -7.511 2.489 -8.705 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -8.274 4.689 -8.805 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -9.350 4.362 -10.149 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -11.645 2.914 -9.507 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -13.030 2.747 -7.320 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -8.075 4.695 -6.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -12.581 3.335 -4.578 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -8.632 4.867 -3.964 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -10.795 4.222 -3.051 1.00 0.00 H new ATOM 300 N PHE A 44 -10.870 2.556 2.606 1.00 0.00 N ATOM 301 CA PHE A 44 -9.446 2.504 2.893 1.00 0.00 C ATOM 302 C PHE A 44 -9.192 2.011 4.319 1.00 0.00 C ATOM 303 O PHE A 44 -9.271 2.788 5.271 1.00 0.00 O ATOM 304 CB PHE A 44 -8.910 3.931 2.755 1.00 0.00 C ATOM 305 CG PHE A 44 -9.446 4.901 3.810 1.00 0.00 C ATOM 306 CD1 PHE A 44 -10.696 5.421 3.682 1.00 0.00 C ATOM 307 CD2 PHE A 44 -8.671 5.244 4.873 1.00 0.00 C ATOM 308 CE1 PHE A 44 -11.193 6.322 4.662 1.00 0.00 C ATOM 309 CE2 PHE A 44 -9.169 6.145 5.852 1.00 0.00 C ATOM 310 CZ PHE A 44 -10.418 6.666 5.725 1.00 0.00 C ATOM 0 HA PHE A 44 -8.952 1.816 2.207 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -7.822 3.907 2.817 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.164 4.310 1.765 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -11.310 5.149 2.836 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -7.678 4.832 4.973 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -12.187 6.734 4.563 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.555 6.416 6.698 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.795 7.353 6.468 1.00 0.00 H new ATOM 319 N ILE A 45 -8.891 0.725 4.422 1.00 0.00 N ATOM 320 CA ILE A 45 -8.625 0.121 5.716 1.00 0.00 C ATOM 321 C ILE A 45 -7.602 0.972 6.471 1.00 0.00 C ATOM 322 O ILE A 45 -7.886 1.467 7.561 1.00 0.00 O ATOM 323 CB ILE A 45 -8.205 -1.341 5.548 1.00 0.00 C ATOM 324 CG1 ILE A 45 -9.387 -2.204 5.103 1.00 0.00 C ATOM 325 CG2 ILE A 45 -7.554 -1.874 6.826 1.00 0.00 C ATOM 326 CD1 ILE A 45 -8.989 -3.679 5.022 1.00 0.00 C ATOM 0 H ILE A 45 -8.825 0.085 3.631 1.00 0.00 H new ATOM 0 HA ILE A 45 -9.532 0.101 6.321 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.455 -1.393 4.759 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -10.213 -2.085 5.804 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -9.743 -1.866 4.130 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -7.265 -2.915 6.680 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -6.670 -1.281 7.059 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.263 -1.807 7.651 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -9.847 -4.271 4.703 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -8.179 -3.798 4.302 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -8.657 -4.021 6.002 1.00 0.00 H new ATOM 337 N MET A 46 -6.435 1.115 5.862 1.00 0.00 N ATOM 338 CA MET A 46 -5.369 1.898 6.464 1.00 0.00 C ATOM 339 C MET A 46 -4.665 2.763 5.416 1.00 0.00 C ATOM 340 O MET A 46 -4.269 2.268 4.362 1.00 0.00 O ATOM 341 CB MET A 46 -4.352 0.960 7.117 1.00 0.00 C ATOM 342 CG MET A 46 -3.939 -0.155 6.155 1.00 0.00 C ATOM 343 SD MET A 46 -2.177 -0.426 6.256 1.00 0.00 S ATOM 344 CE MET A 46 -1.588 1.206 5.840 1.00 0.00 C ATOM 0 H MET A 46 -6.204 0.702 4.958 1.00 0.00 H new ATOM 0 HA MET A 46 -5.807 2.554 7.216 1.00 0.00 H new ATOM 0 HB2 MET A 46 -3.472 1.527 7.422 1.00 0.00 H new ATOM 0 HB3 MET A 46 -4.780 0.526 8.021 1.00 0.00 H new ATOM 0 HG2 MET A 46 -4.471 -1.074 6.400 1.00 0.00 H new ATOM 0 HG3 MET A 46 -4.217 0.112 5.135 1.00 0.00 H new ATOM 0 HE1 MET A 46 -0.536 1.153 5.561 1.00 0.00 H new ATOM 0 HE2 MET A 46 -2.166 1.599 5.003 1.00 0.00 H new ATOM 0 HE3 MET A 46 -1.703 1.865 6.701 1.00 0.00 H new ATOM 352 N GLU A 47 -4.532 4.040 5.742 1.00 0.00 N ATOM 353 CA GLU A 47 -3.884 4.978 4.841 1.00 0.00 C ATOM 354 C GLU A 47 -2.505 5.366 5.382 1.00 0.00 C ATOM 355 O GLU A 47 -2.374 5.743 6.546 1.00 0.00 O ATOM 356 CB GLU A 47 -4.754 6.218 4.620 1.00 0.00 C ATOM 357 CG GLU A 47 -4.856 7.051 5.899 1.00 0.00 C ATOM 358 CD GLU A 47 -4.125 8.387 5.742 1.00 0.00 C ATOM 359 OE1 GLU A 47 -2.993 8.355 5.214 1.00 0.00 O ATOM 360 OE2 GLU A 47 -4.716 9.408 6.155 1.00 0.00 O ATOM 0 H GLU A 47 -4.862 4.447 6.617 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.751 4.491 3.875 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.332 6.825 3.819 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.750 5.915 4.299 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.904 7.231 6.137 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.430 6.495 6.734 1.00 0.00 H new ATOM 365 N GLY A 48 -1.512 5.260 4.511 1.00 0.00 N ATOM 366 CA GLY A 48 -0.150 5.595 4.886 1.00 0.00 C ATOM 367 C GLY A 48 0.754 5.676 3.654 1.00 0.00 C ATOM 368 O GLY A 48 0.397 5.182 2.585 1.00 0.00 O ATOM 0 H GLY A 48 -1.624 4.947 3.547 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.138 6.549 5.413 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.236 4.845 5.576 1.00 0.00 H new ATOM 372 N THR A 49 1.907 6.301 3.845 1.00 0.00 N ATOM 373 CA THR A 49 2.864 6.453 2.762 1.00 0.00 C ATOM 374 C THR A 49 4.157 5.704 3.085 1.00 0.00 C ATOM 375 O THR A 49 4.835 6.022 4.061 1.00 0.00 O ATOM 376 CB THR A 49 3.071 7.949 2.521 1.00 0.00 C ATOM 377 OG1 THR A 49 2.024 8.570 3.261 1.00 0.00 O ATOM 378 CG2 THR A 49 2.793 8.354 1.072 1.00 0.00 C ATOM 0 H THR A 49 2.200 6.708 4.733 1.00 0.00 H new ATOM 0 HA THR A 49 2.491 6.010 1.839 1.00 0.00 H new ATOM 0 HB THR A 49 4.094 8.219 2.784 1.00 0.00 H new ATOM 0 HG1 THR A 49 2.085 9.543 3.161 1.00 0.00 H new ATOM 0 HG21 THR A 49 2.955 9.426 0.956 1.00 0.00 H new ATOM 0 HG22 THR A 49 3.465 7.812 0.407 1.00 0.00 H new ATOM 0 HG23 THR A 49 1.760 8.114 0.819 1.00 0.00 H new ATOM 386 N LEU A 50 4.462 4.723 2.247 1.00 0.00 N ATOM 387 CA LEU A 50 5.663 3.926 2.433 1.00 0.00 C ATOM 388 C LEU A 50 6.568 4.086 1.210 1.00 0.00 C ATOM 389 O LEU A 50 6.090 4.354 0.109 1.00 0.00 O ATOM 390 CB LEU A 50 5.298 2.473 2.743 1.00 0.00 C ATOM 391 CG LEU A 50 4.282 2.261 3.865 1.00 0.00 C ATOM 392 CD1 LEU A 50 2.949 2.935 3.533 1.00 0.00 C ATOM 393 CD2 LEU A 50 4.110 0.773 4.176 1.00 0.00 C ATOM 0 H LEU A 50 3.898 4.462 1.438 1.00 0.00 H new ATOM 0 HA LEU A 50 6.227 4.279 3.296 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.906 2.016 1.834 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.211 1.937 3.001 1.00 0.00 H new ATOM 0 HG LEU A 50 4.667 2.736 4.768 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.244 2.769 4.348 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.105 4.006 3.401 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.546 2.511 2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.382 0.651 4.978 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.759 0.253 3.285 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.067 0.353 4.488 1.00 0.00 H new ATOM 404 N THR A 51 7.861 3.915 1.444 1.00 0.00 N ATOM 405 CA THR A 51 8.839 4.036 0.376 1.00 0.00 C ATOM 406 C THR A 51 9.259 2.653 -0.122 1.00 0.00 C ATOM 407 O THR A 51 9.642 1.793 0.670 1.00 0.00 O ATOM 408 CB THR A 51 10.006 4.876 0.898 1.00 0.00 C ATOM 409 OG1 THR A 51 9.944 6.074 0.128 1.00 0.00 O ATOM 410 CG2 THR A 51 11.366 4.273 0.539 1.00 0.00 C ATOM 0 H THR A 51 8.254 3.693 2.359 1.00 0.00 H new ATOM 0 HA THR A 51 8.417 4.543 -0.492 1.00 0.00 H new ATOM 0 HB THR A 51 9.926 4.976 1.980 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.666 6.677 0.403 1.00 0.00 H new ATOM 0 HG21 THR A 51 12.160 4.907 0.932 1.00 0.00 H new ATOM 0 HG22 THR A 51 11.448 3.277 0.973 1.00 0.00 H new ATOM 0 HG23 THR A 51 11.459 4.205 -0.545 1.00 0.00 H new ATOM 418 N ARG A 52 9.174 2.479 -1.433 1.00 0.00 N ATOM 419 CA ARG A 52 9.541 1.215 -2.047 1.00 0.00 C ATOM 420 C ARG A 52 11.060 1.120 -2.200 1.00 0.00 C ATOM 421 O ARG A 52 11.612 1.537 -3.217 1.00 0.00 O ATOM 422 CB ARG A 52 8.887 1.058 -3.420 1.00 0.00 C ATOM 423 CG ARG A 52 9.233 -0.296 -4.042 1.00 0.00 C ATOM 424 CD ARG A 52 9.014 -0.277 -5.556 1.00 0.00 C ATOM 425 NE ARG A 52 8.563 -1.609 -6.019 1.00 0.00 N ATOM 426 CZ ARG A 52 8.621 -2.020 -7.293 1.00 0.00 C ATOM 427 NH1 ARG A 52 9.111 -1.207 -8.239 1.00 0.00 N ATOM 428 NH2 ARG A 52 8.188 -3.244 -7.622 1.00 0.00 N ATOM 0 H ARG A 52 8.856 3.194 -2.087 1.00 0.00 H new ATOM 0 HA ARG A 52 9.187 0.416 -1.395 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.805 1.152 -3.324 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.220 1.860 -4.079 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.272 -0.545 -3.825 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.617 -1.075 -3.592 1.00 0.00 H new ATOM 0 HD2 ARG A 52 8.271 0.478 -5.815 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.939 -0.001 -6.062 1.00 0.00 H new ATOM 0 HE ARG A 52 8.185 -2.254 -5.325 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.440 -0.274 -7.989 1.00 0.00 H new ATOM 0 HH12 ARG A 52 9.155 -1.521 -9.209 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.814 -3.863 -6.903 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.232 -3.557 -8.592 1.00 0.00 H new ATOM 439 N VAL A 53 11.693 0.569 -1.175 1.00 0.00 N ATOM 440 CA VAL A 53 13.138 0.415 -1.182 1.00 0.00 C ATOM 441 C VAL A 53 13.538 -0.548 -2.302 1.00 0.00 C ATOM 442 O VAL A 53 12.677 -1.111 -2.978 1.00 0.00 O ATOM 443 CB VAL A 53 13.624 -0.036 0.197 1.00 0.00 C ATOM 444 CG1 VAL A 53 14.481 -1.299 0.090 1.00 0.00 C ATOM 445 CG2 VAL A 53 14.387 1.085 0.904 1.00 0.00 C ATOM 0 H VAL A 53 11.232 0.223 -0.334 1.00 0.00 H new ATOM 0 HA VAL A 53 13.623 1.370 -1.385 1.00 0.00 H new ATOM 0 HB VAL A 53 12.747 -0.275 0.799 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.814 -1.598 1.084 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.892 -2.102 -0.353 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.349 -1.098 -0.538 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.721 0.737 1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 53 15.252 1.370 0.305 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.733 1.948 1.030 1.00 0.00 H new ATOM 455 N GLY A 54 14.843 -0.710 -2.463 1.00 0.00 N ATOM 456 CA GLY A 54 15.366 -1.596 -3.488 1.00 0.00 C ATOM 457 C GLY A 54 15.383 -0.905 -4.853 1.00 0.00 C ATOM 458 O GLY A 54 15.890 -1.460 -5.827 1.00 0.00 O ATOM 0 H GLY A 54 15.554 -0.242 -1.900 1.00 0.00 H new ATOM 0 HA2 GLY A 54 16.376 -1.909 -3.222 1.00 0.00 H new ATOM 0 HA3 GLY A 54 14.756 -2.498 -3.540 1.00 0.00 H new ATOM 462 N ALA A 55 14.825 0.296 -4.879 1.00 0.00 N ATOM 463 CA ALA A 55 14.770 1.069 -6.108 1.00 0.00 C ATOM 464 C ALA A 55 14.873 2.558 -5.775 1.00 0.00 C ATOM 465 O ALA A 55 15.494 3.322 -6.511 1.00 0.00 O ATOM 466 CB ALA A 55 13.485 0.729 -6.868 1.00 0.00 C ATOM 0 H ALA A 55 14.407 0.753 -4.069 1.00 0.00 H new ATOM 0 HA ALA A 55 15.609 0.818 -6.757 1.00 0.00 H new ATOM 0 HB1 ALA A 55 13.443 1.309 -7.790 1.00 0.00 H new ATOM 0 HB2 ALA A 55 13.474 -0.334 -7.107 1.00 0.00 H new ATOM 0 HB3 ALA A 55 12.621 0.970 -6.248 1.00 0.00 H new ATOM 472 N LYS A 56 14.254 2.927 -4.663 1.00 0.00 N ATOM 473 CA LYS A 56 14.268 4.311 -4.222 1.00 0.00 C ATOM 474 C LYS A 56 13.086 5.054 -4.849 1.00 0.00 C ATOM 475 O LYS A 56 13.275 5.928 -5.693 1.00 0.00 O ATOM 476 CB LYS A 56 15.625 4.954 -4.518 1.00 0.00 C ATOM 477 CG LYS A 56 16.102 5.796 -3.332 1.00 0.00 C ATOM 478 CD LYS A 56 17.182 5.060 -2.538 1.00 0.00 C ATOM 479 CE LYS A 56 18.543 5.171 -3.228 1.00 0.00 C ATOM 480 NZ LYS A 56 19.556 4.368 -2.507 1.00 0.00 N ATOM 0 H LYS A 56 13.739 2.291 -4.054 1.00 0.00 H new ATOM 0 HA LYS A 56 14.143 4.367 -3.141 1.00 0.00 H new ATOM 0 HB2 LYS A 56 16.359 4.179 -4.737 1.00 0.00 H new ATOM 0 HB3 LYS A 56 15.549 5.581 -5.407 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.494 6.748 -3.691 1.00 0.00 H new ATOM 0 HG3 LYS A 56 15.258 6.024 -2.681 1.00 0.00 H new ATOM 0 HD2 LYS A 56 17.245 5.476 -1.532 1.00 0.00 H new ATOM 0 HD3 LYS A 56 16.909 4.010 -2.432 1.00 0.00 H new ATOM 0 HE2 LYS A 56 18.464 4.827 -4.259 1.00 0.00 H new ATOM 0 HE3 LYS A 56 18.855 6.215 -3.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 20.474 4.454 -2.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 19.643 4.715 -1.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 19.264 3.370 -2.495 1.00 0.00 H new ATOM 490 N HIS A 57 11.893 4.678 -4.413 1.00 0.00 N ATOM 491 CA HIS A 57 10.680 5.296 -4.921 1.00 0.00 C ATOM 492 C HIS A 57 9.609 5.299 -3.829 1.00 0.00 C ATOM 493 O HIS A 57 9.575 4.404 -2.985 1.00 0.00 O ATOM 494 CB HIS A 57 10.216 4.608 -6.205 1.00 0.00 C ATOM 495 CG HIS A 57 11.026 4.975 -7.426 1.00 0.00 C ATOM 496 ND1 HIS A 57 11.250 6.284 -7.812 1.00 0.00 N ATOM 497 CD2 HIS A 57 11.663 4.190 -8.342 1.00 0.00 C ATOM 498 CE1 HIS A 57 11.989 6.277 -8.912 1.00 0.00 C ATOM 499 NE2 HIS A 57 12.243 4.978 -9.239 1.00 0.00 N ATOM 0 H HIS A 57 11.740 3.952 -3.713 1.00 0.00 H new ATOM 0 HA HIS A 57 10.881 6.334 -5.187 1.00 0.00 H new ATOM 0 HB2 HIS A 57 10.261 3.528 -6.063 1.00 0.00 H new ATOM 0 HB3 HIS A 57 9.172 4.863 -6.385 1.00 0.00 H new ATOM 0 HD2 HIS A 57 11.691 3.110 -8.338 1.00 0.00 H new ATOM 0 HE1 HIS A 57 12.330 7.147 -9.454 1.00 0.00 H new ATOM 0 HE2 HIS A 57 12.789 4.663 -10.041 1.00 0.00 H new ATOM 506 N GLU A 58 8.760 6.315 -3.880 1.00 0.00 N ATOM 507 CA GLU A 58 7.690 6.446 -2.905 1.00 0.00 C ATOM 508 C GLU A 58 6.377 5.913 -3.483 1.00 0.00 C ATOM 509 O GLU A 58 6.252 5.744 -4.695 1.00 0.00 O ATOM 510 CB GLU A 58 7.539 7.899 -2.449 1.00 0.00 C ATOM 511 CG GLU A 58 8.834 8.413 -1.818 1.00 0.00 C ATOM 512 CD GLU A 58 8.645 9.821 -1.249 1.00 0.00 C ATOM 513 OE1 GLU A 58 8.203 10.693 -2.029 1.00 0.00 O ATOM 514 OE2 GLU A 58 8.947 9.993 -0.048 1.00 0.00 O ATOM 0 H GLU A 58 8.791 7.055 -4.581 1.00 0.00 H new ATOM 0 HA GLU A 58 7.947 5.850 -2.029 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.272 8.525 -3.300 1.00 0.00 H new ATOM 0 HB3 GLU A 58 6.724 7.975 -1.729 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.150 7.736 -1.025 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.628 8.422 -2.565 1.00 0.00 H new ATOM 519 N ARG A 59 5.432 5.663 -2.589 1.00 0.00 N ATOM 520 CA ARG A 59 4.134 5.153 -2.995 1.00 0.00 C ATOM 521 C ARG A 59 3.111 5.356 -1.877 1.00 0.00 C ATOM 522 O ARG A 59 3.258 4.804 -0.787 1.00 0.00 O ATOM 523 CB ARG A 59 4.212 3.664 -3.342 1.00 0.00 C ATOM 524 CG ARG A 59 4.947 2.885 -2.250 1.00 0.00 C ATOM 525 CD ARG A 59 4.427 1.449 -2.158 1.00 0.00 C ATOM 526 NE ARG A 59 5.320 0.538 -2.908 1.00 0.00 N ATOM 527 CZ ARG A 59 5.083 0.109 -4.155 1.00 0.00 C ATOM 528 NH1 ARG A 59 3.977 0.506 -4.800 1.00 0.00 N ATOM 529 NH2 ARG A 59 5.950 -0.716 -4.757 1.00 0.00 N ATOM 0 H ARG A 59 5.540 5.804 -1.585 1.00 0.00 H new ATOM 0 HA ARG A 59 3.823 5.706 -3.881 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.206 3.263 -3.466 1.00 0.00 H new ATOM 0 HB3 ARG A 59 4.726 3.535 -4.294 1.00 0.00 H new ATOM 0 HG2 ARG A 59 6.016 2.876 -2.462 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.816 3.385 -1.290 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.372 1.140 -1.114 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.416 1.393 -2.561 1.00 0.00 H new ATOM 0 HE ARG A 59 6.170 0.216 -2.446 1.00 0.00 H new ATOM 0 HH11 ARG A 59 3.317 1.134 -4.341 1.00 0.00 H new ATOM 0 HH12 ARG A 59 3.796 0.180 -5.749 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.791 -1.018 -4.266 1.00 0.00 H new ATOM 0 HH22 ARG A 59 5.769 -1.042 -5.706 1.00 0.00 H new ATOM 540 N HIS A 60 2.096 6.151 -2.184 1.00 0.00 N ATOM 541 CA HIS A 60 1.048 6.434 -1.219 1.00 0.00 C ATOM 542 C HIS A 60 0.230 5.166 -0.962 1.00 0.00 C ATOM 543 O HIS A 60 -0.787 4.936 -1.615 1.00 0.00 O ATOM 544 CB HIS A 60 0.186 7.612 -1.680 1.00 0.00 C ATOM 545 CG HIS A 60 -0.068 8.644 -0.609 1.00 0.00 C ATOM 546 ND1 HIS A 60 0.474 9.917 -0.650 1.00 0.00 N ATOM 547 CD2 HIS A 60 -0.812 8.579 0.533 1.00 0.00 C ATOM 548 CE1 HIS A 60 0.069 10.579 0.422 1.00 0.00 C ATOM 549 NE2 HIS A 60 -0.727 9.749 1.155 1.00 0.00 N ATOM 0 H HIS A 60 1.978 6.608 -3.088 1.00 0.00 H new ATOM 0 HA HIS A 60 1.495 6.735 -0.271 1.00 0.00 H new ATOM 0 HB2 HIS A 60 0.673 8.095 -2.527 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -0.771 7.231 -2.037 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -1.374 7.722 0.873 1.00 0.00 H new ATOM 0 HE1 HIS A 60 0.324 11.598 0.672 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -1.182 9.988 2.036 1.00 0.00 H new ATOM 556 N ILE A 61 0.705 4.377 -0.009 1.00 0.00 N ATOM 557 CA ILE A 61 0.030 3.139 0.342 1.00 0.00 C ATOM 558 C ILE A 61 -1.411 3.447 0.752 1.00 0.00 C ATOM 559 O ILE A 61 -1.682 4.488 1.348 1.00 0.00 O ATOM 560 CB ILE A 61 0.824 2.381 1.408 1.00 0.00 C ATOM 561 CG1 ILE A 61 2.157 1.883 0.847 1.00 0.00 C ATOM 562 CG2 ILE A 61 -0.008 1.243 2.005 1.00 0.00 C ATOM 563 CD1 ILE A 61 1.936 0.821 -0.231 1.00 0.00 C ATOM 0 H ILE A 61 1.549 4.571 0.530 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.019 2.474 -0.520 1.00 0.00 H new ATOM 0 HB ILE A 61 1.054 3.072 2.219 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.715 2.721 0.428 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.762 1.468 1.653 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.579 0.720 2.760 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.908 1.652 2.464 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.289 0.545 1.216 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.900 0.484 -0.613 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.399 -0.026 0.197 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.351 1.247 -1.047 1.00 0.00 H new ATOM 574 N PHE A 62 -2.298 2.522 0.416 1.00 0.00 N ATOM 575 CA PHE A 62 -3.706 2.682 0.742 1.00 0.00 C ATOM 576 C PHE A 62 -4.454 1.354 0.605 1.00 0.00 C ATOM 577 O PHE A 62 -5.121 1.115 -0.401 1.00 0.00 O ATOM 578 CB PHE A 62 -4.284 3.686 -0.257 1.00 0.00 C ATOM 579 CG PHE A 62 -4.643 5.040 0.359 1.00 0.00 C ATOM 580 CD1 PHE A 62 -5.652 5.128 1.267 1.00 0.00 C ATOM 581 CD2 PHE A 62 -3.953 6.154 -0.002 1.00 0.00 C ATOM 582 CE1 PHE A 62 -5.984 6.384 1.838 1.00 0.00 C ATOM 583 CE2 PHE A 62 -4.286 7.411 0.569 1.00 0.00 C ATOM 584 CZ PHE A 62 -5.294 7.500 1.478 1.00 0.00 C ATOM 0 H PHE A 62 -2.070 1.659 -0.078 1.00 0.00 H new ATOM 0 HA PHE A 62 -3.814 3.024 1.771 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.562 3.843 -1.058 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -5.177 3.257 -0.712 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -6.200 4.243 1.553 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.152 6.083 -0.723 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -6.785 6.454 2.559 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -3.739 8.297 0.281 1.00 0.00 H new ATOM 0 HZ PHE A 62 -5.546 8.456 1.914 1.00 0.00 H new ATOM 593 N LEU A 63 -4.317 0.525 1.630 1.00 0.00 N ATOM 594 CA LEU A 63 -4.973 -0.771 1.635 1.00 0.00 C ATOM 595 C LEU A 63 -6.481 -0.575 1.793 1.00 0.00 C ATOM 596 O LEU A 63 -6.943 -0.085 2.822 1.00 0.00 O ATOM 597 CB LEU A 63 -4.356 -1.678 2.702 1.00 0.00 C ATOM 598 CG LEU A 63 -5.268 -2.770 3.264 1.00 0.00 C ATOM 599 CD1 LEU A 63 -5.495 -3.879 2.235 1.00 0.00 C ATOM 600 CD2 LEU A 63 -4.720 -3.317 4.584 1.00 0.00 C ATOM 0 H LEU A 63 -3.762 0.726 2.462 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.816 -1.281 0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -3.471 -2.154 2.279 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -4.017 -1.054 3.529 1.00 0.00 H new ATOM 0 HG LEU A 63 -6.240 -2.326 3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.147 -4.642 2.660 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -5.962 -3.459 1.344 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.539 -4.327 1.966 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -5.387 -4.092 4.962 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.729 -3.740 4.419 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.653 -2.509 5.313 1.00 0.00 H new ATOM 611 N PHE A 64 -7.209 -0.968 0.757 1.00 0.00 N ATOM 612 CA PHE A 64 -8.656 -0.841 0.768 1.00 0.00 C ATOM 613 C PHE A 64 -9.315 -2.120 1.290 1.00 0.00 C ATOM 614 O PHE A 64 -8.819 -3.221 1.049 1.00 0.00 O ATOM 615 CB PHE A 64 -9.096 -0.610 -0.679 1.00 0.00 C ATOM 616 CG PHE A 64 -8.564 0.688 -1.291 1.00 0.00 C ATOM 617 CD1 PHE A 64 -8.003 1.636 -0.492 1.00 0.00 C ATOM 618 CD2 PHE A 64 -8.650 0.894 -2.633 1.00 0.00 C ATOM 619 CE1 PHE A 64 -7.511 2.841 -1.060 1.00 0.00 C ATOM 620 CE2 PHE A 64 -8.156 2.098 -3.200 1.00 0.00 C ATOM 621 CZ PHE A 64 -7.597 3.046 -2.402 1.00 0.00 C ATOM 0 H PHE A 64 -6.823 -1.374 -0.095 1.00 0.00 H new ATOM 0 HA PHE A 64 -8.952 -0.019 1.420 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -8.763 -1.450 -1.288 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -10.185 -0.599 -0.720 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -7.932 1.472 0.573 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -9.094 0.141 -3.267 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -7.068 3.595 -0.426 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -8.224 2.261 -4.265 1.00 0.00 H new ATOM 0 HZ PHE A 64 -7.221 3.962 -2.834 1.00 0.00 H new ATOM 630 N ASP A 65 -10.421 -1.933 1.995 1.00 0.00 N ATOM 631 CA ASP A 65 -11.152 -3.058 2.552 1.00 0.00 C ATOM 632 C ASP A 65 -11.496 -4.043 1.433 1.00 0.00 C ATOM 633 O ASP A 65 -11.865 -5.186 1.698 1.00 0.00 O ATOM 634 CB ASP A 65 -12.462 -2.599 3.196 1.00 0.00 C ATOM 635 CG ASP A 65 -12.637 -3.000 4.662 1.00 0.00 C ATOM 636 OD1 ASP A 65 -12.940 -4.191 4.892 1.00 0.00 O ATOM 637 OD2 ASP A 65 -12.464 -2.108 5.520 1.00 0.00 O ATOM 0 H ASP A 65 -10.829 -1.019 2.193 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.523 -3.527 3.308 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -12.525 -1.513 3.122 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -13.294 -3.006 2.622 1.00 0.00 H new ATOM 641 N GLY A 66 -11.362 -3.564 0.205 1.00 0.00 N ATOM 642 CA GLY A 66 -11.653 -4.388 -0.957 1.00 0.00 C ATOM 643 C GLY A 66 -10.385 -5.065 -1.480 1.00 0.00 C ATOM 644 O GLY A 66 -10.396 -6.255 -1.788 1.00 0.00 O ATOM 0 H GLY A 66 -11.056 -2.615 -0.011 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.392 -5.145 -0.695 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.092 -3.773 -1.743 1.00 0.00 H new ATOM 648 N LEU A 67 -9.324 -4.278 -1.565 1.00 0.00 N ATOM 649 CA LEU A 67 -8.051 -4.786 -2.046 1.00 0.00 C ATOM 650 C LEU A 67 -6.930 -3.843 -1.604 1.00 0.00 C ATOM 651 O LEU A 67 -7.129 -2.632 -1.520 1.00 0.00 O ATOM 652 CB LEU A 67 -8.102 -5.015 -3.558 1.00 0.00 C ATOM 653 CG LEU A 67 -9.154 -6.010 -4.051 1.00 0.00 C ATOM 654 CD1 LEU A 67 -9.216 -6.031 -5.579 1.00 0.00 C ATOM 655 CD2 LEU A 67 -8.908 -7.402 -3.468 1.00 0.00 C ATOM 0 H LEU A 67 -9.319 -3.291 -1.309 1.00 0.00 H new ATOM 0 HA LEU A 67 -7.840 -5.761 -1.606 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.281 -4.056 -4.045 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -7.122 -5.361 -3.886 1.00 0.00 H new ATOM 0 HG LEU A 67 -10.130 -5.680 -3.694 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -9.972 -6.747 -5.903 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -9.476 -5.038 -5.946 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.245 -6.323 -5.979 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -9.670 -8.090 -3.835 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -7.923 -7.755 -3.773 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.955 -7.354 -2.380 1.00 0.00 H new ATOM 666 N MET A 68 -5.775 -4.435 -1.334 1.00 0.00 N ATOM 667 CA MET A 68 -4.622 -3.662 -0.904 1.00 0.00 C ATOM 668 C MET A 68 -4.108 -2.767 -2.032 1.00 0.00 C ATOM 669 O MET A 68 -3.403 -3.233 -2.926 1.00 0.00 O ATOM 670 CB MET A 68 -3.509 -4.613 -0.458 1.00 0.00 C ATOM 671 CG MET A 68 -2.487 -3.888 0.421 1.00 0.00 C ATOM 672 SD MET A 68 -0.869 -3.976 -0.325 1.00 0.00 S ATOM 673 CE MET A 68 -0.275 -2.329 0.027 1.00 0.00 C ATOM 0 H MET A 68 -5.613 -5.440 -1.405 1.00 0.00 H new ATOM 0 HA MET A 68 -4.925 -3.026 -0.072 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.939 -5.449 0.093 1.00 0.00 H new ATOM 0 HB3 MET A 68 -3.010 -5.030 -1.333 1.00 0.00 H new ATOM 0 HG2 MET A 68 -2.781 -2.846 0.551 1.00 0.00 H new ATOM 0 HG3 MET A 68 -2.464 -4.338 1.413 1.00 0.00 H new ATOM 0 HE1 MET A 68 0.732 -2.212 -0.373 1.00 0.00 H new ATOM 0 HE2 MET A 68 -0.937 -1.597 -0.436 1.00 0.00 H new ATOM 0 HE3 MET A 68 -0.257 -2.171 1.105 1.00 0.00 H new ATOM 681 N ILE A 69 -4.481 -1.499 -1.955 1.00 0.00 N ATOM 682 CA ILE A 69 -4.067 -0.533 -2.959 1.00 0.00 C ATOM 683 C ILE A 69 -2.796 0.174 -2.487 1.00 0.00 C ATOM 684 O ILE A 69 -2.602 0.375 -1.289 1.00 0.00 O ATOM 685 CB ILE A 69 -5.216 0.422 -3.290 1.00 0.00 C ATOM 686 CG1 ILE A 69 -6.140 -0.179 -4.353 1.00 0.00 C ATOM 687 CG2 ILE A 69 -4.685 1.796 -3.704 1.00 0.00 C ATOM 688 CD1 ILE A 69 -5.337 -0.698 -5.547 1.00 0.00 C ATOM 0 H ILE A 69 -5.066 -1.117 -1.212 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.823 -1.037 -3.894 1.00 0.00 H new ATOM 0 HB ILE A 69 -5.812 0.565 -2.388 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.719 -0.993 -3.918 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.852 0.575 -4.689 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.522 2.455 -3.934 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.101 2.222 -2.888 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.053 1.691 -4.586 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -6.017 -1.120 -6.287 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -4.778 0.124 -5.994 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -4.643 -1.469 -5.211 1.00 0.00 H new ATOM 699 N CYS A 70 -1.963 0.533 -3.452 1.00 0.00 N ATOM 700 CA CYS A 70 -0.715 1.214 -3.151 1.00 0.00 C ATOM 701 C CYS A 70 -0.374 2.132 -4.325 1.00 0.00 C ATOM 702 O CYS A 70 0.038 1.663 -5.386 1.00 0.00 O ATOM 703 CB CYS A 70 0.412 0.223 -2.853 1.00 0.00 C ATOM 704 SG CYS A 70 0.279 -1.228 -3.962 1.00 0.00 S ATOM 0 H CYS A 70 -2.128 0.365 -4.444 1.00 0.00 H new ATOM 0 HA CYS A 70 -0.832 1.812 -2.247 1.00 0.00 H new ATOM 0 HB2 CYS A 70 1.379 0.708 -2.989 1.00 0.00 H new ATOM 0 HB3 CYS A 70 0.360 -0.098 -1.813 1.00 0.00 H new ATOM 0 HG CYS A 70 -0.678 -1.032 -4.820 1.00 0.00 H new ATOM 709 N CYS A 71 -0.555 3.425 -4.097 1.00 0.00 N ATOM 710 CA CYS A 71 -0.271 4.413 -5.122 1.00 0.00 C ATOM 711 C CYS A 71 1.247 4.583 -5.219 1.00 0.00 C ATOM 712 O CYS A 71 1.913 4.823 -4.213 1.00 0.00 O ATOM 713 CB CYS A 71 -0.976 5.741 -4.839 1.00 0.00 C ATOM 714 SG CYS A 71 -2.692 5.432 -4.283 1.00 0.00 S ATOM 0 H CYS A 71 -0.895 3.811 -3.216 1.00 0.00 H new ATOM 0 HA CYS A 71 -0.659 4.067 -6.080 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -0.432 6.296 -4.075 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -0.982 6.358 -5.738 1.00 0.00 H new ATOM 0 HG CYS A 71 -2.687 5.088 -3.029 1.00 0.00 H new ATOM 719 N LYS A 72 1.749 4.450 -6.438 1.00 0.00 N ATOM 720 CA LYS A 72 3.175 4.586 -6.679 1.00 0.00 C ATOM 721 C LYS A 72 3.476 6.012 -7.143 1.00 0.00 C ATOM 722 O LYS A 72 2.989 6.445 -8.186 1.00 0.00 O ATOM 723 CB LYS A 72 3.659 3.507 -7.650 1.00 0.00 C ATOM 724 CG LYS A 72 3.944 2.196 -6.916 1.00 0.00 C ATOM 725 CD LYS A 72 4.702 1.217 -7.815 1.00 0.00 C ATOM 726 CE LYS A 72 6.206 1.272 -7.539 1.00 0.00 C ATOM 727 NZ LYS A 72 6.851 2.300 -8.386 1.00 0.00 N ATOM 0 H LYS A 72 1.193 4.249 -7.269 1.00 0.00 H new ATOM 0 HA LYS A 72 3.734 4.427 -5.757 1.00 0.00 H new ATOM 0 HB2 LYS A 72 2.905 3.341 -8.419 1.00 0.00 H new ATOM 0 HB3 LYS A 72 4.562 3.848 -8.157 1.00 0.00 H new ATOM 0 HG2 LYS A 72 4.528 2.398 -6.018 1.00 0.00 H new ATOM 0 HG3 LYS A 72 3.006 1.746 -6.592 1.00 0.00 H new ATOM 0 HD2 LYS A 72 4.335 0.205 -7.647 1.00 0.00 H new ATOM 0 HD3 LYS A 72 4.512 1.456 -8.861 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.381 1.497 -6.487 1.00 0.00 H new ATOM 0 HE3 LYS A 72 6.654 0.298 -7.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 7.881 2.158 -8.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 6.496 2.220 -9.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 6.630 3.245 -8.013 1.00 0.00 H new ATOM 737 N SER A 73 4.278 6.703 -6.347 1.00 0.00 N ATOM 738 CA SER A 73 4.651 8.072 -6.663 1.00 0.00 C ATOM 739 C SER A 73 6.163 8.168 -6.870 1.00 0.00 C ATOM 740 O SER A 73 6.938 7.690 -6.042 1.00 0.00 O ATOM 741 CB SER A 73 4.204 9.033 -5.560 1.00 0.00 C ATOM 742 OG SER A 73 2.851 8.809 -5.173 1.00 0.00 O ATOM 0 H SER A 73 4.681 6.340 -5.483 1.00 0.00 H new ATOM 0 HA SER A 73 4.146 8.360 -7.585 1.00 0.00 H new ATOM 0 HB2 SER A 73 4.853 8.916 -4.692 1.00 0.00 H new ATOM 0 HB3 SER A 73 4.317 10.060 -5.907 1.00 0.00 H new ATOM 0 HG SER A 73 2.293 9.550 -5.490 1.00 0.00 H new ATOM 747 N ASN A 74 6.538 8.789 -7.978 1.00 0.00 N ATOM 748 CA ASN A 74 7.945 8.954 -8.304 1.00 0.00 C ATOM 749 C ASN A 74 8.243 10.440 -8.518 1.00 0.00 C ATOM 750 O ASN A 74 9.279 10.937 -8.079 1.00 0.00 O ATOM 751 CB ASN A 74 8.303 8.209 -9.592 1.00 0.00 C ATOM 752 CG ASN A 74 7.785 6.771 -9.556 1.00 0.00 C ATOM 753 OD1 ASN A 74 8.725 5.863 -9.307 1.00 0.00 O flip ATOM 754 ND2 ASN A 74 6.609 6.502 -9.741 1.00 0.00 N flip ATOM 0 H ASN A 74 5.892 9.184 -8.662 1.00 0.00 H new ATOM 0 HA ASN A 74 8.532 8.550 -7.479 1.00 0.00 H new ATOM 0 HB2 ASN A 74 7.877 8.731 -10.449 1.00 0.00 H new ATOM 0 HB3 ASN A 74 9.385 8.206 -9.726 1.00 0.00 H new ATOM 0 HD21 ASN A 74 5.938 7.248 -9.927 1.00 0.00 H new ATOM 0 HD22 ASN A 74 6.297 5.532 -9.709 1.00 0.00 H new ATOM 899 N ALA A 86 -3.757 11.808 -12.409 1.00 0.00 N ATOM 900 CA ALA A 86 -3.145 10.701 -11.695 1.00 0.00 C ATOM 901 C ALA A 86 -1.629 10.904 -11.653 1.00 0.00 C ATOM 902 O ALA A 86 -0.868 10.002 -12.001 1.00 0.00 O ATOM 903 CB ALA A 86 -3.538 9.382 -12.362 1.00 0.00 C ATOM 0 HA ALA A 86 -3.502 10.664 -10.666 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.078 8.552 -11.826 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.622 9.272 -12.340 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.194 9.381 -13.396 1.00 0.00 H new ATOM 909 N GLU A 87 -1.234 12.094 -11.224 1.00 0.00 N ATOM 910 CA GLU A 87 0.177 12.426 -11.131 1.00 0.00 C ATOM 911 C GLU A 87 1.007 11.161 -10.903 1.00 0.00 C ATOM 912 O GLU A 87 1.948 10.889 -11.647 1.00 0.00 O ATOM 913 CB GLU A 87 0.428 13.453 -10.025 1.00 0.00 C ATOM 914 CG GLU A 87 -0.395 14.720 -10.257 1.00 0.00 C ATOM 915 CD GLU A 87 0.265 15.932 -9.597 1.00 0.00 C ATOM 916 OE1 GLU A 87 1.488 16.090 -9.797 1.00 0.00 O ATOM 917 OE2 GLU A 87 -0.468 16.673 -8.907 1.00 0.00 O ATOM 0 H GLU A 87 -1.867 12.840 -10.937 1.00 0.00 H new ATOM 0 HA GLU A 87 0.487 12.875 -12.075 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.172 13.021 -9.058 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.488 13.705 -9.991 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.502 14.898 -11.327 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.399 14.584 -9.855 1.00 0.00 H new ATOM 922 N TYR A 88 0.628 10.420 -9.872 1.00 0.00 N ATOM 923 CA TYR A 88 1.325 9.190 -9.537 1.00 0.00 C ATOM 924 C TYR A 88 0.732 8.000 -10.295 1.00 0.00 C ATOM 925 O TYR A 88 0.341 8.131 -11.454 1.00 0.00 O ATOM 926 CB TYR A 88 1.112 8.980 -8.037 1.00 0.00 C ATOM 927 CG TYR A 88 1.353 10.234 -7.193 1.00 0.00 C ATOM 928 CD1 TYR A 88 2.094 11.279 -7.706 1.00 0.00 C ATOM 929 CD2 TYR A 88 0.830 10.319 -5.919 1.00 0.00 C ATOM 930 CE1 TYR A 88 2.321 12.459 -6.912 1.00 0.00 C ATOM 931 CE2 TYR A 88 1.056 11.499 -5.125 1.00 0.00 C ATOM 932 CZ TYR A 88 1.791 12.510 -5.661 1.00 0.00 C ATOM 933 OH TYR A 88 2.005 13.625 -4.911 1.00 0.00 O ATOM 0 H TYR A 88 -0.153 10.648 -9.257 1.00 0.00 H new ATOM 0 HA TYR A 88 2.379 9.262 -9.804 1.00 0.00 H new ATOM 0 HB2 TYR A 88 0.092 8.633 -7.870 1.00 0.00 H new ATOM 0 HB3 TYR A 88 1.779 8.189 -7.693 1.00 0.00 H new ATOM 0 HD1 TYR A 88 2.504 11.212 -8.703 1.00 0.00 H new ATOM 0 HD2 TYR A 88 0.251 9.501 -5.517 1.00 0.00 H new ATOM 0 HE1 TYR A 88 2.899 13.284 -7.301 1.00 0.00 H new ATOM 0 HE2 TYR A 88 0.651 11.579 -4.127 1.00 0.00 H new ATOM 0 HH TYR A 88 1.567 13.523 -4.040 1.00 0.00 H new ATOM 942 N ARG A 89 0.685 6.868 -9.610 1.00 0.00 N ATOM 943 CA ARG A 89 0.147 5.656 -10.204 1.00 0.00 C ATOM 944 C ARG A 89 -0.494 4.777 -9.128 1.00 0.00 C ATOM 945 O ARG A 89 -0.146 4.875 -7.952 1.00 0.00 O ATOM 946 CB ARG A 89 1.240 4.860 -10.919 1.00 0.00 C ATOM 947 CG ARG A 89 0.727 3.482 -11.344 1.00 0.00 C ATOM 948 CD ARG A 89 1.682 2.826 -12.344 1.00 0.00 C ATOM 949 NE ARG A 89 2.549 1.849 -11.650 1.00 0.00 N ATOM 950 CZ ARG A 89 3.586 1.224 -12.224 1.00 0.00 C ATOM 951 NH1 ARG A 89 3.892 1.471 -13.504 1.00 0.00 N ATOM 952 NH2 ARG A 89 4.318 0.352 -11.517 1.00 0.00 N ATOM 0 H ARG A 89 1.011 6.764 -8.649 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.607 5.951 -10.934 1.00 0.00 H new ATOM 0 HB2 ARG A 89 1.582 5.411 -11.795 1.00 0.00 H new ATOM 0 HB3 ARG A 89 2.100 4.744 -10.260 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.619 2.844 -10.467 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.262 3.580 -11.791 1.00 0.00 H new ATOM 0 HD2 ARG A 89 1.113 2.327 -13.129 1.00 0.00 H new ATOM 0 HD3 ARG A 89 2.293 3.587 -12.829 1.00 0.00 H new ATOM 0 HE ARG A 89 2.345 1.638 -10.673 1.00 0.00 H new ATOM 0 HH11 ARG A 89 3.336 2.135 -14.042 1.00 0.00 H new ATOM 0 HH12 ARG A 89 4.681 0.995 -13.941 1.00 0.00 H new ATOM 0 HH21 ARG A 89 4.086 0.164 -10.542 1.00 0.00 H new ATOM 0 HH22 ARG A 89 5.107 -0.124 -11.954 1.00 0.00 H new ATOM 963 N LEU A 90 -1.419 3.936 -9.569 1.00 0.00 N ATOM 964 CA LEU A 90 -2.111 3.040 -8.659 1.00 0.00 C ATOM 965 C LEU A 90 -1.715 1.596 -8.972 1.00 0.00 C ATOM 966 O LEU A 90 -1.610 1.216 -10.137 1.00 0.00 O ATOM 967 CB LEU A 90 -3.620 3.288 -8.707 1.00 0.00 C ATOM 968 CG LEU A 90 -4.501 2.178 -8.128 1.00 0.00 C ATOM 969 CD1 LEU A 90 -4.326 0.875 -8.911 1.00 0.00 C ATOM 970 CD2 LEU A 90 -4.234 1.989 -6.634 1.00 0.00 C ATOM 0 H LEU A 90 -1.705 3.857 -10.545 1.00 0.00 H new ATOM 0 HA LEU A 90 -1.811 3.237 -7.630 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.834 4.212 -8.169 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.909 3.449 -9.746 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.543 2.479 -8.233 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.963 0.103 -8.479 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -4.606 1.036 -9.952 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.285 0.557 -8.860 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.873 1.195 -6.248 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.189 1.720 -6.482 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -4.450 2.918 -6.105 1.00 0.00 H new ATOM 981 N LYS A 91 -1.505 0.830 -7.911 1.00 0.00 N ATOM 982 CA LYS A 91 -1.122 -0.564 -8.058 1.00 0.00 C ATOM 983 C LYS A 91 -2.140 -1.446 -7.331 1.00 0.00 C ATOM 984 O LYS A 91 -2.470 -1.195 -6.173 1.00 0.00 O ATOM 985 CB LYS A 91 0.319 -0.776 -7.593 1.00 0.00 C ATOM 986 CG LYS A 91 0.948 -1.983 -8.293 1.00 0.00 C ATOM 987 CD LYS A 91 1.856 -1.539 -9.441 1.00 0.00 C ATOM 988 CE LYS A 91 1.310 -2.018 -10.788 1.00 0.00 C ATOM 989 NZ LYS A 91 2.352 -2.753 -11.539 1.00 0.00 N ATOM 0 H LYS A 91 -1.593 1.149 -6.946 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.138 -0.856 -9.108 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.908 0.117 -7.801 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.338 -0.926 -6.514 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.524 -2.566 -7.574 1.00 0.00 H new ATOM 0 HG3 LYS A 91 0.163 -2.635 -8.677 1.00 0.00 H new ATOM 0 HD2 LYS A 91 1.940 -0.452 -9.444 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.860 -1.935 -9.290 1.00 0.00 H new ATOM 0 HE2 LYS A 91 0.446 -2.663 -10.628 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.967 -1.164 -11.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.964 -3.071 -12.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 3.165 -2.127 -11.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.660 -3.579 -10.987 1.00 0.00 H new ATOM 999 N GLU A 92 -2.608 -2.464 -8.041 1.00 0.00 N ATOM 1000 CA GLU A 92 -3.580 -3.384 -7.478 1.00 0.00 C ATOM 1001 C GLU A 92 -2.869 -4.550 -6.788 1.00 0.00 C ATOM 1002 O GLU A 92 -2.064 -5.245 -7.407 1.00 0.00 O ATOM 1003 CB GLU A 92 -4.544 -3.889 -8.554 1.00 0.00 C ATOM 1004 CG GLU A 92 -3.813 -4.749 -9.586 1.00 0.00 C ATOM 1005 CD GLU A 92 -4.151 -4.302 -11.010 1.00 0.00 C ATOM 1006 OE1 GLU A 92 -5.353 -4.068 -11.261 1.00 0.00 O ATOM 1007 OE2 GLU A 92 -3.199 -4.205 -11.815 1.00 0.00 O ATOM 0 H GLU A 92 -2.331 -2.671 -9.001 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.168 -2.849 -6.732 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.340 -4.471 -8.090 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.016 -3.041 -9.051 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -2.737 -4.681 -9.425 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -4.089 -5.795 -9.454 1.00 0.00 H new ATOM 1012 N LYS A 93 -3.192 -4.730 -5.516 1.00 0.00 N ATOM 1013 CA LYS A 93 -2.594 -5.800 -4.736 1.00 0.00 C ATOM 1014 C LYS A 93 -3.694 -6.560 -3.994 1.00 0.00 C ATOM 1015 O LYS A 93 -3.912 -6.340 -2.803 1.00 0.00 O ATOM 1016 CB LYS A 93 -1.502 -5.247 -3.818 1.00 0.00 C ATOM 1017 CG LYS A 93 -0.584 -4.286 -4.574 1.00 0.00 C ATOM 1018 CD LYS A 93 0.802 -4.230 -3.930 1.00 0.00 C ATOM 1019 CE LYS A 93 1.842 -3.691 -4.914 1.00 0.00 C ATOM 1020 NZ LYS A 93 2.979 -3.084 -4.186 1.00 0.00 N ATOM 0 H LYS A 93 -3.860 -4.153 -5.006 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.097 -6.516 -5.390 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -1.959 -4.730 -2.974 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.915 -6.069 -3.409 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.494 -4.605 -5.612 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.025 -3.289 -4.584 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.770 -3.595 -3.045 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.093 -5.226 -3.597 1.00 0.00 H new ATOM 0 HE2 LYS A 93 2.201 -4.499 -5.552 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.383 -2.949 -5.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.761 -2.908 -4.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.678 -2.185 -3.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 3.298 -3.732 -3.438 1.00 0.00 H new ATOM 1030 N PHE A 94 -4.361 -7.440 -4.728 1.00 0.00 N ATOM 1031 CA PHE A 94 -5.433 -8.234 -4.155 1.00 0.00 C ATOM 1032 C PHE A 94 -4.909 -9.142 -3.040 1.00 0.00 C ATOM 1033 O PHE A 94 -4.685 -10.331 -3.256 1.00 0.00 O ATOM 1034 CB PHE A 94 -5.998 -9.103 -5.280 1.00 0.00 C ATOM 1035 CG PHE A 94 -6.215 -8.354 -6.596 1.00 0.00 C ATOM 1036 CD1 PHE A 94 -6.647 -7.064 -6.581 1.00 0.00 C ATOM 1037 CD2 PHE A 94 -5.976 -8.978 -7.781 1.00 0.00 C ATOM 1038 CE1 PHE A 94 -6.848 -6.369 -7.803 1.00 0.00 C ATOM 1039 CE2 PHE A 94 -6.177 -8.281 -9.003 1.00 0.00 C ATOM 1040 CZ PHE A 94 -6.609 -6.992 -8.988 1.00 0.00 C ATOM 0 H PHE A 94 -4.179 -7.620 -5.715 1.00 0.00 H new ATOM 0 HA PHE A 94 -6.192 -7.579 -3.727 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.319 -9.937 -5.456 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.948 -9.528 -4.955 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -6.837 -6.569 -5.640 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -5.634 -10.002 -7.793 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -7.191 -5.345 -7.791 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -5.986 -8.775 -9.944 1.00 0.00 H new ATOM 0 HZ PHE A 94 -6.762 -6.463 -9.917 1.00 0.00 H new ATOM 1049 N PHE A 95 -4.727 -8.544 -1.871 1.00 0.00 N ATOM 1050 CA PHE A 95 -4.233 -9.284 -0.722 1.00 0.00 C ATOM 1051 C PHE A 95 -4.886 -8.789 0.571 1.00 0.00 C ATOM 1052 O PHE A 95 -4.491 -9.193 1.663 1.00 0.00 O ATOM 1053 CB PHE A 95 -2.724 -9.034 -0.645 1.00 0.00 C ATOM 1054 CG PHE A 95 -1.988 -9.262 -1.966 1.00 0.00 C ATOM 1055 CD1 PHE A 95 -1.661 -10.523 -2.353 1.00 0.00 C ATOM 1056 CD2 PHE A 95 -1.660 -8.202 -2.753 1.00 0.00 C ATOM 1057 CE1 PHE A 95 -0.977 -10.735 -3.580 1.00 0.00 C ATOM 1058 CE2 PHE A 95 -0.976 -8.414 -3.980 1.00 0.00 C ATOM 1059 CZ PHE A 95 -0.649 -9.676 -4.367 1.00 0.00 C ATOM 0 H PHE A 95 -4.913 -7.557 -1.695 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.466 -10.343 -0.833 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -2.552 -8.009 -0.317 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -2.296 -9.688 0.115 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -1.921 -11.364 -1.728 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.919 -7.200 -2.445 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -0.718 -11.737 -3.888 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -0.716 -7.573 -4.605 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.129 -9.837 -5.300 1.00 0.00 H new ATOM 1068 N MET A 96 -5.874 -7.923 0.402 1.00 0.00 N ATOM 1069 CA MET A 96 -6.587 -7.370 1.542 1.00 0.00 C ATOM 1070 C MET A 96 -7.289 -8.472 2.337 1.00 0.00 C ATOM 1071 O MET A 96 -7.781 -8.231 3.438 1.00 0.00 O ATOM 1072 CB MET A 96 -7.621 -6.354 1.053 1.00 0.00 C ATOM 1073 CG MET A 96 -8.688 -6.103 2.120 1.00 0.00 C ATOM 1074 SD MET A 96 -9.992 -7.313 1.976 1.00 0.00 S ATOM 1075 CE MET A 96 -10.842 -7.039 3.522 1.00 0.00 C ATOM 0 H MET A 96 -6.198 -7.590 -0.506 1.00 0.00 H new ATOM 0 HA MET A 96 -5.865 -6.881 2.196 1.00 0.00 H new ATOM 0 HB2 MET A 96 -7.125 -5.417 0.802 1.00 0.00 H new ATOM 0 HB3 MET A 96 -8.092 -6.719 0.141 1.00 0.00 H new ATOM 0 HG2 MET A 96 -8.241 -6.155 3.113 1.00 0.00 H new ATOM 0 HG3 MET A 96 -9.098 -5.099 2.007 1.00 0.00 H new ATOM 0 HE1 MET A 96 -10.611 -7.850 4.213 1.00 0.00 H new ATOM 0 HE2 MET A 96 -10.518 -6.092 3.953 1.00 0.00 H new ATOM 0 HE3 MET A 96 -11.917 -7.008 3.346 1.00 0.00 H new ATOM 1083 N ARG A 97 -7.313 -9.659 1.749 1.00 0.00 N ATOM 1084 CA ARG A 97 -7.947 -10.799 2.388 1.00 0.00 C ATOM 1085 C ARG A 97 -6.888 -11.793 2.872 1.00 0.00 C ATOM 1086 O ARG A 97 -7.221 -12.823 3.455 1.00 0.00 O ATOM 1087 CB ARG A 97 -8.902 -11.510 1.427 1.00 0.00 C ATOM 1088 CG ARG A 97 -10.165 -11.976 2.154 1.00 0.00 C ATOM 1089 CD ARG A 97 -11.329 -11.016 1.903 1.00 0.00 C ATOM 1090 NE ARG A 97 -11.986 -11.343 0.617 1.00 0.00 N ATOM 1091 CZ ARG A 97 -12.693 -12.460 0.398 1.00 0.00 C ATOM 1092 NH1 ARG A 97 -12.839 -13.364 1.376 1.00 0.00 N ATOM 1093 NH2 ARG A 97 -13.254 -12.673 -0.801 1.00 0.00 N ATOM 0 H ARG A 97 -6.903 -9.856 0.836 1.00 0.00 H new ATOM 0 HA ARG A 97 -8.517 -10.427 3.239 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -9.174 -10.837 0.614 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.400 -12.367 0.977 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.435 -12.976 1.816 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.969 -12.043 3.224 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -12.050 -11.085 2.717 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.966 -9.988 1.885 1.00 0.00 H new ATOM 0 HE ARG A 97 -11.895 -10.677 -0.150 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -12.412 -13.202 2.288 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -13.377 -14.214 1.209 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -13.142 -11.985 -1.546 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -13.792 -13.523 -0.968 1.00 0.00 H new ATOM 1104 N LYS A 98 -5.636 -11.448 2.611 1.00 0.00 N ATOM 1105 CA LYS A 98 -4.527 -12.297 3.011 1.00 0.00 C ATOM 1106 C LYS A 98 -3.208 -11.592 2.689 1.00 0.00 C ATOM 1107 O LYS A 98 -3.025 -11.087 1.582 1.00 0.00 O ATOM 1108 CB LYS A 98 -4.656 -13.683 2.375 1.00 0.00 C ATOM 1109 CG LYS A 98 -4.935 -14.749 3.436 1.00 0.00 C ATOM 1110 CD LYS A 98 -3.679 -15.570 3.733 1.00 0.00 C ATOM 1111 CE LYS A 98 -3.111 -15.223 5.110 1.00 0.00 C ATOM 1112 NZ LYS A 98 -1.857 -15.970 5.357 1.00 0.00 N ATOM 0 H LYS A 98 -5.365 -10.592 2.127 1.00 0.00 H new ATOM 0 HA LYS A 98 -4.544 -12.464 4.088 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -5.461 -13.676 1.640 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -3.739 -13.928 1.840 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -5.287 -14.273 4.351 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -5.732 -15.409 3.093 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -3.917 -16.633 3.691 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.927 -15.381 2.967 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -2.921 -14.151 5.172 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -3.842 -15.462 5.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -1.485 -15.723 6.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -2.048 -16.992 5.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.156 -15.721 4.630 1.00 0.00 H new ATOM 1122 N VAL A 99 -2.324 -11.581 3.675 1.00 0.00 N ATOM 1123 CA VAL A 99 -1.027 -10.946 3.510 1.00 0.00 C ATOM 1124 C VAL A 99 -0.011 -11.623 4.431 1.00 0.00 C ATOM 1125 O VAL A 99 -0.331 -12.607 5.097 1.00 0.00 O ATOM 1126 CB VAL A 99 -1.147 -9.440 3.756 1.00 0.00 C ATOM 1127 CG1 VAL A 99 -2.377 -8.865 3.052 1.00 0.00 C ATOM 1128 CG2 VAL A 99 -1.176 -9.130 5.254 1.00 0.00 C ATOM 0 H VAL A 99 -2.480 -12.001 4.591 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.670 -11.068 2.487 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.265 -8.960 3.332 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.438 -7.794 3.243 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.296 -9.038 1.979 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.275 -9.353 3.431 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.262 -8.053 5.401 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.031 -9.628 5.712 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.256 -9.487 5.717 1.00 0.00 H new ATOM 1138 N GLN A 100 1.193 -11.071 4.440 1.00 0.00 N ATOM 1139 CA GLN A 100 2.258 -11.610 5.269 1.00 0.00 C ATOM 1140 C GLN A 100 3.440 -10.640 5.312 1.00 0.00 C ATOM 1141 O GLN A 100 4.404 -10.796 4.565 1.00 0.00 O ATOM 1142 CB GLN A 100 2.698 -12.987 4.769 1.00 0.00 C ATOM 1143 CG GLN A 100 2.412 -14.066 5.815 1.00 0.00 C ATOM 1144 CD GLN A 100 3.442 -15.195 5.735 1.00 0.00 C ATOM 1145 OE1 GLN A 100 4.047 -15.446 4.705 1.00 0.00 O ATOM 1146 NE2 GLN A 100 3.609 -15.858 6.875 1.00 0.00 N ATOM 0 H GLN A 100 1.455 -10.256 3.886 1.00 0.00 H new ATOM 0 HA GLN A 100 1.876 -11.732 6.283 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.176 -13.226 3.843 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.763 -12.971 4.539 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.428 -13.625 6.812 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.411 -14.470 5.661 1.00 0.00 H new ATOM 0 HE21 GLN A 100 3.070 -15.596 7.701 1.00 0.00 H new ATOM 0 HE22 GLN A 100 4.276 -16.628 6.924 1.00 0.00 H new ATOM 1153 N ILE A 101 3.326 -9.658 6.195 1.00 0.00 N ATOM 1154 CA ILE A 101 4.373 -8.662 6.345 1.00 0.00 C ATOM 1155 C ILE A 101 5.538 -9.267 7.131 1.00 0.00 C ATOM 1156 O ILE A 101 5.328 -10.073 8.037 1.00 0.00 O ATOM 1157 CB ILE A 101 3.811 -7.382 6.967 1.00 0.00 C ATOM 1158 CG1 ILE A 101 4.935 -6.415 7.344 1.00 0.00 C ATOM 1159 CG2 ILE A 101 2.907 -7.703 8.159 1.00 0.00 C ATOM 1160 CD1 ILE A 101 4.667 -5.017 6.785 1.00 0.00 C ATOM 0 H ILE A 101 2.525 -9.531 6.813 1.00 0.00 H new ATOM 0 HA ILE A 101 4.763 -8.370 5.370 1.00 0.00 H new ATOM 0 HB ILE A 101 3.194 -6.882 6.220 1.00 0.00 H new ATOM 0 HG12 ILE A 101 5.028 -6.365 8.429 1.00 0.00 H new ATOM 0 HG13 ILE A 101 5.884 -6.788 6.960 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.521 -6.776 8.583 1.00 0.00 H new ATOM 0 HG22 ILE A 101 2.075 -8.325 7.828 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.480 -8.237 8.917 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.481 -4.350 7.068 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.599 -5.067 5.698 1.00 0.00 H new ATOM 0 HD13 ILE A 101 3.729 -4.637 7.190 1.00 0.00 H new ATOM 1171 N ASN A 102 6.741 -8.856 6.757 1.00 0.00 N ATOM 1172 CA ASN A 102 7.938 -9.347 7.417 1.00 0.00 C ATOM 1173 C ASN A 102 8.864 -8.169 7.728 1.00 0.00 C ATOM 1174 O ASN A 102 9.783 -7.879 6.963 1.00 0.00 O ATOM 1175 CB ASN A 102 8.700 -10.323 6.518 1.00 0.00 C ATOM 1176 CG ASN A 102 8.606 -11.753 7.057 1.00 0.00 C ATOM 1177 OD1 ASN A 102 9.503 -12.256 7.713 1.00 0.00 O ATOM 1178 ND2 ASN A 102 7.473 -12.374 6.745 1.00 0.00 N ATOM 0 H ASN A 102 6.912 -8.188 6.005 1.00 0.00 H new ATOM 0 HA ASN A 102 7.634 -9.859 8.330 1.00 0.00 H new ATOM 0 HB2 ASN A 102 8.294 -10.284 5.507 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.746 -10.023 6.454 1.00 0.00 H new ATOM 0 HD21 ASN A 102 7.313 -13.331 7.059 1.00 0.00 H new ATOM 0 HD22 ASN A 102 6.763 -11.893 6.192 1.00 0.00 H new ATOM 1184 N ASP A 103 8.591 -7.524 8.852 1.00 0.00 N ATOM 1185 CA ASP A 103 9.388 -6.384 9.273 1.00 0.00 C ATOM 1186 C ASP A 103 10.825 -6.841 9.532 1.00 0.00 C ATOM 1187 O ASP A 103 11.221 -7.032 10.681 1.00 0.00 O ATOM 1188 CB ASP A 103 8.844 -5.779 10.568 1.00 0.00 C ATOM 1189 CG ASP A 103 8.843 -6.723 11.773 1.00 0.00 C ATOM 1190 OD1 ASP A 103 9.146 -7.916 11.558 1.00 0.00 O ATOM 1191 OD2 ASP A 103 8.541 -6.229 12.880 1.00 0.00 O ATOM 0 H ASP A 103 7.829 -7.769 9.484 1.00 0.00 H new ATOM 0 HA ASP A 103 9.350 -5.635 8.482 1.00 0.00 H new ATOM 0 HB2 ASP A 103 9.436 -4.898 10.816 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.824 -5.438 10.392 1.00 0.00 H new ATOM 1195 N LYS A 104 11.567 -7.002 8.446 1.00 0.00 N ATOM 1196 CA LYS A 104 12.951 -7.431 8.541 1.00 0.00 C ATOM 1197 C LYS A 104 13.870 -6.231 8.310 1.00 0.00 C ATOM 1198 O LYS A 104 14.424 -6.068 7.224 1.00 0.00 O ATOM 1199 CB LYS A 104 13.216 -8.601 7.591 1.00 0.00 C ATOM 1200 CG LYS A 104 14.019 -9.702 8.286 1.00 0.00 C ATOM 1201 CD LYS A 104 14.512 -10.741 7.276 1.00 0.00 C ATOM 1202 CE LYS A 104 16.037 -10.866 7.319 1.00 0.00 C ATOM 1203 NZ LYS A 104 16.606 -10.722 5.961 1.00 0.00 N ATOM 0 H LYS A 104 11.235 -6.843 7.495 1.00 0.00 H new ATOM 0 HA LYS A 104 13.165 -7.808 9.541 1.00 0.00 H new ATOM 0 HB2 LYS A 104 12.269 -9.007 7.235 1.00 0.00 H new ATOM 0 HB3 LYS A 104 13.760 -8.247 6.715 1.00 0.00 H new ATOM 0 HG2 LYS A 104 14.870 -9.263 8.807 1.00 0.00 H new ATOM 0 HG3 LYS A 104 13.400 -10.188 9.040 1.00 0.00 H new ATOM 0 HD2 LYS A 104 14.058 -11.708 7.492 1.00 0.00 H new ATOM 0 HD3 LYS A 104 14.195 -10.457 6.273 1.00 0.00 H new ATOM 0 HE2 LYS A 104 16.452 -10.102 7.977 1.00 0.00 H new ATOM 0 HE3 LYS A 104 16.317 -11.833 7.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 17.641 -10.809 6.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 16.223 -11.466 5.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 16.354 -9.789 5.576 1.00 0.00 H new ATOM 1213 N ASP A 105 14.006 -5.421 9.351 1.00 0.00 N ATOM 1214 CA ASP A 105 14.849 -4.240 9.275 1.00 0.00 C ATOM 1215 C ASP A 105 15.332 -3.873 10.680 1.00 0.00 C ATOM 1216 O ASP A 105 15.331 -4.711 11.579 1.00 0.00 O ATOM 1217 CB ASP A 105 14.075 -3.046 8.714 1.00 0.00 C ATOM 1218 CG ASP A 105 14.924 -2.020 7.962 1.00 0.00 C ATOM 1219 OD1 ASP A 105 15.677 -2.456 7.063 1.00 0.00 O ATOM 1220 OD2 ASP A 105 14.802 -0.823 8.301 1.00 0.00 O ATOM 0 H ASP A 105 13.546 -5.560 10.251 1.00 0.00 H new ATOM 0 HA ASP A 105 15.688 -4.466 8.617 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.301 -3.417 8.042 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.568 -2.542 9.537 1.00 0.00 H new ATOM 1224 N ASP A 106 15.734 -2.619 10.824 1.00 0.00 N ATOM 1225 CA ASP A 106 16.219 -2.130 12.102 1.00 0.00 C ATOM 1226 C ASP A 106 17.001 -0.833 11.886 1.00 0.00 C ATOM 1227 O ASP A 106 17.124 -0.018 12.798 1.00 0.00 O ATOM 1228 CB ASP A 106 17.157 -3.145 12.760 1.00 0.00 C ATOM 1229 CG ASP A 106 16.660 -3.721 14.087 1.00 0.00 C ATOM 1230 OD1 ASP A 106 15.934 -4.737 14.028 1.00 0.00 O ATOM 1231 OD2 ASP A 106 17.016 -3.132 15.130 1.00 0.00 O ATOM 0 H ASP A 106 15.734 -1.926 10.075 1.00 0.00 H new ATOM 0 HA ASP A 106 15.357 -1.964 12.748 1.00 0.00 H new ATOM 0 HB2 ASP A 106 17.323 -3.967 12.064 1.00 0.00 H new ATOM 0 HB3 ASP A 106 18.123 -2.669 12.927 1.00 0.00 H new ATOM 1235 N THR A 107 17.511 -0.684 10.671 1.00 0.00 N ATOM 1236 CA THR A 107 18.278 0.500 10.323 1.00 0.00 C ATOM 1237 C THR A 107 19.642 0.474 11.015 1.00 0.00 C ATOM 1238 O THR A 107 20.490 1.327 10.756 1.00 0.00 O ATOM 1239 CB THR A 107 17.439 1.729 10.678 1.00 0.00 C ATOM 1240 OG1 THR A 107 17.768 1.991 12.040 1.00 0.00 O ATOM 1241 CG2 THR A 107 15.939 1.425 10.710 1.00 0.00 C ATOM 0 H THR A 107 17.408 -1.363 9.917 1.00 0.00 H new ATOM 0 HA THR A 107 18.491 0.533 9.255 1.00 0.00 H new ATOM 0 HB THR A 107 17.634 2.522 9.956 1.00 0.00 H new ATOM 0 HG1 THR A 107 17.787 1.148 12.540 1.00 0.00 H new ATOM 0 HG21 THR A 107 15.390 2.331 10.967 1.00 0.00 H new ATOM 0 HG22 THR A 107 15.618 1.072 9.730 1.00 0.00 H new ATOM 0 HG23 THR A 107 15.739 0.656 11.456 1.00 0.00 H new ATOM 1249 N ASN A 108 19.812 -0.513 11.881 1.00 0.00 N ATOM 1250 CA ASN A 108 21.059 -0.661 12.613 1.00 0.00 C ATOM 1251 C ASN A 108 22.198 -0.912 11.624 1.00 0.00 C ATOM 1252 O ASN A 108 23.365 -0.950 12.012 1.00 0.00 O ATOM 1253 CB ASN A 108 20.996 -1.851 13.573 1.00 0.00 C ATOM 1254 CG ASN A 108 20.595 -1.400 14.980 1.00 0.00 C ATOM 1255 OD1 ASN A 108 20.273 -0.248 15.222 1.00 0.00 O ATOM 1256 ND2 ASN A 108 20.631 -2.368 15.890 1.00 0.00 N ATOM 0 H ASN A 108 19.107 -1.219 12.093 1.00 0.00 H new ATOM 0 HA ASN A 108 21.227 0.253 13.182 1.00 0.00 H new ATOM 0 HB2 ASN A 108 20.278 -2.583 13.204 1.00 0.00 H new ATOM 0 HB3 ASN A 108 21.967 -2.346 13.609 1.00 0.00 H new ATOM 0 HD21 ASN A 108 20.380 -2.168 16.858 1.00 0.00 H new ATOM 0 HD22 ASN A 108 20.910 -3.311 15.620 1.00 0.00 H new ATOM 1262 N GLU A 109 21.820 -1.078 10.365 1.00 0.00 N ATOM 1263 CA GLU A 109 22.797 -1.324 9.317 1.00 0.00 C ATOM 1264 C GLU A 109 22.225 -0.926 7.954 1.00 0.00 C ATOM 1265 O GLU A 109 22.974 -0.687 7.008 1.00 0.00 O ATOM 1266 CB GLU A 109 23.244 -2.788 9.317 1.00 0.00 C ATOM 1267 CG GLU A 109 24.220 -3.063 8.171 1.00 0.00 C ATOM 1268 CD GLU A 109 25.292 -4.068 8.594 1.00 0.00 C ATOM 1269 OE1 GLU A 109 26.203 -3.647 9.339 1.00 0.00 O ATOM 1270 OE2 GLU A 109 25.177 -5.235 8.163 1.00 0.00 O ATOM 0 H GLU A 109 20.851 -1.047 10.047 1.00 0.00 H new ATOM 0 HA GLU A 109 23.675 -0.710 9.515 1.00 0.00 H new ATOM 0 HB2 GLU A 109 23.718 -3.027 10.269 1.00 0.00 H new ATOM 0 HB3 GLU A 109 22.374 -3.438 9.222 1.00 0.00 H new ATOM 0 HG2 GLU A 109 23.675 -3.448 7.309 1.00 0.00 H new ATOM 0 HG3 GLU A 109 24.692 -2.131 7.859 1.00 0.00 H new ATOM 1275 N TYR A 110 20.902 -0.867 7.898 1.00 0.00 N ATOM 1276 CA TYR A 110 20.221 -0.502 6.667 1.00 0.00 C ATOM 1277 C TYR A 110 19.599 0.892 6.777 1.00 0.00 C ATOM 1278 O TYR A 110 19.847 1.612 7.745 1.00 0.00 O ATOM 1279 CB TYR A 110 19.106 -1.532 6.480 1.00 0.00 C ATOM 1280 CG TYR A 110 19.587 -2.879 5.938 1.00 0.00 C ATOM 1281 CD1 TYR A 110 20.350 -3.710 6.733 1.00 0.00 C ATOM 1282 CD2 TYR A 110 19.259 -3.262 4.653 1.00 0.00 C ATOM 1283 CE1 TYR A 110 20.803 -4.978 6.222 1.00 0.00 C ATOM 1284 CE2 TYR A 110 19.712 -4.530 4.143 1.00 0.00 C ATOM 1285 CZ TYR A 110 20.462 -5.325 4.952 1.00 0.00 C ATOM 1286 OH TYR A 110 20.889 -6.522 4.469 1.00 0.00 O ATOM 0 H TYR A 110 20.284 -1.066 8.685 1.00 0.00 H new ATOM 0 HA TYR A 110 20.921 -0.488 5.831 1.00 0.00 H new ATOM 0 HB2 TYR A 110 18.610 -1.693 7.437 1.00 0.00 H new ATOM 0 HB3 TYR A 110 18.359 -1.124 5.799 1.00 0.00 H new ATOM 0 HD1 TYR A 110 20.607 -3.410 7.738 1.00 0.00 H new ATOM 0 HD2 TYR A 110 18.663 -2.611 4.031 1.00 0.00 H new ATOM 0 HE1 TYR A 110 21.400 -5.638 6.833 1.00 0.00 H new ATOM 0 HE2 TYR A 110 19.462 -4.843 3.140 1.00 0.00 H new ATOM 0 HH TYR A 110 20.569 -6.637 3.550 1.00 0.00 H new ATOM 1295 N LYS A 111 18.805 1.232 5.774 1.00 0.00 N ATOM 1296 CA LYS A 111 18.145 2.526 5.746 1.00 0.00 C ATOM 1297 C LYS A 111 16.972 2.518 6.728 1.00 0.00 C ATOM 1298 O LYS A 111 17.130 2.886 7.891 1.00 0.00 O ATOM 1299 CB LYS A 111 17.747 2.893 4.315 1.00 0.00 C ATOM 1300 CG LYS A 111 16.800 4.095 4.301 1.00 0.00 C ATOM 1301 CD LYS A 111 17.457 5.318 4.942 1.00 0.00 C ATOM 1302 CE LYS A 111 16.623 5.839 6.114 1.00 0.00 C ATOM 1303 NZ LYS A 111 16.944 7.257 6.390 1.00 0.00 N ATOM 0 H LYS A 111 18.603 0.633 4.973 1.00 0.00 H new ATOM 0 HA LYS A 111 18.829 3.309 6.073 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.640 3.122 3.733 1.00 0.00 H new ATOM 0 HB3 LYS A 111 17.265 2.040 3.838 1.00 0.00 H new ATOM 0 HG2 LYS A 111 16.516 4.327 3.274 1.00 0.00 H new ATOM 0 HG3 LYS A 111 15.884 3.847 4.837 1.00 0.00 H new ATOM 0 HD2 LYS A 111 18.457 5.057 5.290 1.00 0.00 H new ATOM 0 HD3 LYS A 111 17.574 6.105 4.197 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.562 5.738 5.886 1.00 0.00 H new ATOM 0 HE3 LYS A 111 16.817 5.237 7.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 16.369 7.594 7.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 17.952 7.345 6.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 16.737 7.830 5.547 1.00 0.00 H new ATOM 1313 N HIS A 112 15.823 2.093 6.224 1.00 0.00 N ATOM 1314 CA HIS A 112 14.624 2.032 7.043 1.00 0.00 C ATOM 1315 C HIS A 112 13.469 1.461 6.219 1.00 0.00 C ATOM 1316 O HIS A 112 12.620 2.207 5.733 1.00 0.00 O ATOM 1317 CB HIS A 112 14.305 3.403 7.642 1.00 0.00 C ATOM 1318 CG HIS A 112 13.672 3.342 9.012 1.00 0.00 C ATOM 1319 ND1 HIS A 112 12.767 2.361 9.376 1.00 0.00 N ATOM 1320 CD2 HIS A 112 13.822 4.150 10.100 1.00 0.00 C ATOM 1321 CE1 HIS A 112 12.396 2.579 10.629 1.00 0.00 C ATOM 1322 NE2 HIS A 112 13.050 3.689 11.076 1.00 0.00 N ATOM 0 H HIS A 112 15.697 1.788 5.259 1.00 0.00 H new ATOM 0 HA HIS A 112 14.789 1.362 7.887 1.00 0.00 H new ATOM 0 HB2 HIS A 112 15.225 3.984 7.704 1.00 0.00 H new ATOM 0 HB3 HIS A 112 13.636 3.936 6.967 1.00 0.00 H new ATOM 0 HD2 HIS A 112 14.461 5.019 10.158 1.00 0.00 H new ATOM 0 HE1 HIS A 112 11.698 1.982 11.197 1.00 0.00 H new ATOM 0 HE2 HIS A 112 12.961 4.097 12.006 1.00 0.00 H new ATOM 1329 N ALA A 113 13.473 0.142 6.087 1.00 0.00 N ATOM 1330 CA ALA A 113 12.435 -0.537 5.330 1.00 0.00 C ATOM 1331 C ALA A 113 12.508 -2.040 5.608 1.00 0.00 C ATOM 1332 O ALA A 113 13.588 -2.578 5.851 1.00 0.00 O ATOM 1333 CB ALA A 113 12.592 -0.211 3.842 1.00 0.00 C ATOM 0 H ALA A 113 14.178 -0.474 6.491 1.00 0.00 H new ATOM 0 HA ALA A 113 11.448 -0.192 5.637 1.00 0.00 H new ATOM 0 HB1 ALA A 113 11.814 -0.720 3.274 1.00 0.00 H new ATOM 0 HB2 ALA A 113 12.504 0.865 3.694 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.570 -0.546 3.497 1.00 0.00 H new ATOM 1339 N PHE A 114 11.346 -2.675 5.564 1.00 0.00 N ATOM 1340 CA PHE A 114 11.265 -4.104 5.809 1.00 0.00 C ATOM 1341 C PHE A 114 10.797 -4.849 4.557 1.00 0.00 C ATOM 1342 O PHE A 114 10.448 -4.227 3.554 1.00 0.00 O ATOM 1343 CB PHE A 114 10.237 -4.310 6.924 1.00 0.00 C ATOM 1344 CG PHE A 114 9.373 -3.079 7.208 1.00 0.00 C ATOM 1345 CD1 PHE A 114 9.953 -1.923 7.626 1.00 0.00 C ATOM 1346 CD2 PHE A 114 8.025 -3.142 7.042 1.00 0.00 C ATOM 1347 CE1 PHE A 114 9.151 -0.780 7.889 1.00 0.00 C ATOM 1348 CE2 PHE A 114 7.222 -2.000 7.306 1.00 0.00 C ATOM 1349 CZ PHE A 114 7.804 -0.844 7.724 1.00 0.00 C ATOM 0 H PHE A 114 10.453 -2.226 5.362 1.00 0.00 H new ATOM 0 HA PHE A 114 12.246 -4.490 6.084 1.00 0.00 H new ATOM 0 HB2 PHE A 114 9.587 -5.143 6.656 1.00 0.00 H new ATOM 0 HB3 PHE A 114 10.759 -4.594 7.838 1.00 0.00 H new ATOM 0 HD1 PHE A 114 11.024 -1.873 7.758 1.00 0.00 H new ATOM 0 HD2 PHE A 114 7.564 -4.060 6.709 1.00 0.00 H new ATOM 0 HE1 PHE A 114 9.612 0.139 8.220 1.00 0.00 H new ATOM 0 HE2 PHE A 114 6.151 -2.050 7.175 1.00 0.00 H new ATOM 0 HZ PHE A 114 7.194 0.025 7.925 1.00 0.00 H new ATOM 1358 N GLU A 115 10.804 -6.170 4.656 1.00 0.00 N ATOM 1359 CA GLU A 115 10.384 -7.006 3.543 1.00 0.00 C ATOM 1360 C GLU A 115 8.951 -7.498 3.760 1.00 0.00 C ATOM 1361 O GLU A 115 8.670 -8.195 4.733 1.00 0.00 O ATOM 1362 CB GLU A 115 11.343 -8.182 3.350 1.00 0.00 C ATOM 1363 CG GLU A 115 12.653 -7.953 4.108 1.00 0.00 C ATOM 1364 CD GLU A 115 13.786 -8.789 3.510 1.00 0.00 C ATOM 1365 OE1 GLU A 115 13.907 -9.961 3.925 1.00 0.00 O ATOM 1366 OE2 GLU A 115 14.506 -8.235 2.650 1.00 0.00 O ATOM 0 H GLU A 115 11.094 -6.682 5.489 1.00 0.00 H new ATOM 0 HA GLU A 115 10.408 -6.406 2.633 1.00 0.00 H new ATOM 0 HB2 GLU A 115 10.872 -9.101 3.700 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.552 -8.315 2.288 1.00 0.00 H new ATOM 0 HG2 GLU A 115 12.918 -6.896 4.072 1.00 0.00 H new ATOM 0 HG3 GLU A 115 12.520 -8.213 5.158 1.00 0.00 H new ATOM 1371 N ILE A 116 8.082 -7.113 2.836 1.00 0.00 N ATOM 1372 CA ILE A 116 6.685 -7.506 2.913 1.00 0.00 C ATOM 1373 C ILE A 116 6.463 -8.756 2.058 1.00 0.00 C ATOM 1374 O ILE A 116 7.240 -9.034 1.146 1.00 0.00 O ATOM 1375 CB ILE A 116 5.778 -6.334 2.538 1.00 0.00 C ATOM 1376 CG1 ILE A 116 6.416 -4.999 2.929 1.00 0.00 C ATOM 1377 CG2 ILE A 116 4.384 -6.502 3.146 1.00 0.00 C ATOM 1378 CD1 ILE A 116 7.050 -5.081 4.319 1.00 0.00 C ATOM 0 H ILE A 116 8.318 -6.533 2.031 1.00 0.00 H new ATOM 0 HA ILE A 116 6.419 -7.769 3.937 1.00 0.00 H new ATOM 0 HB ILE A 116 5.658 -6.329 1.455 1.00 0.00 H new ATOM 0 HG12 ILE A 116 7.174 -4.725 2.195 1.00 0.00 H new ATOM 0 HG13 ILE A 116 5.661 -4.213 2.916 1.00 0.00 H new ATOM 0 HG21 ILE A 116 3.759 -5.655 2.864 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.934 -7.423 2.776 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.464 -6.548 4.232 1.00 0.00 H new ATOM 0 HD11 ILE A 116 7.496 -4.119 4.573 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.285 -5.331 5.054 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.821 -5.851 4.322 1.00 0.00 H new ATOM 1389 N ILE A 117 5.398 -9.474 2.382 1.00 0.00 N ATOM 1390 CA ILE A 117 5.063 -10.686 1.655 1.00 0.00 C ATOM 1391 C ILE A 117 3.549 -10.897 1.693 1.00 0.00 C ATOM 1392 O ILE A 117 2.987 -11.205 2.743 1.00 0.00 O ATOM 1393 CB ILE A 117 5.863 -11.873 2.196 1.00 0.00 C ATOM 1394 CG1 ILE A 117 7.339 -11.764 1.809 1.00 0.00 C ATOM 1395 CG2 ILE A 117 5.249 -13.200 1.743 1.00 0.00 C ATOM 1396 CD1 ILE A 117 8.132 -12.966 2.322 1.00 0.00 C ATOM 0 H ILE A 117 4.756 -9.239 3.139 1.00 0.00 H new ATOM 0 HA ILE A 117 5.345 -10.591 0.606 1.00 0.00 H new ATOM 0 HB ILE A 117 5.814 -11.849 3.285 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.430 -11.700 0.725 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.759 -10.845 2.219 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.836 -14.027 2.141 1.00 0.00 H new ATOM 0 HG22 ILE A 117 4.225 -13.272 2.111 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.247 -13.247 0.654 1.00 0.00 H new ATOM 0 HD11 ILE A 117 9.178 -12.862 2.033 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.059 -13.013 3.409 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.725 -13.881 1.891 1.00 0.00 H new ATOM 1407 N LEU A 118 2.931 -10.723 0.533 1.00 0.00 N ATOM 1408 CA LEU A 118 1.491 -10.890 0.420 1.00 0.00 C ATOM 1409 C LEU A 118 1.192 -12.144 -0.402 1.00 0.00 C ATOM 1410 O LEU A 118 2.108 -12.810 -0.882 1.00 0.00 O ATOM 1411 CB LEU A 118 0.847 -9.619 -0.137 1.00 0.00 C ATOM 1412 CG LEU A 118 1.746 -8.736 -1.005 1.00 0.00 C ATOM 1413 CD1 LEU A 118 1.827 -9.274 -2.435 1.00 0.00 C ATOM 1414 CD2 LEU A 118 1.285 -7.278 -0.966 1.00 0.00 C ATOM 0 H LEU A 118 3.401 -10.468 -0.336 1.00 0.00 H new ATOM 0 HA LEU A 118 1.045 -11.040 1.403 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.025 -9.905 -0.725 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.485 -9.022 0.700 1.00 0.00 H new ATOM 0 HG LEU A 118 2.755 -8.766 -0.593 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.472 -8.628 -3.031 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.238 -10.284 -2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.829 -9.294 -2.873 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.941 -6.672 -1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 118 0.263 -7.209 -1.339 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.322 -6.912 0.060 1.00 0.00 H new ATOM 1425 N LYS A 119 -0.096 -12.428 -0.541 1.00 0.00 N ATOM 1426 CA LYS A 119 -0.528 -13.590 -1.298 1.00 0.00 C ATOM 1427 C LYS A 119 0.090 -13.541 -2.697 1.00 0.00 C ATOM 1428 O LYS A 119 1.041 -12.798 -2.935 1.00 0.00 O ATOM 1429 CB LYS A 119 -2.055 -13.688 -1.303 1.00 0.00 C ATOM 1430 CG LYS A 119 -2.512 -15.140 -1.147 1.00 0.00 C ATOM 1431 CD LYS A 119 -2.101 -15.700 0.216 1.00 0.00 C ATOM 1432 CE LYS A 119 -2.727 -17.076 0.454 1.00 0.00 C ATOM 1433 NZ LYS A 119 -1.772 -18.149 0.095 1.00 0.00 N ATOM 0 H LYS A 119 -0.853 -11.873 -0.142 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.174 -14.506 -0.825 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.464 -13.085 -0.492 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.446 -13.278 -2.234 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.595 -15.198 -1.257 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -2.078 -15.749 -1.940 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -1.015 -15.776 0.270 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -2.412 -15.014 1.004 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -3.017 -17.174 1.500 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -3.636 -17.176 -0.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -2.213 -19.076 0.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -1.516 -18.064 -0.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -0.916 -18.062 0.679 1.00 0.00 H new ATOM 1443 N ASP A 120 -0.476 -14.343 -3.587 1.00 0.00 N ATOM 1444 CA ASP A 120 0.008 -14.400 -4.956 1.00 0.00 C ATOM 1445 C ASP A 120 1.535 -14.487 -4.950 1.00 0.00 C ATOM 1446 O ASP A 120 2.186 -14.118 -5.927 1.00 0.00 O ATOM 1447 CB ASP A 120 -0.391 -13.145 -5.735 1.00 0.00 C ATOM 1448 CG ASP A 120 -0.411 -13.307 -7.256 1.00 0.00 C ATOM 1449 OD1 ASP A 120 -1.249 -14.104 -7.731 1.00 0.00 O ATOM 1450 OD2 ASP A 120 0.411 -12.630 -7.910 1.00 0.00 O ATOM 0 H ASP A 120 -1.265 -14.958 -3.387 1.00 0.00 H new ATOM 0 HA ASP A 120 -0.433 -15.275 -5.433 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -1.381 -12.830 -5.405 1.00 0.00 H new ATOM 0 HB3 ASP A 120 0.300 -12.342 -5.479 1.00 0.00 H new ATOM 1454 N GLU A 121 2.063 -14.979 -3.839 1.00 0.00 N ATOM 1455 CA GLU A 121 3.502 -15.120 -3.692 1.00 0.00 C ATOM 1456 C GLU A 121 4.215 -13.882 -4.240 1.00 0.00 C ATOM 1457 O GLU A 121 4.668 -13.877 -5.384 1.00 0.00 O ATOM 1458 CB GLU A 121 4.001 -16.391 -4.382 1.00 0.00 C ATOM 1459 CG GLU A 121 5.117 -17.052 -3.571 1.00 0.00 C ATOM 1460 CD GLU A 121 4.715 -18.462 -3.132 1.00 0.00 C ATOM 1461 OE1 GLU A 121 3.568 -18.600 -2.653 1.00 0.00 O ATOM 1462 OE2 GLU A 121 5.561 -19.368 -3.285 1.00 0.00 O ATOM 0 H GLU A 121 1.520 -15.285 -3.032 1.00 0.00 H new ATOM 0 HA GLU A 121 3.733 -15.208 -2.630 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.174 -17.090 -4.507 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.366 -16.148 -5.380 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.027 -17.099 -4.169 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.343 -16.445 -2.694 1.00 0.00 H new ATOM 1467 N ASN A 122 4.292 -12.861 -3.399 1.00 0.00 N ATOM 1468 CA ASN A 122 4.941 -11.621 -3.785 1.00 0.00 C ATOM 1469 C ASN A 122 5.557 -10.965 -2.546 1.00 0.00 C ATOM 1470 O ASN A 122 5.110 -11.206 -1.426 1.00 0.00 O ATOM 1471 CB ASN A 122 3.937 -10.637 -4.389 1.00 0.00 C ATOM 1472 CG ASN A 122 3.861 -10.796 -5.908 1.00 0.00 C ATOM 1473 OD1 ASN A 122 4.858 -10.779 -6.611 1.00 0.00 O ATOM 1474 ND2 ASN A 122 2.624 -10.949 -6.375 1.00 0.00 N ATOM 0 H ASN A 122 3.915 -12.868 -2.451 1.00 0.00 H new ATOM 0 HA ASN A 122 5.705 -11.858 -4.526 1.00 0.00 H new ATOM 0 HB2 ASN A 122 2.952 -10.803 -3.953 1.00 0.00 H new ATOM 0 HB3 ASN A 122 4.228 -9.616 -4.141 1.00 0.00 H new ATOM 0 HD21 ASN A 122 2.467 -11.061 -7.377 1.00 0.00 H new ATOM 0 HD22 ASN A 122 1.833 -10.954 -5.731 1.00 0.00 H new ATOM 1480 N SER A 123 6.573 -10.151 -2.791 1.00 0.00 N ATOM 1481 CA SER A 123 7.255 -9.460 -1.709 1.00 0.00 C ATOM 1482 C SER A 123 7.418 -7.979 -2.055 1.00 0.00 C ATOM 1483 O SER A 123 7.255 -7.587 -3.209 1.00 0.00 O ATOM 1484 CB SER A 123 8.619 -10.092 -1.425 1.00 0.00 C ATOM 1485 OG SER A 123 9.655 -9.117 -1.351 1.00 0.00 O ATOM 0 H SER A 123 6.941 -9.954 -3.722 1.00 0.00 H new ATOM 0 HA SER A 123 6.648 -9.552 -0.808 1.00 0.00 H new ATOM 0 HB2 SER A 123 8.574 -10.645 -0.487 1.00 0.00 H new ATOM 0 HB3 SER A 123 8.855 -10.812 -2.208 1.00 0.00 H new ATOM 0 HG SER A 123 10.509 -9.561 -1.167 1.00 0.00 H new ATOM 1490 N VAL A 124 7.737 -7.198 -1.034 1.00 0.00 N ATOM 1491 CA VAL A 124 7.924 -5.768 -1.216 1.00 0.00 C ATOM 1492 C VAL A 124 8.949 -5.259 -0.200 1.00 0.00 C ATOM 1493 O VAL A 124 9.460 -6.029 0.611 1.00 0.00 O ATOM 1494 CB VAL A 124 6.577 -5.048 -1.119 1.00 0.00 C ATOM 1495 CG1 VAL A 124 6.490 -3.909 -2.137 1.00 0.00 C ATOM 1496 CG2 VAL A 124 5.417 -6.030 -1.295 1.00 0.00 C ATOM 0 H VAL A 124 7.871 -7.528 -0.078 1.00 0.00 H new ATOM 0 HA VAL A 124 8.319 -5.557 -2.210 1.00 0.00 H new ATOM 0 HB VAL A 124 6.500 -4.613 -0.122 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.523 -3.414 -2.047 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.286 -3.189 -1.946 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.599 -4.312 -3.144 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.471 -5.493 -1.222 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.489 -6.507 -2.273 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.463 -6.791 -0.516 1.00 0.00 H new ATOM 1506 N ILE A 125 9.217 -3.964 -0.277 1.00 0.00 N ATOM 1507 CA ILE A 125 10.171 -3.342 0.625 1.00 0.00 C ATOM 1508 C ILE A 125 9.678 -1.943 0.997 1.00 0.00 C ATOM 1509 O ILE A 125 10.035 -0.961 0.348 1.00 0.00 O ATOM 1510 CB ILE A 125 11.574 -3.358 0.015 1.00 0.00 C ATOM 1511 CG1 ILE A 125 11.810 -4.640 -0.786 1.00 0.00 C ATOM 1512 CG2 ILE A 125 12.642 -3.151 1.091 1.00 0.00 C ATOM 1513 CD1 ILE A 125 11.170 -4.544 -2.173 1.00 0.00 C ATOM 0 H ILE A 125 8.790 -3.328 -0.951 1.00 0.00 H new ATOM 0 HA ILE A 125 10.245 -3.911 1.552 1.00 0.00 H new ATOM 0 HB ILE A 125 11.652 -2.524 -0.682 1.00 0.00 H new ATOM 0 HG12 ILE A 125 12.881 -4.819 -0.887 1.00 0.00 H new ATOM 0 HG13 ILE A 125 11.394 -5.492 -0.248 1.00 0.00 H new ATOM 0 HG21 ILE A 125 13.630 -3.167 0.631 1.00 0.00 H new ATOM 0 HG22 ILE A 125 12.485 -2.190 1.580 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.573 -3.949 1.830 1.00 0.00 H new ATOM 0 HD11 ILE A 125 11.352 -5.468 -2.722 1.00 0.00 H new ATOM 0 HD12 ILE A 125 10.096 -4.390 -2.068 1.00 0.00 H new ATOM 0 HD13 ILE A 125 11.606 -3.706 -2.717 1.00 0.00 H new ATOM 1524 N PHE A 126 8.864 -1.895 2.041 1.00 0.00 N ATOM 1525 CA PHE A 126 8.317 -0.631 2.508 1.00 0.00 C ATOM 1526 C PHE A 126 9.266 0.043 3.501 1.00 0.00 C ATOM 1527 O PHE A 126 9.799 -0.611 4.397 1.00 0.00 O ATOM 1528 CB PHE A 126 6.998 -0.949 3.215 1.00 0.00 C ATOM 1529 CG PHE A 126 5.879 -1.396 2.273 1.00 0.00 C ATOM 1530 CD1 PHE A 126 6.038 -1.284 0.928 1.00 0.00 C ATOM 1531 CD2 PHE A 126 4.724 -1.906 2.782 1.00 0.00 C ATOM 1532 CE1 PHE A 126 4.998 -1.699 0.053 1.00 0.00 C ATOM 1533 CE2 PHE A 126 3.686 -2.320 1.908 1.00 0.00 C ATOM 1534 CZ PHE A 126 3.844 -2.209 0.561 1.00 0.00 C ATOM 0 H PHE A 126 8.569 -2.711 2.577 1.00 0.00 H new ATOM 0 HA PHE A 126 8.174 0.047 1.667 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.173 -1.732 3.952 1.00 0.00 H new ATOM 0 HB3 PHE A 126 6.668 -0.065 3.761 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.954 -0.880 0.524 1.00 0.00 H new ATOM 0 HD2 PHE A 126 4.598 -1.995 3.851 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.124 -1.609 -1.016 1.00 0.00 H new ATOM 0 HE2 PHE A 126 2.769 -2.724 2.312 1.00 0.00 H new ATOM 0 HZ PHE A 126 3.054 -2.526 -0.104 1.00 0.00 H new ATOM 1543 N SER A 127 9.447 1.341 3.309 1.00 0.00 N ATOM 1544 CA SER A 127 10.323 2.111 4.177 1.00 0.00 C ATOM 1545 C SER A 127 9.494 3.042 5.063 1.00 0.00 C ATOM 1546 O SER A 127 8.803 3.929 4.563 1.00 0.00 O ATOM 1547 CB SER A 127 11.336 2.917 3.362 1.00 0.00 C ATOM 1548 OG SER A 127 12.278 2.077 2.701 1.00 0.00 O ATOM 0 H SER A 127 9.002 1.879 2.565 1.00 0.00 H new ATOM 0 HA SER A 127 10.876 1.416 4.808 1.00 0.00 H new ATOM 0 HB2 SER A 127 10.809 3.522 2.624 1.00 0.00 H new ATOM 0 HB3 SER A 127 11.864 3.607 4.020 1.00 0.00 H new ATOM 0 HG SER A 127 11.811 1.505 2.057 1.00 0.00 H new ATOM 1553 N ALA A 128 9.588 2.808 6.363 1.00 0.00 N ATOM 1554 CA ALA A 128 8.854 3.615 7.324 1.00 0.00 C ATOM 1555 C ALA A 128 9.846 4.325 8.249 1.00 0.00 C ATOM 1556 O ALA A 128 10.886 3.767 8.596 1.00 0.00 O ATOM 1557 CB ALA A 128 7.873 2.728 8.093 1.00 0.00 C ATOM 0 H ALA A 128 10.161 2.071 6.774 1.00 0.00 H new ATOM 0 HA ALA A 128 8.270 4.381 6.815 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.323 3.333 8.813 1.00 0.00 H new ATOM 0 HB2 ALA A 128 7.173 2.269 7.395 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.423 1.948 8.620 1.00 0.00 H new ATOM 1563 N LYS A 129 9.488 5.544 8.623 1.00 0.00 N ATOM 1564 CA LYS A 129 10.333 6.336 9.500 1.00 0.00 C ATOM 1565 C LYS A 129 9.605 6.573 10.825 1.00 0.00 C ATOM 1566 O LYS A 129 10.130 7.238 11.716 1.00 0.00 O ATOM 1567 CB LYS A 129 10.773 7.624 8.801 1.00 0.00 C ATOM 1568 CG LYS A 129 9.571 8.522 8.499 1.00 0.00 C ATOM 1569 CD LYS A 129 10.018 9.844 7.872 1.00 0.00 C ATOM 1570 CE LYS A 129 8.856 10.531 7.152 1.00 0.00 C ATOM 1571 NZ LYS A 129 9.299 11.066 5.845 1.00 0.00 N ATOM 0 H LYS A 129 8.624 6.003 8.335 1.00 0.00 H new ATOM 0 HA LYS A 129 11.252 5.797 9.732 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.483 8.160 9.431 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.291 7.380 7.874 1.00 0.00 H new ATOM 0 HG2 LYS A 129 8.889 8.007 7.823 1.00 0.00 H new ATOM 0 HG3 LYS A 129 9.020 8.719 9.418 1.00 0.00 H new ATOM 0 HD2 LYS A 129 10.411 10.503 8.646 1.00 0.00 H new ATOM 0 HD3 LYS A 129 10.829 9.660 7.168 1.00 0.00 H new ATOM 0 HE2 LYS A 129 8.042 9.822 7.004 1.00 0.00 H new ATOM 0 HE3 LYS A 129 8.465 11.340 7.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 8.498 11.529 5.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 10.061 11.758 5.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 9.650 10.287 5.252 1.00 0.00 H new ATOM 1581 N SER A 130 8.405 6.016 10.912 1.00 0.00 N ATOM 1582 CA SER A 130 7.600 6.157 12.112 1.00 0.00 C ATOM 1583 C SER A 130 7.440 4.800 12.799 1.00 0.00 C ATOM 1584 O SER A 130 6.781 3.906 12.269 1.00 0.00 O ATOM 1585 CB SER A 130 6.228 6.753 11.788 1.00 0.00 C ATOM 1586 OG SER A 130 6.188 8.159 12.023 1.00 0.00 O ATOM 0 H SER A 130 7.972 5.466 10.170 1.00 0.00 H new ATOM 0 HA SER A 130 8.113 6.840 12.789 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.983 6.553 10.745 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.467 6.262 12.395 1.00 0.00 H new ATOM 0 HG SER A 130 5.297 8.502 11.803 1.00 0.00 H new ATOM 1591 N ALA A 131 8.054 4.687 13.968 1.00 0.00 N ATOM 1592 CA ALA A 131 7.987 3.454 14.732 1.00 0.00 C ATOM 1593 C ALA A 131 6.544 2.945 14.749 1.00 0.00 C ATOM 1594 O ALA A 131 6.304 1.741 14.673 1.00 0.00 O ATOM 1595 CB ALA A 131 8.536 3.694 16.139 1.00 0.00 C ATOM 0 H ALA A 131 8.600 5.430 14.404 1.00 0.00 H new ATOM 0 HA ALA A 131 8.603 2.683 14.268 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.485 2.768 16.712 1.00 0.00 H new ATOM 0 HB2 ALA A 131 9.573 4.024 16.074 1.00 0.00 H new ATOM 0 HB3 ALA A 131 7.942 4.461 16.636 1.00 0.00 H new ATOM 1601 N GLU A 132 5.619 3.889 14.848 1.00 0.00 N ATOM 1602 CA GLU A 132 4.206 3.553 14.876 1.00 0.00 C ATOM 1603 C GLU A 132 3.745 3.085 13.494 1.00 0.00 C ATOM 1604 O GLU A 132 2.988 2.122 13.382 1.00 0.00 O ATOM 1605 CB GLU A 132 3.369 4.739 15.361 1.00 0.00 C ATOM 1606 CG GLU A 132 2.731 4.440 16.719 1.00 0.00 C ATOM 1607 CD GLU A 132 1.244 4.110 16.565 1.00 0.00 C ATOM 1608 OE1 GLU A 132 0.555 4.900 15.885 1.00 0.00 O ATOM 1609 OE2 GLU A 132 0.832 3.075 17.132 1.00 0.00 O ATOM 0 H GLU A 132 5.821 4.887 14.910 1.00 0.00 H new ATOM 0 HA GLU A 132 4.061 2.736 15.583 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.998 5.626 15.438 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.591 4.963 14.631 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.246 3.603 17.191 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.850 5.300 17.378 1.00 0.00 H new ATOM 1614 N GLU A 133 4.220 3.789 12.477 1.00 0.00 N ATOM 1615 CA GLU A 133 3.866 3.457 11.108 1.00 0.00 C ATOM 1616 C GLU A 133 4.294 2.025 10.780 1.00 0.00 C ATOM 1617 O GLU A 133 3.505 1.244 10.249 1.00 0.00 O ATOM 1618 CB GLU A 133 4.486 4.453 10.124 1.00 0.00 C ATOM 1619 CG GLU A 133 3.790 5.813 10.209 1.00 0.00 C ATOM 1620 CD GLU A 133 2.323 5.705 9.787 1.00 0.00 C ATOM 1621 OE1 GLU A 133 2.067 5.876 8.576 1.00 0.00 O ATOM 1622 OE2 GLU A 133 1.492 5.454 10.686 1.00 0.00 O ATOM 0 H GLU A 133 4.847 4.588 12.574 1.00 0.00 H new ATOM 0 HA GLU A 133 2.783 3.523 11.008 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.548 4.570 10.340 1.00 0.00 H new ATOM 0 HB3 GLU A 133 4.408 4.063 9.109 1.00 0.00 H new ATOM 0 HG2 GLU A 133 3.852 6.194 11.228 1.00 0.00 H new ATOM 0 HG3 GLU A 133 4.305 6.530 9.569 1.00 0.00 H new ATOM 1627 N LYS A 134 5.540 1.724 11.110 1.00 0.00 N ATOM 1628 CA LYS A 134 6.081 0.399 10.858 1.00 0.00 C ATOM 1629 C LYS A 134 5.171 -0.649 11.498 1.00 0.00 C ATOM 1630 O LYS A 134 4.857 -1.666 10.879 1.00 0.00 O ATOM 1631 CB LYS A 134 7.537 0.317 11.326 1.00 0.00 C ATOM 1632 CG LYS A 134 8.021 -1.134 11.359 1.00 0.00 C ATOM 1633 CD LYS A 134 9.349 -1.251 12.110 1.00 0.00 C ATOM 1634 CE LYS A 134 9.124 -1.705 13.554 1.00 0.00 C ATOM 1635 NZ LYS A 134 9.273 -0.564 14.484 1.00 0.00 N ATOM 0 H LYS A 134 6.191 2.374 11.550 1.00 0.00 H new ATOM 0 HA LYS A 134 6.101 0.193 9.788 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.171 0.900 10.658 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.629 0.758 12.319 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.270 -1.761 11.840 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.141 -1.505 10.341 1.00 0.00 H new ATOM 0 HD2 LYS A 134 9.999 -1.961 11.599 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.861 -0.289 12.103 1.00 0.00 H new ATOM 0 HE2 LYS A 134 8.128 -2.137 13.655 1.00 0.00 H new ATOM 0 HE3 LYS A 134 9.838 -2.487 13.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 9.117 -0.889 15.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 10.232 -0.170 14.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 8.575 0.170 14.248 1.00 0.00 H new ATOM 1645 N ASN A 135 4.771 -0.368 12.729 1.00 0.00 N ATOM 1646 CA ASN A 135 3.901 -1.275 13.460 1.00 0.00 C ATOM 1647 C ASN A 135 2.504 -1.248 12.837 1.00 0.00 C ATOM 1648 O ASN A 135 1.870 -2.291 12.682 1.00 0.00 O ATOM 1649 CB ASN A 135 3.773 -0.854 14.925 1.00 0.00 C ATOM 1650 CG ASN A 135 3.466 -2.060 15.817 1.00 0.00 C ATOM 1651 OD1 ASN A 135 2.330 -2.476 15.972 1.00 0.00 O ATOM 1652 ND2 ASN A 135 4.539 -2.595 16.392 1.00 0.00 N ATOM 0 H ASN A 135 5.033 0.475 13.240 1.00 0.00 H new ATOM 0 HA ASN A 135 4.335 -2.274 13.408 1.00 0.00 H new ATOM 0 HB2 ASN A 135 4.698 -0.380 15.253 1.00 0.00 H new ATOM 0 HB3 ASN A 135 2.981 -0.111 15.026 1.00 0.00 H new ATOM 0 HD21 ASN A 135 4.439 -3.404 17.006 1.00 0.00 H new ATOM 0 HD22 ASN A 135 5.462 -2.197 16.219 1.00 0.00 H new ATOM 1658 N ASN A 136 2.066 -0.045 12.496 1.00 0.00 N ATOM 1659 CA ASN A 136 0.756 0.131 11.894 1.00 0.00 C ATOM 1660 C ASN A 136 0.816 -0.286 10.423 1.00 0.00 C ATOM 1661 O ASN A 136 -0.218 -0.521 9.798 1.00 0.00 O ATOM 1662 CB ASN A 136 0.315 1.595 11.952 1.00 0.00 C ATOM 1663 CG ASN A 136 -0.943 1.755 12.807 1.00 0.00 C ATOM 1664 OD1 ASN A 136 -2.029 2.021 12.317 1.00 0.00 O ATOM 1665 ND2 ASN A 136 -0.739 1.578 14.110 1.00 0.00 N ATOM 0 H ASN A 136 2.595 0.817 12.625 1.00 0.00 H new ATOM 0 HA ASN A 136 0.045 -0.482 12.448 1.00 0.00 H new ATOM 0 HB2 ASN A 136 1.119 2.205 12.364 1.00 0.00 H new ATOM 0 HB3 ASN A 136 0.123 1.961 10.943 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -1.517 1.663 14.764 1.00 0.00 H new ATOM 0 HD22 ASN A 136 0.195 1.357 14.455 1.00 0.00 H new ATOM 1671 N TRP A 137 2.036 -0.365 9.912 1.00 0.00 N ATOM 1672 CA TRP A 137 2.243 -0.751 8.527 1.00 0.00 C ATOM 1673 C TRP A 137 2.119 -2.272 8.436 1.00 0.00 C ATOM 1674 O TRP A 137 1.553 -2.796 7.477 1.00 0.00 O ATOM 1675 CB TRP A 137 3.585 -0.228 8.008 1.00 0.00 C ATOM 1676 CG TRP A 137 3.600 1.276 7.729 1.00 0.00 C ATOM 1677 CD1 TRP A 137 2.693 2.192 8.093 1.00 0.00 C ATOM 1678 CD2 TRP A 137 4.615 2.006 7.008 1.00 0.00 C ATOM 1679 NE1 TRP A 137 3.047 3.454 7.661 1.00 0.00 N ATOM 1680 CE2 TRP A 137 4.253 3.337 6.980 1.00 0.00 C ATOM 1681 CE3 TRP A 137 5.799 1.556 6.398 1.00 0.00 C ATOM 1682 CZ2 TRP A 137 5.021 4.329 6.356 1.00 0.00 C ATOM 1683 CZ3 TRP A 137 6.556 2.558 5.779 1.00 0.00 C ATOM 1684 CH2 TRP A 137 6.205 3.904 5.742 1.00 0.00 C ATOM 0 H TRP A 137 2.891 -0.168 10.432 1.00 0.00 H new ATOM 0 HA TRP A 137 1.486 -0.302 7.884 1.00 0.00 H new ATOM 0 HB2 TRP A 137 4.361 -0.460 8.738 1.00 0.00 H new ATOM 0 HB3 TRP A 137 3.841 -0.760 7.092 1.00 0.00 H new ATOM 0 HD1 TRP A 137 1.797 1.971 8.654 1.00 0.00 H new ATOM 0 HE1 TRP A 137 2.521 4.314 7.813 1.00 0.00 H new ATOM 0 HE3 TRP A 137 6.101 0.519 6.406 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 4.716 5.365 6.349 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 7.477 2.266 5.296 1.00 0.00 H new ATOM 0 HH2 TRP A 137 6.843 4.617 5.242 1.00 0.00 H new ATOM 1694 N MET A 138 2.659 -2.940 9.445 1.00 0.00 N ATOM 1695 CA MET A 138 2.615 -4.392 9.490 1.00 0.00 C ATOM 1696 C MET A 138 1.373 -4.880 10.237 1.00 0.00 C ATOM 1697 O MET A 138 0.788 -5.901 9.877 1.00 0.00 O ATOM 1698 CB MET A 138 3.871 -4.919 10.188 1.00 0.00 C ATOM 1699 CG MET A 138 4.088 -4.217 11.530 1.00 0.00 C ATOM 1700 SD MET A 138 4.261 -5.427 12.831 1.00 0.00 S ATOM 1701 CE MET A 138 2.871 -4.978 13.857 1.00 0.00 C ATOM 0 H MET A 138 3.129 -2.503 10.238 1.00 0.00 H new ATOM 0 HA MET A 138 2.572 -4.768 8.468 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.780 -5.994 10.346 1.00 0.00 H new ATOM 0 HB3 MET A 138 4.739 -4.764 9.548 1.00 0.00 H new ATOM 0 HG2 MET A 138 4.980 -3.592 11.483 1.00 0.00 H new ATOM 0 HG3 MET A 138 3.247 -3.557 11.745 1.00 0.00 H new ATOM 0 HE1 MET A 138 3.036 -5.341 14.872 1.00 0.00 H new ATOM 0 HE2 MET A 138 2.765 -3.893 13.872 1.00 0.00 H new ATOM 0 HE3 MET A 138 1.962 -5.426 13.455 1.00 0.00 H new ATOM 1709 N ALA A 139 1.006 -4.129 11.266 1.00 0.00 N ATOM 1710 CA ALA A 139 -0.156 -4.472 12.067 1.00 0.00 C ATOM 1711 C ALA A 139 -1.393 -4.521 11.168 1.00 0.00 C ATOM 1712 O ALA A 139 -2.154 -5.487 11.204 1.00 0.00 O ATOM 1713 CB ALA A 139 -0.304 -3.465 13.209 1.00 0.00 C ATOM 0 H ALA A 139 1.494 -3.284 11.563 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.036 -5.458 12.516 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.176 -3.722 13.810 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.588 -3.490 13.834 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.430 -2.464 12.797 1.00 0.00 H new ATOM 1719 N ALA A 140 -1.556 -3.466 10.382 1.00 0.00 N ATOM 1720 CA ALA A 140 -2.689 -3.377 9.476 1.00 0.00 C ATOM 1721 C ALA A 140 -2.682 -4.585 8.537 1.00 0.00 C ATOM 1722 O ALA A 140 -3.733 -5.149 8.237 1.00 0.00 O ATOM 1723 CB ALA A 140 -2.632 -2.049 8.718 1.00 0.00 C ATOM 0 H ALA A 140 -0.923 -2.667 10.354 1.00 0.00 H new ATOM 0 HA ALA A 140 -3.627 -3.397 10.031 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -3.481 -1.981 8.038 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -2.669 -1.223 9.428 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.705 -1.995 8.147 1.00 0.00 H new ATOM 1729 N LEU A 141 -1.484 -4.946 8.098 1.00 0.00 N ATOM 1730 CA LEU A 141 -1.326 -6.076 7.199 1.00 0.00 C ATOM 1731 C LEU A 141 -1.640 -7.370 7.953 1.00 0.00 C ATOM 1732 O LEU A 141 -2.366 -8.226 7.449 1.00 0.00 O ATOM 1733 CB LEU A 141 0.062 -6.061 6.557 1.00 0.00 C ATOM 1734 CG LEU A 141 0.098 -5.848 5.041 1.00 0.00 C ATOM 1735 CD1 LEU A 141 0.098 -4.357 4.698 1.00 0.00 C ATOM 1736 CD2 LEU A 141 1.283 -6.581 4.413 1.00 0.00 C ATOM 0 H LEU A 141 -0.614 -4.475 8.349 1.00 0.00 H new ATOM 0 HA LEU A 141 -2.034 -6.007 6.373 1.00 0.00 H new ATOM 0 HB2 LEU A 141 0.650 -5.274 7.029 1.00 0.00 H new ATOM 0 HB3 LEU A 141 0.555 -7.006 6.783 1.00 0.00 H new ATOM 0 HG LEU A 141 -0.808 -6.277 4.613 1.00 0.00 H new ATOM 0 HD11 LEU A 141 0.124 -4.233 3.615 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.804 -3.892 5.095 1.00 0.00 H new ATOM 0 HD13 LEU A 141 0.975 -3.882 5.139 1.00 0.00 H new ATOM 0 HD21 LEU A 141 1.285 -6.413 3.336 1.00 0.00 H new ATOM 0 HD22 LEU A 141 2.212 -6.204 4.841 1.00 0.00 H new ATOM 0 HD23 LEU A 141 1.198 -7.649 4.614 1.00 0.00 H new ATOM 1747 N ILE A 142 -1.078 -7.471 9.148 1.00 0.00 N ATOM 1748 CA ILE A 142 -1.289 -8.646 9.977 1.00 0.00 C ATOM 1749 C ILE A 142 -2.753 -8.700 10.416 1.00 0.00 C ATOM 1750 O ILE A 142 -3.252 -9.757 10.798 1.00 0.00 O ATOM 1751 CB ILE A 142 -0.296 -8.665 11.142 1.00 0.00 C ATOM 1752 CG1 ILE A 142 1.130 -8.904 10.644 1.00 0.00 C ATOM 1753 CG2 ILE A 142 -0.714 -9.688 12.201 1.00 0.00 C ATOM 1754 CD1 ILE A 142 1.444 -10.401 10.579 1.00 0.00 C ATOM 0 H ILE A 142 -0.477 -6.759 9.562 1.00 0.00 H new ATOM 0 HA ILE A 142 -1.094 -9.554 9.407 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.309 -7.685 11.618 1.00 0.00 H new ATOM 0 HG12 ILE A 142 1.254 -8.460 9.656 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.839 -8.408 11.308 1.00 0.00 H new ATOM 0 HG21 ILE A 142 0.008 -9.682 13.018 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -1.700 -9.430 12.587 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -0.747 -10.682 11.754 1.00 0.00 H new ATOM 0 HD11 ILE A 142 2.464 -10.544 10.222 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.343 -10.837 11.573 1.00 0.00 H new ATOM 0 HD13 ILE A 142 0.749 -10.889 9.896 1.00 0.00 H new ATOM 1765 N SER A 143 -3.401 -7.545 10.347 1.00 0.00 N ATOM 1766 CA SER A 143 -4.799 -7.448 10.732 1.00 0.00 C ATOM 1767 C SER A 143 -5.666 -8.251 9.761 1.00 0.00 C ATOM 1768 O SER A 143 -6.508 -9.042 10.185 1.00 0.00 O ATOM 1769 CB SER A 143 -5.258 -5.990 10.772 1.00 0.00 C ATOM 1770 OG SER A 143 -5.621 -5.580 12.087 1.00 0.00 O ATOM 0 H SER A 143 -2.984 -6.670 10.031 1.00 0.00 H new ATOM 0 HA SER A 143 -4.908 -7.863 11.734 1.00 0.00 H new ATOM 0 HB2 SER A 143 -4.459 -5.348 10.400 1.00 0.00 H new ATOM 0 HB3 SER A 143 -6.109 -5.860 10.104 1.00 0.00 H new ATOM 0 HG SER A 143 -5.907 -4.643 12.070 1.00 0.00 H new ATOM 1775 N LEU A 144 -5.431 -8.021 8.478 1.00 0.00 N ATOM 1776 CA LEU A 144 -6.181 -8.713 7.444 1.00 0.00 C ATOM 1777 C LEU A 144 -5.745 -10.179 7.399 1.00 0.00 C ATOM 1778 O LEU A 144 -6.568 -11.081 7.546 1.00 0.00 O ATOM 1779 CB LEU A 144 -6.042 -7.989 6.104 1.00 0.00 C ATOM 1780 CG LEU A 144 -6.763 -6.644 5.990 1.00 0.00 C ATOM 1781 CD1 LEU A 144 -6.360 -5.912 4.709 1.00 0.00 C ATOM 1782 CD2 LEU A 144 -8.279 -6.824 6.094 1.00 0.00 C ATOM 0 H LEU A 144 -4.732 -7.365 8.131 1.00 0.00 H new ATOM 0 HA LEU A 144 -7.246 -8.703 7.675 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -4.982 -7.828 5.909 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -6.415 -8.646 5.318 1.00 0.00 H new ATOM 0 HG LEU A 144 -6.454 -6.019 6.828 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -6.887 -4.959 4.653 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -5.285 -5.732 4.716 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -6.621 -6.522 3.844 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -8.767 -5.853 6.010 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.624 -7.475 5.290 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -8.527 -7.273 7.056 1.00 0.00 H new ATOM 1793 N GLN A 145 -4.450 -10.372 7.193 1.00 0.00 N ATOM 1794 CA GLN A 145 -3.894 -11.713 7.126 1.00 0.00 C ATOM 1795 C GLN A 145 -4.484 -12.587 8.234 1.00 0.00 C ATOM 1796 O GLN A 145 -4.538 -13.810 8.103 1.00 0.00 O ATOM 1797 CB GLN A 145 -2.367 -11.678 7.211 1.00 0.00 C ATOM 1798 CG GLN A 145 -1.809 -13.045 7.613 1.00 0.00 C ATOM 1799 CD GLN A 145 -1.452 -13.075 9.101 1.00 0.00 C ATOM 1800 OE1 GLN A 145 -1.771 -12.175 9.861 1.00 0.00 O ATOM 1801 NE2 GLN A 145 -0.777 -14.158 9.472 1.00 0.00 N ATOM 0 H GLN A 145 -3.770 -9.622 7.070 1.00 0.00 H new ATOM 0 HA GLN A 145 -4.162 -12.149 6.164 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -1.952 -11.381 6.248 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -2.057 -10.927 7.937 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -2.544 -13.820 7.396 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -0.924 -13.270 7.018 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -0.542 -14.873 8.784 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -0.493 -14.274 10.445 1.00 0.00 H new ATOM 1808 N TYR A 146 -4.915 -11.929 9.300 1.00 0.00 N ATOM 1809 CA TYR A 146 -5.499 -12.631 10.429 1.00 0.00 C ATOM 1810 C TYR A 146 -6.945 -13.035 10.135 1.00 0.00 C ATOM 1811 O TYR A 146 -7.381 -14.118 10.520 1.00 0.00 O ATOM 1812 CB TYR A 146 -5.486 -11.640 11.594 1.00 0.00 C ATOM 1813 CG TYR A 146 -4.420 -11.937 12.651 1.00 0.00 C ATOM 1814 CD1 TYR A 146 -3.291 -12.652 12.310 1.00 0.00 C ATOM 1815 CD2 TYR A 146 -4.588 -11.487 13.946 1.00 0.00 C ATOM 1816 CE1 TYR A 146 -2.288 -12.930 13.305 1.00 0.00 C ATOM 1817 CE2 TYR A 146 -3.584 -11.765 14.940 1.00 0.00 C ATOM 1818 CZ TYR A 146 -2.484 -12.473 14.570 1.00 0.00 C ATOM 1819 OH TYR A 146 -1.536 -12.737 15.510 1.00 0.00 O ATOM 0 H TYR A 146 -4.871 -10.915 9.405 1.00 0.00 H new ATOM 0 HA TYR A 146 -4.939 -13.540 10.647 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -5.324 -10.636 11.202 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -6.466 -11.642 12.071 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -3.159 -13.003 11.297 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -5.472 -10.927 14.213 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -1.400 -13.489 13.052 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -3.702 -11.419 15.956 1.00 0.00 H new ATOM 0 HH TYR A 146 -1.809 -12.349 16.368 1.00 0.00 H new ATOM 1828 N ARG A 147 -7.648 -12.142 9.453 1.00 0.00 N ATOM 1829 CA ARG A 147 -9.036 -12.392 9.102 1.00 0.00 C ATOM 1830 C ARG A 147 -9.117 -13.325 7.892 1.00 0.00 C ATOM 1831 O ARG A 147 -9.829 -13.039 6.929 1.00 0.00 O ATOM 1832 CB ARG A 147 -9.767 -11.087 8.782 1.00 0.00 C ATOM 1833 CG ARG A 147 -10.441 -10.515 10.030 1.00 0.00 C ATOM 1834 CD ARG A 147 -10.928 -9.085 9.784 1.00 0.00 C ATOM 1835 NE ARG A 147 -11.083 -8.375 11.072 1.00 0.00 N ATOM 1836 CZ ARG A 147 -12.053 -8.634 11.961 1.00 0.00 C ATOM 1837 NH1 ARG A 147 -12.957 -9.588 11.706 1.00 0.00 N ATOM 1838 NH2 ARG A 147 -12.116 -7.939 13.104 1.00 0.00 N ATOM 0 H ARG A 147 -7.282 -11.245 9.134 1.00 0.00 H new ATOM 0 HA ARG A 147 -9.516 -12.862 9.960 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -9.061 -10.360 8.380 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -10.515 -11.265 8.010 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -11.283 -11.146 10.314 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -9.739 -10.526 10.864 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -10.218 -8.554 9.150 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -11.879 -9.102 9.252 1.00 0.00 H new ATOM 0 HE ARG A 147 -10.410 -7.643 11.298 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -12.908 -10.118 10.836 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -13.695 -9.785 12.382 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -11.426 -7.213 13.298 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.854 -8.136 13.780 1.00 0.00 H new ATOM 1849 N SER A 148 -8.380 -14.423 7.980 1.00 0.00 N ATOM 1850 CA SER A 148 -8.360 -15.399 6.904 1.00 0.00 C ATOM 1851 C SER A 148 -8.067 -16.791 7.466 1.00 0.00 C ATOM 1852 O SER A 148 -7.550 -17.654 6.759 1.00 0.00 O ATOM 1853 CB SER A 148 -7.324 -15.027 5.842 1.00 0.00 C ATOM 1854 OG SER A 148 -7.891 -14.985 4.535 1.00 0.00 O ATOM 0 H SER A 148 -7.792 -14.658 8.780 1.00 0.00 H new ATOM 0 HA SER A 148 -9.341 -15.405 6.429 1.00 0.00 H new ATOM 0 HB2 SER A 148 -6.892 -14.055 6.081 1.00 0.00 H new ATOM 0 HB3 SER A 148 -6.509 -15.751 5.861 1.00 0.00 H new ATOM 0 HG SER A 148 -7.654 -14.138 4.103 1.00 0.00 H new ATOM 1859 N THR A 149 -8.409 -16.967 8.735 1.00 0.00 N ATOM 1860 CA THR A 149 -8.190 -18.239 9.400 1.00 0.00 C ATOM 1861 C THR A 149 -8.935 -18.278 10.735 1.00 0.00 C ATOM 1862 O THR A 149 -9.472 -19.316 11.120 1.00 0.00 O ATOM 1863 CB THR A 149 -6.680 -18.444 9.541 1.00 0.00 C ATOM 1864 OG1 THR A 149 -6.346 -19.315 8.462 1.00 0.00 O ATOM 1865 CG2 THR A 149 -6.312 -19.244 10.792 1.00 0.00 C ATOM 0 H THR A 149 -8.836 -16.249 9.319 1.00 0.00 H new ATOM 0 HA THR A 149 -8.592 -19.066 8.815 1.00 0.00 H new ATOM 0 HB THR A 149 -6.183 -17.474 9.571 1.00 0.00 H new ATOM 0 HG1 THR A 149 -6.587 -18.891 7.612 1.00 0.00 H new ATOM 0 HG21 THR A 149 -5.230 -19.361 10.844 1.00 0.00 H new ATOM 0 HG22 THR A 149 -6.663 -18.715 11.678 1.00 0.00 H new ATOM 0 HG23 THR A 149 -6.781 -20.227 10.746 1.00 0.00 H new ATOM 1873 N LEU A 150 -8.943 -17.135 11.405 1.00 0.00 N ATOM 1874 CA LEU A 150 -9.615 -17.027 12.690 1.00 0.00 C ATOM 1875 C LEU A 150 -11.120 -16.880 12.462 1.00 0.00 C ATOM 1876 O LEU A 150 -11.632 -17.253 11.408 1.00 0.00 O ATOM 1877 CB LEU A 150 -9.004 -15.894 13.518 1.00 0.00 C ATOM 1878 CG LEU A 150 -9.423 -14.476 13.127 1.00 0.00 C ATOM 1879 CD1 LEU A 150 -10.388 -13.885 14.157 1.00 0.00 C ATOM 1880 CD2 LEU A 150 -8.200 -13.583 12.910 1.00 0.00 C ATOM 0 H LEU A 150 -8.496 -16.277 11.083 1.00 0.00 H new ATOM 0 HA LEU A 150 -9.469 -17.935 13.276 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -9.266 -16.053 14.564 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -7.919 -15.963 13.447 1.00 0.00 H new ATOM 0 HG LEU A 150 -9.957 -14.528 12.178 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -10.670 -12.876 13.855 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -11.280 -14.508 14.219 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -9.902 -13.849 15.132 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -8.526 -12.580 12.633 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.618 -13.534 13.830 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -7.584 -13.998 12.112 1.00 0.00 H new