USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 0 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 85 ASN : amide:sc= 1.21 K(o=1.4,f=-0.83) USER MOD Set 1.2: A 88 ASN : amide:sc= 0.155 K(o=1.4,f=-3.2!) USER MOD Set 2.1: A 7 SER OG : rot -147:sc= 0.58 USER MOD Set 2.2: A 75 TYR OH : rot 152:sc= 0.521 USER MOD Set 3.1: A 8 MET CE :methyl -107:sc= -5.06 (180deg=-9.59!) USER MOD Set 3.2: A 73 TYR OH : rot -18:sc= -0.567 USER MOD Set 4.1: A 1 ALA N :NH3+ -121:sc= -0.164 (180deg=-2.63!) USER MOD Set 4.2: A 72 SER OG : rot 56:sc= 0.747 USER MOD Set 5.1: A 25 TYR OH : rot -79:sc= 0.976 USER MOD Set 5.2: A 111 TYR OH : rot -164:sc= 1.15 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0.0378 USER MOD Single : A 17 HIS :FLIP no HD1:sc= 0.197 F(o=-2.5!,f=0.2) USER MOD Single : A 20 MET CE :methyl 142:sc= -0.0481 (180deg=-1.97!) USER MOD Single : A 23 ASN : amide:sc= -0.0487 K(o=-0.049,f=-1.2) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 28 TYR OH : rot -162:sc= 0.274 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HE2:sc= -1.4 X(o=-1.4,f=-1.8!) USER MOD Single : A 50 ASN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 52 TYR OH : rot 61:sc= 0.556 USER MOD Single : A 56 LYS NZ :NH3+ 168:sc= -0.0185 (180deg=-0.245) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=-0.00036) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 169:sc= 0.337 (180deg=0.286) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 TYR OH : rot 130:sc= -0.256 USER MOD Single : A 70 THR OG1 : rot 180:sc=-0.00541 USER MOD Single : A 74 SER OG : rot -54:sc= 0.0272 USER MOD Single : A 76 SER OG : rot -35:sc= 0.141 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 SER OG : rot -67:sc= 1.22 USER MOD Single : A 108 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.599) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 HIS : no HD1:sc= -1.6 X(o=-1.6,f=-1.8) USER MOD Single : A 116 LYS NZ :NH3+ -119:sc= 0.00798 (180deg=-0.147) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 THR OG1 : rot -44:sc= 0.565 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= -0.0833 (180deg=-0.0833) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc=-0.00421 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -7.895 1.415 3.618 1.00 0.00 N ATOM 2 CA ALA A 1 -7.366 2.607 4.301 1.00 0.00 C ATOM 3 C ALA A 1 -5.841 2.550 4.408 1.00 0.00 C ATOM 4 O ALA A 1 -5.228 1.493 4.564 1.00 0.00 O ATOM 5 CB ALA A 1 -7.946 2.750 5.708 1.00 0.00 C ATOM 0 H1 ALA A 1 -8.423 1.706 2.770 1.00 0.00 H new ATOM 0 H2 ALA A 1 -7.107 0.796 3.340 1.00 0.00 H new ATOM 0 H3 ALA A 1 -8.530 0.900 4.261 1.00 0.00 H new ATOM 0 HA ALA A 1 -7.661 3.467 3.700 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -7.534 3.640 6.183 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -9.031 2.841 5.647 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -7.688 1.871 6.299 1.00 0.00 H new ATOM 6 N LEU A 2 -5.249 3.737 4.357 1.00 0.00 N ATOM 7 CA LEU A 2 -3.794 3.921 4.329 1.00 0.00 C ATOM 8 C LEU A 2 -3.169 4.115 5.708 1.00 0.00 C ATOM 9 O LEU A 2 -2.242 3.370 5.979 1.00 0.00 O ATOM 10 CB LEU A 2 -3.572 5.107 3.394 1.00 0.00 C ATOM 11 CG LEU A 2 -2.177 5.404 2.851 1.00 0.00 C ATOM 12 CD1 LEU A 2 -1.310 6.286 3.739 1.00 0.00 C ATOM 13 CD2 LEU A 2 -1.465 4.132 2.451 1.00 0.00 C ATOM 0 H LEU A 2 -5.769 4.614 4.333 1.00 0.00 H new ATOM 0 HA LEU A 2 -3.290 3.023 3.971 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.231 4.970 2.536 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -3.912 6.000 3.918 1.00 0.00 H new ATOM 0 HG LEU A 2 -2.344 6.008 1.959 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -0.340 6.438 3.265 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -1.798 7.250 3.882 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -1.170 5.803 4.706 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -0.474 4.375 2.068 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -1.369 3.480 3.319 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -2.038 3.622 1.677 1.00 0.00 H new ATOM 14 N TRP A 3 -3.604 5.076 6.558 1.00 0.00 N ATOM 15 CA TRP A 3 -3.184 5.118 7.995 1.00 0.00 C ATOM 16 C TRP A 3 -3.475 3.804 8.790 1.00 0.00 C ATOM 17 O TRP A 3 -2.676 3.401 9.638 1.00 0.00 O ATOM 18 CB TRP A 3 -3.789 6.337 8.757 1.00 0.00 C ATOM 19 CG TRP A 3 -5.334 6.295 9.029 1.00 0.00 C ATOM 20 CD1 TRP A 3 -5.982 5.615 10.099 1.00 0.00 C ATOM 21 CD2 TRP A 3 -6.359 6.576 8.135 1.00 0.00 C ATOM 22 NE1 TRP A 3 -7.358 5.461 9.890 1.00 0.00 N ATOM 23 CE2 TRP A 3 -7.567 6.023 8.654 1.00 0.00 C ATOM 24 CE3 TRP A 3 -6.318 7.061 6.802 1.00 0.00 C ATOM 25 CZ2 TRP A 3 -8.703 5.918 7.814 1.00 0.00 C ATOM 26 CZ3 TRP A 3 -7.467 7.019 6.032 1.00 0.00 C ATOM 27 CH2 TRP A 3 -8.645 6.449 6.532 1.00 0.00 C ATOM 0 H TRP A 3 -4.238 5.827 6.286 1.00 0.00 H new ATOM 0 HA TRP A 3 -2.101 5.228 7.947 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -3.276 6.430 9.714 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -3.567 7.240 8.188 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -5.467 5.256 10.978 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -8.045 5.032 10.510 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -5.401 7.458 6.393 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -9.601 5.432 8.166 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -7.455 7.431 5.034 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -9.526 6.422 5.908 1.00 0.00 H new ATOM 28 N GLN A 4 -4.635 3.193 8.495 1.00 0.00 N ATOM 29 CA GLN A 4 -5.110 1.971 9.150 1.00 0.00 C ATOM 30 C GLN A 4 -4.422 0.690 8.638 1.00 0.00 C ATOM 31 O GLN A 4 -4.222 -0.208 9.459 1.00 0.00 O ATOM 32 CB GLN A 4 -6.648 1.900 9.052 1.00 0.00 C ATOM 33 CG GLN A 4 -7.314 1.543 10.392 1.00 0.00 C ATOM 34 CD GLN A 4 -8.840 1.637 10.409 1.00 0.00 C ATOM 35 OE1 GLN A 4 -9.495 2.155 9.502 1.00 0.00 O ATOM 36 NE2 GLN A 4 -9.448 1.142 11.472 1.00 0.00 N ATOM 0 H GLN A 4 -5.276 3.543 7.783 1.00 0.00 H new ATOM 0 HA GLN A 4 -4.827 2.025 10.201 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -7.030 2.860 8.706 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -6.926 1.158 8.304 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -7.026 0.527 10.663 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -6.917 2.203 11.163 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -8.901 0.715 12.219 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -10.464 1.187 11.545 1.00 0.00 H new ATOM 37 N PHE A 5 -4.051 0.602 7.321 1.00 0.00 N ATOM 38 CA PHE A 5 -3.062 -0.424 6.876 1.00 0.00 C ATOM 39 C PHE A 5 -1.630 -0.072 7.346 1.00 0.00 C ATOM 40 O PHE A 5 -0.893 -1.002 7.637 1.00 0.00 O ATOM 41 CB PHE A 5 -3.281 -0.942 5.446 1.00 0.00 C ATOM 42 CG PHE A 5 -2.297 -0.717 4.319 1.00 0.00 C ATOM 43 CD1 PHE A 5 -1.889 0.570 4.039 1.00 0.00 C ATOM 44 CD2 PHE A 5 -1.802 -1.769 3.523 1.00 0.00 C ATOM 45 CE1 PHE A 5 -0.974 0.818 3.026 1.00 0.00 C ATOM 46 CE2 PHE A 5 -0.923 -1.504 2.467 1.00 0.00 C ATOM 47 CZ PHE A 5 -0.500 -0.208 2.227 1.00 0.00 C ATOM 0 H PHE A 5 -4.407 1.205 6.579 1.00 0.00 H new ATOM 0 HA PHE A 5 -3.256 -1.356 7.407 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -3.414 -2.021 5.527 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -4.232 -0.528 5.111 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -2.286 1.393 4.614 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -2.103 -2.786 3.729 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -0.626 1.827 2.858 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -0.575 -2.311 1.839 1.00 0.00 H new ATOM 0 HZ PHE A 5 0.192 0.000 1.425 1.00 0.00 H new ATOM 48 N ARG A 6 -1.268 1.217 7.522 1.00 0.00 N ATOM 49 CA ARG A 6 -0.036 1.657 8.217 1.00 0.00 C ATOM 50 C ARG A 6 0.051 1.509 9.758 1.00 0.00 C ATOM 51 O ARG A 6 0.681 2.290 10.478 1.00 0.00 O ATOM 52 CB ARG A 6 0.209 3.114 7.793 1.00 0.00 C ATOM 53 CG ARG A 6 1.151 3.221 6.608 1.00 0.00 C ATOM 54 CD ARG A 6 0.793 2.616 5.263 1.00 0.00 C ATOM 55 NE ARG A 6 1.893 1.808 4.674 1.00 0.00 N ATOM 56 CZ ARG A 6 2.300 1.815 3.382 1.00 0.00 C ATOM 57 NH1 ARG A 6 1.807 2.611 2.439 1.00 0.00 N ATOM 58 NH2 ARG A 6 3.267 0.993 3.024 1.00 0.00 N ATOM 0 H ARG A 6 -1.832 1.995 7.180 1.00 0.00 H new ATOM 0 HA ARG A 6 0.739 0.958 7.904 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -0.743 3.581 7.540 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.623 3.670 8.634 1.00 0.00 H new ATOM 0 HG2 ARG A 6 1.334 4.283 6.441 1.00 0.00 H new ATOM 0 HG3 ARG A 6 2.099 2.779 6.914 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.090 1.987 5.378 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.527 3.415 4.571 1.00 0.00 H new ATOM 0 HE ARG A 6 2.393 1.184 5.308 1.00 0.00 H new ATOM 0 HH11 ARG A 6 1.069 3.277 2.668 1.00 0.00 H new ATOM 0 HH12 ARG A 6 2.167 2.556 1.486 1.00 0.00 H new ATOM 0 HH21 ARG A 6 3.690 0.372 3.714 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.592 0.978 2.057 1.00 0.00 H new ATOM 59 N SER A 7 -0.624 0.478 10.227 1.00 0.00 N ATOM 60 CA SER A 7 -0.374 -0.091 11.585 1.00 0.00 C ATOM 61 C SER A 7 0.363 -1.444 11.425 1.00 0.00 C ATOM 62 O SER A 7 1.571 -1.617 11.574 1.00 0.00 O ATOM 63 CB SER A 7 -1.627 0.007 12.468 1.00 0.00 C ATOM 64 OG SER A 7 -1.344 -0.445 13.787 1.00 0.00 O ATOM 0 H SER A 7 -1.357 -0.001 9.704 1.00 0.00 H new ATOM 0 HA SER A 7 0.321 0.496 12.185 1.00 0.00 H new ATOM 0 HB2 SER A 7 -1.978 1.039 12.498 1.00 0.00 H new ATOM 0 HB3 SER A 7 -2.430 -0.590 12.037 1.00 0.00 H new ATOM 0 HG SER A 7 -2.143 -0.868 14.166 1.00 0.00 H new ATOM 65 N MET A 8 -0.518 -2.335 11.061 1.00 0.00 N ATOM 66 CA MET A 8 -0.371 -3.670 10.509 1.00 0.00 C ATOM 67 C MET A 8 0.569 -3.923 9.312 1.00 0.00 C ATOM 68 O MET A 8 1.022 -5.054 9.195 1.00 0.00 O ATOM 69 CB MET A 8 -1.827 -4.135 10.223 1.00 0.00 C ATOM 70 CG MET A 8 -2.884 -3.052 9.903 1.00 0.00 C ATOM 71 SD MET A 8 -4.300 -3.818 9.170 1.00 0.00 S ATOM 72 CE MET A 8 -3.584 -3.972 7.570 1.00 0.00 C ATOM 0 H MET A 8 -1.509 -2.112 11.157 1.00 0.00 H new ATOM 0 HA MET A 8 0.176 -4.253 11.250 1.00 0.00 H new ATOM 0 HB2 MET A 8 -1.797 -4.831 9.384 1.00 0.00 H new ATOM 0 HB3 MET A 8 -2.175 -4.696 11.090 1.00 0.00 H new ATOM 0 HG2 MET A 8 -3.171 -2.527 10.814 1.00 0.00 H new ATOM 0 HG3 MET A 8 -2.466 -2.308 9.224 1.00 0.00 H new ATOM 0 HE1 MET A 8 -4.041 -3.248 6.896 1.00 0.00 H new ATOM 0 HE2 MET A 8 -2.512 -3.785 7.632 1.00 0.00 H new ATOM 0 HE3 MET A 8 -3.755 -4.979 7.190 1.00 0.00 H new ATOM 73 N ILE A 9 0.901 -2.964 8.432 1.00 0.00 N ATOM 74 CA ILE A 9 2.052 -3.091 7.454 1.00 0.00 C ATOM 75 C ILE A 9 3.373 -3.357 8.207 1.00 0.00 C ATOM 76 O ILE A 9 4.055 -4.316 7.890 1.00 0.00 O ATOM 77 CB ILE A 9 2.068 -1.831 6.527 1.00 0.00 C ATOM 78 CG1 ILE A 9 0.958 -1.984 5.455 1.00 0.00 C ATOM 79 CG2 ILE A 9 3.392 -1.401 5.834 1.00 0.00 C ATOM 80 CD1 ILE A 9 1.449 -2.678 4.205 1.00 0.00 C ATOM 0 H ILE A 9 0.400 -2.079 8.359 1.00 0.00 H new ATOM 0 HA ILE A 9 1.923 -3.955 6.802 1.00 0.00 H new ATOM 0 HB ILE A 9 1.905 -1.017 7.233 1.00 0.00 H new ATOM 0 HG12 ILE A 9 0.126 -2.548 5.877 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.574 -0.998 5.192 1.00 0.00 H new ATOM 0 HG21 ILE A 9 3.215 -0.510 5.232 1.00 0.00 H new ATOM 0 HG22 ILE A 9 4.145 -1.184 6.591 1.00 0.00 H new ATOM 0 HG23 ILE A 9 3.745 -2.208 5.192 1.00 0.00 H new ATOM 0 HD11 ILE A 9 0.632 -2.758 3.489 1.00 0.00 H new ATOM 0 HD12 ILE A 9 2.262 -2.101 3.764 1.00 0.00 H new ATOM 0 HD13 ILE A 9 1.808 -3.675 4.460 1.00 0.00 H new ATOM 81 N LYS A 10 3.659 -2.547 9.211 1.00 0.00 N ATOM 82 CA LYS A 10 4.752 -2.687 10.179 1.00 0.00 C ATOM 83 C LYS A 10 4.580 -3.756 11.276 1.00 0.00 C ATOM 84 O LYS A 10 5.557 -4.031 11.969 1.00 0.00 O ATOM 85 CB LYS A 10 4.756 -1.217 10.603 1.00 0.00 C ATOM 86 CG LYS A 10 5.661 -0.856 11.746 1.00 0.00 C ATOM 87 CD LYS A 10 4.936 -1.027 13.073 1.00 0.00 C ATOM 88 CE LYS A 10 5.691 -0.459 14.270 1.00 0.00 C ATOM 89 NZ LYS A 10 4.954 -0.703 15.522 1.00 0.00 N ATOM 0 H LYS A 10 3.099 -1.713 9.391 1.00 0.00 H new ATOM 0 HA LYS A 10 5.698 -3.089 9.815 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.037 -0.613 9.740 1.00 0.00 H new ATOM 0 HB3 LYS A 10 3.738 -0.936 10.871 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.550 -1.486 11.727 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.998 0.175 11.639 1.00 0.00 H new ATOM 0 HD2 LYS A 10 3.962 -0.543 13.008 1.00 0.00 H new ATOM 0 HD3 LYS A 10 4.754 -2.088 13.242 1.00 0.00 H new ATOM 0 HE2 LYS A 10 6.679 -0.915 14.331 1.00 0.00 H new ATOM 0 HE3 LYS A 10 5.841 0.612 14.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 5.488 -0.307 16.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 4.020 -0.248 15.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 4.833 -1.727 15.659 1.00 0.00 H new ATOM 90 N CYS A 11 3.375 -4.313 11.471 1.00 0.00 N ATOM 91 CA CYS A 11 3.203 -5.649 12.118 1.00 0.00 C ATOM 92 C CYS A 11 3.681 -6.759 11.122 1.00 0.00 C ATOM 93 O CYS A 11 4.502 -7.585 11.515 1.00 0.00 O ATOM 94 CB CYS A 11 1.750 -5.848 12.538 1.00 0.00 C ATOM 95 SG CYS A 11 1.491 -7.287 13.565 1.00 0.00 S ATOM 0 H CYS A 11 2.499 -3.870 11.195 1.00 0.00 H new ATOM 0 HA CYS A 11 3.809 -5.711 13.022 1.00 0.00 H new ATOM 0 HB2 CYS A 11 1.412 -4.963 13.076 1.00 0.00 H new ATOM 0 HB3 CYS A 11 1.131 -5.934 11.645 1.00 0.00 H new ATOM 96 N ALA A 12 3.244 -6.688 9.837 1.00 0.00 N ATOM 97 CA ALA A 12 3.846 -7.414 8.689 1.00 0.00 C ATOM 98 C ALA A 12 5.386 -7.420 8.600 1.00 0.00 C ATOM 99 O ALA A 12 5.979 -8.437 8.231 1.00 0.00 O ATOM 100 CB ALA A 12 3.075 -7.083 7.401 1.00 0.00 C ATOM 0 H ALA A 12 2.447 -6.112 9.566 1.00 0.00 H new ATOM 0 HA ALA A 12 3.707 -8.479 8.876 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.521 -7.618 6.562 1.00 0.00 H new ATOM 0 HB2 ALA A 12 2.034 -7.386 7.512 1.00 0.00 H new ATOM 0 HB3 ALA A 12 3.123 -6.010 7.214 1.00 0.00 H new ATOM 101 N ILE A 13 6.024 -6.341 9.044 1.00 0.00 N ATOM 102 CA ILE A 13 7.473 -6.244 9.225 1.00 0.00 C ATOM 103 C ILE A 13 7.681 -6.576 10.762 1.00 0.00 C ATOM 104 O ILE A 13 6.868 -6.159 11.587 1.00 0.00 O ATOM 105 CB ILE A 13 7.816 -4.752 8.901 1.00 0.00 C ATOM 106 CG1 ILE A 13 7.215 -4.104 7.625 1.00 0.00 C ATOM 107 CG2 ILE A 13 9.306 -4.421 8.869 1.00 0.00 C ATOM 108 CD1 ILE A 13 7.167 -4.961 6.390 1.00 0.00 C ATOM 0 H ILE A 13 5.534 -5.483 9.296 1.00 0.00 H new ATOM 0 HA ILE A 13 8.090 -6.898 8.609 1.00 0.00 H new ATOM 0 HB ILE A 13 7.314 -4.318 9.766 1.00 0.00 H new ATOM 0 HG12 ILE A 13 6.200 -3.780 7.854 1.00 0.00 H new ATOM 0 HG13 ILE A 13 7.791 -3.208 7.395 1.00 0.00 H new ATOM 0 HG21 ILE A 13 9.439 -3.364 8.636 1.00 0.00 H new ATOM 0 HG22 ILE A 13 9.748 -4.637 9.842 1.00 0.00 H new ATOM 0 HG23 ILE A 13 9.797 -5.025 8.106 1.00 0.00 H new ATOM 0 HD11 ILE A 13 6.726 -4.394 5.570 1.00 0.00 H new ATOM 0 HD12 ILE A 13 8.178 -5.265 6.119 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.562 -5.846 6.585 1.00 0.00 H new ATOM 109 N PRO A 14 8.699 -7.299 11.251 1.00 0.00 N ATOM 110 CA PRO A 14 9.113 -7.265 12.738 1.00 0.00 C ATOM 111 C PRO A 14 9.940 -5.943 12.922 1.00 0.00 C ATOM 112 O PRO A 14 11.172 -5.886 12.903 1.00 0.00 O ATOM 113 CB PRO A 14 9.924 -8.559 12.854 1.00 0.00 C ATOM 114 CG PRO A 14 10.117 -9.056 11.403 1.00 0.00 C ATOM 115 CD PRO A 14 9.755 -7.906 10.458 1.00 0.00 C ATOM 0 HA PRO A 14 8.334 -7.240 13.500 1.00 0.00 H new ATOM 0 HB2 PRO A 14 10.884 -8.379 13.338 1.00 0.00 H new ATOM 0 HB3 PRO A 14 9.398 -9.300 13.456 1.00 0.00 H new ATOM 0 HG2 PRO A 14 11.148 -9.372 11.242 1.00 0.00 H new ATOM 0 HG3 PRO A 14 9.484 -9.922 11.209 1.00 0.00 H new ATOM 0 HD2 PRO A 14 10.590 -7.229 10.276 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.407 -8.252 9.485 1.00 0.00 H new ATOM 116 N GLY A 15 9.110 -4.898 12.942 1.00 0.00 N ATOM 117 CA GLY A 15 9.387 -3.727 12.093 1.00 0.00 C ATOM 118 C GLY A 15 9.373 -2.322 12.668 1.00 0.00 C ATOM 119 O GLY A 15 9.442 -2.135 13.887 1.00 0.00 O ATOM 0 H GLY A 15 8.268 -4.832 13.514 1.00 0.00 H new ATOM 0 HA2 GLY A 15 10.371 -3.880 11.649 1.00 0.00 H new ATOM 0 HA3 GLY A 15 8.663 -3.745 11.278 1.00 0.00 H new ATOM 120 N SER A 16 9.368 -1.327 11.741 1.00 0.00 N ATOM 121 CA SER A 16 9.697 0.092 12.109 1.00 0.00 C ATOM 122 C SER A 16 8.671 1.161 11.644 1.00 0.00 C ATOM 123 O SER A 16 7.725 1.424 12.388 1.00 0.00 O ATOM 124 CB SER A 16 11.184 0.381 11.751 1.00 0.00 C ATOM 125 OG SER A 16 11.464 0.263 10.358 1.00 0.00 O ATOM 0 H SER A 16 9.147 -1.467 10.755 1.00 0.00 H new ATOM 0 HA SER A 16 9.591 0.190 13.189 1.00 0.00 H new ATOM 0 HB2 SER A 16 11.441 1.387 12.082 1.00 0.00 H new ATOM 0 HB3 SER A 16 11.823 -0.308 12.302 1.00 0.00 H new ATOM 0 HG SER A 16 12.411 0.458 10.197 1.00 0.00 H new ATOM 126 N HIS A 17 8.872 1.812 10.486 1.00 0.00 N ATOM 127 CA HIS A 17 7.900 2.754 9.857 1.00 0.00 C ATOM 128 C HIS A 17 7.146 1.910 8.775 1.00 0.00 C ATOM 129 O HIS A 17 7.824 1.326 7.919 1.00 0.00 O ATOM 130 CB HIS A 17 8.470 4.070 9.207 1.00 0.00 C ATOM 131 CG HIS A 17 9.947 4.114 8.930 1.00 0.00 C ATOM 132 ND1 HIS A 17 10.446 3.230 8.004 1.00 0.00 N flip ATOM 133 CD2 HIS A 17 10.957 4.730 9.658 1.00 0.00 C flip ATOM 134 CE1 HIS A 17 11.812 3.214 8.037 1.00 0.00 C flip ATOM 135 NE2 HIS A 17 12.026 4.130 9.034 1.00 0.00 N flip ATOM 0 H HIS A 17 9.728 1.704 9.942 1.00 0.00 H new ATOM 0 HA HIS A 17 7.275 3.147 10.659 1.00 0.00 H new ATOM 0 HB2 HIS A 17 7.945 4.238 8.267 1.00 0.00 H new ATOM 0 HB3 HIS A 17 8.224 4.905 9.863 1.00 0.00 H new ATOM 0 HD2 HIS A 17 10.916 5.452 10.460 1.00 0.00 H new ATOM 0 HE1 HIS A 17 12.517 2.645 7.449 1.00 0.00 H new ATOM 0 HE2 HIS A 17 12.978 4.367 9.313 1.00 0.00 H new ATOM 136 N PRO A 18 5.796 1.808 8.730 1.00 0.00 N ATOM 137 CA PRO A 18 5.092 1.090 7.625 1.00 0.00 C ATOM 138 C PRO A 18 5.234 1.758 6.250 1.00 0.00 C ATOM 139 O PRO A 18 5.518 1.041 5.293 1.00 0.00 O ATOM 140 CB PRO A 18 3.655 0.925 8.103 1.00 0.00 C ATOM 141 CG PRO A 18 3.481 1.855 9.314 1.00 0.00 C ATOM 142 CD PRO A 18 4.865 2.405 9.696 1.00 0.00 C ATOM 0 HA PRO A 18 5.549 0.119 7.435 1.00 0.00 H new ATOM 0 HB2 PRO A 18 2.952 1.185 7.312 1.00 0.00 H new ATOM 0 HB3 PRO A 18 3.456 -0.111 8.379 1.00 0.00 H new ATOM 0 HG2 PRO A 18 2.800 2.671 9.072 1.00 0.00 H new ATOM 0 HG3 PRO A 18 3.043 1.312 10.151 1.00 0.00 H new ATOM 0 HD2 PRO A 18 4.885 3.493 9.641 1.00 0.00 H new ATOM 0 HD3 PRO A 18 5.129 2.132 10.718 1.00 0.00 H new ATOM 143 N LEU A 19 5.119 3.099 6.153 1.00 0.00 N ATOM 144 CA LEU A 19 5.615 3.862 4.996 1.00 0.00 C ATOM 145 C LEU A 19 7.132 3.976 5.037 1.00 0.00 C ATOM 146 O LEU A 19 7.753 2.932 5.168 1.00 0.00 O ATOM 147 CB LEU A 19 4.795 5.179 4.929 1.00 0.00 C ATOM 148 CG LEU A 19 3.703 5.083 3.901 1.00 0.00 C ATOM 149 CD1 LEU A 19 2.772 6.298 4.043 1.00 0.00 C ATOM 150 CD2 LEU A 19 4.285 5.232 2.498 1.00 0.00 C ATOM 0 H LEU A 19 4.682 3.677 6.871 1.00 0.00 H new ATOM 0 HA LEU A 19 5.452 3.361 4.042 1.00 0.00 H new ATOM 0 HB2 LEU A 19 4.361 5.392 5.906 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.456 6.011 4.686 1.00 0.00 H new ATOM 0 HG LEU A 19 3.199 4.127 4.044 1.00 0.00 H new ATOM 0 HD11 LEU A 19 1.977 6.236 3.300 1.00 0.00 H new ATOM 0 HD12 LEU A 19 2.336 6.307 5.042 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.343 7.214 3.888 1.00 0.00 H new ATOM 0 HD21 LEU A 19 3.484 5.161 1.762 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.775 6.202 2.408 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.013 4.440 2.320 1.00 0.00 H new ATOM 151 N MET A 20 7.574 5.225 5.050 1.00 0.00 N ATOM 152 CA MET A 20 8.897 5.877 4.936 1.00 0.00 C ATOM 153 C MET A 20 10.169 5.104 4.579 1.00 0.00 C ATOM 154 O MET A 20 11.003 5.573 3.802 1.00 0.00 O ATOM 155 CB MET A 20 8.863 6.641 6.285 1.00 0.00 C ATOM 156 CG MET A 20 7.822 7.783 6.369 1.00 0.00 C ATOM 157 SD MET A 20 7.246 7.907 8.079 1.00 0.00 S ATOM 158 CE MET A 20 6.102 6.499 8.137 1.00 0.00 C ATOM 0 H MET A 20 6.874 5.958 5.164 1.00 0.00 H new ATOM 0 HA MET A 20 9.006 6.458 4.020 1.00 0.00 H new ATOM 0 HB2 MET A 20 8.661 5.927 7.084 1.00 0.00 H new ATOM 0 HB3 MET A 20 9.852 7.058 6.473 1.00 0.00 H new ATOM 0 HG2 MET A 20 8.267 8.726 6.049 1.00 0.00 H new ATOM 0 HG3 MET A 20 6.985 7.583 5.700 1.00 0.00 H new ATOM 0 HE1 MET A 20 6.176 6.010 9.108 1.00 0.00 H new ATOM 0 HE2 MET A 20 5.082 6.852 7.985 1.00 0.00 H new ATOM 0 HE3 MET A 20 6.360 5.788 7.352 1.00 0.00 H new ATOM 159 N ASP A 21 10.160 3.855 5.018 1.00 0.00 N ATOM 160 CA ASP A 21 10.633 2.702 4.186 1.00 0.00 C ATOM 161 C ASP A 21 9.964 2.548 2.781 1.00 0.00 C ATOM 162 O ASP A 21 10.491 1.775 1.979 1.00 0.00 O ATOM 163 CB ASP A 21 10.611 1.403 5.026 1.00 0.00 C ATOM 164 CG ASP A 21 11.189 0.131 4.401 1.00 0.00 C ATOM 165 OD1 ASP A 21 12.472 0.300 3.942 1.00 0.00 O ATOM 166 OD2 ASP A 21 10.562 -0.925 4.334 1.00 0.00 O ATOM 0 H ASP A 21 9.833 3.588 5.947 1.00 0.00 H new ATOM 0 HA ASP A 21 11.663 2.931 3.914 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.153 1.595 5.952 1.00 0.00 H new ATOM 0 HB3 ASP A 21 9.575 1.200 5.299 1.00 0.00 H new ATOM 167 N PHE A 22 8.858 3.248 2.464 1.00 0.00 N ATOM 168 CA PHE A 22 8.150 3.096 1.190 1.00 0.00 C ATOM 169 C PHE A 22 7.702 4.475 0.617 1.00 0.00 C ATOM 170 O PHE A 22 7.608 4.548 -0.606 1.00 0.00 O ATOM 171 CB PHE A 22 6.988 2.128 1.409 1.00 0.00 C ATOM 172 CG PHE A 22 7.351 0.675 1.783 1.00 0.00 C ATOM 173 CD1 PHE A 22 7.433 0.337 3.146 1.00 0.00 C ATOM 174 CD2 PHE A 22 7.392 -0.360 0.839 1.00 0.00 C ATOM 175 CE1 PHE A 22 7.269 -0.977 3.558 1.00 0.00 C ATOM 176 CE2 PHE A 22 7.322 -1.685 1.256 1.00 0.00 C ATOM 177 CZ PHE A 22 7.280 -1.988 2.615 1.00 0.00 C ATOM 0 H PHE A 22 8.434 3.934 3.089 1.00 0.00 H new ATOM 0 HA PHE A 22 8.813 2.679 0.432 1.00 0.00 H new ATOM 0 HB2 PHE A 22 6.353 2.533 2.197 1.00 0.00 H new ATOM 0 HB3 PHE A 22 6.390 2.105 0.498 1.00 0.00 H new ATOM 0 HD1 PHE A 22 7.625 1.107 3.878 1.00 0.00 H new ATOM 0 HD2 PHE A 22 7.478 -0.129 -0.212 1.00 0.00 H new ATOM 0 HE1 PHE A 22 7.134 -1.208 4.604 1.00 0.00 H new ATOM 0 HE2 PHE A 22 7.300 -2.480 0.525 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.256 -3.019 2.934 1.00 0.00 H new ATOM 178 N ASN A 23 7.476 5.560 1.414 1.00 0.00 N ATOM 179 CA ASN A 23 7.215 6.943 0.871 1.00 0.00 C ATOM 180 C ASN A 23 8.201 7.391 -0.258 1.00 0.00 C ATOM 181 O ASN A 23 7.775 7.749 -1.358 1.00 0.00 O ATOM 182 CB ASN A 23 7.243 7.927 2.079 1.00 0.00 C ATOM 183 CG ASN A 23 6.970 9.412 1.827 1.00 0.00 C ATOM 184 OD1 ASN A 23 6.776 9.885 0.708 1.00 0.00 O ATOM 185 ND2 ASN A 23 6.992 10.205 2.884 1.00 0.00 N ATOM 0 H ASN A 23 7.468 5.512 2.433 1.00 0.00 H new ATOM 0 HA ASN A 23 6.241 6.942 0.381 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.512 7.576 2.808 1.00 0.00 H new ATOM 0 HB3 ASN A 23 8.224 7.847 2.547 1.00 0.00 H new ATOM 0 HD21 ASN A 23 6.848 11.209 2.772 1.00 0.00 H new ATOM 0 HD22 ASN A 23 7.153 9.813 3.812 1.00 0.00 H new ATOM 186 N ASN A 24 9.492 7.339 0.073 1.00 0.00 N ATOM 187 CA ASN A 24 10.600 7.666 -0.839 1.00 0.00 C ATOM 188 C ASN A 24 11.390 6.346 -1.028 1.00 0.00 C ATOM 189 O ASN A 24 12.313 6.033 -0.266 1.00 0.00 O ATOM 190 CB ASN A 24 11.467 8.776 -0.204 1.00 0.00 C ATOM 191 CG ASN A 24 10.900 10.200 -0.273 1.00 0.00 C ATOM 192 OD1 ASN A 24 9.754 10.451 -0.648 1.00 0.00 O ATOM 193 ND2 ASN A 24 11.705 11.176 0.108 1.00 0.00 N ATOM 0 H ASN A 24 9.808 7.063 1.003 1.00 0.00 H new ATOM 0 HA ASN A 24 10.262 8.043 -1.804 1.00 0.00 H new ATOM 0 HB2 ASN A 24 11.634 8.524 0.843 1.00 0.00 H new ATOM 0 HB3 ASN A 24 12.442 8.771 -0.692 1.00 0.00 H new ATOM 0 HD21 ASN A 24 11.378 12.142 0.092 1.00 0.00 H new ATOM 0 HD22 ASN A 24 12.653 10.963 0.418 1.00 0.00 H new ATOM 194 N TYR A 25 10.966 5.557 -2.029 1.00 0.00 N ATOM 195 CA TYR A 25 11.537 4.212 -2.285 1.00 0.00 C ATOM 196 C TYR A 25 11.303 3.902 -3.782 1.00 0.00 C ATOM 197 O TYR A 25 10.199 3.583 -4.234 1.00 0.00 O ATOM 198 CB TYR A 25 10.878 3.194 -1.343 1.00 0.00 C ATOM 199 CG TYR A 25 11.622 1.873 -1.208 1.00 0.00 C ATOM 200 CD1 TYR A 25 12.565 1.714 -0.180 1.00 0.00 C ATOM 201 CD2 TYR A 25 11.321 0.780 -2.030 1.00 0.00 C ATOM 202 CE1 TYR A 25 13.153 0.475 0.063 1.00 0.00 C ATOM 203 CE2 TYR A 25 11.879 -0.464 -1.762 1.00 0.00 C ATOM 204 CZ TYR A 25 12.780 -0.625 -0.709 1.00 0.00 C ATOM 205 OH TYR A 25 13.266 -1.861 -0.436 1.00 0.00 O ATOM 0 H TYR A 25 10.227 5.823 -2.680 1.00 0.00 H new ATOM 0 HA TYR A 25 12.607 4.164 -2.083 1.00 0.00 H new ATOM 0 HB2 TYR A 25 10.783 3.644 -0.355 1.00 0.00 H new ATOM 0 HB3 TYR A 25 9.868 2.991 -1.700 1.00 0.00 H new ATOM 0 HD1 TYR A 25 12.838 2.563 0.430 1.00 0.00 H new ATOM 0 HD2 TYR A 25 10.656 0.904 -2.872 1.00 0.00 H new ATOM 0 HE1 TYR A 25 13.892 0.367 0.843 1.00 0.00 H new ATOM 0 HE2 TYR A 25 11.613 -1.313 -2.374 1.00 0.00 H new ATOM 0 HH TYR A 25 14.178 -1.939 -0.787 1.00 0.00 H new ATOM 206 N GLY A 26 12.398 4.060 -4.516 1.00 0.00 N ATOM 207 CA GLY A 26 12.447 4.032 -5.982 1.00 0.00 C ATOM 208 C GLY A 26 11.854 5.314 -6.564 1.00 0.00 C ATOM 209 O GLY A 26 12.510 6.359 -6.609 1.00 0.00 O ATOM 0 H GLY A 26 13.314 4.217 -4.095 1.00 0.00 H new ATOM 0 HA2 GLY A 26 13.479 3.918 -6.315 1.00 0.00 H new ATOM 0 HA3 GLY A 26 11.895 3.168 -6.353 1.00 0.00 H new ATOM 210 N CYS A 27 10.573 5.188 -6.930 1.00 0.00 N ATOM 211 CA CYS A 27 9.679 6.335 -7.191 1.00 0.00 C ATOM 212 C CYS A 27 8.751 6.538 -5.979 1.00 0.00 C ATOM 213 O CYS A 27 8.905 7.518 -5.246 1.00 0.00 O ATOM 214 CB CYS A 27 8.914 6.278 -8.542 1.00 0.00 C ATOM 215 SG CYS A 27 9.877 5.372 -9.759 1.00 0.00 S ATOM 0 H CYS A 27 10.119 4.283 -7.056 1.00 0.00 H new ATOM 0 HA CYS A 27 10.312 7.214 -7.312 1.00 0.00 H new ATOM 0 HB2 CYS A 27 7.946 5.797 -8.401 1.00 0.00 H new ATOM 0 HB3 CYS A 27 8.718 7.288 -8.901 1.00 0.00 H new ATOM 216 N TYR A 28 7.825 5.593 -5.771 1.00 0.00 N ATOM 217 CA TYR A 28 6.646 5.815 -4.920 1.00 0.00 C ATOM 218 C TYR A 28 6.086 4.560 -4.223 1.00 0.00 C ATOM 219 O TYR A 28 4.912 4.196 -4.372 1.00 0.00 O ATOM 220 CB TYR A 28 5.532 6.404 -5.819 1.00 0.00 C ATOM 221 CG TYR A 28 5.127 5.678 -7.133 1.00 0.00 C ATOM 222 CD1 TYR A 28 5.233 4.280 -7.377 1.00 0.00 C ATOM 223 CD2 TYR A 28 4.737 6.488 -8.190 1.00 0.00 C ATOM 224 CE1 TYR A 28 4.958 3.742 -8.631 1.00 0.00 C ATOM 225 CE2 TYR A 28 4.468 5.949 -9.445 1.00 0.00 C ATOM 226 CZ TYR A 28 4.535 4.575 -9.654 1.00 0.00 C ATOM 227 OH TYR A 28 4.130 4.048 -10.840 1.00 0.00 O ATOM 0 H TYR A 28 7.869 4.661 -6.183 1.00 0.00 H new ATOM 0 HA TYR A 28 6.966 6.479 -4.117 1.00 0.00 H new ATOM 0 HB2 TYR A 28 4.634 6.491 -5.207 1.00 0.00 H new ATOM 0 HB3 TYR A 28 5.834 7.416 -6.088 1.00 0.00 H new ATOM 0 HD1 TYR A 28 5.533 3.624 -6.573 1.00 0.00 H new ATOM 0 HD2 TYR A 28 4.641 7.553 -8.037 1.00 0.00 H new ATOM 0 HE1 TYR A 28 5.074 2.682 -8.805 1.00 0.00 H new ATOM 0 HE2 TYR A 28 4.205 6.603 -10.263 1.00 0.00 H new ATOM 0 HH TYR A 28 4.141 4.745 -11.529 1.00 0.00 H new ATOM 228 N CYS A 29 6.919 3.921 -3.422 1.00 0.00 N ATOM 229 CA CYS A 29 6.552 2.607 -2.836 1.00 0.00 C ATOM 230 C CYS A 29 5.391 2.477 -1.807 1.00 0.00 C ATOM 231 O CYS A 29 5.086 1.376 -1.336 1.00 0.00 O ATOM 232 CB CYS A 29 7.701 1.632 -2.614 1.00 0.00 C ATOM 233 SG CYS A 29 7.159 0.052 -3.329 1.00 0.00 S ATOM 0 H CYS A 29 7.841 4.267 -3.155 1.00 0.00 H new ATOM 0 HA CYS A 29 6.007 2.263 -3.715 1.00 0.00 H new ATOM 0 HB2 CYS A 29 8.612 1.986 -3.095 1.00 0.00 H new ATOM 0 HB3 CYS A 29 7.922 1.525 -1.552 1.00 0.00 H new ATOM 234 N GLY A 30 4.727 3.581 -1.494 1.00 0.00 N ATOM 235 CA GLY A 30 3.576 3.612 -0.596 1.00 0.00 C ATOM 236 C GLY A 30 2.880 4.970 -0.680 1.00 0.00 C ATOM 237 O GLY A 30 1.681 5.002 -0.971 1.00 0.00 O ATOM 0 H GLY A 30 4.976 4.499 -1.863 1.00 0.00 H new ATOM 0 HA2 GLY A 30 2.877 2.819 -0.861 1.00 0.00 H new ATOM 0 HA3 GLY A 30 3.899 3.423 0.428 1.00 0.00 H new ATOM 238 N LEU A 31 3.604 6.082 -0.411 1.00 0.00 N ATOM 239 CA LEU A 31 3.030 7.431 -0.417 1.00 0.00 C ATOM 240 C LEU A 31 3.433 8.114 -1.690 1.00 0.00 C ATOM 241 O LEU A 31 2.626 8.354 -2.595 1.00 0.00 O ATOM 242 CB LEU A 31 3.147 8.124 0.958 1.00 0.00 C ATOM 243 CG LEU A 31 3.312 9.643 1.075 1.00 0.00 C ATOM 244 CD1 LEU A 31 2.271 10.532 0.403 1.00 0.00 C ATOM 245 CD2 LEU A 31 3.417 10.036 2.568 1.00 0.00 C ATOM 0 H LEU A 31 4.599 6.060 -0.185 1.00 0.00 H new ATOM 0 HA LEU A 31 1.942 7.455 -0.485 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.255 7.857 1.525 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.997 7.672 1.470 1.00 0.00 H new ATOM 0 HG LEU A 31 4.224 9.838 0.510 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.522 11.579 0.573 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.258 10.331 -0.668 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.287 10.322 0.823 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.534 11.116 2.652 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.511 9.728 3.090 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.279 9.541 3.015 1.00 0.00 H new ATOM 246 N GLY A 32 4.707 8.486 -1.632 1.00 0.00 N ATOM 247 CA GLY A 32 5.130 9.667 -2.382 1.00 0.00 C ATOM 248 C GLY A 32 5.261 9.547 -3.923 1.00 0.00 C ATOM 249 O GLY A 32 4.426 8.916 -4.571 1.00 0.00 O ATOM 0 H GLY A 32 5.437 8.013 -1.100 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.422 10.468 -2.169 1.00 0.00 H new ATOM 0 HA3 GLY A 32 6.096 9.983 -1.989 1.00 0.00 H new ATOM 250 N GLY A 33 6.288 10.206 -4.488 1.00 0.00 N ATOM 251 CA GLY A 33 6.719 10.072 -5.906 1.00 0.00 C ATOM 252 C GLY A 33 5.748 10.156 -7.101 1.00 0.00 C ATOM 253 O GLY A 33 4.568 10.483 -6.953 1.00 0.00 O ATOM 0 H GLY A 33 6.862 10.866 -3.963 1.00 0.00 H new ATOM 0 HA2 GLY A 33 7.476 10.839 -6.071 1.00 0.00 H new ATOM 0 HA3 GLY A 33 7.220 9.107 -5.985 1.00 0.00 H new ATOM 254 N SER A 34 6.300 9.861 -8.305 1.00 0.00 N ATOM 255 CA SER A 34 5.544 9.898 -9.590 1.00 0.00 C ATOM 256 C SER A 34 6.269 9.133 -10.749 1.00 0.00 C ATOM 257 O SER A 34 7.501 9.070 -10.806 1.00 0.00 O ATOM 258 CB SER A 34 5.282 11.370 -10.016 1.00 0.00 C ATOM 259 OG SER A 34 4.373 11.447 -11.111 1.00 0.00 O ATOM 0 H SER A 34 7.277 9.591 -8.416 1.00 0.00 H new ATOM 0 HA SER A 34 4.599 9.386 -9.410 1.00 0.00 H new ATOM 0 HB2 SER A 34 4.881 11.928 -9.170 1.00 0.00 H new ATOM 0 HB3 SER A 34 6.225 11.843 -10.291 1.00 0.00 H new ATOM 0 HG SER A 34 4.230 12.386 -11.352 1.00 0.00 H new ATOM 260 N GLY A 35 5.449 8.592 -11.674 1.00 0.00 N ATOM 261 CA GLY A 35 5.919 7.933 -12.906 1.00 0.00 C ATOM 262 C GLY A 35 5.575 6.432 -12.980 1.00 0.00 C ATOM 263 O GLY A 35 4.405 6.041 -13.006 1.00 0.00 O ATOM 0 H GLY A 35 4.433 8.602 -11.584 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.482 8.439 -13.767 1.00 0.00 H new ATOM 0 HA3 GLY A 35 7.000 8.052 -12.981 1.00 0.00 H new ATOM 264 N THR A 36 6.638 5.633 -13.062 1.00 0.00 N ATOM 265 CA THR A 36 6.613 4.154 -13.102 1.00 0.00 C ATOM 266 C THR A 36 7.851 3.641 -12.269 1.00 0.00 C ATOM 267 O THR A 36 8.835 4.373 -12.113 1.00 0.00 O ATOM 268 CB THR A 36 6.482 3.522 -14.519 1.00 0.00 C ATOM 269 OG1 THR A 36 6.441 4.477 -15.583 1.00 0.00 O ATOM 270 CG2 THR A 36 5.199 2.679 -14.592 1.00 0.00 C ATOM 0 H THR A 36 7.586 6.006 -13.105 1.00 0.00 H new ATOM 0 HA THR A 36 5.687 3.807 -12.644 1.00 0.00 H new ATOM 0 HB THR A 36 7.379 2.918 -14.656 1.00 0.00 H new ATOM 0 HG1 THR A 36 6.360 4.009 -16.440 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.110 2.238 -15.585 1.00 0.00 H new ATOM 0 HG22 THR A 36 5.241 1.886 -13.845 1.00 0.00 H new ATOM 0 HG23 THR A 36 4.335 3.314 -14.398 1.00 0.00 H new ATOM 271 N PRO A 37 7.852 2.416 -11.701 1.00 0.00 N ATOM 272 CA PRO A 37 8.712 2.059 -10.536 1.00 0.00 C ATOM 273 C PRO A 37 10.143 1.580 -10.847 1.00 0.00 C ATOM 274 O PRO A 37 10.694 1.845 -11.919 1.00 0.00 O ATOM 275 CB PRO A 37 7.789 0.929 -9.989 1.00 0.00 C ATOM 276 CG PRO A 37 7.449 0.117 -11.245 1.00 0.00 C ATOM 277 CD PRO A 37 7.014 1.279 -12.144 1.00 0.00 C ATOM 0 HA PRO A 37 8.963 2.890 -9.877 1.00 0.00 H new ATOM 0 HB2 PRO A 37 8.297 0.320 -9.241 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.894 1.333 -9.516 1.00 0.00 H new ATOM 0 HG2 PRO A 37 8.305 -0.430 -11.642 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.655 -0.611 -11.078 1.00 0.00 H new ATOM 0 HD2 PRO A 37 7.178 1.050 -13.197 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.953 1.497 -12.027 1.00 0.00 H new ATOM 278 N VAL A 38 10.708 0.843 -9.873 1.00 0.00 N ATOM 279 CA VAL A 38 12.052 0.252 -9.944 1.00 0.00 C ATOM 280 C VAL A 38 12.037 -1.266 -9.543 1.00 0.00 C ATOM 281 O VAL A 38 12.417 -2.148 -10.314 1.00 0.00 O ATOM 282 CB VAL A 38 13.104 1.087 -9.122 1.00 0.00 C ATOM 283 CG1 VAL A 38 12.948 2.612 -9.267 1.00 0.00 C ATOM 284 CG2 VAL A 38 13.173 0.880 -7.582 1.00 0.00 C ATOM 0 H VAL A 38 10.230 0.639 -8.996 1.00 0.00 H new ATOM 0 HA VAL A 38 12.374 0.295 -10.984 1.00 0.00 H new ATOM 0 HB VAL A 38 14.003 0.681 -9.586 1.00 0.00 H new ATOM 0 HG11 VAL A 38 13.710 3.114 -8.670 1.00 0.00 H new ATOM 0 HG12 VAL A 38 13.064 2.892 -10.314 1.00 0.00 H new ATOM 0 HG13 VAL A 38 11.959 2.911 -8.919 1.00 0.00 H new ATOM 0 HG21 VAL A 38 13.945 1.525 -7.162 1.00 0.00 H new ATOM 0 HG22 VAL A 38 12.210 1.131 -7.138 1.00 0.00 H new ATOM 0 HG23 VAL A 38 13.413 -0.161 -7.365 1.00 0.00 H new ATOM 285 N ASP A 39 11.594 -1.462 -8.301 1.00 0.00 N ATOM 286 CA ASP A 39 11.576 -2.754 -7.584 1.00 0.00 C ATOM 287 C ASP A 39 10.348 -3.582 -7.920 1.00 0.00 C ATOM 288 O ASP A 39 9.329 -3.025 -8.328 1.00 0.00 O ATOM 289 CB ASP A 39 11.792 -2.518 -6.060 1.00 0.00 C ATOM 290 CG ASP A 39 12.619 -3.640 -5.406 1.00 0.00 C ATOM 291 OD1 ASP A 39 13.847 -3.650 -5.390 1.00 0.00 O ATOM 292 OD2 ASP A 39 11.841 -4.642 -4.898 1.00 0.00 O ATOM 0 H ASP A 39 11.221 -0.699 -7.737 1.00 0.00 H new ATOM 0 HA ASP A 39 12.411 -3.364 -7.929 1.00 0.00 H new ATOM 0 HB2 ASP A 39 12.297 -1.563 -5.910 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.824 -2.448 -5.565 1.00 0.00 H new ATOM 293 N GLU A 40 10.428 -4.921 -7.693 1.00 0.00 N ATOM 294 CA GLU A 40 9.199 -5.751 -7.540 1.00 0.00 C ATOM 295 C GLU A 40 8.171 -5.107 -6.550 1.00 0.00 C ATOM 296 O GLU A 40 6.970 -5.070 -6.809 1.00 0.00 O ATOM 297 CB GLU A 40 9.478 -7.147 -6.961 1.00 0.00 C ATOM 298 CG GLU A 40 8.419 -8.200 -7.273 1.00 0.00 C ATOM 299 CD GLU A 40 7.260 -8.448 -6.322 1.00 0.00 C ATOM 300 OE1 GLU A 40 6.381 -7.626 -6.067 1.00 0.00 O ATOM 301 OE2 GLU A 40 7.281 -9.720 -5.806 1.00 0.00 O ATOM 0 H GLU A 40 11.304 -5.438 -7.613 1.00 0.00 H new ATOM 0 HA GLU A 40 8.808 -5.818 -8.555 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.438 -7.496 -7.341 1.00 0.00 H new ATOM 0 HB3 GLU A 40 9.576 -7.062 -5.879 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.989 -7.943 -8.241 1.00 0.00 H new ATOM 0 HG3 GLU A 40 8.939 -9.150 -7.397 1.00 0.00 H new ATOM 302 N LEU A 41 8.721 -4.594 -5.436 1.00 0.00 N ATOM 303 CA LEU A 41 7.989 -3.812 -4.453 1.00 0.00 C ATOM 304 C LEU A 41 7.265 -2.602 -5.017 1.00 0.00 C ATOM 305 O LEU A 41 6.056 -2.455 -4.848 1.00 0.00 O ATOM 306 CB LEU A 41 8.884 -3.319 -3.289 1.00 0.00 C ATOM 307 CG LEU A 41 9.647 -4.429 -2.555 1.00 0.00 C ATOM 308 CD1 LEU A 41 10.766 -3.765 -1.771 1.00 0.00 C ATOM 309 CD2 LEU A 41 8.528 -5.198 -1.887 1.00 0.00 C ATOM 0 H LEU A 41 9.705 -4.720 -5.199 1.00 0.00 H new ATOM 0 HA LEU A 41 7.246 -4.521 -4.089 1.00 0.00 H new ATOM 0 HB2 LEU A 41 9.603 -2.600 -3.681 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.261 -2.787 -2.569 1.00 0.00 H new ATOM 0 HG LEU A 41 10.220 -5.176 -3.104 1.00 0.00 H new ATOM 0 HD11 LEU A 41 11.334 -4.524 -1.233 1.00 0.00 H new ATOM 0 HD12 LEU A 41 11.427 -3.236 -2.458 1.00 0.00 H new ATOM 0 HD13 LEU A 41 10.341 -3.058 -1.059 1.00 0.00 H new ATOM 0 HD21 LEU A 41 8.946 -6.031 -1.321 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.985 -4.537 -1.212 1.00 0.00 H new ATOM 0 HD23 LEU A 41 7.846 -5.581 -2.646 1.00 0.00 H new ATOM 310 N ASP A 42 8.066 -1.781 -5.711 1.00 0.00 N ATOM 311 CA ASP A 42 7.599 -0.633 -6.479 1.00 0.00 C ATOM 312 C ASP A 42 6.598 -0.957 -7.609 1.00 0.00 C ATOM 313 O ASP A 42 5.813 -0.082 -7.960 1.00 0.00 O ATOM 314 CB ASP A 42 8.840 0.222 -6.755 1.00 0.00 C ATOM 315 CG ASP A 42 8.632 1.730 -6.807 1.00 0.00 C ATOM 316 OD1 ASP A 42 7.661 2.315 -6.333 1.00 0.00 O ATOM 317 OD2 ASP A 42 9.684 2.361 -7.408 1.00 0.00 O ATOM 0 H ASP A 42 9.078 -1.905 -5.751 1.00 0.00 H new ATOM 0 HA ASP A 42 6.905 -0.001 -5.925 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.580 0.007 -5.984 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.268 -0.096 -7.706 1.00 0.00 H new ATOM 318 N ARG A 43 6.547 -2.206 -8.104 1.00 0.00 N ATOM 319 CA ARG A 43 5.465 -2.697 -8.968 1.00 0.00 C ATOM 320 C ARG A 43 4.148 -2.907 -8.174 1.00 0.00 C ATOM 321 O ARG A 43 3.116 -2.482 -8.702 1.00 0.00 O ATOM 322 CB ARG A 43 5.706 -4.102 -9.566 1.00 0.00 C ATOM 323 CG ARG A 43 7.054 -4.433 -10.134 1.00 0.00 C ATOM 324 CD ARG A 43 7.693 -3.446 -11.063 1.00 0.00 C ATOM 325 NE ARG A 43 6.774 -3.107 -12.144 1.00 0.00 N ATOM 326 CZ ARG A 43 7.163 -2.774 -13.395 1.00 0.00 C ATOM 327 NH1 ARG A 43 8.432 -2.617 -13.769 1.00 0.00 N ATOM 328 NH2 ARG A 43 6.233 -2.599 -14.312 1.00 0.00 N ATOM 0 H ARG A 43 7.263 -2.907 -7.913 1.00 0.00 H new ATOM 0 HA ARG A 43 5.418 -1.929 -9.740 1.00 0.00 H new ATOM 0 HB2 ARG A 43 5.490 -4.832 -8.786 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.971 -4.253 -10.356 1.00 0.00 H new ATOM 0 HG2 ARG A 43 7.736 -4.595 -9.299 1.00 0.00 H new ATOM 0 HG3 ARG A 43 6.968 -5.382 -10.664 1.00 0.00 H new ATOM 0 HD2 ARG A 43 7.970 -2.545 -10.515 1.00 0.00 H new ATOM 0 HD3 ARG A 43 8.612 -3.864 -11.474 1.00 0.00 H new ATOM 0 HE ARG A 43 5.774 -3.122 -11.943 1.00 0.00 H new ATOM 0 HH11 ARG A 43 9.183 -2.749 -13.092 1.00 0.00 H new ATOM 0 HH12 ARG A 43 8.652 -2.365 -14.732 1.00 0.00 H new ATOM 0 HH21 ARG A 43 5.249 -2.715 -14.069 1.00 0.00 H new ATOM 0 HH22 ARG A 43 6.497 -2.347 -15.265 1.00 0.00 H new ATOM 329 N CYS A 44 4.134 -3.560 -6.951 1.00 0.00 N ATOM 330 CA CYS A 44 2.884 -3.505 -6.150 1.00 0.00 C ATOM 331 C CYS A 44 2.536 -2.074 -5.597 1.00 0.00 C ATOM 332 O CYS A 44 1.474 -1.932 -5.006 1.00 0.00 O ATOM 333 CB CYS A 44 2.952 -4.483 -4.993 1.00 0.00 C ATOM 334 SG CYS A 44 3.232 -6.181 -5.496 1.00 0.00 S ATOM 0 H CYS A 44 4.909 -4.082 -6.542 1.00 0.00 H new ATOM 0 HA CYS A 44 2.086 -3.778 -6.840 1.00 0.00 H new ATOM 0 HB2 CYS A 44 3.751 -4.177 -4.318 1.00 0.00 H new ATOM 0 HB3 CYS A 44 2.021 -4.430 -4.429 1.00 0.00 H new ATOM 335 N CYS A 45 3.429 -1.090 -5.789 1.00 0.00 N ATOM 336 CA CYS A 45 3.207 0.329 -5.574 1.00 0.00 C ATOM 337 C CYS A 45 2.740 1.096 -6.838 1.00 0.00 C ATOM 338 O CYS A 45 2.018 2.073 -6.616 1.00 0.00 O ATOM 339 CB CYS A 45 4.495 0.940 -5.035 1.00 0.00 C ATOM 340 SG CYS A 45 5.147 -0.035 -3.644 1.00 0.00 S ATOM 0 H CYS A 45 4.375 -1.286 -6.117 1.00 0.00 H new ATOM 0 HA CYS A 45 2.390 0.425 -4.859 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.239 0.989 -5.830 1.00 0.00 H new ATOM 0 HB3 CYS A 45 4.308 1.964 -4.710 1.00 0.00 H new ATOM 341 N GLU A 46 3.077 0.746 -8.136 1.00 0.00 N ATOM 342 CA GLU A 46 2.284 1.309 -9.274 1.00 0.00 C ATOM 343 C GLU A 46 0.788 0.858 -9.228 1.00 0.00 C ATOM 344 O GLU A 46 -0.075 1.626 -9.632 1.00 0.00 O ATOM 345 CB GLU A 46 2.925 1.084 -10.659 1.00 0.00 C ATOM 346 CG GLU A 46 2.845 -0.316 -11.276 1.00 0.00 C ATOM 347 CD GLU A 46 3.240 -0.306 -12.747 1.00 0.00 C ATOM 348 OE1 GLU A 46 2.445 -0.099 -13.663 1.00 0.00 O ATOM 349 OE2 GLU A 46 4.573 -0.548 -12.922 1.00 0.00 O ATOM 0 H GLU A 46 3.839 0.121 -8.397 1.00 0.00 H new ATOM 0 HA GLU A 46 2.300 2.389 -9.130 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.463 1.782 -11.357 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.978 1.356 -10.586 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.500 -0.993 -10.728 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.830 -0.701 -11.174 1.00 0.00 H new ATOM 350 N THR A 47 0.547 -0.358 -8.718 1.00 0.00 N ATOM 351 CA THR A 47 -0.778 -0.917 -8.414 1.00 0.00 C ATOM 352 C THR A 47 -1.284 -0.612 -6.966 1.00 0.00 C ATOM 353 O THR A 47 -2.475 -0.804 -6.746 1.00 0.00 O ATOM 354 CB THR A 47 -0.602 -2.441 -8.696 1.00 0.00 C ATOM 355 OG1 THR A 47 -0.415 -2.650 -10.098 1.00 0.00 O ATOM 356 CG2 THR A 47 -1.752 -3.343 -8.272 1.00 0.00 C ATOM 0 H THR A 47 1.302 -1.007 -8.497 1.00 0.00 H new ATOM 0 HA THR A 47 -1.559 -0.463 -9.023 1.00 0.00 H new ATOM 0 HB THR A 47 0.259 -2.719 -8.088 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.303 -3.608 -10.274 1.00 0.00 H new ATOM 0 HG21 THR A 47 -1.513 -4.377 -8.520 1.00 0.00 H new ATOM 0 HG22 THR A 47 -1.907 -3.254 -7.197 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.660 -3.045 -8.796 1.00 0.00 H new ATOM 357 N HIS A 48 -0.486 -0.153 -5.979 1.00 0.00 N ATOM 358 CA HIS A 48 -1.064 0.540 -4.773 1.00 0.00 C ATOM 359 C HIS A 48 -1.095 2.078 -5.110 1.00 0.00 C ATOM 360 O HIS A 48 -0.367 2.911 -4.568 1.00 0.00 O ATOM 361 CB HIS A 48 -0.371 0.153 -3.451 1.00 0.00 C ATOM 362 CG HIS A 48 -1.389 0.113 -2.278 1.00 0.00 C ATOM 363 ND1 HIS A 48 -1.444 1.101 -1.296 1.00 0.00 N ATOM 364 CD2 HIS A 48 -2.425 -0.839 -2.065 1.00 0.00 C ATOM 365 CE1 HIS A 48 -2.524 0.652 -0.599 1.00 0.00 C ATOM 366 NE2 HIS A 48 -3.240 -0.400 -1.060 1.00 0.00 N ATOM 0 H HIS A 48 0.530 -0.238 -5.976 1.00 0.00 H new ATOM 0 HA HIS A 48 -2.083 0.207 -4.576 1.00 0.00 H new ATOM 0 HB2 HIS A 48 0.104 -0.822 -3.558 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.419 0.870 -3.227 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -0.851 1.917 -1.145 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.548 -1.763 -2.611 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -2.810 1.136 0.323 1.00 0.00 H new ATOM 367 N ASP A 49 -1.990 2.333 -6.073 1.00 0.00 N ATOM 368 CA ASP A 49 -2.162 3.545 -6.880 1.00 0.00 C ATOM 369 C ASP A 49 -3.182 3.047 -7.995 1.00 0.00 C ATOM 370 O ASP A 49 -4.268 3.612 -8.051 1.00 0.00 O ATOM 371 CB ASP A 49 -0.883 4.013 -7.585 1.00 0.00 C ATOM 372 CG ASP A 49 -0.032 5.056 -6.894 1.00 0.00 C ATOM 373 OD1 ASP A 49 -0.469 5.888 -6.099 1.00 0.00 O ATOM 374 OD2 ASP A 49 1.283 4.971 -7.275 1.00 0.00 O ATOM 0 H ASP A 49 -2.678 1.626 -6.331 1.00 0.00 H new ATOM 0 HA ASP A 49 -2.475 4.388 -6.264 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -0.259 3.137 -7.762 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -1.165 4.406 -8.562 1.00 0.00 H new ATOM 375 N ASN A 50 -2.837 2.022 -8.832 1.00 0.00 N ATOM 376 CA ASN A 50 -3.718 1.498 -9.906 1.00 0.00 C ATOM 377 C ASN A 50 -4.815 0.489 -9.481 1.00 0.00 C ATOM 378 O ASN A 50 -5.887 0.486 -10.091 1.00 0.00 O ATOM 379 CB ASN A 50 -2.986 1.058 -11.192 1.00 0.00 C ATOM 380 CG ASN A 50 -2.147 2.142 -11.887 1.00 0.00 C ATOM 381 OD1 ASN A 50 -2.504 3.317 -11.938 1.00 0.00 O ATOM 382 ND2 ASN A 50 -0.998 1.782 -12.430 1.00 0.00 N ATOM 0 H ASN A 50 -1.939 1.541 -8.775 1.00 0.00 H new ATOM 0 HA ASN A 50 -4.275 2.400 -10.161 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -2.333 0.220 -10.947 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -3.727 0.688 -11.901 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.411 2.478 -12.889 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -0.698 0.808 -12.390 1.00 0.00 H new ATOM 383 N CYS A 51 -4.567 -0.367 -8.487 1.00 0.00 N ATOM 384 CA CYS A 51 -5.656 -0.901 -7.644 1.00 0.00 C ATOM 385 C CYS A 51 -5.871 -0.060 -6.349 1.00 0.00 C ATOM 386 O CYS A 51 -6.555 -0.598 -5.477 1.00 0.00 O ATOM 387 CB CYS A 51 -5.512 -2.413 -7.365 1.00 0.00 C ATOM 388 SG CYS A 51 -4.381 -2.945 -6.060 1.00 0.00 S ATOM 0 H CYS A 51 -3.636 -0.706 -8.243 1.00 0.00 H new ATOM 0 HA CYS A 51 -6.572 -0.798 -8.226 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -6.502 -2.801 -7.125 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -5.198 -2.893 -8.292 1.00 0.00 H new ATOM 389 N TYR A 52 -5.355 1.201 -6.153 1.00 0.00 N ATOM 390 CA TYR A 52 -5.721 1.972 -4.908 1.00 0.00 C ATOM 391 C TYR A 52 -6.922 2.887 -5.171 1.00 0.00 C ATOM 392 O TYR A 52 -7.897 2.874 -4.413 1.00 0.00 O ATOM 393 CB TYR A 52 -4.601 2.737 -4.186 1.00 0.00 C ATOM 394 CG TYR A 52 -4.760 2.998 -2.682 1.00 0.00 C ATOM 395 CD1 TYR A 52 -5.830 2.474 -1.943 1.00 0.00 C ATOM 396 CD2 TYR A 52 -3.722 3.649 -1.989 1.00 0.00 C ATOM 397 CE1 TYR A 52 -5.806 2.501 -0.565 1.00 0.00 C ATOM 398 CE2 TYR A 52 -3.737 3.719 -0.592 1.00 0.00 C ATOM 399 CZ TYR A 52 -4.774 3.114 0.116 1.00 0.00 C ATOM 400 OH TYR A 52 -4.729 2.990 1.462 1.00 0.00 O ATOM 0 H TYR A 52 -4.724 1.681 -6.795 1.00 0.00 H new ATOM 0 HA TYR A 52 -5.974 1.184 -4.198 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -3.672 2.186 -4.333 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.482 3.701 -4.681 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.678 2.046 -2.457 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -2.908 4.098 -2.540 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -6.607 2.035 -0.010 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -2.950 4.239 -0.065 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.643 2.043 1.701 1.00 0.00 H new ATOM 401 N ARG A 53 -6.824 3.669 -6.252 1.00 0.00 N ATOM 402 CA ARG A 53 -7.943 4.369 -6.857 1.00 0.00 C ATOM 403 C ARG A 53 -9.289 3.611 -6.932 1.00 0.00 C ATOM 404 O ARG A 53 -10.321 4.198 -6.625 1.00 0.00 O ATOM 405 CB ARG A 53 -7.334 4.923 -8.164 1.00 0.00 C ATOM 406 CG ARG A 53 -7.917 4.328 -9.401 1.00 0.00 C ATOM 407 CD ARG A 53 -7.222 3.125 -9.923 1.00 0.00 C ATOM 408 NE ARG A 53 -6.607 3.374 -11.233 1.00 0.00 N ATOM 409 CZ ARG A 53 -5.646 4.261 -11.556 1.00 0.00 C ATOM 410 NH1 ARG A 53 -5.035 5.062 -10.693 1.00 0.00 N ATOM 411 NH2 ARG A 53 -5.295 4.341 -12.824 1.00 0.00 N ATOM 0 H ARG A 53 -5.940 3.831 -6.735 1.00 0.00 H new ATOM 0 HA ARG A 53 -8.329 5.173 -6.231 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -7.476 6.003 -8.190 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -6.259 4.743 -8.158 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.957 4.067 -9.202 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -7.923 5.089 -10.181 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -6.454 2.813 -9.215 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -7.932 2.302 -10.006 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.954 2.799 -12.001 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -5.285 5.032 -9.705 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -4.315 5.708 -11.018 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -5.747 3.744 -13.517 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -4.571 4.999 -13.112 1.00 0.00 H new ATOM 412 N ASP A 54 -9.183 2.369 -7.428 1.00 0.00 N ATOM 413 CA ASP A 54 -10.261 1.576 -8.068 1.00 0.00 C ATOM 414 C ASP A 54 -11.681 1.439 -7.454 1.00 0.00 C ATOM 415 O ASP A 54 -12.670 1.172 -8.133 1.00 0.00 O ATOM 416 CB ASP A 54 -9.643 0.210 -8.397 1.00 0.00 C ATOM 417 CG ASP A 54 -9.154 -0.680 -7.271 1.00 0.00 C ATOM 418 OD1 ASP A 54 -9.042 -0.304 -6.105 1.00 0.00 O ATOM 419 OD2 ASP A 54 -8.874 -1.949 -7.704 1.00 0.00 O ATOM 0 H ASP A 54 -8.301 1.858 -7.395 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.559 2.191 -8.917 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -10.384 -0.356 -8.962 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -8.799 0.386 -9.064 1.00 0.00 H new ATOM 420 N ALA A 55 -11.660 1.676 -6.149 1.00 0.00 N ATOM 421 CA ALA A 55 -12.774 2.165 -5.316 1.00 0.00 C ATOM 422 C ALA A 55 -13.747 3.193 -5.948 1.00 0.00 C ATOM 423 O ALA A 55 -14.942 3.170 -5.653 1.00 0.00 O ATOM 424 CB ALA A 55 -12.083 2.906 -4.133 1.00 0.00 C ATOM 0 H ALA A 55 -10.814 1.525 -5.599 1.00 0.00 H new ATOM 0 HA ALA A 55 -13.390 1.295 -5.086 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -12.842 3.304 -3.460 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -11.446 2.209 -3.589 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -11.477 3.725 -4.521 1.00 0.00 H new ATOM 425 N LYS A 56 -13.201 4.087 -6.784 1.00 0.00 N ATOM 426 CA LYS A 56 -13.932 5.056 -7.589 1.00 0.00 C ATOM 427 C LYS A 56 -15.106 4.561 -8.475 1.00 0.00 C ATOM 428 O LYS A 56 -16.177 5.155 -8.575 1.00 0.00 O ATOM 429 CB LYS A 56 -12.858 5.976 -8.198 1.00 0.00 C ATOM 430 CG LYS A 56 -12.513 5.650 -9.629 1.00 0.00 C ATOM 431 CD LYS A 56 -11.662 4.416 -9.790 1.00 0.00 C ATOM 432 CE LYS A 56 -10.839 4.201 -11.074 1.00 0.00 C ATOM 433 NZ LYS A 56 -10.225 5.394 -11.693 1.00 0.00 N ATOM 0 H LYS A 56 -12.192 4.151 -6.918 1.00 0.00 H new ATOM 0 HA LYS A 56 -14.603 5.642 -6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -13.205 7.008 -8.144 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -11.954 5.912 -7.593 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.436 5.518 -10.193 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -11.990 6.499 -10.068 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -10.965 4.393 -8.952 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -12.320 3.554 -9.680 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -10.044 3.490 -10.850 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -11.486 3.732 -11.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -9.542 5.096 -12.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -10.965 5.977 -12.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -9.735 5.950 -10.964 1.00 0.00 H new ATOM 434 N ASN A 57 -14.747 3.459 -9.115 1.00 0.00 N ATOM 435 CA ASN A 57 -15.470 2.713 -10.153 1.00 0.00 C ATOM 436 C ASN A 57 -16.285 1.579 -9.503 1.00 0.00 C ATOM 437 O ASN A 57 -17.515 1.628 -9.522 1.00 0.00 O ATOM 438 CB ASN A 57 -14.321 2.284 -11.121 1.00 0.00 C ATOM 439 CG ASN A 57 -14.652 1.319 -12.246 1.00 0.00 C ATOM 440 OD1 ASN A 57 -15.745 1.317 -12.814 1.00 0.00 O ATOM 441 ND2 ASN A 57 -13.688 0.496 -12.621 1.00 0.00 N ATOM 0 H ASN A 57 -13.854 3.014 -8.905 1.00 0.00 H new ATOM 0 HA ASN A 57 -16.231 3.261 -10.708 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -13.908 3.188 -11.569 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -13.530 1.836 -10.520 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -13.843 -0.154 -13.392 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -12.789 0.511 -12.140 1.00 0.00 H new ATOM 442 N LEU A 58 -15.560 0.593 -8.936 1.00 0.00 N ATOM 443 CA LEU A 58 -16.114 -0.523 -8.136 1.00 0.00 C ATOM 444 C LEU A 58 -17.237 -1.379 -8.708 1.00 0.00 C ATOM 445 O LEU A 58 -17.921 -1.063 -9.684 1.00 0.00 O ATOM 446 CB LEU A 58 -16.154 -0.014 -6.697 1.00 0.00 C ATOM 447 CG LEU A 58 -16.237 -0.909 -5.473 1.00 0.00 C ATOM 448 CD1 LEU A 58 -15.228 -2.011 -5.552 1.00 0.00 C ATOM 449 CD2 LEU A 58 -15.928 -0.084 -4.215 1.00 0.00 C ATOM 0 H LEU A 58 -14.545 0.548 -9.023 1.00 0.00 H new ATOM 0 HA LEU A 58 -15.466 -1.398 -8.180 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -15.259 0.595 -6.566 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -17.009 0.659 -6.638 1.00 0.00 H new ATOM 0 HG LEU A 58 -17.241 -1.330 -5.430 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -15.306 -2.640 -4.665 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -15.416 -2.613 -6.441 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -14.227 -1.584 -5.608 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -15.987 -0.725 -3.336 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -14.925 0.335 -4.292 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -16.653 0.725 -4.123 1.00 0.00 H new ATOM 450 N ASP A 59 -17.370 -2.535 -8.059 1.00 0.00 N ATOM 451 CA ASP A 59 -18.551 -3.410 -8.170 1.00 0.00 C ATOM 452 C ASP A 59 -19.816 -2.780 -7.499 1.00 0.00 C ATOM 453 O ASP A 59 -20.941 -3.149 -7.844 1.00 0.00 O ATOM 454 CB ASP A 59 -18.145 -4.627 -7.269 1.00 0.00 C ATOM 455 CG ASP A 59 -18.978 -5.884 -7.474 1.00 0.00 C ATOM 456 OD1 ASP A 59 -18.777 -6.687 -8.384 1.00 0.00 O ATOM 457 OD2 ASP A 59 -19.968 -6.009 -6.533 1.00 0.00 O ATOM 0 H ASP A 59 -16.654 -2.901 -7.431 1.00 0.00 H new ATOM 0 HA ASP A 59 -18.794 -3.622 -9.211 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -17.099 -4.867 -7.459 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -18.219 -4.327 -6.224 1.00 0.00 H new ATOM 458 N SER A 60 -19.587 -1.924 -6.491 1.00 0.00 N ATOM 459 CA SER A 60 -20.579 -1.478 -5.537 1.00 0.00 C ATOM 460 C SER A 60 -20.486 0.043 -5.439 1.00 0.00 C ATOM 461 O SER A 60 -21.538 0.635 -5.175 1.00 0.00 O ATOM 462 CB SER A 60 -20.178 -2.167 -4.207 1.00 0.00 C ATOM 463 OG SER A 60 -21.282 -2.271 -3.321 1.00 0.00 O ATOM 0 H SER A 60 -18.667 -1.516 -6.324 1.00 0.00 H new ATOM 0 HA SER A 60 -21.606 -1.727 -5.805 1.00 0.00 H new ATOM 0 HB2 SER A 60 -19.783 -3.161 -4.416 1.00 0.00 H new ATOM 0 HB3 SER A 60 -19.379 -1.600 -3.729 1.00 0.00 H new ATOM 0 HG SER A 60 -20.997 -2.711 -2.493 1.00 0.00 H new ATOM 464 N CYS A 61 -19.278 0.687 -5.623 1.00 0.00 N ATOM 465 CA CYS A 61 -19.178 2.119 -5.287 1.00 0.00 C ATOM 466 C CYS A 61 -18.704 2.974 -6.471 1.00 0.00 C ATOM 467 O CYS A 61 -17.510 3.132 -6.730 1.00 0.00 O ATOM 468 CB CYS A 61 -18.339 2.192 -4.014 1.00 0.00 C ATOM 469 SG CYS A 61 -18.971 1.002 -2.774 1.00 0.00 S ATOM 0 H CYS A 61 -18.426 0.254 -5.979 1.00 0.00 H new ATOM 0 HA CYS A 61 -20.150 2.570 -5.084 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -17.297 1.971 -4.243 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -18.369 3.203 -3.607 1.00 0.00 H new ATOM 470 N LYS A 62 -19.693 3.531 -7.182 1.00 0.00 N ATOM 471 CA LYS A 62 -19.483 4.303 -8.426 1.00 0.00 C ATOM 472 C LYS A 62 -19.324 5.856 -8.262 1.00 0.00 C ATOM 473 O LYS A 62 -18.720 6.459 -9.153 1.00 0.00 O ATOM 474 CB LYS A 62 -20.683 4.056 -9.392 1.00 0.00 C ATOM 475 CG LYS A 62 -20.798 2.680 -10.073 1.00 0.00 C ATOM 476 CD LYS A 62 -21.171 1.500 -9.168 1.00 0.00 C ATOM 477 CE LYS A 62 -21.721 0.264 -9.908 1.00 0.00 C ATOM 478 NZ LYS A 62 -20.745 -0.408 -10.787 1.00 0.00 N ATOM 0 H LYS A 62 -20.674 3.461 -6.912 1.00 0.00 H new ATOM 0 HA LYS A 62 -18.530 3.939 -8.810 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -21.602 4.228 -8.832 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -20.641 4.813 -10.175 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -21.544 2.752 -10.865 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -19.845 2.455 -10.552 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -20.289 1.203 -8.600 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -21.916 1.835 -8.447 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -22.082 -0.454 -9.171 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -22.581 0.567 -10.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -21.130 -1.323 -11.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -20.558 0.189 -11.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -19.859 -0.564 -10.266 1.00 0.00 H new ATOM 479 N PHE A 63 -19.860 6.482 -7.195 1.00 0.00 N ATOM 480 CA PHE A 63 -19.966 7.961 -7.084 1.00 0.00 C ATOM 481 C PHE A 63 -19.109 8.539 -5.931 1.00 0.00 C ATOM 482 O PHE A 63 -17.895 8.673 -6.110 1.00 0.00 O ATOM 483 CB PHE A 63 -21.443 8.409 -7.265 1.00 0.00 C ATOM 484 CG PHE A 63 -22.463 8.169 -6.147 1.00 0.00 C ATOM 485 CD1 PHE A 63 -22.620 6.919 -5.518 1.00 0.00 C ATOM 486 CD2 PHE A 63 -23.211 9.251 -5.669 1.00 0.00 C ATOM 487 CE1 PHE A 63 -23.431 6.785 -4.391 1.00 0.00 C ATOM 488 CE2 PHE A 63 -24.033 9.113 -4.549 1.00 0.00 C ATOM 489 CZ PHE A 63 -24.127 7.885 -3.899 1.00 0.00 C ATOM 0 H PHE A 63 -20.232 5.984 -6.386 1.00 0.00 H new ATOM 0 HA PHE A 63 -19.475 8.463 -7.918 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -21.433 9.480 -7.470 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -21.823 7.917 -8.160 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -22.107 6.054 -5.912 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -23.152 10.204 -6.173 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -23.519 5.827 -3.900 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -24.597 9.960 -4.186 1.00 0.00 H new ATOM 0 HZ PHE A 63 -24.739 7.787 -3.015 1.00 0.00 H new ATOM 490 N LEU A 64 -19.704 8.863 -4.773 1.00 0.00 N ATOM 491 CA LEU A 64 -19.035 9.563 -3.658 1.00 0.00 C ATOM 492 C LEU A 64 -17.908 8.852 -2.879 1.00 0.00 C ATOM 493 O LEU A 64 -17.623 7.666 -3.057 1.00 0.00 O ATOM 494 CB LEU A 64 -20.179 9.910 -2.649 1.00 0.00 C ATOM 495 CG LEU A 64 -21.102 11.045 -3.156 1.00 0.00 C ATOM 496 CD1 LEU A 64 -22.243 11.151 -2.161 1.00 0.00 C ATOM 497 CD2 LEU A 64 -20.391 12.401 -3.276 1.00 0.00 C ATOM 0 H LEU A 64 -20.681 8.643 -4.579 1.00 0.00 H new ATOM 0 HA LEU A 64 -18.504 10.396 -4.119 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -20.777 9.018 -2.463 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -19.740 10.204 -1.696 1.00 0.00 H new ATOM 0 HG LEU A 64 -21.444 10.801 -4.162 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -22.926 11.941 -2.473 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -22.779 10.203 -2.120 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -21.844 11.386 -1.174 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -21.096 13.151 -3.636 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -20.011 12.700 -2.299 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -19.561 12.316 -3.978 1.00 0.00 H new ATOM 498 N VAL A 65 -17.325 9.668 -1.982 1.00 0.00 N ATOM 499 CA VAL A 65 -16.675 9.227 -0.732 1.00 0.00 C ATOM 500 C VAL A 65 -15.162 8.982 -0.782 1.00 0.00 C ATOM 501 O VAL A 65 -14.416 9.597 -0.012 1.00 0.00 O ATOM 502 CB VAL A 65 -17.466 8.267 0.214 1.00 0.00 C ATOM 503 CG1 VAL A 65 -18.928 8.681 0.467 1.00 0.00 C ATOM 504 CG2 VAL A 65 -17.450 6.767 -0.104 1.00 0.00 C ATOM 0 H VAL A 65 -17.292 10.680 -2.109 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.755 10.169 -0.189 1.00 0.00 H new ATOM 0 HB VAL A 65 -16.866 8.399 1.114 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -19.400 7.959 1.133 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -18.952 9.669 0.927 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -19.468 8.708 -0.480 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -18.041 6.231 0.639 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -17.874 6.600 -1.094 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -16.423 6.402 -0.083 1.00 0.00 H new ATOM 505 N ASP A 66 -14.733 8.081 -1.669 1.00 0.00 N ATOM 506 CA ASP A 66 -13.324 7.662 -1.745 1.00 0.00 C ATOM 507 C ASP A 66 -12.356 8.713 -2.340 1.00 0.00 C ATOM 508 O ASP A 66 -12.347 8.997 -3.542 1.00 0.00 O ATOM 509 CB ASP A 66 -13.119 6.295 -2.447 1.00 0.00 C ATOM 510 CG ASP A 66 -13.638 6.151 -3.869 1.00 0.00 C ATOM 511 OD1 ASP A 66 -14.797 5.840 -4.140 1.00 0.00 O ATOM 512 OD2 ASP A 66 -12.666 6.416 -4.800 1.00 0.00 O ATOM 0 H ASP A 66 -15.341 7.624 -2.349 1.00 0.00 H new ATOM 0 HA ASP A 66 -13.057 7.552 -0.694 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -12.051 6.078 -2.455 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -13.595 5.528 -1.836 1.00 0.00 H new ATOM 513 N ASN A 67 -11.499 9.214 -1.451 1.00 0.00 N ATOM 514 CA ASN A 67 -10.211 9.836 -1.842 1.00 0.00 C ATOM 515 C ASN A 67 -9.166 8.677 -2.143 1.00 0.00 C ATOM 516 O ASN A 67 -9.377 7.555 -1.660 1.00 0.00 O ATOM 517 CB ASN A 67 -9.668 10.725 -0.693 1.00 0.00 C ATOM 518 CG ASN A 67 -10.471 12.005 -0.444 1.00 0.00 C ATOM 519 OD1 ASN A 67 -10.399 12.960 -1.217 1.00 0.00 O ATOM 520 ND2 ASN A 67 -11.243 12.058 0.628 1.00 0.00 N ATOM 0 H ASN A 67 -11.665 9.206 -0.445 1.00 0.00 H new ATOM 0 HA ASN A 67 -10.361 10.459 -2.724 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.650 10.138 0.225 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -8.637 10.997 -0.918 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -11.788 12.898 0.823 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -11.293 11.259 1.260 1.00 0.00 H new ATOM 521 N PRO A 68 -8.045 8.875 -2.886 1.00 0.00 N ATOM 522 CA PRO A 68 -7.019 7.796 -3.132 1.00 0.00 C ATOM 523 C PRO A 68 -6.401 6.993 -1.950 1.00 0.00 C ATOM 524 O PRO A 68 -5.782 5.961 -2.204 1.00 0.00 O ATOM 525 CB PRO A 68 -5.906 8.560 -3.905 1.00 0.00 C ATOM 526 CG PRO A 68 -6.665 9.682 -4.645 1.00 0.00 C ATOM 527 CD PRO A 68 -7.749 10.111 -3.639 1.00 0.00 C ATOM 0 HA PRO A 68 -7.532 6.977 -3.636 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -5.156 8.966 -3.226 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -5.383 7.905 -4.602 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -6.005 10.511 -4.901 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -7.102 9.323 -5.577 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -7.392 10.904 -2.981 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -8.636 10.492 -4.146 1.00 0.00 H new ATOM 528 N TYR A 69 -6.575 7.470 -0.708 1.00 0.00 N ATOM 529 CA TYR A 69 -6.110 6.799 0.520 1.00 0.00 C ATOM 530 C TYR A 69 -7.364 6.939 1.467 1.00 0.00 C ATOM 531 O TYR A 69 -7.567 8.066 1.935 1.00 0.00 O ATOM 532 CB TYR A 69 -4.950 7.551 1.262 1.00 0.00 C ATOM 533 CG TYR A 69 -3.522 7.718 0.669 1.00 0.00 C ATOM 534 CD1 TYR A 69 -3.084 7.126 -0.531 1.00 0.00 C ATOM 535 CD2 TYR A 69 -2.590 8.537 1.342 1.00 0.00 C ATOM 536 CE1 TYR A 69 -1.873 7.487 -1.130 1.00 0.00 C ATOM 537 CE2 TYR A 69 -1.375 8.901 0.742 1.00 0.00 C ATOM 538 CZ TYR A 69 -1.045 8.410 -0.514 1.00 0.00 C ATOM 539 OH TYR A 69 0.084 8.826 -1.149 1.00 0.00 O ATOM 0 H TYR A 69 -7.053 8.352 -0.523 1.00 0.00 H new ATOM 0 HA TYR A 69 -5.747 5.798 0.285 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -5.317 8.557 1.467 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.827 7.054 2.224 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.699 6.373 -1.001 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -2.816 8.890 2.337 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -1.584 7.046 -2.073 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -0.696 9.564 1.258 1.00 0.00 H new ATOM 0 HH TYR A 69 0.121 9.805 -1.143 1.00 0.00 H new ATOM 540 N THR A 70 -8.212 5.903 1.731 1.00 0.00 N ATOM 541 CA THR A 70 -9.249 6.039 2.782 1.00 0.00 C ATOM 542 C THR A 70 -10.107 4.807 3.218 1.00 0.00 C ATOM 543 O THR A 70 -10.260 4.629 4.427 1.00 0.00 O ATOM 544 CB THR A 70 -10.268 7.257 2.658 1.00 0.00 C ATOM 545 OG1 THR A 70 -10.297 7.862 1.364 1.00 0.00 O ATOM 546 CG2 THR A 70 -9.961 8.304 3.734 1.00 0.00 C ATOM 0 H THR A 70 -8.198 5.003 1.250 1.00 0.00 H new ATOM 0 HA THR A 70 -8.503 6.215 3.557 1.00 0.00 H new ATOM 0 HB THR A 70 -11.264 6.841 2.811 1.00 0.00 H new ATOM 0 HG1 THR A 70 -10.943 8.599 1.362 1.00 0.00 H new ATOM 0 HG21 THR A 70 -10.661 9.134 3.644 1.00 0.00 H new ATOM 0 HG22 THR A 70 -10.060 7.851 4.721 1.00 0.00 H new ATOM 0 HG23 THR A 70 -8.943 8.672 3.604 1.00 0.00 H new ATOM 547 N GLU A 71 -10.753 4.051 2.310 1.00 0.00 N ATOM 548 CA GLU A 71 -12.003 3.308 2.673 1.00 0.00 C ATOM 549 C GLU A 71 -12.063 2.304 3.862 1.00 0.00 C ATOM 550 O GLU A 71 -12.959 2.425 4.703 1.00 0.00 O ATOM 551 CB GLU A 71 -12.727 2.668 1.441 1.00 0.00 C ATOM 552 CG GLU A 71 -13.122 3.695 0.364 1.00 0.00 C ATOM 553 CD GLU A 71 -14.463 3.428 -0.307 1.00 0.00 C ATOM 554 OE1 GLU A 71 -15.520 3.696 0.525 1.00 0.00 O ATOM 555 OE2 GLU A 71 -14.580 3.038 -1.467 1.00 0.00 O ATOM 0 H GLU A 71 -10.451 3.932 1.343 1.00 0.00 H new ATOM 0 HA GLU A 71 -12.520 4.174 3.085 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -12.075 1.917 0.995 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -13.622 2.149 1.784 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -13.149 4.686 0.818 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.346 3.716 -0.401 1.00 0.00 H new ATOM 556 N SER A 72 -11.166 1.320 3.894 1.00 0.00 N ATOM 557 CA SER A 72 -11.362 0.089 4.710 1.00 0.00 C ATOM 558 C SER A 72 -10.746 0.050 6.141 1.00 0.00 C ATOM 559 O SER A 72 -10.322 1.063 6.695 1.00 0.00 O ATOM 560 CB SER A 72 -10.872 -1.046 3.752 1.00 0.00 C ATOM 561 OG SER A 72 -9.459 -1.206 3.729 1.00 0.00 O ATOM 0 H SER A 72 -10.291 1.337 3.370 1.00 0.00 H new ATOM 0 HA SER A 72 -12.406 -0.005 5.011 1.00 0.00 H new ATOM 0 HB2 SER A 72 -11.330 -1.988 4.055 1.00 0.00 H new ATOM 0 HB3 SER A 72 -11.221 -0.832 2.742 1.00 0.00 H new ATOM 0 HG SER A 72 -9.132 -1.357 4.640 1.00 0.00 H new ATOM 562 N TYR A 73 -10.793 -1.154 6.735 1.00 0.00 N ATOM 563 CA TYR A 73 -10.049 -1.632 7.900 1.00 0.00 C ATOM 564 C TYR A 73 -10.786 -1.608 9.243 1.00 0.00 C ATOM 565 O TYR A 73 -11.424 -0.631 9.641 1.00 0.00 O ATOM 566 CB TYR A 73 -8.628 -1.078 8.123 1.00 0.00 C ATOM 567 CG TYR A 73 -7.634 -1.715 7.187 1.00 0.00 C ATOM 568 CD1 TYR A 73 -7.213 -3.017 7.460 1.00 0.00 C ATOM 569 CD2 TYR A 73 -7.298 -1.136 5.985 1.00 0.00 C ATOM 570 CE1 TYR A 73 -6.500 -3.752 6.534 1.00 0.00 C ATOM 571 CE2 TYR A 73 -6.567 -1.857 5.055 1.00 0.00 C ATOM 572 CZ TYR A 73 -6.151 -3.160 5.325 1.00 0.00 C ATOM 573 OH TYR A 73 -5.258 -3.794 4.523 1.00 0.00 O ATOM 0 H TYR A 73 -11.412 -1.880 6.374 1.00 0.00 H new ATOM 0 HA TYR A 73 -9.949 -2.666 7.569 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -8.630 0.002 7.974 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -8.324 -1.257 9.154 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -7.450 -3.459 8.416 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -7.603 -0.123 5.767 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -6.217 -4.773 6.746 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -6.316 -1.403 4.108 1.00 0.00 H new ATOM 0 HH TYR A 73 -4.764 -4.460 5.046 1.00 0.00 H new ATOM 574 N SER A 74 -10.565 -2.748 9.916 1.00 0.00 N ATOM 575 CA SER A 74 -11.073 -3.111 11.257 1.00 0.00 C ATOM 576 C SER A 74 -10.372 -4.472 11.583 1.00 0.00 C ATOM 577 O SER A 74 -11.001 -5.533 11.602 1.00 0.00 O ATOM 578 CB SER A 74 -12.597 -3.160 11.068 1.00 0.00 C ATOM 579 OG SER A 74 -13.295 -3.679 12.183 1.00 0.00 O ATOM 0 H SER A 74 -9.991 -3.491 9.517 1.00 0.00 H new ATOM 0 HA SER A 74 -10.869 -2.443 12.094 1.00 0.00 H new ATOM 0 HB2 SER A 74 -12.960 -2.154 10.860 1.00 0.00 H new ATOM 0 HB3 SER A 74 -12.826 -3.768 10.193 1.00 0.00 H new ATOM 0 HG SER A 74 -12.933 -4.560 12.415 1.00 0.00 H new ATOM 580 N TYR A 75 -9.047 -4.407 11.810 1.00 0.00 N ATOM 581 CA TYR A 75 -8.127 -5.558 11.667 1.00 0.00 C ATOM 582 C TYR A 75 -7.837 -6.435 12.903 1.00 0.00 C ATOM 583 O TYR A 75 -8.730 -6.672 13.720 1.00 0.00 O ATOM 584 CB TYR A 75 -6.922 -4.984 10.850 1.00 0.00 C ATOM 585 CG TYR A 75 -6.078 -3.913 11.528 1.00 0.00 C ATOM 586 CD1 TYR A 75 -6.483 -2.576 11.731 1.00 0.00 C ATOM 587 CD2 TYR A 75 -4.876 -4.340 12.066 1.00 0.00 C ATOM 588 CE1 TYR A 75 -5.795 -1.782 12.647 1.00 0.00 C ATOM 589 CE2 TYR A 75 -4.199 -3.565 12.997 1.00 0.00 C ATOM 590 CZ TYR A 75 -4.670 -2.289 13.314 1.00 0.00 C ATOM 591 OH TYR A 75 -4.015 -1.521 14.227 1.00 0.00 O ATOM 0 H TYR A 75 -8.578 -3.549 12.100 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.606 -6.378 11.132 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -6.267 -5.814 10.583 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.309 -4.571 9.918 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -7.320 -2.171 11.181 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.460 -5.288 11.757 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -6.129 -0.774 12.844 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.310 -3.948 13.475 1.00 0.00 H new ATOM 0 HH TYR A 75 -3.579 -2.099 14.888 1.00 0.00 H new ATOM 592 N SER A 76 -6.608 -7.005 12.953 1.00 0.00 N ATOM 593 CA SER A 76 -6.380 -8.320 13.597 1.00 0.00 C ATOM 594 C SER A 76 -4.998 -8.738 14.165 1.00 0.00 C ATOM 595 O SER A 76 -4.949 -9.774 14.837 1.00 0.00 O ATOM 596 CB SER A 76 -6.444 -9.266 12.316 1.00 0.00 C ATOM 597 OG SER A 76 -6.652 -10.636 12.628 1.00 0.00 O ATOM 0 H SER A 76 -5.769 -6.580 12.559 1.00 0.00 H new ATOM 0 HA SER A 76 -7.060 -8.344 14.448 1.00 0.00 H new ATOM 0 HB2 SER A 76 -7.248 -8.925 11.663 1.00 0.00 H new ATOM 0 HB3 SER A 76 -5.514 -9.167 11.755 1.00 0.00 H new ATOM 0 HG SER A 76 -6.190 -10.855 13.464 1.00 0.00 H new ATOM 598 N CYS A 77 -3.904 -8.018 13.875 1.00 0.00 N ATOM 599 CA CYS A 77 -2.580 -8.681 13.694 1.00 0.00 C ATOM 600 C CYS A 77 -1.994 -9.452 14.885 1.00 0.00 C ATOM 601 O CYS A 77 -2.205 -9.112 16.053 1.00 0.00 O ATOM 602 CB CYS A 77 -1.608 -7.597 13.224 1.00 0.00 C ATOM 603 SG CYS A 77 -0.021 -8.306 12.742 1.00 0.00 S ATOM 0 H CYS A 77 -3.895 -7.004 13.761 1.00 0.00 H new ATOM 0 HA CYS A 77 -2.739 -9.480 12.970 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -2.040 -7.059 12.380 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -1.457 -6.870 14.022 1.00 0.00 H new ATOM 604 N SER A 78 -1.281 -10.526 14.523 1.00 0.00 N ATOM 605 CA SER A 78 -0.779 -11.533 15.493 1.00 0.00 C ATOM 606 C SER A 78 0.745 -11.363 15.654 1.00 0.00 C ATOM 607 O SER A 78 1.232 -10.285 16.008 1.00 0.00 O ATOM 608 CB SER A 78 -1.404 -12.894 15.085 1.00 0.00 C ATOM 609 OG SER A 78 -2.825 -12.858 15.240 1.00 0.00 O ATOM 0 H SER A 78 -1.031 -10.730 13.555 1.00 0.00 H new ATOM 0 HA SER A 78 -1.096 -11.420 16.530 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.151 -13.122 14.050 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.985 -13.692 15.698 1.00 0.00 H new ATOM 0 HG SER A 78 -3.205 -13.722 14.977 1.00 0.00 H new ATOM 610 N ASN A 79 1.456 -12.452 15.398 1.00 0.00 N ATOM 611 CA ASN A 79 2.919 -12.506 15.151 1.00 0.00 C ATOM 612 C ASN A 79 3.496 -11.367 14.229 1.00 0.00 C ATOM 613 O ASN A 79 4.511 -10.740 14.531 1.00 0.00 O ATOM 614 CB ASN A 79 3.151 -13.885 14.412 1.00 0.00 C ATOM 615 CG ASN A 79 3.203 -15.126 15.300 1.00 0.00 C ATOM 616 OD1 ASN A 79 3.432 -15.073 16.509 1.00 0.00 O ATOM 617 ND2 ASN A 79 3.015 -16.291 14.706 1.00 0.00 N ATOM 0 H ASN A 79 1.023 -13.374 15.351 1.00 0.00 H new ATOM 0 HA ASN A 79 3.428 -12.385 16.107 1.00 0.00 H new ATOM 0 HB2 ASN A 79 2.354 -14.020 13.681 1.00 0.00 H new ATOM 0 HB3 ASN A 79 4.086 -13.822 13.856 1.00 0.00 H new ATOM 0 HD21 ASN A 79 3.059 -17.153 15.249 1.00 0.00 H new ATOM 0 HD22 ASN A 79 2.826 -16.328 13.704 1.00 0.00 H new ATOM 618 N THR A 80 2.770 -11.207 13.129 1.00 0.00 N ATOM 619 CA THR A 80 3.040 -10.359 11.964 1.00 0.00 C ATOM 620 C THR A 80 1.748 -10.287 11.015 1.00 0.00 C ATOM 621 O THR A 80 1.592 -9.325 10.266 1.00 0.00 O ATOM 622 CB THR A 80 4.220 -10.835 11.050 1.00 0.00 C ATOM 623 OG1 THR A 80 3.971 -12.125 10.490 1.00 0.00 O ATOM 624 CG2 THR A 80 5.589 -10.897 11.706 1.00 0.00 C ATOM 0 H THR A 80 1.893 -11.714 13.015 1.00 0.00 H new ATOM 0 HA THR A 80 3.311 -9.398 12.400 1.00 0.00 H new ATOM 0 HB THR A 80 4.252 -10.054 10.290 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.727 -12.388 9.925 1.00 0.00 H new ATOM 0 HG21 THR A 80 6.326 -11.239 10.979 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.866 -9.906 12.064 1.00 0.00 H new ATOM 0 HG23 THR A 80 5.559 -11.591 12.546 1.00 0.00 H new ATOM 625 N GLU A 81 0.903 -11.326 11.074 1.00 0.00 N ATOM 626 CA GLU A 81 -0.162 -11.625 10.114 1.00 0.00 C ATOM 627 C GLU A 81 -1.533 -11.129 10.532 1.00 0.00 C ATOM 628 O GLU A 81 -1.949 -11.274 11.684 1.00 0.00 O ATOM 629 CB GLU A 81 -0.261 -13.183 10.043 1.00 0.00 C ATOM 630 CG GLU A 81 0.981 -13.722 9.335 1.00 0.00 C ATOM 631 CD GLU A 81 0.969 -15.203 9.055 1.00 0.00 C ATOM 632 OE1 GLU A 81 0.384 -15.497 7.850 1.00 0.00 O ATOM 633 OE2 GLU A 81 1.433 -16.043 9.827 1.00 0.00 O ATOM 0 H GLU A 81 0.948 -12.011 11.828 1.00 0.00 H new ATOM 0 HA GLU A 81 0.092 -11.132 9.176 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -0.336 -13.603 11.046 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -1.161 -13.480 9.505 1.00 0.00 H new ATOM 0 HG2 GLU A 81 1.100 -13.191 8.391 1.00 0.00 H new ATOM 0 HG3 GLU A 81 1.855 -13.491 9.943 1.00 0.00 H new ATOM 634 N ILE A 82 -2.245 -10.620 9.526 1.00 0.00 N ATOM 635 CA ILE A 82 -3.462 -9.816 9.764 1.00 0.00 C ATOM 636 C ILE A 82 -4.679 -10.557 9.108 1.00 0.00 C ATOM 637 O ILE A 82 -4.844 -11.764 9.306 1.00 0.00 O ATOM 638 CB ILE A 82 -3.143 -8.319 9.400 1.00 0.00 C ATOM 639 CG1 ILE A 82 -1.775 -7.774 9.908 1.00 0.00 C ATOM 640 CG2 ILE A 82 -4.185 -7.353 9.981 1.00 0.00 C ATOM 641 CD1 ILE A 82 -0.655 -7.599 8.913 1.00 0.00 C ATOM 0 H ILE A 82 -2.009 -10.744 8.542 1.00 0.00 H new ATOM 0 HA ILE A 82 -3.783 -9.733 10.802 1.00 0.00 H new ATOM 0 HB ILE A 82 -3.139 -8.351 8.310 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -1.957 -6.806 10.376 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -1.421 -8.445 10.691 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -3.926 -6.330 9.706 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.170 -7.598 9.583 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.200 -7.444 11.067 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.227 -7.212 9.423 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.419 -8.561 8.458 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.963 -6.897 8.138 1.00 0.00 H new ATOM 642 N THR A 83 -5.533 -9.795 8.416 1.00 0.00 N ATOM 643 CA THR A 83 -6.761 -10.269 7.713 1.00 0.00 C ATOM 644 C THR A 83 -7.357 -9.056 6.921 1.00 0.00 C ATOM 645 O THR A 83 -7.172 -9.077 5.710 1.00 0.00 O ATOM 646 CB THR A 83 -7.781 -11.085 8.539 1.00 0.00 C ATOM 647 OG1 THR A 83 -8.753 -11.662 7.665 1.00 0.00 O ATOM 648 CG2 THR A 83 -8.489 -10.276 9.614 1.00 0.00 C ATOM 0 H THR A 83 -5.395 -8.789 8.318 1.00 0.00 H new ATOM 0 HA THR A 83 -6.459 -11.053 7.018 1.00 0.00 H new ATOM 0 HB THR A 83 -7.210 -11.857 9.055 1.00 0.00 H new ATOM 0 HG1 THR A 83 -9.398 -12.180 8.190 1.00 0.00 H new ATOM 0 HG21 THR A 83 -9.188 -10.917 10.151 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.754 -9.877 10.313 1.00 0.00 H new ATOM 0 HG23 THR A 83 -9.033 -9.453 9.151 1.00 0.00 H new ATOM 649 N CYS A 84 -8.183 -8.139 7.505 1.00 0.00 N ATOM 650 CA CYS A 84 -8.462 -6.791 6.985 1.00 0.00 C ATOM 651 C CYS A 84 -9.571 -6.113 7.839 1.00 0.00 C ATOM 652 O CYS A 84 -9.286 -5.209 8.618 1.00 0.00 O ATOM 653 CB CYS A 84 -8.632 -6.540 5.502 1.00 0.00 C ATOM 654 SG CYS A 84 -10.105 -7.253 4.802 1.00 0.00 S ATOM 0 H CYS A 84 -8.680 -8.335 8.374 1.00 0.00 H new ATOM 0 HA CYS A 84 -7.491 -6.311 7.103 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -8.645 -5.464 5.327 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -7.764 -6.939 4.976 1.00 0.00 H new ATOM 655 N ASN A 85 -10.831 -6.548 7.646 1.00 0.00 N ATOM 656 CA ASN A 85 -12.026 -5.909 8.230 1.00 0.00 C ATOM 657 C ASN A 85 -13.096 -6.951 8.655 1.00 0.00 C ATOM 658 O ASN A 85 -12.941 -8.160 8.443 1.00 0.00 O ATOM 659 CB ASN A 85 -12.544 -4.860 7.204 1.00 0.00 C ATOM 660 CG ASN A 85 -13.362 -5.286 5.981 1.00 0.00 C ATOM 661 OD1 ASN A 85 -14.381 -4.675 5.662 1.00 0.00 O ATOM 662 ND2 ASN A 85 -12.961 -6.318 5.262 1.00 0.00 N ATOM 0 H ASN A 85 -11.050 -7.363 7.073 1.00 0.00 H new ATOM 0 HA ASN A 85 -11.774 -5.398 9.159 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -13.150 -4.144 7.759 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -11.673 -4.320 6.833 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -13.496 -6.608 4.443 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -12.116 -6.826 5.525 1.00 0.00 H new ATOM 663 N SER A 86 -14.201 -6.461 9.248 1.00 0.00 N ATOM 664 CA SER A 86 -15.397 -7.308 9.513 1.00 0.00 C ATOM 665 C SER A 86 -16.702 -6.512 9.240 1.00 0.00 C ATOM 666 O SER A 86 -17.543 -6.338 10.127 1.00 0.00 O ATOM 667 CB SER A 86 -15.304 -7.915 10.928 1.00 0.00 C ATOM 668 OG SER A 86 -16.341 -8.867 11.145 1.00 0.00 O ATOM 0 H SER A 86 -14.298 -5.493 9.553 1.00 0.00 H new ATOM 0 HA SER A 86 -15.425 -8.151 8.822 1.00 0.00 H new ATOM 0 HB2 SER A 86 -14.333 -8.393 11.059 1.00 0.00 H new ATOM 0 HB3 SER A 86 -15.372 -7.122 11.673 1.00 0.00 H new ATOM 0 HG SER A 86 -16.260 -9.239 12.048 1.00 0.00 H new ATOM 669 N LYS A 87 -16.862 -6.061 7.979 1.00 0.00 N ATOM 670 CA LYS A 87 -18.028 -5.264 7.525 1.00 0.00 C ATOM 671 C LYS A 87 -18.181 -5.199 5.953 1.00 0.00 C ATOM 672 O LYS A 87 -18.649 -4.182 5.433 1.00 0.00 O ATOM 673 CB LYS A 87 -18.010 -3.858 8.193 1.00 0.00 C ATOM 674 CG LYS A 87 -16.897 -2.912 7.749 1.00 0.00 C ATOM 675 CD LYS A 87 -15.726 -2.718 8.711 1.00 0.00 C ATOM 676 CE LYS A 87 -14.649 -1.766 8.139 1.00 0.00 C ATOM 677 NZ LYS A 87 -15.039 -0.344 8.126 1.00 0.00 N ATOM 0 H LYS A 87 -16.183 -6.239 7.239 1.00 0.00 H new ATOM 0 HA LYS A 87 -18.926 -5.785 7.857 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -18.967 -3.375 7.999 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.934 -3.993 9.272 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.500 -3.277 6.802 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -17.340 -1.936 7.554 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -16.096 -2.319 9.655 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.274 -3.685 8.930 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -13.737 -1.875 8.725 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.412 -2.075 7.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.264 0.225 7.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.891 -0.223 7.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.237 -0.029 9.097 1.00 0.00 H new ATOM 678 N ASN A 88 -17.844 -6.285 5.226 1.00 0.00 N ATOM 679 CA ASN A 88 -17.722 -6.285 3.753 1.00 0.00 C ATOM 680 C ASN A 88 -18.958 -5.852 2.891 1.00 0.00 C ATOM 681 O ASN A 88 -19.944 -6.569 2.704 1.00 0.00 O ATOM 682 CB ASN A 88 -17.265 -7.678 3.202 1.00 0.00 C ATOM 683 CG ASN A 88 -16.028 -8.315 3.835 1.00 0.00 C ATOM 684 OD1 ASN A 88 -14.893 -7.986 3.498 1.00 0.00 O ATOM 685 ND2 ASN A 88 -16.208 -9.244 4.758 1.00 0.00 N ATOM 0 H ASN A 88 -17.648 -7.193 5.648 1.00 0.00 H new ATOM 0 HA ASN A 88 -16.978 -5.497 3.631 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -18.097 -8.374 3.314 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -17.080 -7.573 2.133 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -15.402 -9.692 5.195 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -17.153 -9.513 5.034 1.00 0.00 H new ATOM 686 N ASN A 89 -18.779 -4.656 2.353 1.00 0.00 N ATOM 687 CA ASN A 89 -19.466 -4.140 1.145 1.00 0.00 C ATOM 688 C ASN A 89 -18.245 -3.578 0.334 1.00 0.00 C ATOM 689 O ASN A 89 -17.369 -2.935 0.921 1.00 0.00 O ATOM 690 CB ASN A 89 -20.485 -3.013 1.378 1.00 0.00 C ATOM 691 CG ASN A 89 -21.631 -3.344 2.331 1.00 0.00 C ATOM 692 OD1 ASN A 89 -21.527 -3.141 3.541 1.00 0.00 O ATOM 693 ND2 ASN A 89 -22.737 -3.864 1.824 1.00 0.00 N ATOM 0 H ASN A 89 -18.128 -3.979 2.750 1.00 0.00 H new ATOM 0 HA ASN A 89 -20.070 -4.916 0.675 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -19.955 -2.143 1.765 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -20.908 -2.726 0.415 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -23.517 -4.102 2.437 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -22.810 -4.027 0.820 1.00 0.00 H new ATOM 694 N ALA A 90 -18.174 -3.793 -0.987 1.00 0.00 N ATOM 695 CA ALA A 90 -16.929 -3.547 -1.773 1.00 0.00 C ATOM 696 C ALA A 90 -16.175 -2.198 -1.597 1.00 0.00 C ATOM 697 O ALA A 90 -14.951 -2.168 -1.688 1.00 0.00 O ATOM 698 CB ALA A 90 -17.193 -3.881 -3.241 1.00 0.00 C ATOM 0 H ALA A 90 -18.956 -4.136 -1.545 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.200 -4.223 -1.325 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -16.288 -3.704 -3.823 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -17.482 -4.928 -3.330 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -17.997 -3.249 -3.619 1.00 0.00 H new ATOM 699 N CYS A 91 -16.884 -1.106 -1.283 1.00 0.00 N ATOM 700 CA CYS A 91 -16.299 0.142 -0.703 1.00 0.00 C ATOM 701 C CYS A 91 -15.125 -0.088 0.329 1.00 0.00 C ATOM 702 O CYS A 91 -14.003 0.315 0.056 1.00 0.00 O ATOM 703 CB CYS A 91 -17.469 0.766 0.081 1.00 0.00 C ATOM 704 SG CYS A 91 -18.749 1.603 -0.874 1.00 0.00 S ATOM 0 H CYS A 91 -17.893 -1.049 -1.421 1.00 0.00 H new ATOM 0 HA CYS A 91 -15.875 0.741 -1.509 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -17.944 -0.023 0.663 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -17.056 1.482 0.792 1.00 0.00 H new ATOM 705 N GLU A 92 -15.396 -0.759 1.459 1.00 0.00 N ATOM 706 CA GLU A 92 -14.371 -1.220 2.405 1.00 0.00 C ATOM 707 C GLU A 92 -13.771 -2.562 1.947 1.00 0.00 C ATOM 708 O GLU A 92 -12.561 -2.604 1.783 1.00 0.00 O ATOM 709 CB GLU A 92 -14.882 -1.347 3.862 1.00 0.00 C ATOM 710 CG GLU A 92 -16.208 -2.090 4.059 1.00 0.00 C ATOM 711 CD GLU A 92 -17.368 -1.240 4.552 1.00 0.00 C ATOM 712 OE1 GLU A 92 -17.270 -0.397 5.443 1.00 0.00 O ATOM 713 OE2 GLU A 92 -18.535 -1.530 3.894 1.00 0.00 O ATOM 0 H GLU A 92 -16.345 -0.999 1.744 1.00 0.00 H new ATOM 0 HA GLU A 92 -13.601 -0.448 2.406 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -14.116 -1.854 4.449 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -14.988 -0.344 4.275 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -16.492 -2.547 3.111 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -16.048 -2.901 4.769 1.00 0.00 H new ATOM 714 N ALA A 93 -14.570 -3.627 1.733 1.00 0.00 N ATOM 715 CA ALA A 93 -14.040 -4.963 1.438 1.00 0.00 C ATOM 716 C ALA A 93 -13.038 -5.095 0.283 1.00 0.00 C ATOM 717 O ALA A 93 -12.058 -5.832 0.412 1.00 0.00 O ATOM 718 CB ALA A 93 -15.119 -5.968 1.028 1.00 0.00 C ATOM 0 H ALA A 93 -15.589 -3.581 1.760 1.00 0.00 H new ATOM 0 HA ALA A 93 -13.557 -5.159 2.395 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -14.658 -6.934 0.825 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -15.843 -6.074 1.836 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -15.626 -5.612 0.131 1.00 0.00 H new ATOM 719 N PHE A 94 -13.357 -4.443 -0.863 1.00 0.00 N ATOM 720 CA PHE A 94 -12.457 -4.535 -2.046 1.00 0.00 C ATOM 721 C PHE A 94 -11.214 -3.645 -1.852 1.00 0.00 C ATOM 722 O PHE A 94 -10.152 -4.004 -2.367 1.00 0.00 O ATOM 723 CB PHE A 94 -13.319 -4.416 -3.317 1.00 0.00 C ATOM 724 CG PHE A 94 -12.748 -3.848 -4.611 1.00 0.00 C ATOM 725 CD1 PHE A 94 -12.065 -2.642 -4.575 1.00 0.00 C ATOM 726 CD2 PHE A 94 -13.149 -4.332 -5.868 1.00 0.00 C ATOM 727 CE1 PHE A 94 -11.631 -2.012 -5.724 1.00 0.00 C ATOM 728 CE2 PHE A 94 -12.723 -3.704 -7.047 1.00 0.00 C ATOM 729 CZ PHE A 94 -11.940 -2.547 -6.968 1.00 0.00 C ATOM 0 H PHE A 94 -14.191 -3.871 -0.995 1.00 0.00 H new ATOM 0 HA PHE A 94 -11.974 -5.504 -2.175 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.689 -5.416 -3.545 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -14.185 -3.807 -3.058 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -11.866 -2.181 -3.619 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -13.793 -5.197 -5.926 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -11.051 -1.103 -5.656 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -12.997 -4.110 -8.009 1.00 0.00 H new ATOM 0 HZ PHE A 94 -11.578 -2.073 -7.869 1.00 0.00 H new ATOM 730 N ILE A 95 -11.340 -2.483 -1.163 1.00 0.00 N ATOM 731 CA ILE A 95 -10.160 -1.643 -0.816 1.00 0.00 C ATOM 732 C ILE A 95 -9.269 -2.413 0.218 1.00 0.00 C ATOM 733 O ILE A 95 -8.048 -2.373 0.080 1.00 0.00 O ATOM 734 CB ILE A 95 -10.624 -0.222 -0.368 1.00 0.00 C ATOM 735 CG1 ILE A 95 -11.066 0.628 -1.592 1.00 0.00 C ATOM 736 CG2 ILE A 95 -9.499 0.597 0.327 1.00 0.00 C ATOM 737 CD1 ILE A 95 -12.358 0.266 -2.313 1.00 0.00 C ATOM 0 H ILE A 95 -12.232 -2.108 -0.840 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.526 -1.467 -1.685 1.00 0.00 H new ATOM 0 HB ILE A 95 -11.442 -0.403 0.329 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.153 1.663 -1.260 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -10.260 0.595 -2.325 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -9.885 1.575 0.614 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -9.158 0.066 1.216 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.664 0.725 -0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -12.519 0.957 -3.141 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.287 -0.751 -2.698 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.194 0.333 -1.617 1.00 0.00 H new ATOM 738 N CYS A 96 -9.889 -3.150 1.173 1.00 0.00 N ATOM 739 CA CYS A 96 -9.223 -4.187 1.990 1.00 0.00 C ATOM 740 C CYS A 96 -8.400 -5.200 1.157 1.00 0.00 C ATOM 741 O CYS A 96 -7.274 -5.488 1.565 1.00 0.00 O ATOM 742 CB CYS A 96 -10.286 -4.882 2.879 1.00 0.00 C ATOM 743 SG CYS A 96 -10.107 -6.676 2.911 1.00 0.00 S ATOM 0 H CYS A 96 -10.878 -3.037 1.398 1.00 0.00 H new ATOM 0 HA CYS A 96 -8.483 -3.696 2.623 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -10.211 -4.496 3.896 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -11.281 -4.627 2.514 1.00 0.00 H new ATOM 744 N ASN A 97 -8.923 -5.707 0.012 1.00 0.00 N ATOM 745 CA ASN A 97 -8.105 -6.582 -0.886 1.00 0.00 C ATOM 746 C ASN A 97 -6.855 -5.926 -1.539 1.00 0.00 C ATOM 747 O ASN A 97 -5.816 -6.592 -1.569 1.00 0.00 O ATOM 748 CB ASN A 97 -9.030 -7.177 -1.969 1.00 0.00 C ATOM 749 CG ASN A 97 -8.594 -8.508 -2.585 1.00 0.00 C ATOM 750 OD1 ASN A 97 -7.663 -9.182 -2.141 1.00 0.00 O ATOM 751 ND2 ASN A 97 -9.277 -8.927 -3.636 1.00 0.00 N ATOM 0 H ASN A 97 -9.876 -5.536 -0.310 1.00 0.00 H new ATOM 0 HA ASN A 97 -7.681 -7.351 -0.240 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -10.021 -7.311 -1.535 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -9.129 -6.446 -2.772 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -9.034 -9.811 -4.083 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -10.047 -8.366 -4.000 1.00 0.00 H new ATOM 752 N CYS A 98 -6.925 -4.677 -2.043 1.00 0.00 N ATOM 753 CA CYS A 98 -5.709 -3.977 -2.546 1.00 0.00 C ATOM 754 C CYS A 98 -4.688 -3.642 -1.421 1.00 0.00 C ATOM 755 O CYS A 98 -3.506 -3.921 -1.622 1.00 0.00 O ATOM 756 CB CYS A 98 -6.098 -2.754 -3.379 1.00 0.00 C ATOM 757 SG CYS A 98 -4.667 -2.074 -4.258 1.00 0.00 S ATOM 0 H CYS A 98 -7.787 -4.136 -2.115 1.00 0.00 H new ATOM 0 HA CYS A 98 -5.183 -4.670 -3.202 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -6.870 -3.031 -4.097 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -6.525 -1.990 -2.730 1.00 0.00 H new ATOM 758 N ASP A 99 -5.128 -3.117 -0.251 1.00 0.00 N ATOM 759 CA ASP A 99 -4.247 -2.867 0.917 1.00 0.00 C ATOM 760 C ASP A 99 -3.557 -4.130 1.469 1.00 0.00 C ATOM 761 O ASP A 99 -2.334 -4.130 1.519 1.00 0.00 O ATOM 762 CB ASP A 99 -4.946 -2.092 2.038 1.00 0.00 C ATOM 763 CG ASP A 99 -5.261 -0.631 1.764 1.00 0.00 C ATOM 764 OD1 ASP A 99 -4.481 0.279 2.030 1.00 0.00 O ATOM 765 OD2 ASP A 99 -6.503 -0.447 1.225 1.00 0.00 O ATOM 0 H ASP A 99 -6.101 -2.856 -0.091 1.00 0.00 H new ATOM 0 HA ASP A 99 -3.455 -2.233 0.518 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -5.880 -2.603 2.274 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -4.320 -2.144 2.929 1.00 0.00 H new ATOM 766 N ARG A 100 -4.284 -5.185 1.844 1.00 0.00 N ATOM 767 CA ARG A 100 -3.653 -6.451 2.258 1.00 0.00 C ATOM 768 C ARG A 100 -2.803 -7.173 1.213 1.00 0.00 C ATOM 769 O ARG A 100 -1.757 -7.656 1.632 1.00 0.00 O ATOM 770 CB ARG A 100 -4.702 -7.449 2.733 1.00 0.00 C ATOM 771 CG ARG A 100 -5.356 -7.083 4.055 1.00 0.00 C ATOM 772 CD ARG A 100 -4.499 -7.238 5.314 1.00 0.00 C ATOM 773 NE ARG A 100 -4.231 -8.665 5.546 1.00 0.00 N ATOM 774 CZ ARG A 100 -3.029 -9.229 5.740 1.00 0.00 C ATOM 775 NH1 ARG A 100 -1.889 -8.557 5.801 1.00 0.00 N ATOM 776 NH2 ARG A 100 -2.979 -10.539 5.886 1.00 0.00 N ATOM 0 H ARG A 100 -5.304 -5.193 1.871 1.00 0.00 H new ATOM 0 HA ARG A 100 -2.975 -6.126 3.048 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -5.475 -7.537 1.970 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -4.237 -8.430 2.830 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -5.687 -6.046 3.995 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -6.249 -7.697 4.174 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -3.561 -6.694 5.199 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -5.014 -6.808 6.173 1.00 0.00 H new ATOM 0 HE ARG A 100 -5.039 -9.288 5.561 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -1.889 -7.542 5.698 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -1.011 -9.054 5.951 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -3.837 -11.089 5.850 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -2.082 -11.002 6.035 1.00 0.00 H new ATOM 777 N ASN A 101 -3.160 -7.284 -0.087 1.00 0.00 N ATOM 778 CA ASN A 101 -2.160 -7.852 -1.053 1.00 0.00 C ATOM 779 C ASN A 101 -0.923 -6.892 -1.292 1.00 0.00 C ATOM 780 O ASN A 101 0.104 -7.354 -1.790 1.00 0.00 O ATOM 781 CB ASN A 101 -2.886 -8.249 -2.349 1.00 0.00 C ATOM 782 CG ASN A 101 -2.083 -9.162 -3.280 1.00 0.00 C ATOM 783 OD1 ASN A 101 -1.889 -10.344 -2.999 1.00 0.00 O ATOM 784 ND2 ASN A 101 -1.605 -8.648 -4.401 1.00 0.00 N ATOM 0 H ASN A 101 -4.061 -7.014 -0.482 1.00 0.00 H new ATOM 0 HA ASN A 101 -1.719 -8.750 -0.620 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -3.819 -8.749 -2.088 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -3.152 -7.342 -2.893 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -1.070 -9.233 -5.043 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -1.772 -7.667 -4.624 1.00 0.00 H new ATOM 785 N ALA A 102 -1.028 -5.610 -0.892 1.00 0.00 N ATOM 786 CA ALA A 102 0.118 -4.733 -0.643 1.00 0.00 C ATOM 787 C ALA A 102 0.791 -4.988 0.742 1.00 0.00 C ATOM 788 O ALA A 102 1.995 -4.844 0.736 1.00 0.00 O ATOM 789 CB ALA A 102 -0.305 -3.284 -0.862 1.00 0.00 C ATOM 0 H ALA A 102 -1.926 -5.154 -0.732 1.00 0.00 H new ATOM 0 HA ALA A 102 0.904 -4.968 -1.360 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.544 -2.625 -0.678 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -0.648 -3.156 -1.889 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -1.114 -3.033 -0.176 1.00 0.00 H new ATOM 790 N ALA A 103 0.161 -5.392 1.879 1.00 0.00 N ATOM 791 CA ALA A 103 0.925 -5.910 3.094 1.00 0.00 C ATOM 792 C ALA A 103 1.813 -7.199 2.896 1.00 0.00 C ATOM 793 O ALA A 103 2.704 -7.477 3.685 1.00 0.00 O ATOM 794 CB ALA A 103 -0.097 -6.132 4.219 1.00 0.00 C ATOM 0 H ALA A 103 -0.852 -5.378 1.999 1.00 0.00 H new ATOM 0 HA ALA A 103 1.666 -5.146 3.327 1.00 0.00 H new ATOM 0 HB1 ALA A 103 0.414 -6.504 5.107 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -0.591 -5.189 4.453 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.840 -6.861 3.897 1.00 0.00 H new ATOM 795 N ILE A 104 1.475 -7.909 1.843 1.00 0.00 N ATOM 796 CA ILE A 104 2.044 -9.167 1.275 1.00 0.00 C ATOM 797 C ILE A 104 3.125 -8.924 0.208 1.00 0.00 C ATOM 798 O ILE A 104 4.102 -9.645 0.061 1.00 0.00 O ATOM 799 CB ILE A 104 0.747 -9.785 0.627 1.00 0.00 C ATOM 800 CG1 ILE A 104 -0.179 -10.549 1.586 1.00 0.00 C ATOM 801 CG2 ILE A 104 0.900 -10.577 -0.682 1.00 0.00 C ATOM 802 CD1 ILE A 104 -0.287 -10.010 3.000 1.00 0.00 C ATOM 0 H ILE A 104 0.691 -7.597 1.270 1.00 0.00 H new ATOM 0 HA ILE A 104 2.554 -9.786 2.012 1.00 0.00 H new ATOM 0 HB ILE A 104 0.264 -8.848 0.349 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.178 -10.568 1.151 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.165 -11.582 1.641 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.076 -10.939 -1.004 1.00 0.00 H new ATOM 0 HG22 ILE A 104 1.319 -9.930 -1.452 1.00 0.00 H new ATOM 0 HG23 ILE A 104 1.565 -11.425 -0.519 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.969 -10.635 3.577 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.697 -10.018 3.469 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -0.667 -8.989 2.972 1.00 0.00 H new ATOM 803 N CYS A 105 2.864 -7.982 -0.682 1.00 0.00 N ATOM 804 CA CYS A 105 3.947 -7.445 -1.522 1.00 0.00 C ATOM 805 C CYS A 105 4.992 -6.658 -0.660 1.00 0.00 C ATOM 806 O CYS A 105 6.190 -6.742 -0.900 1.00 0.00 O ATOM 807 CB CYS A 105 3.381 -6.498 -2.555 1.00 0.00 C ATOM 808 SG CYS A 105 2.595 -7.270 -3.956 1.00 0.00 S ATOM 0 H CYS A 105 1.943 -7.576 -0.848 1.00 0.00 H new ATOM 0 HA CYS A 105 4.437 -8.290 -2.006 1.00 0.00 H new ATOM 0 HB2 CYS A 105 2.656 -5.847 -2.067 1.00 0.00 H new ATOM 0 HB3 CYS A 105 4.187 -5.861 -2.918 1.00 0.00 H new ATOM 809 N PHE A 106 4.516 -5.928 0.342 1.00 0.00 N ATOM 810 CA PHE A 106 5.360 -5.052 1.159 1.00 0.00 C ATOM 811 C PHE A 106 6.060 -5.728 2.314 1.00 0.00 C ATOM 812 O PHE A 106 7.225 -5.391 2.552 1.00 0.00 O ATOM 813 CB PHE A 106 4.567 -3.822 1.536 1.00 0.00 C ATOM 814 CG PHE A 106 4.151 -2.911 0.346 1.00 0.00 C ATOM 815 CD1 PHE A 106 4.571 -3.021 -1.015 1.00 0.00 C ATOM 816 CD2 PHE A 106 3.167 -1.988 0.661 1.00 0.00 C ATOM 817 CE1 PHE A 106 3.985 -2.219 -1.985 1.00 0.00 C ATOM 818 CE2 PHE A 106 2.640 -1.134 -0.297 1.00 0.00 C ATOM 819 CZ PHE A 106 3.035 -1.264 -1.625 1.00 0.00 C ATOM 0 H PHE A 106 3.533 -5.924 0.614 1.00 0.00 H new ATOM 0 HA PHE A 106 6.210 -4.743 0.550 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.667 -4.137 2.063 1.00 0.00 H new ATOM 0 HB3 PHE A 106 5.156 -3.230 2.237 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.342 -3.726 -1.289 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.802 -1.932 1.676 1.00 0.00 H new ATOM 0 HE1 PHE A 106 4.266 -2.335 -3.021 1.00 0.00 H new ATOM 0 HE2 PHE A 106 1.928 -0.373 -0.014 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.604 -0.623 -2.380 1.00 0.00 H new ATOM 820 N SER A 107 5.424 -6.691 3.007 1.00 0.00 N ATOM 821 CA SER A 107 6.212 -7.491 3.977 1.00 0.00 C ATOM 822 C SER A 107 7.225 -8.511 3.410 1.00 0.00 C ATOM 823 O SER A 107 8.135 -8.924 4.135 1.00 0.00 O ATOM 824 CB SER A 107 5.361 -8.156 5.063 1.00 0.00 C ATOM 825 OG SER A 107 4.510 -9.192 4.600 1.00 0.00 O ATOM 0 H SER A 107 4.435 -6.928 2.928 1.00 0.00 H new ATOM 0 HA SER A 107 6.823 -6.704 4.419 1.00 0.00 H new ATOM 0 HB2 SER A 107 6.024 -8.563 5.826 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.751 -7.392 5.546 1.00 0.00 H new ATOM 0 HG SER A 107 3.813 -8.811 4.026 1.00 0.00 H new ATOM 826 N LYS A 108 7.049 -8.903 2.143 1.00 0.00 N ATOM 827 CA LYS A 108 7.658 -10.112 1.605 1.00 0.00 C ATOM 828 C LYS A 108 8.216 -9.809 0.208 1.00 0.00 C ATOM 829 O LYS A 108 9.384 -9.421 0.212 1.00 0.00 O ATOM 830 CB LYS A 108 6.753 -11.355 1.752 1.00 0.00 C ATOM 831 CG LYS A 108 5.283 -11.196 2.182 1.00 0.00 C ATOM 832 CD LYS A 108 4.314 -12.222 1.590 1.00 0.00 C ATOM 833 CE LYS A 108 4.510 -12.745 0.160 1.00 0.00 C ATOM 834 NZ LYS A 108 3.377 -13.596 -0.248 1.00 0.00 N ATOM 0 H LYS A 108 6.482 -8.389 1.469 1.00 0.00 H new ATOM 0 HA LYS A 108 8.518 -10.411 2.204 1.00 0.00 H new ATOM 0 HB2 LYS A 108 6.755 -11.872 0.792 1.00 0.00 H new ATOM 0 HB3 LYS A 108 7.231 -12.019 2.472 1.00 0.00 H new ATOM 0 HG2 LYS A 108 5.231 -11.257 3.269 1.00 0.00 H new ATOM 0 HG3 LYS A 108 4.946 -10.198 1.902 1.00 0.00 H new ATOM 0 HD2 LYS A 108 4.318 -13.088 2.252 1.00 0.00 H new ATOM 0 HD3 LYS A 108 3.316 -11.787 1.639 1.00 0.00 H new ATOM 0 HE2 LYS A 108 4.606 -11.906 -0.529 1.00 0.00 H new ATOM 0 HE3 LYS A 108 5.438 -13.314 0.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 3.285 -13.578 -1.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 3.545 -14.572 0.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 2.501 -13.238 0.184 1.00 0.00 H new ATOM 835 N ALA A 109 7.489 -9.969 -0.956 1.00 0.00 N ATOM 836 CA ALA A 109 8.149 -9.814 -2.321 1.00 0.00 C ATOM 837 C ALA A 109 9.629 -10.305 -2.399 1.00 0.00 C ATOM 838 O ALA A 109 9.905 -11.366 -1.826 1.00 0.00 O ATOM 839 CB ALA A 109 7.661 -8.446 -2.751 1.00 0.00 C ATOM 0 H ALA A 109 6.495 -10.194 -0.986 1.00 0.00 H new ATOM 0 HA ALA A 109 7.875 -10.505 -3.118 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.068 -8.207 -3.733 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.572 -8.447 -2.800 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.991 -7.699 -2.029 1.00 0.00 H new ATOM 840 N PRO A 110 10.585 -9.624 -3.027 1.00 0.00 N ATOM 841 CA PRO A 110 12.055 -9.927 -2.910 1.00 0.00 C ATOM 842 C PRO A 110 12.849 -9.010 -1.872 1.00 0.00 C ATOM 843 O PRO A 110 14.079 -8.961 -1.922 1.00 0.00 O ATOM 844 CB PRO A 110 12.492 -9.456 -4.342 1.00 0.00 C ATOM 845 CG PRO A 110 11.675 -8.171 -4.472 1.00 0.00 C ATOM 846 CD PRO A 110 10.310 -8.601 -4.025 1.00 0.00 C ATOM 0 HA PRO A 110 12.246 -10.950 -2.587 1.00 0.00 H new ATOM 0 HB2 PRO A 110 13.565 -9.274 -4.410 1.00 0.00 H new ATOM 0 HB3 PRO A 110 12.243 -10.186 -5.113 1.00 0.00 H new ATOM 0 HG2 PRO A 110 12.073 -7.373 -3.846 1.00 0.00 H new ATOM 0 HG3 PRO A 110 11.667 -7.798 -5.496 1.00 0.00 H new ATOM 0 HD2 PRO A 110 9.746 -7.770 -3.602 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.723 -8.996 -4.854 1.00 0.00 H new ATOM 847 N TYR A 111 12.098 -8.363 -0.961 1.00 0.00 N ATOM 848 CA TYR A 111 12.497 -7.115 -0.272 1.00 0.00 C ATOM 849 C TYR A 111 13.931 -6.992 0.277 1.00 0.00 C ATOM 850 O TYR A 111 14.425 -7.813 1.056 1.00 0.00 O ATOM 851 CB TYR A 111 11.559 -7.036 1.010 1.00 0.00 C ATOM 852 CG TYR A 111 11.290 -5.611 1.526 1.00 0.00 C ATOM 853 CD1 TYR A 111 12.240 -4.679 2.042 1.00 0.00 C ATOM 854 CD2 TYR A 111 10.039 -5.143 1.190 1.00 0.00 C ATOM 855 CE1 TYR A 111 11.917 -3.315 2.099 1.00 0.00 C ATOM 856 CE2 TYR A 111 9.773 -3.783 1.145 1.00 0.00 C ATOM 857 CZ TYR A 111 10.693 -2.862 1.620 1.00 0.00 C ATOM 858 OH TYR A 111 10.494 -1.525 1.433 1.00 0.00 O ATOM 0 H TYR A 111 11.178 -8.698 -0.676 1.00 0.00 H new ATOM 0 HA TYR A 111 12.419 -6.337 -1.032 1.00 0.00 H new ATOM 0 HB2 TYR A 111 10.605 -7.508 0.775 1.00 0.00 H new ATOM 0 HB3 TYR A 111 12.013 -7.618 1.812 1.00 0.00 H new ATOM 0 HD1 TYR A 111 13.204 -5.023 2.387 1.00 0.00 H new ATOM 0 HD2 TYR A 111 9.253 -5.846 0.958 1.00 0.00 H new ATOM 0 HE1 TYR A 111 12.623 -2.613 2.517 1.00 0.00 H new ATOM 0 HE2 TYR A 111 8.836 -3.437 0.734 1.00 0.00 H new ATOM 0 HH TYR A 111 9.535 -1.347 1.336 1.00 0.00 H new ATOM 859 N ASN A 112 14.563 -5.915 -0.201 1.00 0.00 N ATOM 860 CA ASN A 112 15.875 -5.463 0.282 1.00 0.00 C ATOM 861 C ASN A 112 15.748 -3.898 0.265 1.00 0.00 C ATOM 862 O ASN A 112 15.511 -3.227 -0.742 1.00 0.00 O ATOM 863 CB ASN A 112 17.065 -5.934 -0.575 1.00 0.00 C ATOM 864 CG ASN A 112 17.361 -7.434 -0.498 1.00 0.00 C ATOM 865 OD1 ASN A 112 17.697 -7.963 0.562 1.00 0.00 O ATOM 866 ND2 ASN A 112 17.253 -8.148 -1.604 1.00 0.00 N ATOM 0 H ASN A 112 14.177 -5.327 -0.940 1.00 0.00 H new ATOM 0 HA ASN A 112 16.095 -5.883 1.263 1.00 0.00 H new ATOM 0 HB2 ASN A 112 16.872 -5.669 -1.615 1.00 0.00 H new ATOM 0 HB3 ASN A 112 17.956 -5.386 -0.266 1.00 0.00 H new ATOM 0 HD21 ASN A 112 17.449 -9.149 -1.586 1.00 0.00 H new ATOM 0 HD22 ASN A 112 16.974 -7.698 -2.476 1.00 0.00 H new ATOM 867 N LYS A 113 15.991 -3.439 1.478 1.00 0.00 N ATOM 868 CA LYS A 113 15.892 -2.080 2.020 1.00 0.00 C ATOM 869 C LYS A 113 17.193 -1.296 1.917 1.00 0.00 C ATOM 870 O LYS A 113 18.040 -1.225 2.813 1.00 0.00 O ATOM 871 CB LYS A 113 15.370 -2.261 3.459 1.00 0.00 C ATOM 872 CG LYS A 113 16.212 -3.068 4.484 1.00 0.00 C ATOM 873 CD LYS A 113 16.553 -4.539 4.204 1.00 0.00 C ATOM 874 CE LYS A 113 17.942 -4.815 3.585 1.00 0.00 C ATOM 875 NZ LYS A 113 19.040 -4.741 4.567 1.00 0.00 N ATOM 0 H LYS A 113 16.302 -4.085 2.204 1.00 0.00 H new ATOM 0 HA LYS A 113 15.209 -1.460 1.439 1.00 0.00 H new ATOM 0 HB2 LYS A 113 15.213 -1.266 3.877 1.00 0.00 H new ATOM 0 HB3 LYS A 113 14.392 -2.737 3.394 1.00 0.00 H new ATOM 0 HG2 LYS A 113 17.154 -2.537 4.621 1.00 0.00 H new ATOM 0 HG3 LYS A 113 15.685 -3.033 5.437 1.00 0.00 H new ATOM 0 HD2 LYS A 113 16.480 -5.091 5.141 1.00 0.00 H new ATOM 0 HD3 LYS A 113 15.794 -4.945 3.535 1.00 0.00 H new ATOM 0 HE2 LYS A 113 17.939 -5.804 3.127 1.00 0.00 H new ATOM 0 HE3 LYS A 113 18.127 -4.095 2.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 19.944 -4.935 4.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 19.067 -3.790 4.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 18.884 -5.446 5.316 1.00 0.00 H new ATOM 876 N GLU A 114 17.373 -0.806 0.685 1.00 0.00 N ATOM 877 CA GLU A 114 18.727 -0.867 0.069 1.00 0.00 C ATOM 878 C GLU A 114 18.902 0.269 -0.923 1.00 0.00 C ATOM 879 O GLU A 114 19.825 1.080 -0.810 1.00 0.00 O ATOM 880 CB GLU A 114 18.988 -2.367 -0.197 1.00 0.00 C ATOM 881 CG GLU A 114 19.048 -2.787 -1.619 1.00 0.00 C ATOM 882 CD GLU A 114 20.377 -2.745 -2.322 1.00 0.00 C ATOM 883 OE1 GLU A 114 21.266 -3.577 -2.143 1.00 0.00 O ATOM 884 OE2 GLU A 114 20.475 -1.680 -3.181 1.00 0.00 O ATOM 0 H GLU A 114 16.646 -0.381 0.109 1.00 0.00 H new ATOM 0 HA GLU A 114 19.612 -0.610 0.652 1.00 0.00 H new ATOM 0 HB2 GLU A 114 19.930 -2.639 0.279 1.00 0.00 H new ATOM 0 HB3 GLU A 114 18.204 -2.942 0.296 1.00 0.00 H new ATOM 0 HG2 GLU A 114 18.673 -3.809 -1.680 1.00 0.00 H new ATOM 0 HG3 GLU A 114 18.356 -2.159 -2.180 1.00 0.00 H new ATOM 885 N HIS A 115 17.931 0.350 -1.841 1.00 0.00 N ATOM 886 CA HIS A 115 17.594 1.576 -2.567 1.00 0.00 C ATOM 887 C HIS A 115 16.379 2.204 -1.804 1.00 0.00 C ATOM 888 O HIS A 115 15.227 2.250 -2.223 1.00 0.00 O ATOM 889 CB HIS A 115 17.497 1.266 -4.074 1.00 0.00 C ATOM 890 CG HIS A 115 16.297 0.512 -4.641 1.00 0.00 C ATOM 891 ND1 HIS A 115 15.015 1.031 -4.671 1.00 0.00 N ATOM 892 CD2 HIS A 115 16.238 -0.845 -4.322 1.00 0.00 C ATOM 893 CE1 HIS A 115 14.370 -0.015 -4.040 1.00 0.00 C ATOM 894 NE2 HIS A 115 14.967 -1.246 -3.993 1.00 0.00 N ATOM 0 H HIS A 115 17.350 -0.447 -2.102 1.00 0.00 H new ATOM 0 HA HIS A 115 18.347 2.364 -2.574 1.00 0.00 H new ATOM 0 HB2 HIS A 115 17.555 2.218 -4.601 1.00 0.00 H new ATOM 0 HB3 HIS A 115 18.388 0.698 -4.342 1.00 0.00 H new ATOM 0 HD2 HIS A 115 17.094 -1.504 -4.333 1.00 0.00 H new ATOM 0 HE1 HIS A 115 13.402 0.137 -3.587 1.00 0.00 H new ATOM 0 HE2 HIS A 115 14.588 -2.169 -3.781 1.00 0.00 H new ATOM 895 N LYS A 116 16.597 2.638 -0.578 1.00 0.00 N ATOM 896 CA LYS A 116 15.780 3.579 0.140 1.00 0.00 C ATOM 897 C LYS A 116 16.429 4.920 -0.197 1.00 0.00 C ATOM 898 O LYS A 116 17.657 5.035 -0.375 1.00 0.00 O ATOM 899 CB LYS A 116 16.037 3.069 1.578 1.00 0.00 C ATOM 900 CG LYS A 116 15.820 4.163 2.597 1.00 0.00 C ATOM 901 CD LYS A 116 14.575 3.925 3.403 1.00 0.00 C ATOM 902 CE LYS A 116 14.346 5.172 4.265 1.00 0.00 C ATOM 903 NZ LYS A 116 13.547 4.933 5.476 1.00 0.00 N ATOM 0 H LYS A 116 17.397 2.321 -0.030 1.00 0.00 H new ATOM 0 HA LYS A 116 14.712 3.677 -0.053 1.00 0.00 H new ATOM 0 HB2 LYS A 116 15.373 2.232 1.793 1.00 0.00 H new ATOM 0 HB3 LYS A 116 17.058 2.694 1.656 1.00 0.00 H new ATOM 0 HG2 LYS A 116 16.681 4.217 3.263 1.00 0.00 H new ATOM 0 HG3 LYS A 116 15.748 5.125 2.090 1.00 0.00 H new ATOM 0 HD2 LYS A 116 13.721 3.748 2.749 1.00 0.00 H new ATOM 0 HD3 LYS A 116 14.686 3.040 4.029 1.00 0.00 H new ATOM 0 HE2 LYS A 116 15.314 5.580 4.557 1.00 0.00 H new ATOM 0 HE3 LYS A 116 13.850 5.931 3.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 12.681 5.507 5.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 13.293 3.926 5.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 14.102 5.196 6.315 1.00 0.00 H new ATOM 904 N ASN A 117 15.601 5.979 -0.073 1.00 0.00 N ATOM 905 CA ASN A 117 16.137 7.348 0.188 1.00 0.00 C ATOM 906 C ASN A 117 16.469 8.070 -1.122 1.00 0.00 C ATOM 907 O ASN A 117 16.017 9.199 -1.327 1.00 0.00 O ATOM 908 CB ASN A 117 17.266 7.304 1.273 1.00 0.00 C ATOM 909 CG ASN A 117 17.253 8.445 2.268 1.00 0.00 C ATOM 910 OD1 ASN A 117 17.755 9.535 1.995 1.00 0.00 O ATOM 911 ND2 ASN A 117 16.682 8.233 3.441 1.00 0.00 N ATOM 0 H ASN A 117 14.585 5.925 -0.146 1.00 0.00 H new ATOM 0 HA ASN A 117 15.368 7.978 0.636 1.00 0.00 H new ATOM 0 HB2 ASN A 117 17.184 6.365 1.821 1.00 0.00 H new ATOM 0 HB3 ASN A 117 18.232 7.295 0.768 1.00 0.00 H new ATOM 0 HD21 ASN A 117 16.653 8.979 4.136 1.00 0.00 H new ATOM 0 HD22 ASN A 117 16.271 7.324 3.651 1.00 0.00 H new ATOM 912 N LEU A 118 17.233 7.332 -1.975 1.00 0.00 N ATOM 913 CA LEU A 118 17.454 7.665 -3.413 1.00 0.00 C ATOM 914 C LEU A 118 17.711 9.150 -3.669 1.00 0.00 C ATOM 915 O LEU A 118 18.488 9.788 -2.949 1.00 0.00 O ATOM 916 CB LEU A 118 16.459 6.853 -4.249 1.00 0.00 C ATOM 917 CG LEU A 118 16.748 5.308 -4.200 1.00 0.00 C ATOM 918 CD1 LEU A 118 15.407 4.653 -3.986 1.00 0.00 C ATOM 919 CD2 LEU A 118 17.158 4.641 -5.502 1.00 0.00 C ATOM 0 H LEU A 118 17.717 6.483 -1.682 1.00 0.00 H new ATOM 0 HA LEU A 118 18.418 7.330 -3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 118 15.448 7.041 -3.888 1.00 0.00 H new ATOM 0 HB3 LEU A 118 16.497 7.193 -5.284 1.00 0.00 H new ATOM 0 HG LEU A 118 17.543 5.200 -3.462 1.00 0.00 H new ATOM 0 HD11 LEU A 118 15.533 3.571 -3.942 1.00 0.00 H new ATOM 0 HD12 LEU A 118 14.975 5.006 -3.050 1.00 0.00 H new ATOM 0 HD13 LEU A 118 14.742 4.907 -4.812 1.00 0.00 H new ATOM 0 HD21 LEU A 118 17.327 3.578 -5.329 1.00 0.00 H new ATOM 0 HD22 LEU A 118 16.366 4.767 -6.240 1.00 0.00 H new ATOM 0 HD23 LEU A 118 18.076 5.099 -5.872 1.00 0.00 H new ATOM 920 N ASP A 119 17.134 9.661 -4.750 1.00 0.00 N ATOM 921 CA ASP A 119 17.659 10.866 -5.434 1.00 0.00 C ATOM 922 C ASP A 119 16.656 11.421 -6.458 1.00 0.00 C ATOM 923 O ASP A 119 16.308 12.605 -6.419 1.00 0.00 O ATOM 924 CB ASP A 119 19.054 10.509 -5.964 1.00 0.00 C ATOM 925 CG ASP A 119 20.109 11.597 -5.949 1.00 0.00 C ATOM 926 OD1 ASP A 119 19.611 12.838 -6.263 1.00 0.00 O ATOM 927 OD2 ASP A 119 21.290 11.376 -5.685 1.00 0.00 O ATOM 0 H ASP A 119 16.299 9.267 -5.183 1.00 0.00 H new ATOM 0 HA ASP A 119 17.780 11.711 -4.756 1.00 0.00 H new ATOM 0 HB2 ASP A 119 19.430 9.668 -5.381 1.00 0.00 H new ATOM 0 HB3 ASP A 119 18.944 10.161 -6.991 1.00 0.00 H new ATOM 928 N THR A 120 16.135 10.524 -7.295 1.00 0.00 N ATOM 929 CA THR A 120 14.820 10.677 -7.963 1.00 0.00 C ATOM 930 C THR A 120 15.009 11.310 -9.332 1.00 0.00 C ATOM 931 O THR A 120 14.387 12.318 -9.678 1.00 0.00 O ATOM 932 CB THR A 120 13.619 11.038 -7.039 1.00 0.00 C ATOM 933 OG1 THR A 120 13.470 12.438 -6.837 1.00 0.00 O ATOM 934 CG2 THR A 120 13.755 10.321 -5.672 1.00 0.00 C ATOM 0 H THR A 120 16.612 9.656 -7.539 1.00 0.00 H new ATOM 0 HA THR A 120 14.393 9.707 -8.218 1.00 0.00 H new ATOM 0 HB THR A 120 12.721 10.693 -7.552 1.00 0.00 H new ATOM 0 HG1 THR A 120 14.348 12.839 -6.667 1.00 0.00 H new ATOM 0 HG21 THR A 120 12.908 10.583 -5.038 1.00 0.00 H new ATOM 0 HG22 THR A 120 13.772 9.242 -5.827 1.00 0.00 H new ATOM 0 HG23 THR A 120 14.681 10.632 -5.188 1.00 0.00 H new ATOM 935 N LYS A 121 15.911 10.659 -10.108 1.00 0.00 N ATOM 936 CA LYS A 121 16.282 11.101 -11.477 1.00 0.00 C ATOM 937 C LYS A 121 16.790 9.824 -12.239 1.00 0.00 C ATOM 938 O LYS A 121 16.230 9.409 -13.255 1.00 0.00 O ATOM 939 CB LYS A 121 17.315 12.239 -11.567 1.00 0.00 C ATOM 940 CG LYS A 121 17.582 13.150 -10.363 1.00 0.00 C ATOM 941 CD LYS A 121 19.043 13.115 -9.892 1.00 0.00 C ATOM 942 CE LYS A 121 19.464 11.736 -9.359 1.00 0.00 C ATOM 943 NZ LYS A 121 20.901 11.751 -9.044 1.00 0.00 N ATOM 0 H LYS A 121 16.400 9.817 -9.805 1.00 0.00 H new ATOM 0 HA LYS A 121 15.394 11.544 -11.928 1.00 0.00 H new ATOM 0 HB2 LYS A 121 18.267 11.787 -11.845 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.014 12.881 -12.395 1.00 0.00 H new ATOM 0 HG2 LYS A 121 17.315 14.174 -10.624 1.00 0.00 H new ATOM 0 HG3 LYS A 121 16.934 12.852 -9.539 1.00 0.00 H new ATOM 0 HD2 LYS A 121 19.694 13.393 -10.721 1.00 0.00 H new ATOM 0 HD3 LYS A 121 19.186 13.861 -9.110 1.00 0.00 H new ATOM 0 HE2 LYS A 121 18.888 11.487 -8.468 1.00 0.00 H new ATOM 0 HE3 LYS A 121 19.251 10.967 -10.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 21.187 10.818 -8.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 21.443 11.971 -9.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 21.090 12.475 -8.321 1.00 0.00 H new ATOM 944 N LYS A 122 17.809 9.209 -11.628 1.00 0.00 N ATOM 945 CA LYS A 122 18.183 7.808 -11.784 1.00 0.00 C ATOM 946 C LYS A 122 17.012 6.803 -11.377 1.00 0.00 C ATOM 947 O LYS A 122 16.670 5.853 -12.079 1.00 0.00 O ATOM 948 CB LYS A 122 19.233 7.746 -10.597 1.00 0.00 C ATOM 949 CG LYS A 122 20.625 8.108 -10.954 1.00 0.00 C ATOM 950 CD LYS A 122 21.651 7.996 -9.829 1.00 0.00 C ATOM 951 CE LYS A 122 22.802 8.925 -10.202 1.00 0.00 C ATOM 952 NZ LYS A 122 23.947 8.851 -9.277 1.00 0.00 N ATOM 0 H LYS A 122 18.422 9.704 -10.980 1.00 0.00 H new ATOM 0 HA LYS A 122 18.483 7.542 -12.798 1.00 0.00 H new ATOM 0 HB2 LYS A 122 18.896 8.412 -9.802 1.00 0.00 H new ATOM 0 HB3 LYS A 122 19.233 6.736 -10.188 1.00 0.00 H new ATOM 0 HG2 LYS A 122 20.946 7.470 -11.778 1.00 0.00 H new ATOM 0 HG3 LYS A 122 20.630 9.133 -11.324 1.00 0.00 H new ATOM 0 HD2 LYS A 122 21.213 8.285 -8.874 1.00 0.00 H new ATOM 0 HD3 LYS A 122 22.000 6.969 -9.722 1.00 0.00 H new ATOM 0 HE2 LYS A 122 23.143 8.681 -11.208 1.00 0.00 H new ATOM 0 HE3 LYS A 122 22.435 9.951 -10.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 24.690 9.507 -9.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 23.637 9.112 -8.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 24.323 7.881 -9.267 1.00 0.00 H new ATOM 953 N TYR A 123 16.474 7.146 -10.210 1.00 0.00 N ATOM 954 CA TYR A 123 15.536 6.427 -9.353 1.00 0.00 C ATOM 955 C TYR A 123 14.090 6.777 -9.693 1.00 0.00 C ATOM 956 O TYR A 123 13.297 5.846 -9.849 1.00 0.00 O ATOM 957 CB TYR A 123 16.201 6.937 -8.047 1.00 0.00 C ATOM 958 CG TYR A 123 17.694 6.438 -7.802 1.00 0.00 C ATOM 959 CD1 TYR A 123 18.254 5.281 -8.387 1.00 0.00 C ATOM 960 CD2 TYR A 123 18.513 7.233 -7.025 1.00 0.00 C ATOM 961 CE1 TYR A 123 19.618 5.044 -8.291 1.00 0.00 C ATOM 962 CE2 TYR A 123 19.877 6.995 -6.930 1.00 0.00 C ATOM 963 CZ TYR A 123 20.435 5.879 -7.543 1.00 0.00 C ATOM 964 OH TYR A 123 21.785 5.689 -7.527 1.00 0.00 O ATOM 0 H TYR A 123 16.715 8.045 -9.792 1.00 0.00 H new ATOM 0 HA TYR A 123 15.409 5.345 -9.386 1.00 0.00 H new ATOM 0 HB2 TYR A 123 16.197 8.027 -8.059 1.00 0.00 H new ATOM 0 HB3 TYR A 123 15.588 6.625 -7.201 1.00 0.00 H new ATOM 0 HD1 TYR A 123 17.620 4.580 -8.910 1.00 0.00 H new ATOM 0 HD2 TYR A 123 18.082 8.059 -6.479 1.00 0.00 H new ATOM 0 HE1 TYR A 123 20.049 4.198 -8.806 1.00 0.00 H new ATOM 0 HE2 TYR A 123 20.506 7.678 -6.379 1.00 0.00 H new ATOM 0 HH TYR A 123 22.204 6.364 -6.953 1.00 0.00 H new ATOM 965 N CYS A 124 13.765 8.089 -9.857 1.00 0.00 N ATOM 966 CA CYS A 124 12.511 8.575 -10.469 1.00 0.00 C ATOM 967 C CYS A 124 12.410 10.087 -10.732 1.00 0.00 C ATOM 968 O CYS A 124 12.862 10.621 -11.745 1.00 0.00 O ATOM 969 CB CYS A 124 11.246 7.953 -9.923 1.00 0.00 C ATOM 970 SG CYS A 124 10.548 6.737 -11.021 1.00 0.00 S ATOM 971 OXT CYS A 124 11.747 10.772 -9.745 1.00 0.00 O ATOM 0 H CYS A 124 14.382 8.845 -9.560 1.00 0.00 H new ATOM 0 HA CYS A 124 12.601 8.170 -11.477 1.00 0.00 H new ATOM 0 HB2 CYS A 124 11.461 7.487 -8.961 1.00 0.00 H new ATOM 0 HB3 CYS A 124 10.510 8.736 -9.740 1.00 0.00 H new TER 972 CYS A 124 HETATM 973 CA CA A 125 2.121 5.652 -4.173 1.00 0.00 CA