USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=25 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 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 122 ASN : amide:sc= -0.35 K(o=-0.35,f=-2.4!) USER MOD Set 2.1: A 57 HIS : no HE2:sc= -3.34! C(o=-3.5!,f=-5.7!) USER MOD Set 2.2: A 72 LYS NZ :NH3+ -159:sc= 0.0109 (180deg=0) USER MOD Set 2.3: A 74 ASN : amide:sc= -0.151 X(o=-3.5,f=-3.3) USER MOD Single : A 26 GLN : amide:sc= -0.0673 X(o=-0.067,f=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN :FLIP amide:sc= -8.26! C(o=-11!,f=-8.3!) USER MOD Single : A 46 MET CE :methyl 136:sc= -5.58! (180deg=-8.61!) USER MOD Single : A 49 THR OG1 : rot 70:sc= 0.187 USER MOD Single : A 51 THR OG1 : rot 131:sc= -0.225 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS :FLIP no HD1:sc= -2.35! C(o=-5.2!,f=-2.3!) USER MOD Single : A 68 MET CE :methyl -173:sc= -4.02! (180deg=-4.36!) USER MOD Single : A 70 CYS SG : rot 180:sc= -1.73 USER MOD Single : A 71 CYS SG : rot 14:sc= 0.872 USER MOD Single : A 73 SER OG : rot 163:sc= 0.509! USER MOD Single : A 88 TYR OH : rot 180:sc= -0.0858 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 MET CE :methyl -172:sc= -2! (180deg=-2.32!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -0.243 K(o=-0.24,f=-2.2!) USER MOD Single : A 102 ASN : amide:sc= -0.133 K(o=-0.13,f=-0.91) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ -168:sc=-0.00243 (180deg=-0.162) USER MOD Single : A 112 HIS :FLIP no HE2:sc= -0.565 F(o=-1.6,f=-0.56) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 68:sc= -10.2! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 170:sc= 0.0778 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 ASN : amide:sc= -0.346 K(o=-0.35,f=-0.98!) USER MOD Single : A 136 ASN : amide:sc= -0.345 K(o=-0.35,f=-2.3!) USER MOD Single : A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN :FLIP amide:sc= -1.61! C(o=-2.3!,f=-1.6!) USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 SER OG : rot 96:sc= 1.04 USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 60 N GLN A 26 -8.117 8.639 -6.496 1.00 0.00 N ATOM 61 CA GLN A 26 -8.268 8.171 -7.863 1.00 0.00 C ATOM 62 C GLN A 26 -7.468 9.058 -8.820 1.00 0.00 C ATOM 63 O GLN A 26 -7.190 8.664 -9.951 1.00 0.00 O ATOM 64 CB GLN A 26 -9.743 8.119 -8.266 1.00 0.00 C ATOM 65 CG GLN A 26 -10.434 6.893 -7.667 1.00 0.00 C ATOM 66 CD GLN A 26 -11.479 6.328 -8.630 1.00 0.00 C ATOM 67 OE1 GLN A 26 -12.669 6.318 -8.359 1.00 0.00 O ATOM 68 NE2 GLN A 26 -10.971 5.857 -9.766 1.00 0.00 N ATOM 0 HA GLN A 26 -7.874 7.157 -7.924 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.247 9.025 -7.930 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.826 8.092 -9.353 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.692 6.128 -7.440 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.911 7.164 -6.725 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -9.965 5.896 -9.930 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -11.588 5.457 -10.473 1.00 0.00 H new ATOM 75 N LYS A 27 -7.123 10.239 -8.330 1.00 0.00 N ATOM 76 CA LYS A 27 -6.360 11.185 -9.126 1.00 0.00 C ATOM 77 C LYS A 27 -4.865 10.941 -8.910 1.00 0.00 C ATOM 78 O LYS A 27 -4.034 11.750 -9.321 1.00 0.00 O ATOM 79 CB LYS A 27 -6.800 12.619 -8.821 1.00 0.00 C ATOM 80 CG LYS A 27 -7.813 13.115 -9.855 1.00 0.00 C ATOM 81 CD LYS A 27 -8.924 12.086 -10.069 1.00 0.00 C ATOM 82 CE LYS A 27 -9.649 11.779 -8.757 1.00 0.00 C ATOM 83 NZ LYS A 27 -10.537 12.902 -8.382 1.00 0.00 N ATOM 0 H LYS A 27 -7.358 10.563 -7.392 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.556 11.034 -10.187 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.241 12.664 -7.825 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.930 13.276 -8.815 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.245 14.059 -9.523 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -7.307 13.312 -10.800 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.637 12.463 -10.803 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.501 11.168 -10.478 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -10.233 10.865 -8.863 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -8.921 11.603 -7.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -11.022 12.678 -7.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -9.971 13.766 -8.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.243 13.052 -9.131 1.00 0.00 H new ATOM 93 N ASN A 28 -4.569 9.822 -8.265 1.00 0.00 N ATOM 94 CA ASN A 28 -3.189 9.461 -7.989 1.00 0.00 C ATOM 95 C ASN A 28 -2.934 8.032 -8.471 1.00 0.00 C ATOM 96 O ASN A 28 -1.818 7.695 -8.865 1.00 0.00 O ATOM 97 CB ASN A 28 -2.895 9.513 -6.488 1.00 0.00 C ATOM 98 CG ASN A 28 -2.200 10.823 -6.110 1.00 0.00 C ATOM 99 OD1 ASN A 28 -1.182 11.143 -6.904 1.00 0.00 O flip ATOM 100 ND2 ASN A 28 -2.566 11.499 -5.162 1.00 0.00 N flip ATOM 0 H ASN A 28 -5.261 9.154 -7.926 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.545 10.171 -8.507 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -3.825 9.416 -5.928 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -2.265 8.669 -6.208 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -3.356 11.194 -4.593 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.082 12.369 -4.939 1.00 0.00 H new ATOM 106 N ILE A 29 -3.987 7.229 -8.424 1.00 0.00 N ATOM 107 CA ILE A 29 -3.891 5.843 -8.851 1.00 0.00 C ATOM 108 C ILE A 29 -3.375 5.792 -10.290 1.00 0.00 C ATOM 109 O ILE A 29 -2.618 6.664 -10.713 1.00 0.00 O ATOM 110 CB ILE A 29 -5.229 5.128 -8.652 1.00 0.00 C ATOM 111 CG1 ILE A 29 -6.373 5.914 -9.295 1.00 0.00 C ATOM 112 CG2 ILE A 29 -5.486 4.850 -7.169 1.00 0.00 C ATOM 113 CD1 ILE A 29 -6.354 5.763 -10.817 1.00 0.00 C ATOM 0 H ILE A 29 -4.911 7.512 -8.097 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.172 5.303 -8.235 1.00 0.00 H new ATOM 0 HB ILE A 29 -5.179 4.163 -9.157 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -7.327 5.561 -8.903 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.289 6.968 -9.029 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.443 4.341 -7.055 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.690 4.219 -6.774 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.508 5.792 -6.621 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -7.177 6.331 -11.249 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.409 6.139 -11.208 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -6.462 4.711 -11.080 1.00 0.00 H new ATOM 124 N ASP A 30 -3.806 4.762 -11.003 1.00 0.00 N ATOM 125 CA ASP A 30 -3.396 4.586 -12.386 1.00 0.00 C ATOM 126 C ASP A 30 -4.511 3.875 -13.157 1.00 0.00 C ATOM 127 O ASP A 30 -5.153 4.471 -14.020 1.00 0.00 O ATOM 128 CB ASP A 30 -2.133 3.729 -12.483 1.00 0.00 C ATOM 129 CG ASP A 30 -2.087 2.778 -13.680 1.00 0.00 C ATOM 130 OD1 ASP A 30 -1.833 3.282 -14.795 1.00 0.00 O ATOM 131 OD2 ASP A 30 -2.305 1.568 -13.454 1.00 0.00 O ATOM 0 H ASP A 30 -4.435 4.041 -10.649 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.195 5.572 -12.805 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -1.267 4.389 -12.529 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.039 3.143 -11.569 1.00 0.00 H new ATOM 135 N GLY A 31 -4.706 2.609 -12.817 1.00 0.00 N ATOM 136 CA GLY A 31 -5.732 1.809 -13.466 1.00 0.00 C ATOM 137 C GLY A 31 -6.781 1.340 -12.457 1.00 0.00 C ATOM 138 O GLY A 31 -7.598 0.473 -12.764 1.00 0.00 O ATOM 0 H GLY A 31 -4.171 2.117 -12.101 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -6.213 2.394 -14.250 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.274 0.945 -13.948 1.00 0.00 H new ATOM 142 N TRP A 32 -6.725 1.933 -11.273 1.00 0.00 N ATOM 143 CA TRP A 32 -7.661 1.587 -10.217 1.00 0.00 C ATOM 144 C TRP A 32 -8.231 0.201 -10.526 1.00 0.00 C ATOM 145 O TRP A 32 -7.626 -0.813 -10.183 1.00 0.00 O ATOM 146 CB TRP A 32 -8.742 2.659 -10.069 1.00 0.00 C ATOM 147 CG TRP A 32 -9.805 2.330 -9.019 1.00 0.00 C ATOM 148 CD1 TRP A 32 -10.923 1.607 -9.175 1.00 0.00 C ATOM 149 CD2 TRP A 32 -9.805 2.743 -7.636 1.00 0.00 C ATOM 150 NE1 TRP A 32 -11.640 1.525 -7.999 1.00 0.00 N ATOM 151 CE2 TRP A 32 -10.938 2.237 -7.032 1.00 0.00 C ATOM 152 CE3 TRP A 32 -8.877 3.518 -6.918 1.00 0.00 C ATOM 153 CZ2 TRP A 32 -11.250 2.451 -5.685 1.00 0.00 C ATOM 154 CZ3 TRP A 32 -9.203 3.723 -5.572 1.00 0.00 C ATOM 155 CH2 TRP A 32 -10.340 3.220 -4.950 1.00 0.00 C ATOM 0 H TRP A 32 -6.046 2.651 -11.022 1.00 0.00 H new ATOM 0 HA TRP A 32 -7.156 1.548 -9.252 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -8.268 3.605 -9.807 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -9.230 2.803 -11.033 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -11.225 1.147 -10.104 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -12.523 1.033 -7.864 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -7.983 3.923 -7.369 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -12.145 2.045 -5.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -8.524 4.313 -4.975 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -10.520 3.422 -3.904 1.00 0.00 H new ATOM 300 N PHE A 44 -10.957 2.317 3.139 1.00 0.00 N ATOM 301 CA PHE A 44 -9.513 2.234 3.278 1.00 0.00 C ATOM 302 C PHE A 44 -9.125 1.713 4.664 1.00 0.00 C ATOM 303 O PHE A 44 -9.021 2.485 5.615 1.00 0.00 O ATOM 304 CB PHE A 44 -8.965 3.652 3.109 1.00 0.00 C ATOM 305 CG PHE A 44 -9.639 4.692 4.006 1.00 0.00 C ATOM 306 CD1 PHE A 44 -10.773 5.317 3.588 1.00 0.00 C ATOM 307 CD2 PHE A 44 -9.106 4.990 5.220 1.00 0.00 C ATOM 308 CE1 PHE A 44 -11.399 6.282 4.421 1.00 0.00 C ATOM 309 CE2 PHE A 44 -9.732 5.955 6.052 1.00 0.00 C ATOM 310 CZ PHE A 44 -10.866 6.581 5.636 1.00 0.00 C ATOM 0 HA PHE A 44 -9.107 1.549 2.534 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -7.896 3.644 3.320 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -9.083 3.954 2.068 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -11.197 5.079 2.623 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -8.206 4.493 5.552 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -12.299 6.779 4.089 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -9.308 6.192 7.016 1.00 0.00 H new ATOM 0 HZ PHE A 44 -11.342 7.314 6.270 1.00 0.00 H new ATOM 319 N ILE A 45 -8.921 0.406 4.733 1.00 0.00 N ATOM 320 CA ILE A 45 -8.547 -0.228 5.986 1.00 0.00 C ATOM 321 C ILE A 45 -7.532 0.654 6.715 1.00 0.00 C ATOM 322 O ILE A 45 -7.754 1.045 7.860 1.00 0.00 O ATOM 323 CB ILE A 45 -8.055 -1.656 5.739 1.00 0.00 C ATOM 324 CG1 ILE A 45 -9.231 -2.619 5.569 1.00 0.00 C ATOM 325 CG2 ILE A 45 -7.100 -2.106 6.845 1.00 0.00 C ATOM 326 CD1 ILE A 45 -9.847 -2.977 6.923 1.00 0.00 C ATOM 0 H ILE A 45 -9.008 -0.232 3.942 1.00 0.00 H new ATOM 0 HA ILE A 45 -9.415 -0.323 6.638 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.493 -1.667 4.805 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -9.988 -2.165 4.930 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.893 -3.526 5.068 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -6.765 -3.124 6.645 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -6.238 -1.440 6.874 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.615 -2.075 7.805 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -10.681 -3.663 6.773 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -9.094 -3.453 7.551 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -10.206 -2.071 7.411 1.00 0.00 H new ATOM 337 N MET A 46 -6.440 0.942 6.022 1.00 0.00 N ATOM 338 CA MET A 46 -5.390 1.771 6.591 1.00 0.00 C ATOM 339 C MET A 46 -4.931 2.835 5.591 1.00 0.00 C ATOM 340 O MET A 46 -4.959 2.609 4.382 1.00 0.00 O ATOM 341 CB MET A 46 -4.201 0.891 6.983 1.00 0.00 C ATOM 342 CG MET A 46 -3.298 0.620 5.778 1.00 0.00 C ATOM 343 SD MET A 46 -1.742 -0.066 6.323 1.00 0.00 S ATOM 344 CE MET A 46 -1.415 -1.195 4.981 1.00 0.00 C ATOM 0 H MET A 46 -6.259 0.616 5.072 1.00 0.00 H new ATOM 0 HA MET A 46 -5.787 2.274 7.473 1.00 0.00 H new ATOM 0 HB2 MET A 46 -3.626 1.380 7.770 1.00 0.00 H new ATOM 0 HB3 MET A 46 -4.562 -0.053 7.391 1.00 0.00 H new ATOM 0 HG2 MET A 46 -3.789 -0.071 5.093 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.124 1.545 5.228 1.00 0.00 H new ATOM 0 HE1 MET A 46 -0.369 -1.116 4.686 1.00 0.00 H new ATOM 0 HE2 MET A 46 -1.625 -2.215 5.304 1.00 0.00 H new ATOM 0 HE3 MET A 46 -2.052 -0.945 4.132 1.00 0.00 H new ATOM 352 N GLU A 47 -4.518 3.970 6.133 1.00 0.00 N ATOM 353 CA GLU A 47 -4.053 5.070 5.304 1.00 0.00 C ATOM 354 C GLU A 47 -2.669 5.532 5.763 1.00 0.00 C ATOM 355 O GLU A 47 -2.520 6.058 6.865 1.00 0.00 O ATOM 356 CB GLU A 47 -5.052 6.228 5.319 1.00 0.00 C ATOM 357 CG GLU A 47 -5.378 6.653 6.753 1.00 0.00 C ATOM 358 CD GLU A 47 -6.876 6.522 7.036 1.00 0.00 C ATOM 359 OE1 GLU A 47 -7.276 5.421 7.474 1.00 0.00 O ATOM 360 OE2 GLU A 47 -7.586 7.524 6.809 1.00 0.00 O ATOM 0 H GLU A 47 -4.495 4.153 7.136 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.973 4.717 4.276 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.641 7.075 4.770 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.967 5.930 4.807 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -4.816 6.037 7.455 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -5.063 7.685 6.911 1.00 0.00 H new ATOM 365 N GLY A 48 -1.691 5.320 4.895 1.00 0.00 N ATOM 366 CA GLY A 48 -0.324 5.709 5.198 1.00 0.00 C ATOM 367 C GLY A 48 0.541 5.700 3.936 1.00 0.00 C ATOM 368 O GLY A 48 0.162 5.113 2.923 1.00 0.00 O ATOM 0 H GLY A 48 -1.818 4.884 3.982 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.315 6.704 5.642 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.097 5.027 5.937 1.00 0.00 H new ATOM 372 N THR A 49 1.688 6.355 4.038 1.00 0.00 N ATOM 373 CA THR A 49 2.610 6.430 2.918 1.00 0.00 C ATOM 374 C THR A 49 3.892 5.654 3.230 1.00 0.00 C ATOM 375 O THR A 49 4.486 5.833 4.292 1.00 0.00 O ATOM 376 CB THR A 49 2.855 7.907 2.604 1.00 0.00 C ATOM 377 OG1 THR A 49 4.248 7.974 2.312 1.00 0.00 O ATOM 378 CG2 THR A 49 2.688 8.802 3.833 1.00 0.00 C ATOM 0 H THR A 49 2.000 6.839 4.880 1.00 0.00 H new ATOM 0 HA THR A 49 2.191 5.960 2.029 1.00 0.00 H new ATOM 0 HB THR A 49 2.167 8.231 1.823 1.00 0.00 H new ATOM 0 HG1 THR A 49 4.424 7.531 1.456 1.00 0.00 H new ATOM 0 HG21 THR A 49 2.873 9.840 3.555 1.00 0.00 H new ATOM 0 HG22 THR A 49 1.673 8.705 4.219 1.00 0.00 H new ATOM 0 HG23 THR A 49 3.399 8.500 4.602 1.00 0.00 H new ATOM 386 N LEU A 50 4.280 4.811 2.285 1.00 0.00 N ATOM 387 CA LEU A 50 5.480 4.008 2.446 1.00 0.00 C ATOM 388 C LEU A 50 6.383 4.196 1.224 1.00 0.00 C ATOM 389 O LEU A 50 5.924 4.639 0.172 1.00 0.00 O ATOM 390 CB LEU A 50 5.115 2.547 2.721 1.00 0.00 C ATOM 391 CG LEU A 50 4.096 2.309 3.837 1.00 0.00 C ATOM 392 CD1 LEU A 50 2.718 2.843 3.443 1.00 0.00 C ATOM 393 CD2 LEU A 50 4.047 0.832 4.230 1.00 0.00 C ATOM 0 H LEU A 50 3.785 4.666 1.405 1.00 0.00 H new ATOM 0 HA LEU A 50 6.046 4.341 3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.725 2.111 1.801 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.028 2.005 2.968 1.00 0.00 H new ATOM 0 HG LEU A 50 4.418 2.865 4.717 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.012 2.661 4.253 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.784 3.914 3.252 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.375 2.335 2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.315 0.691 5.025 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.762 0.234 3.364 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.029 0.516 4.581 1.00 0.00 H new ATOM 404 N THR A 51 7.649 3.852 1.406 1.00 0.00 N ATOM 405 CA THR A 51 8.619 3.978 0.331 1.00 0.00 C ATOM 406 C THR A 51 9.147 2.600 -0.075 1.00 0.00 C ATOM 407 O THR A 51 9.637 1.847 0.765 1.00 0.00 O ATOM 408 CB THR A 51 9.717 4.937 0.796 1.00 0.00 C ATOM 409 OG1 THR A 51 9.430 6.152 0.111 1.00 0.00 O ATOM 410 CG2 THR A 51 11.101 4.537 0.280 1.00 0.00 C ATOM 0 H THR A 51 8.026 3.486 2.281 1.00 0.00 H new ATOM 0 HA THR A 51 8.163 4.394 -0.567 1.00 0.00 H new ATOM 0 HB THR A 51 9.731 4.971 1.885 1.00 0.00 H new ATOM 0 HG1 THR A 51 9.441 6.897 0.748 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.843 5.250 0.639 1.00 0.00 H new ATOM 0 HG22 THR A 51 11.351 3.540 0.643 1.00 0.00 H new ATOM 0 HG23 THR A 51 11.096 4.536 -0.810 1.00 0.00 H new ATOM 418 N ARG A 52 9.029 2.312 -1.363 1.00 0.00 N ATOM 419 CA ARG A 52 9.488 1.039 -1.890 1.00 0.00 C ATOM 420 C ARG A 52 10.991 1.091 -2.170 1.00 0.00 C ATOM 421 O ARG A 52 11.422 1.685 -3.158 1.00 0.00 O ATOM 422 CB ARG A 52 8.748 0.678 -3.180 1.00 0.00 C ATOM 423 CG ARG A 52 8.919 -0.805 -3.514 1.00 0.00 C ATOM 424 CD ARG A 52 7.684 -1.351 -4.232 1.00 0.00 C ATOM 425 NE ARG A 52 8.015 -1.670 -5.639 1.00 0.00 N ATOM 426 CZ ARG A 52 8.976 -2.529 -6.008 1.00 0.00 C ATOM 427 NH1 ARG A 52 9.705 -3.160 -5.077 1.00 0.00 N ATOM 428 NH2 ARG A 52 9.207 -2.756 -7.308 1.00 0.00 N ATOM 0 H ARG A 52 8.622 2.939 -2.057 1.00 0.00 H new ATOM 0 HA ARG A 52 9.281 0.276 -1.140 1.00 0.00 H new ATOM 0 HB2 ARG A 52 7.688 0.910 -3.073 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.126 1.285 -4.002 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.799 -0.941 -4.143 1.00 0.00 H new ATOM 0 HG3 ARG A 52 9.091 -1.370 -2.598 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.323 -2.245 -3.723 1.00 0.00 H new ATOM 0 HD3 ARG A 52 6.879 -0.617 -4.197 1.00 0.00 H new ATOM 0 HE ARG A 52 7.479 -1.208 -6.373 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.529 -2.987 -4.087 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.436 -3.813 -5.358 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.652 -2.275 -8.016 1.00 0.00 H new ATOM 0 HH22 ARG A 52 9.938 -3.409 -7.590 1.00 0.00 H new ATOM 439 N VAL A 53 11.748 0.463 -1.283 1.00 0.00 N ATOM 440 CA VAL A 53 13.194 0.431 -1.422 1.00 0.00 C ATOM 441 C VAL A 53 13.585 -0.706 -2.370 1.00 0.00 C ATOM 442 O VAL A 53 14.114 -1.728 -1.934 1.00 0.00 O ATOM 443 CB VAL A 53 13.849 0.313 -0.045 1.00 0.00 C ATOM 444 CG1 VAL A 53 15.219 -0.362 -0.145 1.00 0.00 C ATOM 445 CG2 VAL A 53 13.961 1.682 0.627 1.00 0.00 C ATOM 0 H VAL A 53 11.387 -0.028 -0.465 1.00 0.00 H new ATOM 0 HA VAL A 53 13.557 1.360 -1.861 1.00 0.00 H new ATOM 0 HB VAL A 53 13.211 -0.315 0.577 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.663 -0.433 0.848 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.102 -1.362 -0.563 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.869 0.228 -0.791 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.430 1.570 1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.567 2.343 0.007 1.00 0.00 H new ATOM 0 HG23 VAL A 53 12.966 2.110 0.749 1.00 0.00 H new ATOM 455 N GLY A 54 13.311 -0.489 -3.648 1.00 0.00 N ATOM 456 CA GLY A 54 13.629 -1.482 -4.660 1.00 0.00 C ATOM 457 C GLY A 54 13.894 -0.820 -6.014 1.00 0.00 C ATOM 458 O GLY A 54 14.008 -1.502 -7.031 1.00 0.00 O ATOM 0 H GLY A 54 12.872 0.360 -4.006 1.00 0.00 H new ATOM 0 HA2 GLY A 54 14.506 -2.052 -4.352 1.00 0.00 H new ATOM 0 HA3 GLY A 54 12.805 -2.189 -4.752 1.00 0.00 H new ATOM 462 N ALA A 55 13.985 0.502 -5.982 1.00 0.00 N ATOM 463 CA ALA A 55 14.235 1.264 -7.194 1.00 0.00 C ATOM 464 C ALA A 55 13.912 2.738 -6.939 1.00 0.00 C ATOM 465 O ALA A 55 13.348 3.412 -7.801 1.00 0.00 O ATOM 466 CB ALA A 55 13.413 0.678 -8.344 1.00 0.00 C ATOM 0 H ALA A 55 13.890 1.064 -5.136 1.00 0.00 H new ATOM 0 HA ALA A 55 15.285 1.200 -7.478 1.00 0.00 H new ATOM 0 HB1 ALA A 55 13.600 1.249 -9.253 1.00 0.00 H new ATOM 0 HB2 ALA A 55 13.700 -0.362 -8.503 1.00 0.00 H new ATOM 0 HB3 ALA A 55 12.353 0.728 -8.096 1.00 0.00 H new ATOM 472 N LYS A 56 14.282 3.196 -5.752 1.00 0.00 N ATOM 473 CA LYS A 56 14.040 4.578 -5.375 1.00 0.00 C ATOM 474 C LYS A 56 12.605 4.959 -5.745 1.00 0.00 C ATOM 475 O LYS A 56 12.380 5.662 -6.729 1.00 0.00 O ATOM 476 CB LYS A 56 15.098 5.495 -5.989 1.00 0.00 C ATOM 477 CG LYS A 56 16.383 5.485 -5.158 1.00 0.00 C ATOM 478 CD LYS A 56 16.487 6.742 -4.293 1.00 0.00 C ATOM 479 CE LYS A 56 17.040 6.409 -2.907 1.00 0.00 C ATOM 480 NZ LYS A 56 18.186 7.289 -2.581 1.00 0.00 N ATOM 0 H LYS A 56 14.748 2.634 -5.039 1.00 0.00 H new ATOM 0 HA LYS A 56 14.135 4.700 -4.296 1.00 0.00 H new ATOM 0 HB2 LYS A 56 15.317 5.173 -7.007 1.00 0.00 H new ATOM 0 HB3 LYS A 56 14.710 6.512 -6.053 1.00 0.00 H new ATOM 0 HG2 LYS A 56 16.402 4.600 -4.523 1.00 0.00 H new ATOM 0 HG3 LYS A 56 17.247 5.422 -5.819 1.00 0.00 H new ATOM 0 HD2 LYS A 56 17.134 7.471 -4.781 1.00 0.00 H new ATOM 0 HD3 LYS A 56 15.504 7.203 -4.195 1.00 0.00 H new ATOM 0 HE2 LYS A 56 16.257 6.529 -2.158 1.00 0.00 H new ATOM 0 HE3 LYS A 56 17.354 5.366 -2.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 18.550 7.050 -1.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 18.939 7.155 -3.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 17.875 8.282 -2.591 1.00 0.00 H new ATOM 490 N HIS A 57 11.671 4.478 -4.937 1.00 0.00 N ATOM 491 CA HIS A 57 10.265 4.759 -5.168 1.00 0.00 C ATOM 492 C HIS A 57 9.605 5.190 -3.856 1.00 0.00 C ATOM 493 O HIS A 57 9.830 4.577 -2.814 1.00 0.00 O ATOM 494 CB HIS A 57 9.569 3.559 -5.815 1.00 0.00 C ATOM 495 CG HIS A 57 9.954 3.331 -7.257 1.00 0.00 C ATOM 496 ND1 HIS A 57 10.504 4.322 -8.052 1.00 0.00 N ATOM 497 CD2 HIS A 57 9.865 2.217 -8.038 1.00 0.00 C ATOM 498 CE1 HIS A 57 10.730 3.815 -9.256 1.00 0.00 C ATOM 499 NE2 HIS A 57 10.333 2.510 -9.245 1.00 0.00 N ATOM 0 H HIS A 57 11.861 3.895 -4.122 1.00 0.00 H new ATOM 0 HA HIS A 57 10.167 5.585 -5.873 1.00 0.00 H new ATOM 0 HB2 HIS A 57 9.804 2.663 -5.241 1.00 0.00 H new ATOM 0 HB3 HIS A 57 8.490 3.702 -5.756 1.00 0.00 H new ATOM 0 HD1 HIS A 57 10.702 5.279 -7.761 1.00 0.00 H new ATOM 0 HD2 HIS A 57 9.479 1.258 -7.727 1.00 0.00 H new ATOM 0 HE1 HIS A 57 11.154 4.343 -10.098 1.00 0.00 H new ATOM 506 N GLU A 58 8.804 6.241 -3.951 1.00 0.00 N ATOM 507 CA GLU A 58 8.110 6.761 -2.784 1.00 0.00 C ATOM 508 C GLU A 58 6.717 7.258 -3.174 1.00 0.00 C ATOM 509 O GLU A 58 6.549 7.896 -4.212 1.00 0.00 O ATOM 510 CB GLU A 58 8.922 7.872 -2.114 1.00 0.00 C ATOM 511 CG GLU A 58 8.087 8.599 -1.058 1.00 0.00 C ATOM 512 CD GLU A 58 8.985 9.282 -0.025 1.00 0.00 C ATOM 513 OE1 GLU A 58 9.418 10.419 -0.313 1.00 0.00 O ATOM 514 OE2 GLU A 58 9.219 8.653 1.029 1.00 0.00 O ATOM 0 H GLU A 58 8.620 6.747 -4.817 1.00 0.00 H new ATOM 0 HA GLU A 58 7.997 5.953 -2.061 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.812 7.448 -1.650 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.263 8.583 -2.867 1.00 0.00 H new ATOM 0 HG2 GLU A 58 7.451 9.341 -1.540 1.00 0.00 H new ATOM 0 HG3 GLU A 58 7.427 7.889 -0.559 1.00 0.00 H new ATOM 519 N ARG A 59 5.753 6.946 -2.320 1.00 0.00 N ATOM 520 CA ARG A 59 4.379 7.353 -2.561 1.00 0.00 C ATOM 521 C ARG A 59 3.492 6.956 -1.379 1.00 0.00 C ATOM 522 O ARG A 59 3.986 6.459 -0.368 1.00 0.00 O ATOM 523 CB ARG A 59 3.831 6.713 -3.838 1.00 0.00 C ATOM 524 CG ARG A 59 2.875 7.664 -4.561 1.00 0.00 C ATOM 525 CD ARG A 59 3.405 9.099 -4.538 1.00 0.00 C ATOM 526 NE ARG A 59 2.814 9.838 -3.400 1.00 0.00 N ATOM 527 CZ ARG A 59 3.188 11.071 -3.030 1.00 0.00 C ATOM 528 NH1 ARG A 59 4.154 11.709 -3.704 1.00 0.00 N ATOM 529 NH2 ARG A 59 2.595 11.666 -1.985 1.00 0.00 N ATOM 0 H ARG A 59 5.896 6.416 -1.460 1.00 0.00 H new ATOM 0 HA ARG A 59 4.370 8.437 -2.678 1.00 0.00 H new ATOM 0 HB2 ARG A 59 4.656 6.449 -4.499 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.311 5.787 -3.591 1.00 0.00 H new ATOM 0 HG2 ARG A 59 2.744 7.338 -5.593 1.00 0.00 H new ATOM 0 HG3 ARG A 59 1.894 7.628 -4.088 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.492 9.093 -4.453 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.161 9.601 -5.474 1.00 0.00 H new ATOM 0 HE ARG A 59 2.076 9.381 -2.864 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.605 11.257 -4.499 1.00 0.00 H new ATOM 0 HH12 ARG A 59 4.438 12.647 -3.422 1.00 0.00 H new ATOM 0 HH21 ARG A 59 1.859 11.180 -1.472 1.00 0.00 H new ATOM 0 HH22 ARG A 59 2.880 12.604 -1.703 1.00 0.00 H new ATOM 540 N HIS A 60 2.198 7.189 -1.547 1.00 0.00 N ATOM 541 CA HIS A 60 1.239 6.861 -0.506 1.00 0.00 C ATOM 542 C HIS A 60 0.701 5.446 -0.732 1.00 0.00 C ATOM 543 O HIS A 60 0.643 4.973 -1.865 1.00 0.00 O ATOM 544 CB HIS A 60 0.129 7.912 -0.440 1.00 0.00 C ATOM 545 CG HIS A 60 0.487 9.131 0.378 1.00 0.00 C ATOM 546 ND1 HIS A 60 1.601 9.919 0.362 1.00 0.00 N flip ATOM 547 CD2 HIS A 60 -0.352 9.658 1.344 1.00 0.00 C flip ATOM 548 CE1 HIS A 60 1.449 10.876 1.270 1.00 0.00 C flip ATOM 549 NE2 HIS A 60 0.240 10.716 1.880 1.00 0.00 N flip ATOM 0 H HIS A 60 1.792 7.600 -2.387 1.00 0.00 H new ATOM 0 HA HIS A 60 1.732 6.875 0.466 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -0.120 8.227 -1.453 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -0.766 7.454 -0.019 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -1.324 9.273 1.615 1.00 0.00 H new ATOM 0 HE1 HIS A 60 2.166 11.654 1.489 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -0.142 11.307 2.619 1.00 0.00 H new ATOM 556 N ILE A 61 0.322 4.811 0.367 1.00 0.00 N ATOM 557 CA ILE A 61 -0.209 3.459 0.304 1.00 0.00 C ATOM 558 C ILE A 61 -1.567 3.416 1.007 1.00 0.00 C ATOM 559 O ILE A 61 -1.695 3.858 2.147 1.00 0.00 O ATOM 560 CB ILE A 61 0.805 2.458 0.864 1.00 0.00 C ATOM 561 CG1 ILE A 61 2.177 2.645 0.213 1.00 0.00 C ATOM 562 CG2 ILE A 61 0.293 1.023 0.723 1.00 0.00 C ATOM 563 CD1 ILE A 61 2.083 2.516 -1.309 1.00 0.00 C ATOM 0 H ILE A 61 0.372 5.207 1.306 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.376 3.163 -0.732 1.00 0.00 H new ATOM 0 HB ILE A 61 0.926 2.653 1.930 1.00 0.00 H new ATOM 0 HG12 ILE A 61 2.577 3.624 0.475 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.873 1.902 0.602 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.032 0.332 1.128 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -0.643 0.915 1.270 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.125 0.798 -0.330 1.00 0.00 H new ATOM 0 HD11 ILE A 61 3.071 2.653 -1.747 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.705 1.527 -1.568 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.405 3.276 -1.697 1.00 0.00 H new ATOM 574 N PHE A 62 -2.548 2.880 0.296 1.00 0.00 N ATOM 575 CA PHE A 62 -3.893 2.773 0.836 1.00 0.00 C ATOM 576 C PHE A 62 -4.459 1.368 0.625 1.00 0.00 C ATOM 577 O PHE A 62 -4.726 0.966 -0.506 1.00 0.00 O ATOM 578 CB PHE A 62 -4.761 3.780 0.079 1.00 0.00 C ATOM 579 CG PHE A 62 -4.940 5.116 0.801 1.00 0.00 C ATOM 580 CD1 PHE A 62 -3.877 5.950 0.962 1.00 0.00 C ATOM 581 CD2 PHE A 62 -6.161 5.470 1.283 1.00 0.00 C ATOM 582 CE1 PHE A 62 -4.044 7.191 1.632 1.00 0.00 C ATOM 583 CE2 PHE A 62 -6.327 6.711 1.953 1.00 0.00 C ATOM 584 CZ PHE A 62 -5.265 7.545 2.114 1.00 0.00 C ATOM 0 H PHE A 62 -2.438 2.515 -0.650 1.00 0.00 H new ATOM 0 HA PHE A 62 -3.880 2.972 1.908 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -4.316 3.964 -0.899 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -5.742 3.339 -0.095 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -2.907 5.668 0.580 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -7.004 4.808 1.156 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -3.201 7.854 1.759 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -7.297 6.993 2.335 1.00 0.00 H new ATOM 0 HZ PHE A 62 -5.391 8.488 2.625 1.00 0.00 H new ATOM 593 N LEU A 63 -4.627 0.659 1.733 1.00 0.00 N ATOM 594 CA LEU A 63 -5.157 -0.692 1.682 1.00 0.00 C ATOM 595 C LEU A 63 -6.660 -0.657 1.966 1.00 0.00 C ATOM 596 O LEU A 63 -7.082 -0.256 3.049 1.00 0.00 O ATOM 597 CB LEU A 63 -4.375 -1.609 2.626 1.00 0.00 C ATOM 598 CG LEU A 63 -5.141 -2.131 3.843 1.00 0.00 C ATOM 599 CD1 LEU A 63 -6.231 -3.120 3.421 1.00 0.00 C ATOM 600 CD2 LEU A 63 -4.186 -2.735 4.875 1.00 0.00 C ATOM 0 H LEU A 63 -4.405 0.996 2.670 1.00 0.00 H new ATOM 0 HA LEU A 63 -5.030 -1.114 0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.015 -2.464 2.054 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.496 -1.069 2.979 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.639 -1.288 4.321 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -6.761 -3.476 4.304 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -6.934 -2.623 2.752 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.775 -3.966 2.906 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.756 -3.098 5.730 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.640 -3.564 4.424 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.480 -1.974 5.207 1.00 0.00 H new ATOM 611 N PHE A 64 -7.427 -1.082 0.972 1.00 0.00 N ATOM 612 CA PHE A 64 -8.874 -1.104 1.101 1.00 0.00 C ATOM 613 C PHE A 64 -9.349 -2.416 1.729 1.00 0.00 C ATOM 614 O PHE A 64 -8.708 -3.454 1.566 1.00 0.00 O ATOM 615 CB PHE A 64 -9.450 -0.990 -0.311 1.00 0.00 C ATOM 616 CG PHE A 64 -9.007 0.265 -1.066 1.00 0.00 C ATOM 617 CD1 PHE A 64 -8.495 1.323 -0.382 1.00 0.00 C ATOM 618 CD2 PHE A 64 -9.124 0.322 -2.420 1.00 0.00 C ATOM 619 CE1 PHE A 64 -8.083 2.488 -1.082 1.00 0.00 C ATOM 620 CE2 PHE A 64 -8.713 1.487 -3.120 1.00 0.00 C ATOM 621 CZ PHE A 64 -8.201 2.545 -2.436 1.00 0.00 C ATOM 0 H PHE A 64 -7.073 -1.414 0.075 1.00 0.00 H new ATOM 0 HA PHE A 64 -9.203 -0.286 1.742 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -9.155 -1.869 -0.884 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -10.538 -0.999 -0.250 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -8.402 1.277 0.693 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -9.530 -0.519 -2.963 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -7.676 3.329 -0.539 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -8.807 1.533 -4.195 1.00 0.00 H new ATOM 0 HZ PHE A 64 -7.888 3.431 -2.968 1.00 0.00 H new ATOM 630 N ASP A 65 -10.468 -2.328 2.432 1.00 0.00 N ATOM 631 CA ASP A 65 -11.036 -3.495 3.085 1.00 0.00 C ATOM 632 C ASP A 65 -11.527 -4.480 2.022 1.00 0.00 C ATOM 633 O ASP A 65 -12.058 -5.539 2.351 1.00 0.00 O ATOM 634 CB ASP A 65 -12.231 -3.110 3.959 1.00 0.00 C ATOM 635 CG ASP A 65 -12.263 -3.773 5.339 1.00 0.00 C ATOM 636 OD1 ASP A 65 -11.520 -4.763 5.510 1.00 0.00 O ATOM 637 OD2 ASP A 65 -13.032 -3.275 6.190 1.00 0.00 O ATOM 0 H ASP A 65 -10.997 -1.466 2.564 1.00 0.00 H new ATOM 0 HA ASP A 65 -10.262 -3.943 3.708 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -12.231 -2.028 4.092 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -13.148 -3.366 3.428 1.00 0.00 H new ATOM 641 N GLY A 66 -11.330 -4.096 0.770 1.00 0.00 N ATOM 642 CA GLY A 66 -11.745 -4.933 -0.343 1.00 0.00 C ATOM 643 C GLY A 66 -10.533 -5.493 -1.091 1.00 0.00 C ATOM 644 O GLY A 66 -10.587 -6.598 -1.626 1.00 0.00 O ATOM 0 H GLY A 66 -10.889 -3.217 0.501 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -12.361 -5.754 0.025 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.363 -4.353 -1.028 1.00 0.00 H new ATOM 648 N LEU A 67 -9.469 -4.704 -1.102 1.00 0.00 N ATOM 649 CA LEU A 67 -8.246 -5.108 -1.775 1.00 0.00 C ATOM 650 C LEU A 67 -7.139 -4.100 -1.458 1.00 0.00 C ATOM 651 O LEU A 67 -7.380 -2.894 -1.438 1.00 0.00 O ATOM 652 CB LEU A 67 -8.495 -5.297 -3.272 1.00 0.00 C ATOM 653 CG LEU A 67 -7.470 -4.655 -4.209 1.00 0.00 C ATOM 654 CD1 LEU A 67 -6.141 -5.412 -4.169 1.00 0.00 C ATOM 655 CD2 LEU A 67 -8.022 -4.542 -5.632 1.00 0.00 C ATOM 0 H LEU A 67 -9.428 -3.788 -0.656 1.00 0.00 H new ATOM 0 HA LEU A 67 -7.911 -6.078 -1.407 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.530 -6.366 -3.482 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.479 -4.893 -3.510 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.275 -3.642 -3.858 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -5.430 -4.935 -4.844 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -5.744 -5.397 -3.154 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -6.301 -6.444 -4.481 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.273 -4.082 -6.277 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -8.264 -5.536 -6.008 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.922 -3.927 -5.625 1.00 0.00 H new ATOM 666 N MET A 68 -5.950 -4.632 -1.219 1.00 0.00 N ATOM 667 CA MET A 68 -4.805 -3.795 -0.904 1.00 0.00 C ATOM 668 C MET A 68 -4.250 -3.127 -2.165 1.00 0.00 C ATOM 669 O MET A 68 -3.860 -3.808 -3.111 1.00 0.00 O ATOM 670 CB MET A 68 -3.712 -4.646 -0.254 1.00 0.00 C ATOM 671 CG MET A 68 -2.632 -3.765 0.375 1.00 0.00 C ATOM 672 SD MET A 68 -2.262 -4.339 2.025 1.00 0.00 S ATOM 673 CE MET A 68 -1.433 -5.872 1.641 1.00 0.00 C ATOM 0 H MET A 68 -5.754 -5.633 -1.237 1.00 0.00 H new ATOM 0 HA MET A 68 -5.128 -3.015 -0.214 1.00 0.00 H new ATOM 0 HB2 MET A 68 -4.152 -5.288 0.509 1.00 0.00 H new ATOM 0 HB3 MET A 68 -3.263 -5.300 -1.001 1.00 0.00 H new ATOM 0 HG2 MET A 68 -1.731 -3.787 -0.237 1.00 0.00 H new ATOM 0 HG3 MET A 68 -2.970 -2.729 0.408 1.00 0.00 H new ATOM 0 HE1 MET A 68 -1.243 -6.423 2.562 1.00 0.00 H new ATOM 0 HE2 MET A 68 -2.062 -6.471 0.983 1.00 0.00 H new ATOM 0 HE3 MET A 68 -0.487 -5.659 1.143 1.00 0.00 H new ATOM 681 N ILE A 69 -4.235 -1.803 -2.136 1.00 0.00 N ATOM 682 CA ILE A 69 -3.735 -1.036 -3.264 1.00 0.00 C ATOM 683 C ILE A 69 -2.662 -0.061 -2.777 1.00 0.00 C ATOM 684 O ILE A 69 -2.747 0.457 -1.664 1.00 0.00 O ATOM 685 CB ILE A 69 -4.889 -0.360 -4.005 1.00 0.00 C ATOM 686 CG1 ILE A 69 -4.460 0.996 -4.570 1.00 0.00 C ATOM 687 CG2 ILE A 69 -6.124 -0.242 -3.109 1.00 0.00 C ATOM 688 CD1 ILE A 69 -4.608 2.099 -3.520 1.00 0.00 C ATOM 0 H ILE A 69 -4.561 -1.242 -1.349 1.00 0.00 H new ATOM 0 HA ILE A 69 -3.261 -1.694 -3.992 1.00 0.00 H new ATOM 0 HB ILE A 69 -5.164 -0.989 -4.851 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -3.424 0.943 -4.904 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.065 1.238 -5.444 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.929 0.242 -3.661 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.444 -1.236 -2.798 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -5.879 0.352 -2.229 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -4.297 3.052 -3.947 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.650 2.165 -3.206 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -3.983 1.867 -2.658 1.00 0.00 H new ATOM 699 N CYS A 70 -1.675 0.161 -3.634 1.00 0.00 N ATOM 700 CA CYS A 70 -0.587 1.066 -3.304 1.00 0.00 C ATOM 701 C CYS A 70 -0.299 1.936 -4.529 1.00 0.00 C ATOM 702 O CYS A 70 -0.076 1.420 -5.623 1.00 0.00 O ATOM 703 CB CYS A 70 0.657 0.307 -2.838 1.00 0.00 C ATOM 704 SG CYS A 70 0.800 -1.278 -3.742 1.00 0.00 S ATOM 0 H CYS A 70 -1.606 -0.270 -4.556 1.00 0.00 H new ATOM 0 HA CYS A 70 -0.879 1.702 -2.468 1.00 0.00 H new ATOM 0 HB2 CYS A 70 1.547 0.913 -3.007 1.00 0.00 H new ATOM 0 HB3 CYS A 70 0.598 0.119 -1.766 1.00 0.00 H new ATOM 0 HG CYS A 70 1.861 -1.913 -3.340 1.00 0.00 H new ATOM 709 N CYS A 71 -0.312 3.242 -4.303 1.00 0.00 N ATOM 710 CA CYS A 71 -0.055 4.189 -5.375 1.00 0.00 C ATOM 711 C CYS A 71 1.394 4.664 -5.258 1.00 0.00 C ATOM 712 O CYS A 71 1.714 5.494 -4.408 1.00 0.00 O ATOM 713 CB CYS A 71 -1.042 5.357 -5.346 1.00 0.00 C ATOM 714 SG CYS A 71 -1.169 6.028 -3.647 1.00 0.00 S ATOM 0 H CYS A 71 -0.496 3.666 -3.394 1.00 0.00 H new ATOM 0 HA CYS A 71 -0.200 3.700 -6.338 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -0.713 6.139 -6.031 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -2.022 5.024 -5.689 1.00 0.00 H new ATOM 0 HG CYS A 71 -0.196 5.561 -2.922 1.00 0.00 H new ATOM 719 N LYS A 72 2.234 4.117 -6.125 1.00 0.00 N ATOM 720 CA LYS A 72 3.643 4.474 -6.130 1.00 0.00 C ATOM 721 C LYS A 72 3.872 5.609 -7.131 1.00 0.00 C ATOM 722 O LYS A 72 3.155 5.720 -8.124 1.00 0.00 O ATOM 723 CB LYS A 72 4.508 3.239 -6.392 1.00 0.00 C ATOM 724 CG LYS A 72 5.995 3.576 -6.271 1.00 0.00 C ATOM 725 CD LYS A 72 6.723 3.322 -7.592 1.00 0.00 C ATOM 726 CE LYS A 72 7.084 4.641 -8.282 1.00 0.00 C ATOM 727 NZ LYS A 72 7.525 4.394 -9.673 1.00 0.00 N ATOM 0 H LYS A 72 1.966 3.429 -6.829 1.00 0.00 H new ATOM 0 HA LYS A 72 3.946 4.845 -5.151 1.00 0.00 H new ATOM 0 HB2 LYS A 72 4.251 2.453 -5.682 1.00 0.00 H new ATOM 0 HB3 LYS A 72 4.300 2.849 -7.388 1.00 0.00 H new ATOM 0 HG2 LYS A 72 6.113 4.620 -5.982 1.00 0.00 H new ATOM 0 HG3 LYS A 72 6.445 2.974 -5.482 1.00 0.00 H new ATOM 0 HD2 LYS A 72 7.629 2.744 -7.407 1.00 0.00 H new ATOM 0 HD3 LYS A 72 6.092 2.724 -8.250 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.221 5.307 -8.281 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.876 5.144 -7.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 8.089 5.202 -10.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 8.104 3.531 -9.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 6.693 4.276 -10.285 1.00 0.00 H new ATOM 737 N SER A 73 4.876 6.421 -6.834 1.00 0.00 N ATOM 738 CA SER A 73 5.210 7.544 -7.694 1.00 0.00 C ATOM 739 C SER A 73 6.719 7.792 -7.668 1.00 0.00 C ATOM 740 O SER A 73 7.422 7.274 -6.802 1.00 0.00 O ATOM 741 CB SER A 73 4.456 8.806 -7.271 1.00 0.00 C ATOM 742 OG SER A 73 4.458 9.798 -8.294 1.00 0.00 O ATOM 0 H SER A 73 5.469 6.324 -6.010 1.00 0.00 H new ATOM 0 HA SER A 73 4.907 7.298 -8.712 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.428 8.547 -7.020 1.00 0.00 H new ATOM 0 HB3 SER A 73 4.911 9.215 -6.369 1.00 0.00 H new ATOM 0 HG SER A 73 3.757 10.458 -8.111 1.00 0.00 H new ATOM 747 N ASN A 74 7.172 8.586 -8.628 1.00 0.00 N ATOM 748 CA ASN A 74 8.585 8.910 -8.726 1.00 0.00 C ATOM 749 C ASN A 74 8.778 10.409 -8.489 1.00 0.00 C ATOM 750 O ASN A 74 9.680 11.021 -9.061 1.00 0.00 O ATOM 751 CB ASN A 74 9.132 8.576 -10.115 1.00 0.00 C ATOM 752 CG ASN A 74 10.646 8.361 -10.072 1.00 0.00 C ATOM 753 OD1 ASN A 74 11.425 9.142 -10.593 1.00 0.00 O ATOM 754 ND2 ASN A 74 11.017 7.262 -9.423 1.00 0.00 N ATOM 0 H ASN A 74 6.585 9.014 -9.344 1.00 0.00 H new ATOM 0 HA ASN A 74 9.118 8.323 -7.978 1.00 0.00 H new ATOM 0 HB2 ASN A 74 8.644 7.678 -10.495 1.00 0.00 H new ATOM 0 HB3 ASN A 74 8.896 9.385 -10.807 1.00 0.00 H new ATOM 0 HD21 ASN A 74 12.006 7.029 -9.338 1.00 0.00 H new ATOM 0 HD22 ASN A 74 10.312 6.651 -9.010 1.00 0.00 H new ATOM 899 N ALA A 86 -3.765 10.926 -11.954 1.00 0.00 N ATOM 900 CA ALA A 86 -3.224 9.730 -11.331 1.00 0.00 C ATOM 901 C ALA A 86 -1.699 9.748 -11.440 1.00 0.00 C ATOM 902 O ALA A 86 -1.093 8.773 -11.883 1.00 0.00 O ATOM 903 CB ALA A 86 -3.841 8.491 -11.986 1.00 0.00 C ATOM 0 HA ALA A 86 -3.478 9.701 -10.271 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.436 7.593 -11.520 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.923 8.511 -11.856 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -3.604 8.486 -13.050 1.00 0.00 H new ATOM 909 N GLU A 87 -1.121 10.867 -11.028 1.00 0.00 N ATOM 910 CA GLU A 87 0.322 11.024 -11.073 1.00 0.00 C ATOM 911 C GLU A 87 1.012 9.694 -10.761 1.00 0.00 C ATOM 912 O GLU A 87 1.838 9.221 -11.539 1.00 0.00 O ATOM 913 CB GLU A 87 0.785 12.121 -10.111 1.00 0.00 C ATOM 914 CG GLU A 87 0.004 13.416 -10.341 1.00 0.00 C ATOM 915 CD GLU A 87 0.756 14.618 -9.765 1.00 0.00 C ATOM 916 OE1 GLU A 87 1.978 14.694 -10.012 1.00 0.00 O ATOM 917 OE2 GLU A 87 0.089 15.434 -9.091 1.00 0.00 O ATOM 0 H GLU A 87 -1.627 11.674 -10.661 1.00 0.00 H new ATOM 0 HA GLU A 87 0.603 11.328 -12.081 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.650 11.788 -9.082 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.850 12.305 -10.249 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.159 13.562 -11.409 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.979 13.340 -9.876 1.00 0.00 H new ATOM 922 N TYR A 88 0.647 9.129 -9.619 1.00 0.00 N ATOM 923 CA TYR A 88 1.219 7.863 -9.194 1.00 0.00 C ATOM 924 C TYR A 88 0.580 6.693 -9.943 1.00 0.00 C ATOM 925 O TYR A 88 -0.243 6.897 -10.836 1.00 0.00 O ATOM 926 CB TYR A 88 0.900 7.735 -7.703 1.00 0.00 C ATOM 927 CG TYR A 88 1.014 9.049 -6.927 1.00 0.00 C ATOM 928 CD1 TYR A 88 1.787 10.078 -7.424 1.00 0.00 C ATOM 929 CD2 TYR A 88 0.344 9.203 -5.730 1.00 0.00 C ATOM 930 CE1 TYR A 88 1.895 11.314 -6.693 1.00 0.00 C ATOM 931 CE2 TYR A 88 0.452 10.439 -4.999 1.00 0.00 C ATOM 932 CZ TYR A 88 1.222 11.434 -5.517 1.00 0.00 C ATOM 933 OH TYR A 88 1.324 12.602 -4.827 1.00 0.00 O ATOM 0 H TYR A 88 -0.038 9.525 -8.975 1.00 0.00 H new ATOM 0 HA TYR A 88 2.290 7.839 -9.396 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.112 7.345 -7.591 1.00 0.00 H new ATOM 0 HB3 TYR A 88 1.575 7.003 -7.259 1.00 0.00 H new ATOM 0 HD1 TYR A 88 2.311 9.957 -8.361 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -0.261 8.397 -5.342 1.00 0.00 H new ATOM 0 HE1 TYR A 88 2.497 12.128 -7.070 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -0.066 10.573 -4.061 1.00 0.00 H new ATOM 0 HH TYR A 88 0.790 12.545 -4.007 1.00 0.00 H new ATOM 942 N ARG A 89 0.981 5.492 -9.553 1.00 0.00 N ATOM 943 CA ARG A 89 0.457 4.289 -10.177 1.00 0.00 C ATOM 944 C ARG A 89 -0.016 3.300 -9.109 1.00 0.00 C ATOM 945 O ARG A 89 0.796 2.728 -8.384 1.00 0.00 O ATOM 946 CB ARG A 89 1.516 3.615 -11.052 1.00 0.00 C ATOM 947 CG ARG A 89 1.668 4.345 -12.388 1.00 0.00 C ATOM 948 CD ARG A 89 2.573 3.561 -13.341 1.00 0.00 C ATOM 949 NE ARG A 89 3.658 4.433 -13.841 1.00 0.00 N ATOM 950 CZ ARG A 89 4.403 4.162 -14.922 1.00 0.00 C ATOM 951 NH1 ARG A 89 4.184 3.041 -15.622 1.00 0.00 N ATOM 952 NH2 ARG A 89 5.366 5.012 -15.302 1.00 0.00 N ATOM 0 H ARG A 89 1.663 5.326 -8.813 1.00 0.00 H new ATOM 0 HA ARG A 89 -0.384 4.582 -10.805 1.00 0.00 H new ATOM 0 HB2 ARG A 89 2.472 3.604 -10.529 1.00 0.00 H new ATOM 0 HB3 ARG A 89 1.238 2.576 -11.231 1.00 0.00 H new ATOM 0 HG2 ARG A 89 0.688 4.485 -12.844 1.00 0.00 H new ATOM 0 HG3 ARG A 89 2.085 5.338 -12.219 1.00 0.00 H new ATOM 0 HD2 ARG A 89 2.997 2.699 -12.826 1.00 0.00 H new ATOM 0 HD3 ARG A 89 1.989 3.178 -14.178 1.00 0.00 H new ATOM 0 HE ARG A 89 3.852 5.295 -13.331 1.00 0.00 H new ATOM 0 HH11 ARG A 89 3.451 2.394 -15.332 1.00 0.00 H new ATOM 0 HH12 ARG A 89 4.751 2.834 -16.445 1.00 0.00 H new ATOM 0 HH21 ARG A 89 5.532 5.865 -14.769 1.00 0.00 H new ATOM 0 HH22 ARG A 89 5.933 4.806 -16.125 1.00 0.00 H new ATOM 963 N LEU A 90 -1.329 3.129 -9.046 1.00 0.00 N ATOM 964 CA LEU A 90 -1.920 2.220 -8.080 1.00 0.00 C ATOM 965 C LEU A 90 -1.511 0.785 -8.420 1.00 0.00 C ATOM 966 O LEU A 90 -1.417 0.423 -9.591 1.00 0.00 O ATOM 967 CB LEU A 90 -3.434 2.427 -8.005 1.00 0.00 C ATOM 968 CG LEU A 90 -4.295 1.264 -8.504 1.00 0.00 C ATOM 969 CD1 LEU A 90 -3.911 0.870 -9.932 1.00 0.00 C ATOM 970 CD2 LEU A 90 -4.222 0.076 -7.542 1.00 0.00 C ATOM 0 H LEU A 90 -2.000 3.605 -9.649 1.00 0.00 H new ATOM 0 HA LEU A 90 -1.543 2.431 -7.079 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.702 2.633 -6.969 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -3.688 3.316 -8.583 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.333 1.594 -8.530 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -4.538 0.042 -10.262 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -4.056 1.722 -10.596 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.865 0.565 -9.957 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.842 -0.737 -7.920 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.189 -0.263 -7.461 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -4.582 0.381 -6.559 1.00 0.00 H new ATOM 981 N LYS A 91 -1.279 0.006 -7.374 1.00 0.00 N ATOM 982 CA LYS A 91 -0.882 -1.381 -7.545 1.00 0.00 C ATOM 983 C LYS A 91 -1.916 -2.289 -6.878 1.00 0.00 C ATOM 984 O LYS A 91 -1.893 -2.473 -5.662 1.00 0.00 O ATOM 985 CB LYS A 91 0.546 -1.597 -7.038 1.00 0.00 C ATOM 986 CG LYS A 91 1.503 -1.875 -8.198 1.00 0.00 C ATOM 987 CD LYS A 91 2.636 -2.807 -7.763 1.00 0.00 C ATOM 988 CE LYS A 91 3.966 -2.382 -8.390 1.00 0.00 C ATOM 989 NZ LYS A 91 4.542 -1.235 -7.653 1.00 0.00 N ATOM 0 H LYS A 91 -1.359 0.310 -6.403 1.00 0.00 H new ATOM 0 HA LYS A 91 -0.862 -1.644 -8.603 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.879 -0.715 -6.491 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.565 -2.432 -6.338 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.955 -2.325 -9.026 1.00 0.00 H new ATOM 0 HG3 LYS A 91 1.919 -0.936 -8.563 1.00 0.00 H new ATOM 0 HD2 LYS A 91 2.723 -2.798 -6.676 1.00 0.00 H new ATOM 0 HD3 LYS A 91 2.402 -3.831 -8.056 1.00 0.00 H new ATOM 0 HE2 LYS A 91 4.665 -3.218 -8.377 1.00 0.00 H new ATOM 0 HE3 LYS A 91 3.813 -2.111 -9.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 5.444 -0.959 -8.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 3.881 -0.433 -7.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.707 -1.506 -6.663 1.00 0.00 H new ATOM 999 N GLU A 92 -2.800 -2.832 -7.702 1.00 0.00 N ATOM 1000 CA GLU A 92 -3.841 -3.718 -7.207 1.00 0.00 C ATOM 1001 C GLU A 92 -3.219 -4.940 -6.529 1.00 0.00 C ATOM 1002 O GLU A 92 -2.807 -5.884 -7.201 1.00 0.00 O ATOM 1003 CB GLU A 92 -4.787 -4.136 -8.334 1.00 0.00 C ATOM 1004 CG GLU A 92 -4.022 -4.839 -9.458 1.00 0.00 C ATOM 1005 CD GLU A 92 -4.716 -4.631 -10.806 1.00 0.00 C ATOM 1006 OE1 GLU A 92 -5.960 -4.510 -10.791 1.00 0.00 O ATOM 1007 OE2 GLU A 92 -3.986 -4.598 -11.821 1.00 0.00 O ATOM 0 H GLU A 92 -2.817 -2.676 -8.710 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.430 -3.177 -6.466 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.556 -4.801 -7.941 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.297 -3.258 -8.730 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -3.003 -4.454 -9.506 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -3.950 -5.905 -9.242 1.00 0.00 H new ATOM 1012 N LYS A 93 -3.172 -4.883 -5.206 1.00 0.00 N ATOM 1013 CA LYS A 93 -2.608 -5.974 -4.430 1.00 0.00 C ATOM 1014 C LYS A 93 -3.739 -6.751 -3.754 1.00 0.00 C ATOM 1015 O LYS A 93 -3.997 -6.569 -2.564 1.00 0.00 O ATOM 1016 CB LYS A 93 -1.553 -5.449 -3.453 1.00 0.00 C ATOM 1017 CG LYS A 93 -0.527 -4.572 -4.175 1.00 0.00 C ATOM 1018 CD LYS A 93 0.855 -5.227 -4.169 1.00 0.00 C ATOM 1019 CE LYS A 93 1.282 -5.620 -5.585 1.00 0.00 C ATOM 1020 NZ LYS A 93 2.484 -6.482 -5.544 1.00 0.00 N ATOM 0 H LYS A 93 -3.515 -4.098 -4.652 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.085 -6.674 -5.082 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.037 -4.874 -2.663 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.047 -6.287 -2.973 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.848 -4.402 -5.203 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.473 -3.596 -3.692 1.00 0.00 H new ATOM 0 HD2 LYS A 93 1.585 -4.539 -3.743 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.840 -6.111 -3.531 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.468 -6.145 -6.084 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.490 -4.724 -6.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 2.760 -6.739 -6.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.264 -5.968 -5.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.274 -7.345 -5.003 1.00 0.00 H new ATOM 1030 N PHE A 94 -4.383 -7.601 -4.540 1.00 0.00 N ATOM 1031 CA PHE A 94 -5.480 -8.407 -4.031 1.00 0.00 C ATOM 1032 C PHE A 94 -4.959 -9.604 -3.233 1.00 0.00 C ATOM 1033 O PHE A 94 -5.060 -10.744 -3.682 1.00 0.00 O ATOM 1034 CB PHE A 94 -6.260 -8.918 -5.245 1.00 0.00 C ATOM 1035 CG PHE A 94 -5.380 -9.265 -6.448 1.00 0.00 C ATOM 1036 CD1 PHE A 94 -4.811 -10.496 -6.542 1.00 0.00 C ATOM 1037 CD2 PHE A 94 -5.167 -8.340 -7.423 1.00 0.00 C ATOM 1038 CE1 PHE A 94 -3.994 -10.818 -7.659 1.00 0.00 C ATOM 1039 CE2 PHE A 94 -4.350 -8.662 -8.540 1.00 0.00 C ATOM 1040 CZ PHE A 94 -3.781 -9.893 -8.634 1.00 0.00 C ATOM 0 H PHE A 94 -4.166 -7.749 -5.526 1.00 0.00 H new ATOM 0 HA PHE A 94 -6.105 -7.808 -3.368 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -6.826 -9.803 -4.954 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -6.984 -8.160 -5.544 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -4.980 -11.229 -5.767 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -5.619 -7.362 -7.348 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -3.542 -11.796 -7.734 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -4.181 -7.929 -9.315 1.00 0.00 H new ATOM 0 HZ PHE A 94 -3.160 -10.137 -9.483 1.00 0.00 H new ATOM 1049 N PHE A 95 -4.413 -9.302 -2.065 1.00 0.00 N ATOM 1050 CA PHE A 95 -3.875 -10.339 -1.200 1.00 0.00 C ATOM 1051 C PHE A 95 -4.253 -10.085 0.261 1.00 0.00 C ATOM 1052 O PHE A 95 -3.996 -10.920 1.125 1.00 0.00 O ATOM 1053 CB PHE A 95 -2.352 -10.290 -1.337 1.00 0.00 C ATOM 1054 CG PHE A 95 -1.865 -9.949 -2.747 1.00 0.00 C ATOM 1055 CD1 PHE A 95 -2.227 -10.730 -3.799 1.00 0.00 C ATOM 1056 CD2 PHE A 95 -1.069 -8.865 -2.946 1.00 0.00 C ATOM 1057 CE1 PHE A 95 -1.774 -10.415 -5.107 1.00 0.00 C ATOM 1058 CE2 PHE A 95 -0.615 -8.549 -4.255 1.00 0.00 C ATOM 1059 CZ PHE A 95 -0.978 -9.330 -5.308 1.00 0.00 C ATOM 0 H PHE A 95 -4.331 -8.354 -1.697 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.278 -11.310 -1.488 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -1.958 -9.551 -0.639 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -1.940 -11.256 -1.045 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.860 -11.591 -3.640 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -0.782 -8.245 -2.110 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -2.061 -11.036 -5.942 1.00 0.00 H new ATOM 0 HE2 PHE A 95 0.018 -7.689 -4.414 1.00 0.00 H new ATOM 0 HZ PHE A 95 -0.634 -9.089 -6.303 1.00 0.00 H new ATOM 1068 N MET A 96 -4.857 -8.929 0.490 1.00 0.00 N ATOM 1069 CA MET A 96 -5.273 -8.554 1.831 1.00 0.00 C ATOM 1070 C MET A 96 -5.937 -9.732 2.547 1.00 0.00 C ATOM 1071 O MET A 96 -5.683 -9.968 3.728 1.00 0.00 O ATOM 1072 CB MET A 96 -6.255 -7.384 1.754 1.00 0.00 C ATOM 1073 CG MET A 96 -7.151 -7.501 0.519 1.00 0.00 C ATOM 1074 SD MET A 96 -8.784 -6.884 0.890 1.00 0.00 S ATOM 1075 CE MET A 96 -9.771 -8.256 0.314 1.00 0.00 C ATOM 0 H MET A 96 -5.069 -8.239 -0.231 1.00 0.00 H new ATOM 0 HA MET A 96 -4.389 -8.260 2.397 1.00 0.00 H new ATOM 0 HB2 MET A 96 -6.870 -7.361 2.653 1.00 0.00 H new ATOM 0 HB3 MET A 96 -5.704 -6.444 1.721 1.00 0.00 H new ATOM 0 HG2 MET A 96 -6.720 -6.938 -0.308 1.00 0.00 H new ATOM 0 HG3 MET A 96 -7.210 -8.541 0.200 1.00 0.00 H new ATOM 0 HE1 MET A 96 -10.826 -7.981 0.339 1.00 0.00 H new ATOM 0 HE2 MET A 96 -9.485 -8.506 -0.708 1.00 0.00 H new ATOM 0 HE3 MET A 96 -9.605 -9.119 0.959 1.00 0.00 H new ATOM 1083 N ARG A 97 -6.776 -10.438 1.805 1.00 0.00 N ATOM 1084 CA ARG A 97 -7.478 -11.585 2.354 1.00 0.00 C ATOM 1085 C ARG A 97 -6.488 -12.551 3.009 1.00 0.00 C ATOM 1086 O ARG A 97 -6.883 -13.414 3.791 1.00 0.00 O ATOM 1087 CB ARG A 97 -8.259 -12.326 1.267 1.00 0.00 C ATOM 1088 CG ARG A 97 -9.187 -13.378 1.878 1.00 0.00 C ATOM 1089 CD ARG A 97 -10.611 -13.233 1.336 1.00 0.00 C ATOM 1090 NE ARG A 97 -11.543 -14.060 2.135 1.00 0.00 N ATOM 1091 CZ ARG A 97 -12.055 -13.686 3.315 1.00 0.00 C ATOM 1092 NH1 ARG A 97 -11.731 -12.497 3.840 1.00 0.00 N ATOM 1093 NH2 ARG A 97 -12.894 -14.501 3.970 1.00 0.00 N ATOM 0 H ARG A 97 -6.986 -10.238 0.827 1.00 0.00 H new ATOM 0 HA ARG A 97 -8.180 -11.216 3.102 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -8.844 -11.614 0.685 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -7.564 -12.806 0.578 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.809 -14.376 1.655 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -9.195 -13.275 2.963 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -10.918 -12.188 1.371 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.644 -13.540 0.291 1.00 0.00 H new ATOM 0 HE ARG A 97 -11.812 -14.971 1.764 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.094 -11.876 3.341 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -12.121 -12.213 4.739 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -13.142 -15.406 3.570 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -13.284 -14.216 4.869 1.00 0.00 H new ATOM 1104 N LYS A 98 -5.221 -12.371 2.665 1.00 0.00 N ATOM 1105 CA LYS A 98 -4.172 -13.216 3.209 1.00 0.00 C ATOM 1106 C LYS A 98 -2.808 -12.657 2.798 1.00 0.00 C ATOM 1107 O LYS A 98 -2.349 -12.890 1.682 1.00 0.00 O ATOM 1108 CB LYS A 98 -4.388 -14.674 2.798 1.00 0.00 C ATOM 1109 CG LYS A 98 -4.679 -14.782 1.299 1.00 0.00 C ATOM 1110 CD LYS A 98 -5.156 -16.189 0.934 1.00 0.00 C ATOM 1111 CE LYS A 98 -6.680 -16.235 0.803 1.00 0.00 C ATOM 1112 NZ LYS A 98 -7.186 -17.589 1.120 1.00 0.00 N ATOM 0 H LYS A 98 -4.898 -11.653 2.017 1.00 0.00 H new ATOM 0 HA LYS A 98 -4.206 -13.209 4.298 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.503 -15.260 3.044 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -5.218 -15.097 3.365 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -5.439 -14.052 1.019 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -3.780 -14.540 0.732 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -4.697 -16.500 -0.005 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -4.832 -16.896 1.697 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -7.131 -15.505 1.475 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -6.972 -15.959 -0.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -8.222 -17.603 1.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -6.769 -18.278 0.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -6.923 -17.838 2.095 1.00 0.00 H new ATOM 1122 N VAL A 99 -2.199 -11.930 3.723 1.00 0.00 N ATOM 1123 CA VAL A 99 -0.898 -11.335 3.471 1.00 0.00 C ATOM 1124 C VAL A 99 0.093 -11.818 4.532 1.00 0.00 C ATOM 1125 O VAL A 99 -0.262 -12.608 5.404 1.00 0.00 O ATOM 1126 CB VAL A 99 -1.020 -9.811 3.416 1.00 0.00 C ATOM 1127 CG1 VAL A 99 -2.298 -9.389 2.688 1.00 0.00 C ATOM 1128 CG2 VAL A 99 -0.963 -9.206 4.820 1.00 0.00 C ATOM 0 H VAL A 99 -2.583 -11.740 4.649 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.515 -11.651 2.501 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.171 -9.427 2.851 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -2.360 -8.301 2.663 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.280 -9.775 1.669 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -3.165 -9.790 3.213 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.052 -8.122 4.753 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.783 -9.601 5.420 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.013 -9.464 5.289 1.00 0.00 H new ATOM 1138 N GLN A 100 1.317 -11.321 4.423 1.00 0.00 N ATOM 1139 CA GLN A 100 2.361 -11.693 5.363 1.00 0.00 C ATOM 1140 C GLN A 100 3.517 -10.692 5.293 1.00 0.00 C ATOM 1141 O GLN A 100 4.351 -10.763 4.392 1.00 0.00 O ATOM 1142 CB GLN A 100 2.854 -13.117 5.101 1.00 0.00 C ATOM 1143 CG GLN A 100 2.402 -14.066 6.214 1.00 0.00 C ATOM 1144 CD GLN A 100 1.859 -15.372 5.633 1.00 0.00 C ATOM 1145 OE1 GLN A 100 1.990 -15.660 4.455 1.00 0.00 O ATOM 1146 NE2 GLN A 100 1.242 -16.145 6.523 1.00 0.00 N ATOM 0 H GLN A 100 1.609 -10.665 3.699 1.00 0.00 H new ATOM 0 HA GLN A 100 1.943 -11.668 6.369 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.473 -13.467 4.142 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.942 -13.123 5.033 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.240 -14.280 6.877 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.632 -13.584 6.817 1.00 0.00 H new ATOM 0 HE21 GLN A 100 1.167 -15.844 7.495 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.844 -17.038 6.234 1.00 0.00 H new ATOM 1153 N ILE A 101 3.529 -9.782 6.256 1.00 0.00 N ATOM 1154 CA ILE A 101 4.568 -8.768 6.316 1.00 0.00 C ATOM 1155 C ILE A 101 5.751 -9.304 7.125 1.00 0.00 C ATOM 1156 O ILE A 101 5.563 -9.965 8.146 1.00 0.00 O ATOM 1157 CB ILE A 101 4.003 -7.452 6.853 1.00 0.00 C ATOM 1158 CG1 ILE A 101 5.126 -6.524 7.322 1.00 0.00 C ATOM 1159 CG2 ILE A 101 2.972 -7.707 7.953 1.00 0.00 C ATOM 1160 CD1 ILE A 101 5.033 -5.161 6.633 1.00 0.00 C ATOM 0 H ILE A 101 2.835 -9.726 7.002 1.00 0.00 H new ATOM 0 HA ILE A 101 4.939 -8.544 5.316 1.00 0.00 H new ATOM 0 HB ILE A 101 3.486 -6.944 6.039 1.00 0.00 H new ATOM 0 HG12 ILE A 101 5.068 -6.394 8.403 1.00 0.00 H new ATOM 0 HG13 ILE A 101 6.093 -6.979 7.107 1.00 0.00 H new ATOM 0 HG21 ILE A 101 2.586 -6.755 8.318 1.00 0.00 H new ATOM 0 HG22 ILE A 101 2.151 -8.302 7.552 1.00 0.00 H new ATOM 0 HG23 ILE A 101 3.443 -8.246 8.775 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.842 -4.520 6.983 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.115 -5.292 5.554 1.00 0.00 H new ATOM 0 HD13 ILE A 101 4.075 -4.698 6.870 1.00 0.00 H new ATOM 1171 N ASN A 102 6.946 -9.001 6.639 1.00 0.00 N ATOM 1172 CA ASN A 102 8.160 -9.444 7.303 1.00 0.00 C ATOM 1173 C ASN A 102 9.033 -8.229 7.624 1.00 0.00 C ATOM 1174 O ASN A 102 9.997 -7.948 6.913 1.00 0.00 O ATOM 1175 CB ASN A 102 8.967 -10.383 6.406 1.00 0.00 C ATOM 1176 CG ASN A 102 9.636 -11.487 7.228 1.00 0.00 C ATOM 1177 OD1 ASN A 102 9.071 -12.029 8.163 1.00 0.00 O ATOM 1178 ND2 ASN A 102 10.868 -11.787 6.829 1.00 0.00 N ATOM 0 H ASN A 102 7.099 -8.453 5.792 1.00 0.00 H new ATOM 0 HA ASN A 102 7.873 -9.973 8.212 1.00 0.00 H new ATOM 0 HB2 ASN A 102 8.312 -10.828 5.657 1.00 0.00 H new ATOM 0 HB3 ASN A 102 9.726 -9.815 5.868 1.00 0.00 H new ATOM 0 HD21 ASN A 102 11.399 -12.510 7.314 1.00 0.00 H new ATOM 0 HD22 ASN A 102 11.282 -11.294 6.038 1.00 0.00 H new ATOM 1184 N ASP A 103 8.664 -7.541 8.694 1.00 0.00 N ATOM 1185 CA ASP A 103 9.402 -6.363 9.118 1.00 0.00 C ATOM 1186 C ASP A 103 10.831 -6.766 9.484 1.00 0.00 C ATOM 1187 O ASP A 103 11.157 -6.913 10.661 1.00 0.00 O ATOM 1188 CB ASP A 103 8.759 -5.726 10.351 1.00 0.00 C ATOM 1189 CG ASP A 103 8.724 -6.616 11.595 1.00 0.00 C ATOM 1190 OD1 ASP A 103 8.478 -7.829 11.418 1.00 0.00 O ATOM 1191 OD2 ASP A 103 8.944 -6.063 12.695 1.00 0.00 O ATOM 0 H ASP A 103 7.863 -7.777 9.280 1.00 0.00 H new ATOM 0 HA ASP A 103 9.395 -5.646 8.297 1.00 0.00 H new ATOM 0 HB2 ASP A 103 9.300 -4.811 10.592 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.738 -5.436 10.101 1.00 0.00 H new ATOM 1195 N LYS A 104 11.647 -6.933 8.453 1.00 0.00 N ATOM 1196 CA LYS A 104 13.034 -7.316 8.651 1.00 0.00 C ATOM 1197 C LYS A 104 13.865 -6.068 8.958 1.00 0.00 C ATOM 1198 O LYS A 104 14.579 -5.565 8.091 1.00 0.00 O ATOM 1199 CB LYS A 104 13.546 -8.116 7.452 1.00 0.00 C ATOM 1200 CG LYS A 104 14.632 -9.107 7.876 1.00 0.00 C ATOM 1201 CD LYS A 104 15.997 -8.697 7.320 1.00 0.00 C ATOM 1202 CE LYS A 104 16.679 -9.872 6.618 1.00 0.00 C ATOM 1203 NZ LYS A 104 17.947 -10.218 7.299 1.00 0.00 N ATOM 0 H LYS A 104 11.374 -6.810 7.478 1.00 0.00 H new ATOM 0 HA LYS A 104 13.126 -7.980 9.510 1.00 0.00 H new ATOM 0 HB2 LYS A 104 12.719 -8.654 6.989 1.00 0.00 H new ATOM 0 HB3 LYS A 104 13.944 -7.435 6.699 1.00 0.00 H new ATOM 0 HG2 LYS A 104 14.679 -9.157 8.964 1.00 0.00 H new ATOM 0 HG3 LYS A 104 14.376 -10.106 7.522 1.00 0.00 H new ATOM 0 HD2 LYS A 104 15.875 -7.871 6.619 1.00 0.00 H new ATOM 0 HD3 LYS A 104 16.630 -8.336 8.131 1.00 0.00 H new ATOM 0 HE2 LYS A 104 16.014 -10.736 6.613 1.00 0.00 H new ATOM 0 HE3 LYS A 104 16.877 -9.616 5.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 18.397 -11.018 6.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 18.586 -9.397 7.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 17.750 -10.482 8.285 1.00 0.00 H new ATOM 1213 N ASP A 105 13.743 -5.604 10.193 1.00 0.00 N ATOM 1214 CA ASP A 105 14.473 -4.424 10.624 1.00 0.00 C ATOM 1215 C ASP A 105 15.966 -4.625 10.349 1.00 0.00 C ATOM 1216 O ASP A 105 16.405 -5.740 10.074 1.00 0.00 O ATOM 1217 CB ASP A 105 14.299 -4.186 12.125 1.00 0.00 C ATOM 1218 CG ASP A 105 14.083 -5.449 12.960 1.00 0.00 C ATOM 1219 OD1 ASP A 105 15.051 -6.233 13.064 1.00 0.00 O ATOM 1220 OD2 ASP A 105 12.955 -5.604 13.475 1.00 0.00 O ATOM 0 H ASP A 105 13.150 -6.024 10.909 1.00 0.00 H new ATOM 0 HA ASP A 105 14.083 -3.567 10.075 1.00 0.00 H new ATOM 0 HB2 ASP A 105 15.181 -3.668 12.500 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.450 -3.520 12.276 1.00 0.00 H new ATOM 1224 N ASP A 106 16.702 -3.527 10.432 1.00 0.00 N ATOM 1225 CA ASP A 106 18.135 -3.568 10.196 1.00 0.00 C ATOM 1226 C ASP A 106 18.723 -2.171 10.406 1.00 0.00 C ATOM 1227 O ASP A 106 19.827 -2.030 10.931 1.00 0.00 O ATOM 1228 CB ASP A 106 18.445 -4.000 8.761 1.00 0.00 C ATOM 1229 CG ASP A 106 18.740 -5.490 8.583 1.00 0.00 C ATOM 1230 OD1 ASP A 106 19.763 -5.938 9.146 1.00 0.00 O ATOM 1231 OD2 ASP A 106 17.936 -6.148 7.888 1.00 0.00 O ATOM 0 H ASP A 106 16.333 -2.604 10.659 1.00 0.00 H new ATOM 0 HA ASP A 106 18.570 -4.286 10.891 1.00 0.00 H new ATOM 0 HB2 ASP A 106 17.599 -3.734 8.127 1.00 0.00 H new ATOM 0 HB3 ASP A 106 19.303 -3.430 8.403 1.00 0.00 H new ATOM 1235 N THR A 107 17.960 -1.174 9.985 1.00 0.00 N ATOM 1236 CA THR A 107 18.391 0.208 10.121 1.00 0.00 C ATOM 1237 C THR A 107 19.890 0.272 10.421 1.00 0.00 C ATOM 1238 O THR A 107 20.693 0.565 9.537 1.00 0.00 O ATOM 1239 CB THR A 107 17.527 0.870 11.196 1.00 0.00 C ATOM 1240 OG1 THR A 107 16.980 -0.227 11.924 1.00 0.00 O ATOM 1241 CG2 THR A 107 16.303 1.576 10.611 1.00 0.00 C ATOM 0 H THR A 107 17.046 -1.295 9.549 1.00 0.00 H new ATOM 0 HA THR A 107 18.254 0.758 9.190 1.00 0.00 H new ATOM 0 HB THR A 107 18.128 1.589 11.754 1.00 0.00 H new ATOM 0 HG1 THR A 107 16.407 0.111 12.643 1.00 0.00 H new ATOM 0 HG21 THR A 107 15.725 2.029 11.416 1.00 0.00 H new ATOM 0 HG22 THR A 107 16.627 2.351 9.917 1.00 0.00 H new ATOM 0 HG23 THR A 107 15.683 0.852 10.082 1.00 0.00 H new ATOM 1249 N ASN A 108 20.222 -0.008 11.673 1.00 0.00 N ATOM 1250 CA ASN A 108 21.610 0.014 12.101 1.00 0.00 C ATOM 1251 C ASN A 108 22.506 -0.411 10.936 1.00 0.00 C ATOM 1252 O ASN A 108 23.636 0.059 10.814 1.00 0.00 O ATOM 1253 CB ASN A 108 21.846 -0.960 13.258 1.00 0.00 C ATOM 1254 CG ASN A 108 21.603 -0.278 14.606 1.00 0.00 C ATOM 1255 OD1 ASN A 108 22.490 0.315 15.199 1.00 0.00 O ATOM 1256 ND2 ASN A 108 20.358 -0.396 15.056 1.00 0.00 N ATOM 0 H ASN A 108 19.554 -0.251 12.404 1.00 0.00 H new ATOM 0 HA ASN A 108 21.845 1.027 12.428 1.00 0.00 H new ATOM 0 HB2 ASN A 108 21.183 -1.819 13.156 1.00 0.00 H new ATOM 0 HB3 ASN A 108 22.867 -1.339 13.217 1.00 0.00 H new ATOM 0 HD21 ASN A 108 20.096 0.023 15.948 1.00 0.00 H new ATOM 0 HD22 ASN A 108 19.664 -0.906 14.509 1.00 0.00 H new ATOM 1262 N GLU A 109 21.967 -1.295 10.109 1.00 0.00 N ATOM 1263 CA GLU A 109 22.704 -1.789 8.959 1.00 0.00 C ATOM 1264 C GLU A 109 22.020 -1.347 7.663 1.00 0.00 C ATOM 1265 O GLU A 109 22.670 -1.225 6.625 1.00 0.00 O ATOM 1266 CB GLU A 109 22.849 -3.311 9.011 1.00 0.00 C ATOM 1267 CG GLU A 109 23.696 -3.822 7.844 1.00 0.00 C ATOM 1268 CD GLU A 109 24.795 -4.767 8.338 1.00 0.00 C ATOM 1269 OE1 GLU A 109 25.283 -4.530 9.464 1.00 0.00 O ATOM 1270 OE2 GLU A 109 25.122 -5.704 7.577 1.00 0.00 O ATOM 0 H GLU A 109 21.029 -1.682 10.213 1.00 0.00 H new ATOM 0 HA GLU A 109 23.707 -1.362 8.983 1.00 0.00 H new ATOM 0 HB2 GLU A 109 23.309 -3.604 9.955 1.00 0.00 H new ATOM 0 HB3 GLU A 109 21.863 -3.775 8.980 1.00 0.00 H new ATOM 0 HG2 GLU A 109 23.059 -4.341 7.128 1.00 0.00 H new ATOM 0 HG3 GLU A 109 24.145 -2.979 7.319 1.00 0.00 H new ATOM 1275 N TYR A 110 20.719 -1.122 7.764 1.00 0.00 N ATOM 1276 CA TYR A 110 19.941 -0.697 6.613 1.00 0.00 C ATOM 1277 C TYR A 110 19.516 0.767 6.748 1.00 0.00 C ATOM 1278 O TYR A 110 20.007 1.482 7.621 1.00 0.00 O ATOM 1279 CB TYR A 110 18.690 -1.579 6.600 1.00 0.00 C ATOM 1280 CG TYR A 110 18.937 -3.000 6.091 1.00 0.00 C ATOM 1281 CD1 TYR A 110 20.226 -3.442 5.875 1.00 0.00 C ATOM 1282 CD2 TYR A 110 17.870 -3.840 5.846 1.00 0.00 C ATOM 1283 CE1 TYR A 110 20.458 -4.779 5.395 1.00 0.00 C ATOM 1284 CE2 TYR A 110 18.101 -5.178 5.367 1.00 0.00 C ATOM 1285 CZ TYR A 110 19.385 -5.582 5.164 1.00 0.00 C ATOM 1286 OH TYR A 110 19.604 -6.845 4.711 1.00 0.00 O ATOM 0 H TYR A 110 20.183 -1.226 8.626 1.00 0.00 H new ATOM 0 HA TYR A 110 20.528 -0.789 5.699 1.00 0.00 H new ATOM 0 HB2 TYR A 110 18.284 -1.631 7.610 1.00 0.00 H new ATOM 0 HB3 TYR A 110 17.931 -1.107 5.976 1.00 0.00 H new ATOM 0 HD1 TYR A 110 21.061 -2.785 6.066 1.00 0.00 H new ATOM 0 HD2 TYR A 110 16.861 -3.494 6.014 1.00 0.00 H new ATOM 0 HE1 TYR A 110 21.462 -5.137 5.222 1.00 0.00 H new ATOM 0 HE2 TYR A 110 17.275 -5.846 5.173 1.00 0.00 H new ATOM 0 HH TYR A 110 18.746 -7.303 4.592 1.00 0.00 H new ATOM 1295 N LYS A 111 18.608 1.170 5.871 1.00 0.00 N ATOM 1296 CA LYS A 111 18.113 2.536 5.881 1.00 0.00 C ATOM 1297 C LYS A 111 16.894 2.624 6.802 1.00 0.00 C ATOM 1298 O LYS A 111 17.010 3.047 7.951 1.00 0.00 O ATOM 1299 CB LYS A 111 17.842 3.018 4.455 1.00 0.00 C ATOM 1300 CG LYS A 111 18.355 4.445 4.252 1.00 0.00 C ATOM 1301 CD LYS A 111 17.770 5.393 5.301 1.00 0.00 C ATOM 1302 CE LYS A 111 16.242 5.410 5.234 1.00 0.00 C ATOM 1303 NZ LYS A 111 15.787 5.979 3.946 1.00 0.00 N ATOM 0 H LYS A 111 18.202 0.575 5.149 1.00 0.00 H new ATOM 0 HA LYS A 111 18.867 3.212 6.283 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.326 2.349 3.743 1.00 0.00 H new ATOM 0 HB3 LYS A 111 16.772 2.980 4.252 1.00 0.00 H new ATOM 0 HG2 LYS A 111 19.443 4.456 4.313 1.00 0.00 H new ATOM 0 HG3 LYS A 111 18.088 4.792 3.254 1.00 0.00 H new ATOM 0 HD2 LYS A 111 18.090 5.083 6.296 1.00 0.00 H new ATOM 0 HD3 LYS A 111 18.156 6.400 5.142 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.856 4.397 5.348 1.00 0.00 H new ATOM 0 HE3 LYS A 111 15.842 5.998 6.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.766 6.173 3.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 16.299 6.864 3.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 15.976 5.300 3.181 1.00 0.00 H new ATOM 1313 N HIS A 112 15.754 2.218 6.263 1.00 0.00 N ATOM 1314 CA HIS A 112 14.516 2.247 7.022 1.00 0.00 C ATOM 1315 C HIS A 112 13.391 1.625 6.191 1.00 0.00 C ATOM 1316 O HIS A 112 12.588 2.340 5.593 1.00 0.00 O ATOM 1317 CB HIS A 112 14.194 3.669 7.485 1.00 0.00 C ATOM 1318 CG HIS A 112 13.986 3.798 8.975 1.00 0.00 C ATOM 1319 ND1 HIS A 112 13.120 3.160 9.813 1.00 0.00 N flip ATOM 1320 CD2 HIS A 112 14.723 4.667 9.761 1.00 0.00 C flip ATOM 1321 CE1 HIS A 112 13.317 3.613 11.045 1.00 0.00 C flip ATOM 1322 NE2 HIS A 112 14.309 4.548 11.015 1.00 0.00 N flip ATOM 0 H HIS A 112 15.662 1.867 5.310 1.00 0.00 H new ATOM 0 HA HIS A 112 14.626 1.650 7.927 1.00 0.00 H new ATOM 0 HB2 HIS A 112 15.006 4.331 7.183 1.00 0.00 H new ATOM 0 HB3 HIS A 112 13.296 4.012 6.972 1.00 0.00 H new ATOM 0 HD1 HIS A 112 12.436 2.454 9.539 1.00 0.00 H new ATOM 0 HD2 HIS A 112 15.502 5.329 9.412 1.00 0.00 H new ATOM 0 HE1 HIS A 112 12.780 3.294 11.926 1.00 0.00 H new ATOM 1329 N ALA A 113 13.369 0.300 6.182 1.00 0.00 N ATOM 1330 CA ALA A 113 12.355 -0.426 5.435 1.00 0.00 C ATOM 1331 C ALA A 113 12.408 -1.906 5.819 1.00 0.00 C ATOM 1332 O ALA A 113 13.359 -2.352 6.458 1.00 0.00 O ATOM 1333 CB ALA A 113 12.569 -0.205 3.936 1.00 0.00 C ATOM 0 H ALA A 113 14.036 -0.289 6.680 1.00 0.00 H new ATOM 0 HA ALA A 113 11.359 -0.057 5.680 1.00 0.00 H new ATOM 0 HB1 ALA A 113 11.809 -0.749 3.376 1.00 0.00 H new ATOM 0 HB2 ALA A 113 12.494 0.859 3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 113 13.557 -0.567 3.652 1.00 0.00 H new ATOM 1339 N PHE A 114 11.373 -2.627 5.412 1.00 0.00 N ATOM 1340 CA PHE A 114 11.289 -4.047 5.705 1.00 0.00 C ATOM 1341 C PHE A 114 10.805 -4.832 4.484 1.00 0.00 C ATOM 1342 O PHE A 114 10.372 -4.243 3.495 1.00 0.00 O ATOM 1343 CB PHE A 114 10.273 -4.211 6.837 1.00 0.00 C ATOM 1344 CG PHE A 114 9.399 -2.977 7.072 1.00 0.00 C ATOM 1345 CD1 PHE A 114 9.898 -1.908 7.747 1.00 0.00 C ATOM 1346 CD2 PHE A 114 8.122 -2.951 6.605 1.00 0.00 C ATOM 1347 CE1 PHE A 114 9.088 -0.763 7.964 1.00 0.00 C ATOM 1348 CE2 PHE A 114 7.310 -1.806 6.823 1.00 0.00 C ATOM 1349 CZ PHE A 114 7.810 -0.736 7.498 1.00 0.00 C ATOM 0 H PHE A 114 10.586 -2.254 4.882 1.00 0.00 H new ATOM 0 HA PHE A 114 12.272 -4.428 5.982 1.00 0.00 H new ATOM 0 HB2 PHE A 114 9.630 -5.062 6.614 1.00 0.00 H new ATOM 0 HB3 PHE A 114 10.806 -4.447 7.758 1.00 0.00 H new ATOM 0 HD1 PHE A 114 10.912 -1.930 8.119 1.00 0.00 H new ATOM 0 HD2 PHE A 114 7.725 -3.800 6.069 1.00 0.00 H new ATOM 0 HE1 PHE A 114 9.486 0.087 8.499 1.00 0.00 H new ATOM 0 HE2 PHE A 114 6.296 -1.785 6.453 1.00 0.00 H new ATOM 0 HZ PHE A 114 7.193 0.135 7.664 1.00 0.00 H new ATOM 1358 N GLU A 115 10.896 -6.149 4.592 1.00 0.00 N ATOM 1359 CA GLU A 115 10.473 -7.021 3.509 1.00 0.00 C ATOM 1360 C GLU A 115 9.062 -7.549 3.774 1.00 0.00 C ATOM 1361 O GLU A 115 8.801 -8.137 4.822 1.00 0.00 O ATOM 1362 CB GLU A 115 11.462 -8.172 3.314 1.00 0.00 C ATOM 1363 CG GLU A 115 12.785 -7.885 4.028 1.00 0.00 C ATOM 1364 CD GLU A 115 13.929 -8.689 3.406 1.00 0.00 C ATOM 1365 OE1 GLU A 115 14.023 -9.891 3.736 1.00 0.00 O ATOM 1366 OE2 GLU A 115 14.682 -8.084 2.613 1.00 0.00 O ATOM 0 H GLU A 115 11.257 -6.634 5.414 1.00 0.00 H new ATOM 0 HA GLU A 115 10.455 -6.441 2.586 1.00 0.00 H new ATOM 0 HB2 GLU A 115 11.030 -9.096 3.698 1.00 0.00 H new ATOM 0 HB3 GLU A 115 11.644 -8.323 2.250 1.00 0.00 H new ATOM 0 HG2 GLU A 115 13.010 -6.820 3.970 1.00 0.00 H new ATOM 0 HG3 GLU A 115 12.693 -8.134 5.085 1.00 0.00 H new ATOM 1371 N ILE A 116 8.188 -7.320 2.805 1.00 0.00 N ATOM 1372 CA ILE A 116 6.810 -7.765 2.919 1.00 0.00 C ATOM 1373 C ILE A 116 6.632 -9.067 2.134 1.00 0.00 C ATOM 1374 O ILE A 116 7.473 -9.416 1.306 1.00 0.00 O ATOM 1375 CB ILE A 116 5.849 -6.653 2.492 1.00 0.00 C ATOM 1376 CG1 ILE A 116 6.426 -5.275 2.822 1.00 0.00 C ATOM 1377 CG2 ILE A 116 4.464 -6.858 3.108 1.00 0.00 C ATOM 1378 CD1 ILE A 116 6.770 -5.166 4.309 1.00 0.00 C ATOM 0 H ILE A 116 8.408 -6.832 1.937 1.00 0.00 H new ATOM 0 HA ILE A 116 6.566 -7.983 3.959 1.00 0.00 H new ATOM 0 HB ILE A 116 5.729 -6.701 1.410 1.00 0.00 H new ATOM 0 HG12 ILE A 116 7.320 -5.099 2.224 1.00 0.00 H new ATOM 0 HG13 ILE A 116 5.706 -4.502 2.554 1.00 0.00 H new ATOM 0 HG21 ILE A 116 3.801 -6.054 2.788 1.00 0.00 H new ATOM 0 HG22 ILE A 116 4.058 -7.815 2.780 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.545 -6.851 4.195 1.00 0.00 H new ATOM 0 HD11 ILE A 116 7.178 -4.177 4.516 1.00 0.00 H new ATOM 0 HD12 ILE A 116 5.869 -5.319 4.903 1.00 0.00 H new ATOM 0 HD13 ILE A 116 7.508 -5.925 4.568 1.00 0.00 H new ATOM 1389 N ILE A 117 5.532 -9.748 2.421 1.00 0.00 N ATOM 1390 CA ILE A 117 5.234 -11.002 1.752 1.00 0.00 C ATOM 1391 C ILE A 117 3.717 -11.198 1.697 1.00 0.00 C ATOM 1392 O ILE A 117 3.120 -11.713 2.640 1.00 0.00 O ATOM 1393 CB ILE A 117 5.979 -12.159 2.424 1.00 0.00 C ATOM 1394 CG1 ILE A 117 7.481 -12.081 2.141 1.00 0.00 C ATOM 1395 CG2 ILE A 117 5.386 -13.506 2.010 1.00 0.00 C ATOM 1396 CD1 ILE A 117 8.213 -13.288 2.732 1.00 0.00 C ATOM 0 H ILE A 117 4.837 -9.455 3.108 1.00 0.00 H new ATOM 0 HA ILE A 117 5.591 -10.978 0.722 1.00 0.00 H new ATOM 0 HB ILE A 117 5.850 -12.069 3.503 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.650 -12.039 1.065 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.887 -11.162 2.563 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.933 -14.311 2.501 1.00 0.00 H new ATOM 0 HG22 ILE A 117 4.337 -13.548 2.304 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.464 -13.621 0.929 1.00 0.00 H new ATOM 0 HD11 ILE A 117 9.279 -13.208 2.517 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.061 -13.313 3.811 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.821 -14.204 2.289 1.00 0.00 H new ATOM 1407 N LEU A 118 3.139 -10.775 0.583 1.00 0.00 N ATOM 1408 CA LEU A 118 1.704 -10.897 0.392 1.00 0.00 C ATOM 1409 C LEU A 118 1.416 -12.067 -0.551 1.00 0.00 C ATOM 1410 O LEU A 118 2.315 -12.553 -1.235 1.00 0.00 O ATOM 1411 CB LEU A 118 1.111 -9.567 -0.079 1.00 0.00 C ATOM 1412 CG LEU A 118 1.971 -8.756 -1.051 1.00 0.00 C ATOM 1413 CD1 LEU A 118 1.903 -9.342 -2.463 1.00 0.00 C ATOM 1414 CD2 LEU A 118 1.581 -7.277 -1.024 1.00 0.00 C ATOM 0 H LEU A 118 3.638 -10.347 -0.197 1.00 0.00 H new ATOM 0 HA LEU A 118 1.212 -11.122 1.338 1.00 0.00 H new ATOM 0 HB2 LEU A 118 0.151 -9.768 -0.555 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.909 -8.951 0.797 1.00 0.00 H new ATOM 0 HG LEU A 118 3.009 -8.821 -0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.523 -8.747 -3.134 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.267 -10.369 -2.448 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.871 -9.327 -2.814 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.207 -6.723 -1.723 1.00 0.00 H new ATOM 0 HD22 LEU A 118 0.535 -7.171 -1.311 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.723 -6.882 -0.018 1.00 0.00 H new ATOM 1425 N LYS A 119 0.159 -12.485 -0.558 1.00 0.00 N ATOM 1426 CA LYS A 119 -0.258 -13.589 -1.406 1.00 0.00 C ATOM 1427 C LYS A 119 0.276 -13.368 -2.822 1.00 0.00 C ATOM 1428 O LYS A 119 0.929 -12.361 -3.094 1.00 0.00 O ATOM 1429 CB LYS A 119 -1.776 -13.769 -1.344 1.00 0.00 C ATOM 1430 CG LYS A 119 -2.149 -15.248 -1.234 1.00 0.00 C ATOM 1431 CD LYS A 119 -1.581 -15.864 0.046 1.00 0.00 C ATOM 1432 CE LYS A 119 -0.462 -16.858 -0.274 1.00 0.00 C ATOM 1433 NZ LYS A 119 -0.703 -18.148 0.412 1.00 0.00 N ATOM 0 H LYS A 119 -0.585 -12.079 0.010 1.00 0.00 H new ATOM 0 HA LYS A 119 0.166 -14.526 -1.046 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -2.176 -13.225 -0.488 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.233 -13.340 -2.236 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -3.234 -15.355 -1.243 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -1.769 -15.788 -2.101 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -1.198 -15.076 0.694 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -2.376 -16.370 0.594 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -0.406 -17.017 -1.351 1.00 0.00 H new ATOM 0 HE3 LYS A 119 0.498 -16.447 0.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 0.065 -18.811 0.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -0.734 -17.994 1.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -1.610 -18.546 0.094 1.00 0.00 H new ATOM 1443 N ASP A 120 -0.019 -14.327 -3.688 1.00 0.00 N ATOM 1444 CA ASP A 120 0.424 -14.250 -5.070 1.00 0.00 C ATOM 1445 C ASP A 120 1.950 -14.357 -5.118 1.00 0.00 C ATOM 1446 O ASP A 120 2.557 -14.151 -6.168 1.00 0.00 O ATOM 1447 CB ASP A 120 0.023 -12.917 -5.704 1.00 0.00 C ATOM 1448 CG ASP A 120 0.029 -12.901 -7.233 1.00 0.00 C ATOM 1449 OD1 ASP A 120 -0.155 -13.993 -7.814 1.00 0.00 O ATOM 1450 OD2 ASP A 120 0.215 -11.797 -7.789 1.00 0.00 O ATOM 0 H ASP A 120 -0.559 -15.161 -3.459 1.00 0.00 H new ATOM 0 HA ASP A 120 -0.045 -15.066 -5.620 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -0.976 -12.653 -5.357 1.00 0.00 H new ATOM 0 HB3 ASP A 120 0.701 -12.143 -5.345 1.00 0.00 H new ATOM 1454 N GLU A 121 2.526 -14.677 -3.969 1.00 0.00 N ATOM 1455 CA GLU A 121 3.969 -14.812 -3.866 1.00 0.00 C ATOM 1456 C GLU A 121 4.659 -13.556 -4.402 1.00 0.00 C ATOM 1457 O GLU A 121 5.224 -13.571 -5.493 1.00 0.00 O ATOM 1458 CB GLU A 121 4.455 -16.061 -4.605 1.00 0.00 C ATOM 1459 CG GLU A 121 5.595 -16.739 -3.842 1.00 0.00 C ATOM 1460 CD GLU A 121 6.621 -17.337 -4.807 1.00 0.00 C ATOM 1461 OE1 GLU A 121 6.920 -16.655 -5.811 1.00 0.00 O ATOM 1462 OE2 GLU A 121 7.083 -18.462 -4.518 1.00 0.00 O ATOM 0 H GLU A 121 2.019 -14.847 -3.100 1.00 0.00 H new ATOM 0 HA GLU A 121 4.230 -14.926 -2.814 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.628 -16.760 -4.728 1.00 0.00 H new ATOM 0 HB3 GLU A 121 4.793 -15.788 -5.605 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.083 -16.014 -3.190 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.193 -17.524 -3.201 1.00 0.00 H new ATOM 1467 N ASN A 122 4.591 -12.498 -3.606 1.00 0.00 N ATOM 1468 CA ASN A 122 5.201 -11.236 -3.986 1.00 0.00 C ATOM 1469 C ASN A 122 5.639 -10.487 -2.726 1.00 0.00 C ATOM 1470 O ASN A 122 4.821 -10.205 -1.852 1.00 0.00 O ATOM 1471 CB ASN A 122 4.211 -10.350 -4.743 1.00 0.00 C ATOM 1472 CG ASN A 122 4.547 -10.302 -6.235 1.00 0.00 C ATOM 1473 OD1 ASN A 122 5.424 -10.997 -6.723 1.00 0.00 O ATOM 1474 ND2 ASN A 122 3.805 -9.444 -6.929 1.00 0.00 N ATOM 0 H ASN A 122 4.123 -12.490 -2.700 1.00 0.00 H new ATOM 0 HA ASN A 122 6.053 -11.454 -4.630 1.00 0.00 H new ATOM 0 HB2 ASN A 122 3.199 -10.731 -4.607 1.00 0.00 H new ATOM 0 HB3 ASN A 122 4.230 -9.342 -4.330 1.00 0.00 H new ATOM 0 HD21 ASN A 122 3.953 -9.337 -7.932 1.00 0.00 H new ATOM 0 HD22 ASN A 122 3.088 -8.893 -6.458 1.00 0.00 H new ATOM 1480 N SER A 123 6.928 -10.185 -2.673 1.00 0.00 N ATOM 1481 CA SER A 123 7.484 -9.473 -1.534 1.00 0.00 C ATOM 1482 C SER A 123 7.656 -7.993 -1.876 1.00 0.00 C ATOM 1483 O SER A 123 7.876 -7.640 -3.034 1.00 0.00 O ATOM 1484 CB SER A 123 8.822 -10.079 -1.106 1.00 0.00 C ATOM 1485 OG SER A 123 9.855 -9.811 -2.051 1.00 0.00 O ATOM 0 H SER A 123 7.604 -10.420 -3.400 1.00 0.00 H new ATOM 0 HA SER A 123 6.790 -9.567 -0.699 1.00 0.00 H new ATOM 0 HB2 SER A 123 9.107 -9.678 -0.133 1.00 0.00 H new ATOM 0 HB3 SER A 123 8.710 -11.157 -0.986 1.00 0.00 H new ATOM 0 HG SER A 123 10.694 -10.213 -1.742 1.00 0.00 H new ATOM 1490 N VAL A 124 7.551 -7.164 -0.848 1.00 0.00 N ATOM 1491 CA VAL A 124 7.693 -5.729 -1.024 1.00 0.00 C ATOM 1492 C VAL A 124 8.765 -5.205 -0.067 1.00 0.00 C ATOM 1493 O VAL A 124 9.255 -5.944 0.787 1.00 0.00 O ATOM 1494 CB VAL A 124 6.338 -5.042 -0.837 1.00 0.00 C ATOM 1495 CG1 VAL A 124 6.238 -3.784 -1.701 1.00 0.00 C ATOM 1496 CG2 VAL A 124 5.189 -6.006 -1.137 1.00 0.00 C ATOM 0 H VAL A 124 7.369 -7.459 0.111 1.00 0.00 H new ATOM 0 HA VAL A 124 8.022 -5.500 -2.038 1.00 0.00 H new ATOM 0 HB VAL A 124 6.257 -4.739 0.207 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.266 -3.315 -1.550 1.00 0.00 H new ATOM 0 HG12 VAL A 124 7.026 -3.085 -1.419 1.00 0.00 H new ATOM 0 HG13 VAL A 124 6.351 -4.054 -2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.238 -5.493 -0.997 1.00 0.00 H new ATOM 0 HG22 VAL A 124 5.265 -6.354 -2.167 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.244 -6.859 -0.461 1.00 0.00 H new ATOM 1506 N ILE A 125 9.101 -3.935 -0.242 1.00 0.00 N ATOM 1507 CA ILE A 125 10.106 -3.304 0.595 1.00 0.00 C ATOM 1508 C ILE A 125 9.614 -1.920 1.021 1.00 0.00 C ATOM 1509 O ILE A 125 10.002 -0.911 0.434 1.00 0.00 O ATOM 1510 CB ILE A 125 11.460 -3.282 -0.118 1.00 0.00 C ATOM 1511 CG1 ILE A 125 11.875 -4.691 -0.547 1.00 0.00 C ATOM 1512 CG2 ILE A 125 12.526 -2.609 0.750 1.00 0.00 C ATOM 1513 CD1 ILE A 125 12.192 -4.737 -2.043 1.00 0.00 C ATOM 0 H ILE A 125 8.694 -3.326 -0.952 1.00 0.00 H new ATOM 0 HA ILE A 125 10.260 -3.882 1.506 1.00 0.00 H new ATOM 0 HB ILE A 125 11.360 -2.685 -1.025 1.00 0.00 H new ATOM 0 HG12 ILE A 125 12.749 -5.006 0.023 1.00 0.00 H new ATOM 0 HG13 ILE A 125 11.075 -5.395 -0.319 1.00 0.00 H new ATOM 0 HG21 ILE A 125 13.478 -2.607 0.220 1.00 0.00 H new ATOM 0 HG22 ILE A 125 12.227 -1.583 0.963 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.633 -3.158 1.686 1.00 0.00 H new ATOM 0 HD11 ILE A 125 12.484 -5.749 -2.322 1.00 0.00 H new ATOM 0 HD12 ILE A 125 11.309 -4.445 -2.611 1.00 0.00 H new ATOM 0 HD13 ILE A 125 13.009 -4.050 -2.263 1.00 0.00 H new ATOM 1524 N PHE A 126 8.766 -1.915 2.039 1.00 0.00 N ATOM 1525 CA PHE A 126 8.216 -0.671 2.550 1.00 0.00 C ATOM 1526 C PHE A 126 9.219 0.037 3.464 1.00 0.00 C ATOM 1527 O PHE A 126 9.820 -0.590 4.335 1.00 0.00 O ATOM 1528 CB PHE A 126 6.971 -1.033 3.363 1.00 0.00 C ATOM 1529 CG PHE A 126 5.701 -1.183 2.522 1.00 0.00 C ATOM 1530 CD1 PHE A 126 5.432 -0.291 1.532 1.00 0.00 C ATOM 1531 CD2 PHE A 126 4.842 -2.209 2.766 1.00 0.00 C ATOM 1532 CE1 PHE A 126 4.254 -0.430 0.752 1.00 0.00 C ATOM 1533 CE2 PHE A 126 3.663 -2.348 1.986 1.00 0.00 C ATOM 1534 CZ PHE A 126 3.394 -1.454 0.996 1.00 0.00 C ATOM 0 H PHE A 126 8.446 -2.753 2.524 1.00 0.00 H new ATOM 0 HA PHE A 126 7.982 -0.000 1.723 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.155 -1.967 3.894 1.00 0.00 H new ATOM 0 HB3 PHE A 126 6.806 -0.264 4.118 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.115 0.523 1.339 1.00 0.00 H new ATOM 0 HD2 PHE A 126 5.056 -2.918 3.552 1.00 0.00 H new ATOM 0 HE1 PHE A 126 4.041 0.278 -0.035 1.00 0.00 H new ATOM 0 HE2 PHE A 126 2.981 -3.163 2.179 1.00 0.00 H new ATOM 0 HZ PHE A 126 2.497 -1.558 0.404 1.00 0.00 H new ATOM 1543 N SER A 127 9.368 1.333 3.232 1.00 0.00 N ATOM 1544 CA SER A 127 10.288 2.133 4.023 1.00 0.00 C ATOM 1545 C SER A 127 9.507 3.119 4.894 1.00 0.00 C ATOM 1546 O SER A 127 8.905 4.062 4.383 1.00 0.00 O ATOM 1547 CB SER A 127 11.276 2.882 3.128 1.00 0.00 C ATOM 1548 OG SER A 127 12.247 2.010 2.557 1.00 0.00 O ATOM 0 H SER A 127 8.868 1.849 2.508 1.00 0.00 H new ATOM 0 HA SER A 127 10.859 1.463 4.666 1.00 0.00 H new ATOM 0 HB2 SER A 127 10.731 3.389 2.332 1.00 0.00 H new ATOM 0 HB3 SER A 127 11.780 3.653 3.710 1.00 0.00 H new ATOM 0 HG SER A 127 11.811 1.411 1.915 1.00 0.00 H new ATOM 1553 N ALA A 128 9.542 2.867 6.195 1.00 0.00 N ATOM 1554 CA ALA A 128 8.846 3.721 7.142 1.00 0.00 C ATOM 1555 C ALA A 128 9.866 4.388 8.068 1.00 0.00 C ATOM 1556 O ALA A 128 10.890 3.793 8.398 1.00 0.00 O ATOM 1557 CB ALA A 128 7.812 2.896 7.911 1.00 0.00 C ATOM 0 H ALA A 128 10.042 2.083 6.615 1.00 0.00 H new ATOM 0 HA ALA A 128 8.308 4.513 6.620 1.00 0.00 H new ATOM 0 HB1 ALA A 128 7.290 3.537 8.621 1.00 0.00 H new ATOM 0 HB2 ALA A 128 7.093 2.470 7.211 1.00 0.00 H new ATOM 0 HB3 ALA A 128 8.315 2.093 8.449 1.00 0.00 H new ATOM 1563 N LYS A 129 9.550 5.613 8.459 1.00 0.00 N ATOM 1564 CA LYS A 129 10.426 6.367 9.339 1.00 0.00 C ATOM 1565 C LYS A 129 9.757 6.520 10.707 1.00 0.00 C ATOM 1566 O LYS A 129 10.390 6.963 11.665 1.00 0.00 O ATOM 1567 CB LYS A 129 10.818 7.698 8.695 1.00 0.00 C ATOM 1568 CG LYS A 129 12.254 7.649 8.167 1.00 0.00 C ATOM 1569 CD LYS A 129 12.715 9.033 7.708 1.00 0.00 C ATOM 1570 CE LYS A 129 13.728 9.627 8.689 1.00 0.00 C ATOM 1571 NZ LYS A 129 14.639 10.562 7.992 1.00 0.00 N ATOM 0 H LYS A 129 8.699 6.103 8.183 1.00 0.00 H new ATOM 0 HA LYS A 129 11.361 5.829 9.498 1.00 0.00 H new ATOM 0 HB2 LYS A 129 10.134 7.926 7.878 1.00 0.00 H new ATOM 0 HB3 LYS A 129 10.722 8.502 9.425 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.920 7.280 8.947 1.00 0.00 H new ATOM 0 HG3 LYS A 129 12.316 6.947 7.336 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.163 8.961 6.717 1.00 0.00 H new ATOM 0 HD3 LYS A 129 11.855 9.697 7.622 1.00 0.00 H new ATOM 0 HE2 LYS A 129 13.204 10.149 9.490 1.00 0.00 H new ATOM 0 HE3 LYS A 129 14.305 8.827 9.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 15.320 10.956 8.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.152 10.054 7.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.086 11.335 7.569 1.00 0.00 H new ATOM 1581 N SER A 130 8.488 6.144 10.756 1.00 0.00 N ATOM 1582 CA SER A 130 7.728 6.233 11.991 1.00 0.00 C ATOM 1583 C SER A 130 7.596 4.847 12.626 1.00 0.00 C ATOM 1584 O SER A 130 6.896 3.984 12.100 1.00 0.00 O ATOM 1585 CB SER A 130 6.343 6.838 11.743 1.00 0.00 C ATOM 1586 OG SER A 130 6.310 8.232 12.033 1.00 0.00 O ATOM 0 H SER A 130 7.967 5.777 9.960 1.00 0.00 H new ATOM 0 HA SER A 130 8.264 6.889 12.676 1.00 0.00 H new ATOM 0 HB2 SER A 130 6.058 6.677 10.703 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.606 6.322 12.359 1.00 0.00 H new ATOM 0 HG SER A 130 5.466 8.613 11.711 1.00 0.00 H new ATOM 1591 N ALA A 131 8.280 4.680 13.748 1.00 0.00 N ATOM 1592 CA ALA A 131 8.248 3.414 14.461 1.00 0.00 C ATOM 1593 C ALA A 131 6.805 2.911 14.536 1.00 0.00 C ATOM 1594 O ALA A 131 6.557 1.709 14.464 1.00 0.00 O ATOM 1595 CB ALA A 131 8.877 3.590 15.845 1.00 0.00 C ATOM 0 H ALA A 131 8.859 5.399 14.181 1.00 0.00 H new ATOM 0 HA ALA A 131 8.832 2.661 13.931 1.00 0.00 H new ATOM 0 HB1 ALA A 131 8.853 2.640 16.379 1.00 0.00 H new ATOM 0 HB2 ALA A 131 9.911 3.919 15.736 1.00 0.00 H new ATOM 0 HB3 ALA A 131 8.316 4.337 16.407 1.00 0.00 H new ATOM 1601 N GLU A 132 5.889 3.858 14.678 1.00 0.00 N ATOM 1602 CA GLU A 132 4.476 3.527 14.764 1.00 0.00 C ATOM 1603 C GLU A 132 3.969 3.014 13.415 1.00 0.00 C ATOM 1604 O GLU A 132 3.261 2.010 13.354 1.00 0.00 O ATOM 1605 CB GLU A 132 3.658 4.731 15.236 1.00 0.00 C ATOM 1606 CG GLU A 132 3.032 4.465 16.606 1.00 0.00 C ATOM 1607 CD GLU A 132 1.542 4.140 16.474 1.00 0.00 C ATOM 1608 OE1 GLU A 132 1.237 2.942 16.287 1.00 0.00 O ATOM 1609 OE2 GLU A 132 0.743 5.097 16.562 1.00 0.00 O ATOM 0 H GLU A 132 6.098 4.855 14.736 1.00 0.00 H new ATOM 0 HA GLU A 132 4.352 2.735 15.502 1.00 0.00 H new ATOM 0 HB2 GLU A 132 4.298 5.612 15.289 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.875 4.950 14.510 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.547 3.636 17.090 1.00 0.00 H new ATOM 0 HG3 GLU A 132 3.162 5.338 17.245 1.00 0.00 H new ATOM 1614 N GLU A 133 4.350 3.727 12.365 1.00 0.00 N ATOM 1615 CA GLU A 133 3.943 3.357 11.021 1.00 0.00 C ATOM 1616 C GLU A 133 4.479 1.967 10.668 1.00 0.00 C ATOM 1617 O GLU A 133 3.786 1.175 10.030 1.00 0.00 O ATOM 1618 CB GLU A 133 4.408 4.398 10.001 1.00 0.00 C ATOM 1619 CG GLU A 133 3.335 5.468 9.783 1.00 0.00 C ATOM 1620 CD GLU A 133 3.352 6.499 10.913 1.00 0.00 C ATOM 1621 OE1 GLU A 133 2.967 6.115 12.037 1.00 0.00 O ATOM 1622 OE2 GLU A 133 3.749 7.649 10.625 1.00 0.00 O ATOM 0 H GLU A 133 4.937 4.560 12.419 1.00 0.00 H new ATOM 0 HA GLU A 133 2.854 3.325 10.988 1.00 0.00 H new ATOM 0 HB2 GLU A 133 5.329 4.867 10.348 1.00 0.00 H new ATOM 0 HB3 GLU A 133 4.636 3.908 9.054 1.00 0.00 H new ATOM 0 HG2 GLU A 133 3.502 5.967 8.828 1.00 0.00 H new ATOM 0 HG3 GLU A 133 2.353 4.998 9.729 1.00 0.00 H new ATOM 1627 N LYS A 134 5.705 1.714 11.097 1.00 0.00 N ATOM 1628 CA LYS A 134 6.342 0.435 10.834 1.00 0.00 C ATOM 1629 C LYS A 134 5.501 -0.684 11.455 1.00 0.00 C ATOM 1630 O LYS A 134 5.384 -1.767 10.882 1.00 0.00 O ATOM 1631 CB LYS A 134 7.795 0.450 11.315 1.00 0.00 C ATOM 1632 CG LYS A 134 8.377 -0.965 11.341 1.00 0.00 C ATOM 1633 CD LYS A 134 9.693 -1.001 12.122 1.00 0.00 C ATOM 1634 CE LYS A 134 9.575 -1.903 13.353 1.00 0.00 C ATOM 1635 NZ LYS A 134 10.914 -2.343 13.803 1.00 0.00 N ATOM 0 H LYS A 134 6.276 2.374 11.626 1.00 0.00 H new ATOM 0 HA LYS A 134 6.388 0.245 9.762 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.393 1.081 10.658 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.848 0.887 12.312 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.661 -1.649 11.796 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.545 -1.312 10.321 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.493 -1.363 11.477 1.00 0.00 H new ATOM 0 HD3 LYS A 134 9.965 0.008 12.431 1.00 0.00 H new ATOM 0 HE2 LYS A 134 9.073 -1.366 14.158 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.960 -2.772 13.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.816 -2.954 14.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 11.380 -2.873 13.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 11.489 -1.511 14.048 1.00 0.00 H new ATOM 1645 N ASN A 135 4.938 -0.385 12.616 1.00 0.00 N ATOM 1646 CA ASN A 135 4.113 -1.351 13.319 1.00 0.00 C ATOM 1647 C ASN A 135 2.683 -1.285 12.778 1.00 0.00 C ATOM 1648 O ASN A 135 2.015 -2.310 12.649 1.00 0.00 O ATOM 1649 CB ASN A 135 4.065 -1.048 14.817 1.00 0.00 C ATOM 1650 CG ASN A 135 3.479 -2.226 15.598 1.00 0.00 C ATOM 1651 OD1 ASN A 135 2.831 -3.104 15.051 1.00 0.00 O ATOM 1652 ND2 ASN A 135 3.740 -2.196 16.901 1.00 0.00 N ATOM 0 H ASN A 135 5.037 0.514 13.088 1.00 0.00 H new ATOM 0 HA ASN A 135 4.546 -2.339 13.164 1.00 0.00 H new ATOM 0 HB2 ASN A 135 5.070 -0.831 15.180 1.00 0.00 H new ATOM 0 HB3 ASN A 135 3.463 -0.156 14.992 1.00 0.00 H new ATOM 0 HD21 ASN A 135 3.391 -2.938 17.508 1.00 0.00 H new ATOM 0 HD22 ASN A 135 4.289 -1.431 17.294 1.00 0.00 H new ATOM 1658 N ASN A 136 2.256 -0.068 12.474 1.00 0.00 N ATOM 1659 CA ASN A 136 0.917 0.147 11.950 1.00 0.00 C ATOM 1660 C ASN A 136 0.875 -0.287 10.483 1.00 0.00 C ATOM 1661 O ASN A 136 -0.187 -0.627 9.964 1.00 0.00 O ATOM 1662 CB ASN A 136 0.529 1.625 12.017 1.00 0.00 C ATOM 1663 CG ASN A 136 -0.657 1.838 12.960 1.00 0.00 C ATOM 1664 OD1 ASN A 136 -1.383 0.919 13.303 1.00 0.00 O ATOM 1665 ND2 ASN A 136 -0.812 3.096 13.359 1.00 0.00 N ATOM 0 H ASN A 136 2.813 0.780 12.580 1.00 0.00 H new ATOM 0 HA ASN A 136 0.220 -0.435 12.553 1.00 0.00 H new ATOM 0 HB2 ASN A 136 1.381 2.213 12.359 1.00 0.00 H new ATOM 0 HB3 ASN A 136 0.274 1.983 11.020 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -1.575 3.340 13.990 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -0.168 3.817 13.034 1.00 0.00 H new ATOM 1671 N TRP A 137 2.042 -0.259 9.856 1.00 0.00 N ATOM 1672 CA TRP A 137 2.150 -0.644 8.460 1.00 0.00 C ATOM 1673 C TRP A 137 1.984 -2.163 8.374 1.00 0.00 C ATOM 1674 O TRP A 137 1.206 -2.662 7.562 1.00 0.00 O ATOM 1675 CB TRP A 137 3.467 -0.152 7.856 1.00 0.00 C ATOM 1676 CG TRP A 137 3.521 1.360 7.628 1.00 0.00 C ATOM 1677 CD1 TRP A 137 2.653 2.289 8.053 1.00 0.00 C ATOM 1678 CD2 TRP A 137 4.533 2.084 6.898 1.00 0.00 C ATOM 1679 NE1 TRP A 137 3.032 3.554 7.652 1.00 0.00 N ATOM 1680 CE2 TRP A 137 4.212 3.426 6.927 1.00 0.00 C ATOM 1681 CE3 TRP A 137 5.683 1.621 6.235 1.00 0.00 C ATOM 1682 CZ2 TRP A 137 4.989 4.413 6.311 1.00 0.00 C ATOM 1683 CZ3 TRP A 137 6.449 2.621 5.624 1.00 0.00 C ATOM 1684 CH2 TRP A 137 6.139 3.976 5.644 1.00 0.00 C ATOM 0 H TRP A 137 2.921 0.024 10.290 1.00 0.00 H new ATOM 0 HA TRP A 137 1.364 -0.174 7.869 1.00 0.00 H new ATOM 0 HB2 TRP A 137 4.287 -0.439 8.515 1.00 0.00 H new ATOM 0 HB3 TRP A 137 3.630 -0.659 6.905 1.00 0.00 H new ATOM 0 HD1 TRP A 137 1.769 2.075 8.635 1.00 0.00 H new ATOM 0 HE1 TRP A 137 2.537 4.424 7.851 1.00 0.00 H new ATOM 0 HE3 TRP A 137 5.954 0.576 6.200 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 4.716 5.457 6.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 7.344 2.318 5.100 1.00 0.00 H new ATOM 0 HH2 TRP A 137 6.782 4.688 5.148 1.00 0.00 H new ATOM 1694 N MET A 138 2.728 -2.857 9.223 1.00 0.00 N ATOM 1695 CA MET A 138 2.673 -4.308 9.255 1.00 0.00 C ATOM 1696 C MET A 138 1.402 -4.794 9.955 1.00 0.00 C ATOM 1697 O MET A 138 0.690 -5.650 9.434 1.00 0.00 O ATOM 1698 CB MET A 138 3.900 -4.851 9.988 1.00 0.00 C ATOM 1699 CG MET A 138 4.093 -4.145 11.332 1.00 0.00 C ATOM 1700 SD MET A 138 3.711 -5.262 12.670 1.00 0.00 S ATOM 1701 CE MET A 138 5.314 -6.008 12.917 1.00 0.00 C ATOM 0 H MET A 138 3.373 -2.440 9.895 1.00 0.00 H new ATOM 0 HA MET A 138 2.662 -4.674 8.228 1.00 0.00 H new ATOM 0 HB2 MET A 138 3.787 -5.923 10.149 1.00 0.00 H new ATOM 0 HB3 MET A 138 4.787 -4.714 9.370 1.00 0.00 H new ATOM 0 HG2 MET A 138 5.121 -3.794 11.423 1.00 0.00 H new ATOM 0 HG3 MET A 138 3.450 -3.267 11.386 1.00 0.00 H new ATOM 0 HE1 MET A 138 5.255 -6.738 13.725 1.00 0.00 H new ATOM 0 HE2 MET A 138 5.629 -6.506 12.000 1.00 0.00 H new ATOM 0 HE3 MET A 138 6.038 -5.236 13.177 1.00 0.00 H new ATOM 1709 N ALA A 139 1.158 -4.226 11.127 1.00 0.00 N ATOM 1710 CA ALA A 139 -0.014 -4.591 11.905 1.00 0.00 C ATOM 1711 C ALA A 139 -1.253 -4.537 11.008 1.00 0.00 C ATOM 1712 O ALA A 139 -2.097 -5.430 11.057 1.00 0.00 O ATOM 1713 CB ALA A 139 -0.131 -3.664 13.117 1.00 0.00 C ATOM 0 H ALA A 139 1.751 -3.516 11.556 1.00 0.00 H new ATOM 0 HA ALA A 139 0.077 -5.610 12.281 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.010 -3.937 13.701 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.761 -3.761 13.737 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.227 -2.632 12.778 1.00 0.00 H new ATOM 1719 N ALA A 140 -1.322 -3.481 10.212 1.00 0.00 N ATOM 1720 CA ALA A 140 -2.444 -3.299 9.305 1.00 0.00 C ATOM 1721 C ALA A 140 -2.498 -4.474 8.327 1.00 0.00 C ATOM 1722 O ALA A 140 -3.574 -4.997 8.039 1.00 0.00 O ATOM 1723 CB ALA A 140 -2.312 -1.952 8.593 1.00 0.00 C ATOM 0 H ALA A 140 -0.620 -2.742 10.175 1.00 0.00 H new ATOM 0 HA ALA A 140 -3.385 -3.285 9.855 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -3.153 -1.816 7.913 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -2.308 -1.149 9.331 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -1.381 -1.929 8.027 1.00 0.00 H new ATOM 1729 N LEU A 141 -1.325 -4.854 7.842 1.00 0.00 N ATOM 1730 CA LEU A 141 -1.225 -5.957 6.902 1.00 0.00 C ATOM 1731 C LEU A 141 -1.626 -7.256 7.603 1.00 0.00 C ATOM 1732 O LEU A 141 -2.427 -8.027 7.077 1.00 0.00 O ATOM 1733 CB LEU A 141 0.169 -6.001 6.273 1.00 0.00 C ATOM 1734 CG LEU A 141 0.214 -6.141 4.750 1.00 0.00 C ATOM 1735 CD1 LEU A 141 0.251 -4.769 4.074 1.00 0.00 C ATOM 1736 CD2 LEU A 141 1.384 -7.025 4.316 1.00 0.00 C ATOM 0 H LEU A 141 -0.435 -4.417 8.083 1.00 0.00 H new ATOM 0 HA LEU A 141 -1.918 -5.815 6.073 1.00 0.00 H new ATOM 0 HB2 LEU A 141 0.700 -5.090 6.550 1.00 0.00 H new ATOM 0 HB3 LEU A 141 0.717 -6.835 6.711 1.00 0.00 H new ATOM 0 HG LEU A 141 -0.702 -6.635 4.425 1.00 0.00 H new ATOM 0 HD11 LEU A 141 0.283 -4.897 2.992 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -0.641 -4.205 4.347 1.00 0.00 H new ATOM 0 HD13 LEU A 141 1.138 -4.226 4.401 1.00 0.00 H new ATOM 0 HD21 LEU A 141 1.393 -7.108 3.229 1.00 0.00 H new ATOM 0 HD22 LEU A 141 2.320 -6.581 4.654 1.00 0.00 H new ATOM 0 HD23 LEU A 141 1.273 -8.017 4.755 1.00 0.00 H new ATOM 1747 N ILE A 142 -1.049 -7.459 8.778 1.00 0.00 N ATOM 1748 CA ILE A 142 -1.336 -8.652 9.556 1.00 0.00 C ATOM 1749 C ILE A 142 -2.808 -8.642 9.975 1.00 0.00 C ATOM 1750 O ILE A 142 -3.371 -9.684 10.305 1.00 0.00 O ATOM 1751 CB ILE A 142 -0.363 -8.772 10.731 1.00 0.00 C ATOM 1752 CG1 ILE A 142 0.996 -9.300 10.265 1.00 0.00 C ATOM 1753 CG2 ILE A 142 -0.958 -9.629 11.850 1.00 0.00 C ATOM 1754 CD1 ILE A 142 0.945 -10.811 10.029 1.00 0.00 C ATOM 0 H ILE A 142 -0.384 -6.817 9.210 1.00 0.00 H new ATOM 0 HA ILE A 142 -1.183 -9.546 8.952 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.198 -7.776 11.142 1.00 0.00 H new ATOM 0 HG12 ILE A 142 1.291 -8.794 9.345 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.755 -9.070 11.013 1.00 0.00 H new ATOM 0 HG21 ILE A 142 -0.246 -9.698 12.673 1.00 0.00 H new ATOM 0 HG22 ILE A 142 -1.881 -9.172 12.206 1.00 0.00 H new ATOM 0 HG23 ILE A 142 -1.171 -10.628 11.469 1.00 0.00 H new ATOM 0 HD11 ILE A 142 1.923 -11.161 9.699 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.674 -11.315 10.956 1.00 0.00 H new ATOM 0 HD13 ILE A 142 0.202 -11.035 9.264 1.00 0.00 H new ATOM 1765 N SER A 143 -3.389 -7.451 9.949 1.00 0.00 N ATOM 1766 CA SER A 143 -4.784 -7.290 10.322 1.00 0.00 C ATOM 1767 C SER A 143 -5.685 -7.933 9.265 1.00 0.00 C ATOM 1768 O SER A 143 -6.717 -8.515 9.595 1.00 0.00 O ATOM 1769 CB SER A 143 -5.140 -5.813 10.498 1.00 0.00 C ATOM 1770 OG SER A 143 -6.342 -5.640 11.245 1.00 0.00 O ATOM 0 H SER A 143 -2.919 -6.588 9.675 1.00 0.00 H new ATOM 0 HA SER A 143 -4.943 -7.789 11.278 1.00 0.00 H new ATOM 0 HB2 SER A 143 -4.322 -5.300 11.004 1.00 0.00 H new ATOM 0 HB3 SER A 143 -5.251 -5.347 9.519 1.00 0.00 H new ATOM 0 HG SER A 143 -6.535 -4.684 11.337 1.00 0.00 H new ATOM 1775 N LEU A 144 -5.262 -7.805 8.016 1.00 0.00 N ATOM 1776 CA LEU A 144 -6.018 -8.365 6.909 1.00 0.00 C ATOM 1777 C LEU A 144 -5.922 -9.891 6.952 1.00 0.00 C ATOM 1778 O LEU A 144 -6.935 -10.577 7.086 1.00 0.00 O ATOM 1779 CB LEU A 144 -5.556 -7.756 5.583 1.00 0.00 C ATOM 1780 CG LEU A 144 -5.767 -6.250 5.426 1.00 0.00 C ATOM 1781 CD1 LEU A 144 -5.388 -5.786 4.019 1.00 0.00 C ATOM 1782 CD2 LEU A 144 -7.200 -5.855 5.793 1.00 0.00 C ATOM 0 H LEU A 144 -4.405 -7.322 7.746 1.00 0.00 H new ATOM 0 HA LEU A 144 -7.074 -8.109 7.000 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -4.494 -7.969 5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -6.079 -8.262 4.772 1.00 0.00 H new ATOM 0 HG LEU A 144 -5.103 -5.739 6.123 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -5.548 -4.711 3.935 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -4.338 -6.013 3.832 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -6.007 -6.303 3.286 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -7.323 -4.779 5.673 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.900 -6.376 5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -7.399 -6.129 6.829 1.00 0.00 H new ATOM 1793 N GLN A 145 -4.696 -10.378 6.837 1.00 0.00 N ATOM 1794 CA GLN A 145 -4.454 -11.811 6.860 1.00 0.00 C ATOM 1795 C GLN A 145 -5.162 -12.448 8.059 1.00 0.00 C ATOM 1796 O GLN A 145 -5.436 -13.648 8.056 1.00 0.00 O ATOM 1797 CB GLN A 145 -2.955 -12.115 6.885 1.00 0.00 C ATOM 1798 CG GLN A 145 -2.480 -12.418 8.307 1.00 0.00 C ATOM 1799 CD GLN A 145 -2.621 -13.908 8.626 1.00 0.00 C ATOM 1800 OE1 GLN A 145 -3.328 -14.161 9.724 1.00 0.00 O flip ATOM 1801 NE2 GLN A 145 -2.121 -14.770 7.922 1.00 0.00 N flip ATOM 0 H GLN A 145 -3.859 -9.806 6.728 1.00 0.00 H new ATOM 0 HA GLN A 145 -4.863 -12.244 5.947 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -2.742 -12.966 6.238 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -2.401 -11.265 6.486 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -1.439 -12.115 8.419 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -3.060 -11.833 9.021 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -1.590 -14.506 7.092 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -2.234 -15.755 8.163 1.00 0.00 H new ATOM 1808 N TYR A 146 -5.438 -11.618 9.053 1.00 0.00 N ATOM 1809 CA TYR A 146 -6.108 -12.085 10.254 1.00 0.00 C ATOM 1810 C TYR A 146 -7.596 -12.329 9.992 1.00 0.00 C ATOM 1811 O TYR A 146 -8.220 -13.152 10.661 1.00 0.00 O ATOM 1812 CB TYR A 146 -5.962 -10.962 11.283 1.00 0.00 C ATOM 1813 CG TYR A 146 -4.970 -11.271 12.406 1.00 0.00 C ATOM 1814 CD1 TYR A 146 -4.912 -12.541 12.944 1.00 0.00 C ATOM 1815 CD2 TYR A 146 -4.134 -10.281 12.880 1.00 0.00 C ATOM 1816 CE1 TYR A 146 -3.978 -12.833 14.001 1.00 0.00 C ATOM 1817 CE2 TYR A 146 -3.200 -10.573 13.937 1.00 0.00 C ATOM 1818 CZ TYR A 146 -3.168 -11.833 14.445 1.00 0.00 C ATOM 1819 OH TYR A 146 -2.286 -12.109 15.442 1.00 0.00 O ATOM 0 H TYR A 146 -5.210 -10.624 9.051 1.00 0.00 H new ATOM 0 HA TYR A 146 -5.672 -13.024 10.595 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -5.644 -10.054 10.771 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -6.938 -10.756 11.721 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -5.567 -13.315 12.572 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -4.180 -9.288 12.459 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -3.922 -13.822 14.431 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -2.540 -9.808 14.317 1.00 0.00 H new ATOM 0 HH TYR A 146 -1.772 -11.303 15.657 1.00 0.00 H new ATOM 1828 N ARG A 147 -8.120 -11.601 9.018 1.00 0.00 N ATOM 1829 CA ARG A 147 -9.523 -11.729 8.659 1.00 0.00 C ATOM 1830 C ARG A 147 -9.700 -12.801 7.583 1.00 0.00 C ATOM 1831 O ARG A 147 -10.536 -12.660 6.692 1.00 0.00 O ATOM 1832 CB ARG A 147 -10.082 -10.401 8.144 1.00 0.00 C ATOM 1833 CG ARG A 147 -11.311 -9.974 8.950 1.00 0.00 C ATOM 1834 CD ARG A 147 -10.900 -9.257 10.237 1.00 0.00 C ATOM 1835 NE ARG A 147 -11.457 -7.886 10.252 1.00 0.00 N ATOM 1836 CZ ARG A 147 -11.421 -7.072 11.315 1.00 0.00 C ATOM 1837 NH1 ARG A 147 -10.855 -7.486 12.457 1.00 0.00 N ATOM 1838 NH2 ARG A 147 -11.952 -5.843 11.238 1.00 0.00 N ATOM 0 H ARG A 147 -7.599 -10.920 8.466 1.00 0.00 H new ATOM 0 HA ARG A 147 -10.070 -12.017 9.556 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -9.314 -9.630 8.208 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -10.349 -10.498 7.092 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -11.936 -9.316 8.346 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -11.913 -10.850 9.193 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -11.258 -9.813 11.103 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -9.813 -9.218 10.310 1.00 0.00 H new ATOM 0 HE ARG A 147 -11.896 -7.539 9.399 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -10.452 -8.421 12.517 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -10.828 -6.866 13.267 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.384 -5.527 10.369 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -11.924 -5.224 12.048 1.00 0.00 H new ATOM 1849 N SER A 148 -8.898 -13.849 7.699 1.00 0.00 N ATOM 1850 CA SER A 148 -8.956 -14.945 6.747 1.00 0.00 C ATOM 1851 C SER A 148 -9.397 -16.230 7.453 1.00 0.00 C ATOM 1852 O SER A 148 -9.031 -17.328 7.037 1.00 0.00 O ATOM 1853 CB SER A 148 -7.602 -15.154 6.065 1.00 0.00 C ATOM 1854 OG SER A 148 -7.745 -15.472 4.683 1.00 0.00 O ATOM 0 H SER A 148 -8.204 -13.962 8.438 1.00 0.00 H new ATOM 0 HA SER A 148 -9.686 -14.691 5.978 1.00 0.00 H new ATOM 0 HB2 SER A 148 -7.000 -14.251 6.169 1.00 0.00 H new ATOM 0 HB3 SER A 148 -7.062 -15.957 6.568 1.00 0.00 H new ATOM 0 HG SER A 148 -7.649 -14.657 4.148 1.00 0.00 H new ATOM 1859 N THR A 149 -10.176 -16.048 8.509 1.00 0.00 N ATOM 1860 CA THR A 149 -10.672 -17.178 9.276 1.00 0.00 C ATOM 1861 C THR A 149 -11.629 -16.702 10.370 1.00 0.00 C ATOM 1862 O THR A 149 -12.660 -17.328 10.613 1.00 0.00 O ATOM 1863 CB THR A 149 -9.465 -17.947 9.818 1.00 0.00 C ATOM 1864 OG1 THR A 149 -9.837 -19.316 9.685 1.00 0.00 O ATOM 1865 CG2 THR A 149 -9.277 -17.757 11.325 1.00 0.00 C ATOM 0 H THR A 149 -10.476 -15.135 8.851 1.00 0.00 H new ATOM 0 HA THR A 149 -11.254 -17.855 8.651 1.00 0.00 H new ATOM 0 HB THR A 149 -8.565 -17.622 9.296 1.00 0.00 H new ATOM 0 HG1 THR A 149 -9.110 -19.886 10.012 1.00 0.00 H new ATOM 0 HG21 THR A 149 -8.407 -18.324 11.657 1.00 0.00 H new ATOM 0 HG22 THR A 149 -9.126 -16.700 11.542 1.00 0.00 H new ATOM 0 HG23 THR A 149 -10.164 -18.112 11.850 1.00 0.00 H new ATOM 1873 N LEU A 150 -11.255 -15.599 11.000 1.00 0.00 N ATOM 1874 CA LEU A 150 -12.068 -15.030 12.062 1.00 0.00 C ATOM 1875 C LEU A 150 -13.033 -14.004 11.467 1.00 0.00 C ATOM 1876 O LEU A 150 -13.307 -14.027 10.267 1.00 0.00 O ATOM 1877 CB LEU A 150 -11.180 -14.468 13.173 1.00 0.00 C ATOM 1878 CG LEU A 150 -10.544 -13.104 12.898 1.00 0.00 C ATOM 1879 CD1 LEU A 150 -11.209 -12.009 13.733 1.00 0.00 C ATOM 1880 CD2 LEU A 150 -9.030 -13.150 13.116 1.00 0.00 C ATOM 0 H LEU A 150 -10.399 -15.083 10.796 1.00 0.00 H new ATOM 0 HA LEU A 150 -12.676 -15.803 12.532 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -11.775 -14.392 14.083 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -10.383 -15.185 13.372 1.00 0.00 H new ATOM 0 HG LEU A 150 -10.712 -12.856 11.850 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -10.737 -11.050 13.518 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -12.269 -11.956 13.485 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -11.095 -12.240 14.792 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -8.603 -12.168 12.914 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -8.819 -13.432 14.148 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -8.587 -13.884 12.442 1.00 0.00 H new