USER MOD reduce.3.24.130724 H: found=0, std=0, add=896, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 893 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 37 LYS NZ :NH3+ -157:sc= -0.131 (180deg=-1.65) USER MOD Set 1.2: A 67 HIS : no HD1:sc= -1.79! C(o=-1.9!,f=-7.6!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl 159:sc= -0.292 (180deg=-1.46!) USER MOD Single : A 11 LYS NZ :NH3+ -141:sc= 1.65 (180deg=0.195) USER MOD Single : A 12 ASN : amide:sc= 0.841 K(o=0.84,f=-0.048) USER MOD Single : A 19 LYS NZ :NH3+ -169:sc= -0.748 (180deg=-1.02) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 164:sc= -0.0059 (180deg=-0.103) USER MOD Single : A 29 ASN :FLIP amide:sc= -1.31 F(o=-4.6!,f=-1.3) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.0252 USER MOD Single : A 40 HIS : no HD1:sc= -1.28 K(o=-1.3,f=-3.3!) USER MOD Single : A 41 TYR OH : rot -165:sc= -2.19 USER MOD Single : A 45 CYS SG : rot 16:sc= -2.04! USER MOD Single : A 47 GLN : amide:sc= -1.76! C(o=-1.8!,f=-3.8!) USER MOD Single : A 57 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.34) USER MOD Single : A 62 ASN :FLIP amide:sc= -0.858! C(o=-13!,f=-0.86!) USER MOD Single : A 66 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.209) USER MOD Single : A 68 HIS : no HD1:sc= -1.55! C(o=-1.6!,f=-1.3!) USER MOD Single : A 70 THR OG1 : rot 117:sc= -6.92! USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot -130:sc= -0.27 USER MOD Single : A 80 HIS : no HD1:sc= -0.361 K(o=-0.36,f=-3.2) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 CYS SG : rot -168:sc= -2.76! USER MOD Single : A 85 LYS NZ :NH3+ -163:sc= -0.0623 (180deg=-0.506) USER MOD Single : A 89 SER OG : rot -29:sc= 0.0108 USER MOD Single : A 90 LYS NZ :NH3+ 151:sc= -4.92! (180deg=-6.78!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= -2.47! (180deg=-2.47!) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.0487 USER MOD Single : A 97 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.336) USER MOD Single : A 103 THR OG1 : rot -143:sc= -0.861! USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.206! USER MOD Single : A 110 ASN :FLIP amide:sc= -15.9! C(o=-21!,f=-16!) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 162:sc= -1.02 (180deg=-1.64) USER MOD Single : A 118 GLN : amide:sc= -15.1! C(o=-15!,f=-31!) USER MOD ----------------------------------------------------------------- ATOM 43 N LYS A 4 -6.745 -8.424 85.876 1.00 0.00 N ATOM 44 CA LYS A 4 -6.744 -8.071 87.323 1.00 0.00 C ATOM 45 C LYS A 4 -6.212 -9.244 88.154 1.00 0.00 C ATOM 46 O LYS A 4 -5.161 -9.161 88.754 1.00 0.00 O ATOM 47 CB LYS A 4 -8.170 -7.732 87.755 1.00 0.00 C ATOM 48 CG LYS A 4 -8.697 -6.586 86.889 1.00 0.00 C ATOM 49 CD LYS A 4 -9.961 -6.002 87.519 1.00 0.00 C ATOM 50 CE LYS A 4 -10.391 -4.763 86.733 1.00 0.00 C ATOM 51 NZ LYS A 4 -11.463 -4.046 87.479 1.00 0.00 N ATOM 0 HA LYS A 4 -6.096 -7.209 87.485 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.812 -8.607 87.652 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -8.186 -7.447 88.807 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.936 -5.811 86.792 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.914 -6.947 85.884 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -10.759 -6.744 87.515 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.774 -5.740 88.560 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.537 -4.103 86.579 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.752 -5.053 85.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -11.755 -3.204 86.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -12.280 -4.677 87.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.103 -3.756 88.411 1.00 0.00 H new ATOM 65 N GLU A 5 -6.925 -10.334 88.197 1.00 0.00 N ATOM 66 CA GLU A 5 -6.452 -11.504 88.994 1.00 0.00 C ATOM 67 C GLU A 5 -5.038 -11.892 88.553 1.00 0.00 C ATOM 68 O GLU A 5 -4.132 -12.002 89.356 1.00 0.00 O ATOM 69 CB GLU A 5 -7.395 -12.686 88.764 1.00 0.00 C ATOM 70 CG GLU A 5 -7.020 -13.834 89.703 1.00 0.00 C ATOM 71 CD GLU A 5 -7.934 -15.031 89.431 1.00 0.00 C ATOM 72 OE1 GLU A 5 -8.614 -15.013 88.419 1.00 0.00 O ATOM 73 OE2 GLU A 5 -7.938 -15.945 90.240 1.00 0.00 O ATOM 0 H GLU A 5 -7.814 -10.467 87.716 1.00 0.00 H new ATOM 0 HA GLU A 5 -6.441 -11.240 90.052 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -8.426 -12.381 88.941 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -7.334 -13.016 87.727 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -5.978 -14.116 89.552 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.117 -13.516 90.741 1.00 0.00 H new ATOM 80 N PHE A 6 -4.849 -12.106 87.283 1.00 0.00 N ATOM 81 CA PHE A 6 -3.507 -12.496 86.768 1.00 0.00 C ATOM 82 C PHE A 6 -2.468 -11.457 87.217 1.00 0.00 C ATOM 83 O PHE A 6 -1.418 -11.790 87.732 1.00 0.00 O ATOM 84 CB PHE A 6 -3.576 -12.526 85.233 1.00 0.00 C ATOM 85 CG PHE A 6 -2.517 -13.444 84.654 1.00 0.00 C ATOM 86 CD1 PHE A 6 -1.171 -13.303 85.015 1.00 0.00 C ATOM 87 CD2 PHE A 6 -2.891 -14.438 83.738 1.00 0.00 C ATOM 88 CE1 PHE A 6 -0.204 -14.155 84.466 1.00 0.00 C ATOM 89 CE2 PHE A 6 -1.924 -15.288 83.188 1.00 0.00 C ATOM 90 CZ PHE A 6 -0.580 -15.147 83.553 1.00 0.00 C ATOM 0 H PHE A 6 -5.575 -12.027 86.571 1.00 0.00 H new ATOM 0 HA PHE A 6 -3.220 -13.475 87.152 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -4.564 -12.862 84.917 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -3.441 -11.518 84.841 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -0.878 -12.537 85.717 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -3.928 -14.548 83.456 1.00 0.00 H new ATOM 0 HE1 PHE A 6 0.833 -14.046 84.748 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -2.215 -16.052 82.482 1.00 0.00 H new ATOM 0 HZ PHE A 6 0.166 -15.803 83.130 1.00 0.00 H new ATOM 100 N MET A 7 -2.749 -10.205 86.994 1.00 0.00 N ATOM 101 CA MET A 7 -1.787 -9.127 87.362 1.00 0.00 C ATOM 102 C MET A 7 -1.774 -8.876 88.878 1.00 0.00 C ATOM 103 O MET A 7 -0.742 -8.922 89.518 1.00 0.00 O ATOM 104 CB MET A 7 -2.203 -7.844 86.636 1.00 0.00 C ATOM 105 CG MET A 7 -1.460 -6.643 87.225 1.00 0.00 C ATOM 106 SD MET A 7 -1.532 -5.257 86.061 1.00 0.00 S ATOM 107 CE MET A 7 -3.297 -5.367 85.670 1.00 0.00 C ATOM 0 H MET A 7 -3.615 -9.877 86.567 1.00 0.00 H new ATOM 0 HA MET A 7 -0.783 -9.434 87.068 1.00 0.00 H new ATOM 0 HB2 MET A 7 -1.983 -7.931 85.572 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.279 -7.697 86.728 1.00 0.00 H new ATOM 0 HG2 MET A 7 -1.908 -6.356 88.177 1.00 0.00 H new ATOM 0 HG3 MET A 7 -0.422 -6.908 87.428 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.642 -4.412 85.275 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.457 -6.147 84.925 1.00 0.00 H new ATOM 0 HE3 MET A 7 -3.856 -5.609 86.574 1.00 0.00 H new ATOM 117 N TRP A 8 -2.907 -8.583 89.450 1.00 0.00 N ATOM 118 CA TRP A 8 -2.960 -8.299 90.914 1.00 0.00 C ATOM 119 C TRP A 8 -2.214 -9.379 91.698 1.00 0.00 C ATOM 120 O TRP A 8 -1.960 -9.238 92.878 1.00 0.00 O ATOM 121 CB TRP A 8 -4.422 -8.260 91.365 1.00 0.00 C ATOM 122 CG TRP A 8 -4.493 -7.847 92.798 1.00 0.00 C ATOM 123 CD1 TRP A 8 -4.480 -8.693 93.852 1.00 0.00 C ATOM 124 CD2 TRP A 8 -4.588 -6.503 93.352 1.00 0.00 C ATOM 125 NE1 TRP A 8 -4.563 -7.954 95.019 1.00 0.00 N ATOM 126 CE2 TRP A 8 -4.630 -6.599 94.762 1.00 0.00 C ATOM 127 CE3 TRP A 8 -4.640 -5.223 92.772 1.00 0.00 C ATOM 128 CZ2 TRP A 8 -4.723 -5.466 95.570 1.00 0.00 C ATOM 129 CZ3 TRP A 8 -4.734 -4.080 93.581 1.00 0.00 C ATOM 130 CH2 TRP A 8 -4.773 -4.201 94.978 1.00 0.00 C ATOM 0 H TRP A 8 -3.803 -8.527 88.966 1.00 0.00 H new ATOM 0 HA TRP A 8 -2.483 -7.338 91.106 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -4.985 -7.561 90.746 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -4.879 -9.241 91.236 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -4.415 -9.769 93.793 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -4.573 -8.360 95.954 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -4.607 -5.119 91.698 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -4.756 -5.565 96.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -4.777 -3.102 93.125 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -4.842 -3.318 95.595 1.00 0.00 H new ATOM 141 N ALA A 9 -1.867 -10.458 91.058 1.00 0.00 N ATOM 142 CA ALA A 9 -1.146 -11.549 91.770 1.00 0.00 C ATOM 143 C ALA A 9 0.358 -11.259 91.802 1.00 0.00 C ATOM 144 O ALA A 9 0.986 -11.314 92.840 1.00 0.00 O ATOM 145 CB ALA A 9 -1.398 -12.874 91.049 1.00 0.00 C ATOM 0 H ALA A 9 -2.052 -10.633 90.070 1.00 0.00 H new ATOM 0 HA ALA A 9 -1.513 -11.610 92.795 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.872 -13.676 91.567 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.467 -13.087 91.042 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -1.035 -12.805 90.024 1.00 0.00 H new ATOM 151 N LEU A 10 0.938 -10.957 90.673 1.00 0.00 N ATOM 152 CA LEU A 10 2.401 -10.671 90.641 1.00 0.00 C ATOM 153 C LEU A 10 2.771 -9.702 91.764 1.00 0.00 C ATOM 154 O LEU A 10 3.821 -9.800 92.366 1.00 0.00 O ATOM 155 CB LEU A 10 2.786 -10.008 89.311 1.00 0.00 C ATOM 156 CG LEU A 10 2.233 -10.794 88.113 1.00 0.00 C ATOM 157 CD1 LEU A 10 1.789 -9.809 87.027 1.00 0.00 C ATOM 158 CD2 LEU A 10 3.328 -11.704 87.542 1.00 0.00 C ATOM 0 H LEU A 10 0.463 -10.896 89.772 1.00 0.00 H new ATOM 0 HA LEU A 10 2.930 -11.617 90.760 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.403 -8.988 89.287 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.871 -9.943 89.236 1.00 0.00 H new ATOM 0 HG LEU A 10 1.387 -11.400 88.438 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.395 -10.361 86.174 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.013 -9.154 87.425 1.00 0.00 H new ATOM 0 HD13 LEU A 10 2.642 -9.209 86.709 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.932 -12.260 86.692 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.173 -11.097 87.217 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.658 -12.403 88.311 1.00 0.00 H new ATOM 170 N LYS A 11 1.932 -8.738 92.008 1.00 0.00 N ATOM 171 CA LYS A 11 2.240 -7.708 93.047 1.00 0.00 C ATOM 172 C LYS A 11 1.829 -8.161 94.448 1.00 0.00 C ATOM 173 O LYS A 11 2.558 -7.981 95.405 1.00 0.00 O ATOM 174 CB LYS A 11 1.476 -6.426 92.703 1.00 0.00 C ATOM 175 CG LYS A 11 1.683 -5.378 93.806 1.00 0.00 C ATOM 176 CD LYS A 11 0.440 -5.314 94.703 1.00 0.00 C ATOM 177 CE LYS A 11 -0.684 -4.574 93.973 1.00 0.00 C ATOM 178 NZ LYS A 11 -1.744 -4.202 94.950 1.00 0.00 N ATOM 0 H LYS A 11 1.039 -8.615 91.531 1.00 0.00 H new ATOM 0 HA LYS A 11 3.318 -7.544 93.050 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.822 -6.033 91.747 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.414 -6.645 92.593 1.00 0.00 H new ATOM 0 HG2 LYS A 11 2.560 -5.632 94.402 1.00 0.00 H new ATOM 0 HG3 LYS A 11 1.872 -4.401 93.361 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.116 -6.321 94.964 1.00 0.00 H new ATOM 0 HD3 LYS A 11 0.679 -4.804 95.636 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.291 -3.681 93.487 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -1.102 -5.206 93.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -2.679 -4.329 94.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -1.670 -4.810 95.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.625 -3.207 95.230 1.00 0.00 H new ATOM 192 N ASN A 12 0.660 -8.704 94.594 1.00 0.00 N ATOM 193 CA ASN A 12 0.210 -9.107 95.959 1.00 0.00 C ATOM 194 C ASN A 12 0.848 -10.433 96.369 1.00 0.00 C ATOM 195 O ASN A 12 0.372 -11.118 97.254 1.00 0.00 O ATOM 196 CB ASN A 12 -1.314 -9.229 95.988 1.00 0.00 C ATOM 197 CG ASN A 12 -1.811 -9.051 97.425 1.00 0.00 C ATOM 198 OD1 ASN A 12 -1.808 -7.955 97.952 1.00 0.00 O ATOM 199 ND2 ASN A 12 -2.234 -10.093 98.085 1.00 0.00 N ATOM 0 H ASN A 12 -0.002 -8.887 93.840 1.00 0.00 H new ATOM 0 HA ASN A 12 0.524 -8.341 96.668 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -1.763 -8.476 95.340 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -1.619 -10.202 95.604 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -2.563 -9.990 99.045 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -2.236 -11.011 97.641 1.00 0.00 H new ATOM 206 N GLY A 13 1.945 -10.778 95.760 1.00 0.00 N ATOM 207 CA GLY A 13 2.654 -12.029 96.129 1.00 0.00 C ATOM 208 C GLY A 13 1.743 -13.253 96.000 1.00 0.00 C ATOM 209 O GLY A 13 2.096 -14.330 96.437 1.00 0.00 O ATOM 0 H GLY A 13 2.385 -10.239 95.014 1.00 0.00 H new ATOM 0 HA2 GLY A 13 3.527 -12.155 95.489 1.00 0.00 H new ATOM 0 HA3 GLY A 13 3.019 -11.953 97.153 1.00 0.00 H new ATOM 213 N ASP A 14 0.588 -13.122 95.403 1.00 0.00 N ATOM 214 CA ASP A 14 -0.292 -14.314 95.263 1.00 0.00 C ATOM 215 C ASP A 14 0.384 -15.292 94.311 1.00 0.00 C ATOM 216 O ASP A 14 -0.212 -15.820 93.395 1.00 0.00 O ATOM 217 CB ASP A 14 -1.638 -13.912 94.691 1.00 0.00 C ATOM 218 CG ASP A 14 -2.139 -12.645 95.385 1.00 0.00 C ATOM 219 OD1 ASP A 14 -1.659 -12.357 96.469 1.00 0.00 O ATOM 220 OD2 ASP A 14 -2.998 -11.986 94.822 1.00 0.00 O ATOM 0 H ASP A 14 0.222 -12.254 95.012 1.00 0.00 H new ATOM 0 HA ASP A 14 -0.451 -14.770 96.240 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.551 -13.740 93.618 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.357 -14.720 94.826 1.00 0.00 H new ATOM 225 N LEU A 15 1.638 -15.509 94.534 1.00 0.00 N ATOM 226 CA LEU A 15 2.437 -16.424 93.685 1.00 0.00 C ATOM 227 C LEU A 15 1.606 -17.655 93.312 1.00 0.00 C ATOM 228 O LEU A 15 1.729 -18.200 92.235 1.00 0.00 O ATOM 229 CB LEU A 15 3.680 -16.822 94.492 1.00 0.00 C ATOM 230 CG LEU A 15 4.669 -17.656 93.664 1.00 0.00 C ATOM 231 CD1 LEU A 15 4.266 -19.132 93.688 1.00 0.00 C ATOM 232 CD2 LEU A 15 4.729 -17.159 92.214 1.00 0.00 C ATOM 0 H LEU A 15 2.163 -15.077 95.295 1.00 0.00 H new ATOM 0 HA LEU A 15 2.733 -15.939 92.755 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.179 -15.923 94.853 1.00 0.00 H new ATOM 0 HB3 LEU A 15 3.374 -17.391 95.370 1.00 0.00 H new ATOM 0 HG LEU A 15 5.658 -17.545 94.109 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.975 -19.712 93.097 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.269 -19.493 94.716 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.267 -19.243 93.267 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.437 -17.767 91.650 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.741 -17.238 91.761 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.052 -16.118 92.199 1.00 0.00 H new ATOM 244 N ASP A 16 0.755 -18.085 94.190 1.00 0.00 N ATOM 245 CA ASP A 16 -0.092 -19.266 93.900 1.00 0.00 C ATOM 246 C ASP A 16 -1.026 -18.964 92.722 1.00 0.00 C ATOM 247 O ASP A 16 -1.430 -19.849 91.992 1.00 0.00 O ATOM 248 CB ASP A 16 -0.923 -19.577 95.140 1.00 0.00 C ATOM 249 CG ASP A 16 0.004 -19.965 96.293 1.00 0.00 C ATOM 250 OD1 ASP A 16 1.198 -19.745 96.168 1.00 0.00 O ATOM 251 OD2 ASP A 16 -0.494 -20.475 97.283 1.00 0.00 O ATOM 0 H ASP A 16 0.608 -17.664 95.107 1.00 0.00 H new ATOM 0 HA ASP A 16 0.536 -20.118 93.640 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.521 -18.709 95.417 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.619 -20.389 94.930 1.00 0.00 H new ATOM 256 N GLU A 17 -1.389 -17.723 92.546 1.00 0.00 N ATOM 257 CA GLU A 17 -2.315 -17.363 91.431 1.00 0.00 C ATOM 258 C GLU A 17 -1.561 -17.305 90.096 1.00 0.00 C ATOM 259 O GLU A 17 -2.013 -17.842 89.102 1.00 0.00 O ATOM 260 CB GLU A 17 -2.955 -16.005 91.726 1.00 0.00 C ATOM 261 CG GLU A 17 -4.046 -16.176 92.787 1.00 0.00 C ATOM 262 CD GLU A 17 -4.789 -14.853 92.980 1.00 0.00 C ATOM 263 OE1 GLU A 17 -4.215 -13.955 93.574 1.00 0.00 O ATOM 264 OE2 GLU A 17 -5.920 -14.760 92.533 1.00 0.00 O ATOM 0 H GLU A 17 -1.085 -16.941 93.126 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.089 -18.127 91.354 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.199 -15.303 92.076 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.381 -15.586 90.815 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.744 -16.955 92.482 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.603 -16.496 93.730 1.00 0.00 H new ATOM 271 N VAL A 18 -0.419 -16.674 90.049 1.00 0.00 N ATOM 272 CA VAL A 18 0.328 -16.618 88.757 1.00 0.00 C ATOM 273 C VAL A 18 0.849 -18.019 88.442 1.00 0.00 C ATOM 274 O VAL A 18 1.131 -18.354 87.308 1.00 0.00 O ATOM 275 CB VAL A 18 1.513 -15.648 88.865 1.00 0.00 C ATOM 276 CG1 VAL A 18 1.115 -14.277 88.311 1.00 0.00 C ATOM 277 CG2 VAL A 18 1.932 -15.506 90.332 1.00 0.00 C ATOM 0 H VAL A 18 0.025 -16.201 90.836 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.336 -16.268 87.967 1.00 0.00 H new ATOM 0 HB VAL A 18 2.349 -16.041 88.286 1.00 0.00 H new ATOM 0 HG11 VAL A 18 1.960 -13.593 88.390 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.826 -14.377 87.265 1.00 0.00 H new ATOM 0 HG13 VAL A 18 0.275 -13.883 88.883 1.00 0.00 H new ATOM 0 HG21 VAL A 18 2.773 -14.817 90.405 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.095 -15.120 90.914 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.226 -16.480 90.722 1.00 0.00 H new ATOM 287 N LYS A 19 0.982 -18.832 89.450 1.00 0.00 N ATOM 288 CA LYS A 19 1.488 -20.216 89.249 1.00 0.00 C ATOM 289 C LYS A 19 0.440 -21.056 88.522 1.00 0.00 C ATOM 290 O LYS A 19 0.762 -21.941 87.758 1.00 0.00 O ATOM 291 CB LYS A 19 1.782 -20.836 90.618 1.00 0.00 C ATOM 292 CG LYS A 19 2.507 -22.174 90.447 1.00 0.00 C ATOM 293 CD LYS A 19 3.180 -22.569 91.769 1.00 0.00 C ATOM 294 CE LYS A 19 4.586 -21.970 91.833 1.00 0.00 C ATOM 295 NZ LYS A 19 5.131 -22.128 93.210 1.00 0.00 N ATOM 0 H LYS A 19 0.759 -18.593 90.416 1.00 0.00 H new ATOM 0 HA LYS A 19 2.396 -20.190 88.647 1.00 0.00 H new ATOM 0 HB2 LYS A 19 2.394 -20.155 91.210 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.851 -20.986 91.165 1.00 0.00 H new ATOM 0 HG2 LYS A 19 1.800 -22.946 90.143 1.00 0.00 H new ATOM 0 HG3 LYS A 19 3.253 -22.096 89.657 1.00 0.00 H new ATOM 0 HD2 LYS A 19 2.585 -22.215 92.611 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.233 -23.655 91.851 1.00 0.00 H new ATOM 0 HE2 LYS A 19 5.237 -22.466 91.114 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.556 -20.915 91.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 5.999 -21.563 93.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 4.427 -21.801 93.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 5.349 -23.130 93.384 1.00 0.00 H new ATOM 309 N ASP A 20 -0.808 -20.791 88.769 1.00 0.00 N ATOM 310 CA ASP A 20 -1.891 -21.577 88.115 1.00 0.00 C ATOM 311 C ASP A 20 -1.957 -21.269 86.612 1.00 0.00 C ATOM 312 O ASP A 20 -2.068 -22.158 85.786 1.00 0.00 O ATOM 313 CB ASP A 20 -3.230 -21.217 88.765 1.00 0.00 C ATOM 314 CG ASP A 20 -4.243 -22.334 88.503 1.00 0.00 C ATOM 315 OD1 ASP A 20 -4.034 -23.088 87.566 1.00 0.00 O ATOM 316 OD2 ASP A 20 -5.210 -22.415 89.241 1.00 0.00 O ATOM 0 H ASP A 20 -1.130 -20.058 89.401 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.681 -22.639 88.242 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.099 -21.075 89.838 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.600 -20.274 88.362 1.00 0.00 H new ATOM 321 N TYR A 21 -1.916 -20.016 86.252 1.00 0.00 N ATOM 322 CA TYR A 21 -2.010 -19.655 84.808 1.00 0.00 C ATOM 323 C TYR A 21 -0.895 -20.332 84.008 1.00 0.00 C ATOM 324 O TYR A 21 -1.156 -21.080 83.089 1.00 0.00 O ATOM 325 CB TYR A 21 -1.908 -18.135 84.654 1.00 0.00 C ATOM 326 CG TYR A 21 -3.262 -17.520 84.922 1.00 0.00 C ATOM 327 CD1 TYR A 21 -4.273 -17.608 83.956 1.00 0.00 C ATOM 328 CD2 TYR A 21 -3.510 -16.870 86.137 1.00 0.00 C ATOM 329 CE1 TYR A 21 -5.530 -17.045 84.205 1.00 0.00 C ATOM 330 CE2 TYR A 21 -4.769 -16.309 86.387 1.00 0.00 C ATOM 331 CZ TYR A 21 -5.778 -16.396 85.421 1.00 0.00 C ATOM 332 OH TYR A 21 -7.019 -15.847 85.668 1.00 0.00 O ATOM 0 H TYR A 21 -1.822 -19.228 86.893 1.00 0.00 H new ATOM 0 HA TYR A 21 -2.970 -20.000 84.422 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.169 -17.735 85.348 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -1.571 -17.880 83.649 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -4.082 -18.110 83.019 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -2.731 -16.801 86.881 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -6.309 -17.111 83.459 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -4.961 -15.809 87.325 1.00 0.00 H new ATOM 0 HH TYR A 21 -7.024 -15.436 86.557 1.00 0.00 H new ATOM 342 N VAL A 22 0.341 -20.080 84.333 1.00 0.00 N ATOM 343 CA VAL A 22 1.439 -20.721 83.562 1.00 0.00 C ATOM 344 C VAL A 22 1.382 -22.236 83.760 1.00 0.00 C ATOM 345 O VAL A 22 1.998 -22.987 83.030 1.00 0.00 O ATOM 346 CB VAL A 22 2.796 -20.175 84.020 1.00 0.00 C ATOM 347 CG1 VAL A 22 3.209 -20.814 85.347 1.00 0.00 C ATOM 348 CG2 VAL A 22 3.852 -20.488 82.958 1.00 0.00 C ATOM 0 H VAL A 22 0.636 -19.465 85.091 1.00 0.00 H new ATOM 0 HA VAL A 22 1.316 -20.493 82.503 1.00 0.00 H new ATOM 0 HB VAL A 22 2.714 -19.097 84.158 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.175 -20.415 85.658 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.461 -20.589 86.108 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.286 -21.894 85.222 1.00 0.00 H new ATOM 0 HG21 VAL A 22 4.818 -20.101 83.281 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.921 -21.567 82.820 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.570 -20.019 82.015 1.00 0.00 H new ATOM 358 N ALA A 23 0.639 -22.698 84.730 1.00 0.00 N ATOM 359 CA ALA A 23 0.549 -24.165 84.941 1.00 0.00 C ATOM 360 C ALA A 23 0.018 -24.785 83.655 1.00 0.00 C ATOM 361 O ALA A 23 0.164 -25.966 83.408 1.00 0.00 O ATOM 362 CB ALA A 23 -0.408 -24.475 86.096 1.00 0.00 C ATOM 0 H ALA A 23 0.097 -22.127 85.378 1.00 0.00 H new ATOM 0 HA ALA A 23 1.529 -24.571 85.190 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.466 -25.554 86.241 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -0.041 -24.005 87.009 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.399 -24.087 85.861 1.00 0.00 H new ATOM 368 N LYS A 24 -0.582 -23.979 82.822 1.00 0.00 N ATOM 369 CA LYS A 24 -1.106 -24.495 81.532 1.00 0.00 C ATOM 370 C LYS A 24 0.065 -24.973 80.677 1.00 0.00 C ATOM 371 O LYS A 24 0.349 -26.152 80.598 1.00 0.00 O ATOM 372 CB LYS A 24 -1.875 -23.386 80.797 1.00 0.00 C ATOM 373 CG LYS A 24 -3.385 -23.618 80.939 1.00 0.00 C ATOM 374 CD LYS A 24 -3.788 -23.503 82.414 1.00 0.00 C ATOM 375 CE LYS A 24 -4.153 -22.053 82.739 1.00 0.00 C ATOM 376 NZ LYS A 24 -5.516 -21.755 82.215 1.00 0.00 N ATOM 0 H LYS A 24 -0.731 -22.983 82.983 1.00 0.00 H new ATOM 0 HA LYS A 24 -1.787 -25.326 81.718 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.607 -22.412 81.207 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -1.597 -23.375 79.743 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -3.933 -22.887 80.344 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.649 -24.603 80.555 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.636 -24.156 82.621 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -2.968 -23.833 83.052 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.123 -21.892 83.817 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -3.424 -21.375 82.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.875 -20.885 82.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.471 -21.627 81.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -6.154 -22.545 82.438 1.00 0.00 H new ATOM 390 N GLY A 25 0.748 -24.069 80.030 1.00 0.00 N ATOM 391 CA GLY A 25 1.895 -24.487 79.179 1.00 0.00 C ATOM 392 C GLY A 25 2.797 -23.296 78.841 1.00 0.00 C ATOM 393 O GLY A 25 2.641 -22.656 77.822 1.00 0.00 O ATOM 0 H GLY A 25 0.563 -23.066 80.054 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.476 -25.251 79.696 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.523 -24.938 78.259 1.00 0.00 H new ATOM 397 N GLU A 26 3.757 -23.029 79.685 1.00 0.00 N ATOM 398 CA GLU A 26 4.727 -21.912 79.445 1.00 0.00 C ATOM 399 C GLU A 26 4.072 -20.733 78.713 1.00 0.00 C ATOM 400 O GLU A 26 3.848 -20.771 77.519 1.00 0.00 O ATOM 401 CB GLU A 26 5.918 -22.430 78.628 1.00 0.00 C ATOM 402 CG GLU A 26 5.434 -23.405 77.552 1.00 0.00 C ATOM 403 CD GLU A 26 6.624 -23.863 76.708 1.00 0.00 C ATOM 404 OE1 GLU A 26 7.742 -23.539 77.071 1.00 0.00 O ATOM 405 OE2 GLU A 26 6.396 -24.533 75.714 1.00 0.00 O ATOM 0 H GLU A 26 3.916 -23.547 80.549 1.00 0.00 H new ATOM 0 HA GLU A 26 5.067 -21.552 80.416 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.441 -21.594 78.163 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.631 -22.927 79.286 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.951 -24.265 78.016 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.689 -22.924 76.919 1.00 0.00 H new ATOM 412 N ASP A 27 3.797 -19.673 79.420 1.00 0.00 N ATOM 413 CA ASP A 27 3.189 -18.470 78.782 1.00 0.00 C ATOM 414 C ASP A 27 3.701 -17.231 79.519 1.00 0.00 C ATOM 415 O ASP A 27 3.006 -16.247 79.678 1.00 0.00 O ATOM 416 CB ASP A 27 1.663 -18.549 78.885 1.00 0.00 C ATOM 417 CG ASP A 27 1.128 -19.501 77.812 1.00 0.00 C ATOM 418 OD1 ASP A 27 1.300 -19.199 76.642 1.00 0.00 O ATOM 419 OD2 ASP A 27 0.558 -20.516 78.178 1.00 0.00 O ATOM 0 H ASP A 27 3.969 -19.587 80.422 1.00 0.00 H new ATOM 0 HA ASP A 27 3.463 -18.418 77.728 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.372 -18.900 79.875 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.227 -17.558 78.757 1.00 0.00 H new ATOM 424 N VAL A 28 4.918 -17.295 79.991 1.00 0.00 N ATOM 425 CA VAL A 28 5.506 -16.155 80.750 1.00 0.00 C ATOM 426 C VAL A 28 6.036 -15.074 79.802 1.00 0.00 C ATOM 427 O VAL A 28 7.226 -14.852 79.697 1.00 0.00 O ATOM 428 CB VAL A 28 6.648 -16.686 81.620 1.00 0.00 C ATOM 429 CG1 VAL A 28 6.067 -17.631 82.672 1.00 0.00 C ATOM 430 CG2 VAL A 28 7.655 -17.455 80.752 1.00 0.00 C ATOM 0 H VAL A 28 5.536 -18.099 79.881 1.00 0.00 H new ATOM 0 HA VAL A 28 4.732 -15.704 81.371 1.00 0.00 H new ATOM 0 HB VAL A 28 7.157 -15.851 82.102 1.00 0.00 H new ATOM 0 HG11 VAL A 28 6.871 -18.016 83.299 1.00 0.00 H new ATOM 0 HG12 VAL A 28 5.352 -17.090 83.291 1.00 0.00 H new ATOM 0 HG13 VAL A 28 5.563 -18.461 82.177 1.00 0.00 H new ATOM 0 HG21 VAL A 28 8.464 -17.829 81.379 1.00 0.00 H new ATOM 0 HG22 VAL A 28 7.153 -18.293 80.268 1.00 0.00 H new ATOM 0 HG23 VAL A 28 8.063 -16.789 79.992 1.00 0.00 H new ATOM 440 N ASN A 29 5.161 -14.386 79.125 1.00 0.00 N ATOM 441 CA ASN A 29 5.603 -13.314 78.201 1.00 0.00 C ATOM 442 C ASN A 29 4.366 -12.581 77.678 1.00 0.00 C ATOM 443 O ASN A 29 4.325 -12.129 76.551 1.00 0.00 O ATOM 444 CB ASN A 29 6.371 -13.934 77.032 1.00 0.00 C ATOM 445 CG ASN A 29 5.723 -15.259 76.633 1.00 0.00 C ATOM 446 OD1 ASN A 29 5.937 -16.320 77.357 1.00 0.00 O flip ATOM 447 ND2 ASN A 29 5.013 -15.329 75.649 1.00 0.00 N flip ATOM 0 H ASN A 29 4.152 -14.524 79.175 1.00 0.00 H new ATOM 0 HA ASN A 29 6.256 -12.613 78.722 1.00 0.00 H new ATOM 0 HB2 ASN A 29 6.374 -13.250 76.183 1.00 0.00 H new ATOM 0 HB3 ASN A 29 7.411 -14.097 77.314 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.845 -14.498 75.081 1.00 0.00 H new ATOM 0 HD22 ASN A 29 4.585 -16.218 75.391 1.00 0.00 H new ATOM 454 N ARG A 30 3.350 -12.476 78.495 1.00 0.00 N ATOM 455 CA ARG A 30 2.096 -11.793 78.063 1.00 0.00 C ATOM 456 C ARG A 30 1.998 -10.404 78.696 1.00 0.00 C ATOM 457 O ARG A 30 1.858 -10.265 79.895 1.00 0.00 O ATOM 458 CB ARG A 30 0.900 -12.630 78.514 1.00 0.00 C ATOM 459 CG ARG A 30 0.984 -14.020 77.884 1.00 0.00 C ATOM 460 CD ARG A 30 -0.371 -14.714 78.004 1.00 0.00 C ATOM 461 NE ARG A 30 -1.411 -13.878 77.343 1.00 0.00 N ATOM 462 CZ ARG A 30 -2.574 -14.390 77.054 1.00 0.00 C ATOM 463 NH1 ARG A 30 -2.829 -15.634 77.350 1.00 0.00 N ATOM 464 NH2 ARG A 30 -3.481 -13.657 76.469 1.00 0.00 N ATOM 0 H ARG A 30 3.336 -12.837 79.449 1.00 0.00 H new ATOM 0 HA ARG A 30 2.103 -11.687 76.978 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.889 -12.712 79.601 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -0.030 -12.142 78.222 1.00 0.00 H new ATOM 0 HG2 ARG A 30 1.272 -13.939 76.836 1.00 0.00 H new ATOM 0 HG3 ARG A 30 1.753 -14.611 78.381 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -0.330 -15.699 77.540 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -0.623 -14.866 79.053 1.00 0.00 H new ATOM 0 HE ARG A 30 -1.213 -12.903 77.116 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -2.119 -16.205 77.807 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -3.739 -16.036 77.124 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -3.279 -12.684 76.238 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -4.392 -14.057 76.242 1.00 0.00 H new ATOM 478 N THR A 31 2.047 -9.375 77.896 1.00 0.00 N ATOM 479 CA THR A 31 1.932 -7.997 78.447 1.00 0.00 C ATOM 480 C THR A 31 0.590 -7.872 79.179 1.00 0.00 C ATOM 481 O THR A 31 -0.448 -7.723 78.567 1.00 0.00 O ATOM 482 CB THR A 31 1.993 -6.986 77.296 1.00 0.00 C ATOM 483 OG1 THR A 31 2.930 -7.434 76.325 1.00 0.00 O ATOM 484 CG2 THR A 31 2.426 -5.622 77.831 1.00 0.00 C ATOM 0 H THR A 31 2.162 -9.430 76.884 1.00 0.00 H new ATOM 0 HA THR A 31 2.749 -7.798 79.141 1.00 0.00 H new ATOM 0 HB THR A 31 1.007 -6.897 76.840 1.00 0.00 H new ATOM 0 HG1 THR A 31 2.970 -6.790 75.587 1.00 0.00 H new ATOM 0 HG21 THR A 31 2.468 -4.906 77.010 1.00 0.00 H new ATOM 0 HG22 THR A 31 1.708 -5.279 78.576 1.00 0.00 H new ATOM 0 HG23 THR A 31 3.411 -5.707 78.289 1.00 0.00 H new ATOM 492 N LEU A 32 0.597 -7.960 80.483 1.00 0.00 N ATOM 493 CA LEU A 32 -0.690 -7.876 81.234 1.00 0.00 C ATOM 494 C LEU A 32 -1.196 -6.429 81.314 1.00 0.00 C ATOM 495 O LEU A 32 -2.386 -6.188 81.276 1.00 0.00 O ATOM 496 CB LEU A 32 -0.562 -8.500 82.649 1.00 0.00 C ATOM 497 CG LEU A 32 0.594 -7.912 83.497 1.00 0.00 C ATOM 498 CD1 LEU A 32 1.947 -8.090 82.801 1.00 0.00 C ATOM 499 CD2 LEU A 32 0.357 -6.427 83.803 1.00 0.00 C ATOM 0 H LEU A 32 1.431 -8.085 81.057 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.428 -8.457 80.681 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.501 -8.356 83.184 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.414 -9.575 82.548 1.00 0.00 H new ATOM 0 HG LEU A 32 0.614 -8.465 84.436 1.00 0.00 H new ATOM 0 HD11 LEU A 32 2.735 -7.666 83.424 1.00 0.00 H new ATOM 0 HD12 LEU A 32 2.139 -9.152 82.645 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.931 -7.579 81.838 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.184 -6.042 84.399 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.292 -5.869 82.869 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.574 -6.314 84.358 1.00 0.00 H new ATOM 511 N GLU A 33 -0.326 -5.462 81.413 1.00 0.00 N ATOM 512 CA GLU A 33 -0.803 -4.047 81.481 1.00 0.00 C ATOM 513 C GLU A 33 -1.030 -3.522 80.063 1.00 0.00 C ATOM 514 O GLU A 33 -2.124 -3.562 79.539 1.00 0.00 O ATOM 515 CB GLU A 33 0.233 -3.178 82.199 1.00 0.00 C ATOM 516 CG GLU A 33 -0.310 -1.754 82.367 1.00 0.00 C ATOM 517 CD GLU A 33 -0.079 -0.958 81.081 1.00 0.00 C ATOM 518 OE1 GLU A 33 1.067 -0.645 80.800 1.00 0.00 O ATOM 519 OE2 GLU A 33 -1.050 -0.674 80.400 1.00 0.00 O ATOM 0 H GLU A 33 0.686 -5.586 81.450 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.739 -4.008 82.038 1.00 0.00 H new ATOM 0 HB2 GLU A 33 0.466 -3.605 83.174 1.00 0.00 H new ATOM 0 HB3 GLU A 33 1.162 -3.158 81.629 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.374 -1.786 82.600 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.185 -1.262 83.204 1.00 0.00 H new ATOM 526 N GLY A 34 0.005 -3.034 79.439 1.00 0.00 N ATOM 527 CA GLY A 34 -0.130 -2.508 78.052 1.00 0.00 C ATOM 528 C GLY A 34 1.246 -2.507 77.392 1.00 0.00 C ATOM 529 O GLY A 34 1.373 -2.578 76.186 1.00 0.00 O ATOM 0 H GLY A 34 0.944 -2.977 79.832 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -0.823 -3.125 77.480 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -0.541 -1.499 78.069 1.00 0.00 H new ATOM 533 N GLY A 35 2.275 -2.435 78.185 1.00 0.00 N ATOM 534 CA GLY A 35 3.657 -2.433 77.629 1.00 0.00 C ATOM 535 C GLY A 35 4.632 -2.909 78.706 1.00 0.00 C ATOM 536 O GLY A 35 5.758 -2.458 78.782 1.00 0.00 O ATOM 0 H GLY A 35 2.219 -2.377 79.202 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.712 -3.085 76.757 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.926 -1.431 77.295 1.00 0.00 H new ATOM 540 N ARG A 36 4.203 -3.815 79.545 1.00 0.00 N ATOM 541 CA ARG A 36 5.093 -4.323 80.628 1.00 0.00 C ATOM 542 C ARG A 36 4.902 -5.833 80.782 1.00 0.00 C ATOM 543 O ARG A 36 3.848 -6.364 80.500 1.00 0.00 O ATOM 544 CB ARG A 36 4.735 -3.623 81.939 1.00 0.00 C ATOM 545 CG ARG A 36 4.400 -2.157 81.651 1.00 0.00 C ATOM 546 CD ARG A 36 4.155 -1.406 82.962 1.00 0.00 C ATOM 547 NE ARG A 36 4.565 0.015 82.790 1.00 0.00 N ATOM 548 CZ ARG A 36 4.184 0.911 83.655 1.00 0.00 C ATOM 549 NH1 ARG A 36 3.441 0.561 84.668 1.00 0.00 N ATOM 550 NH2 ARG A 36 4.545 2.155 83.504 1.00 0.00 N ATOM 0 H ARG A 36 3.270 -4.226 79.526 1.00 0.00 H new ATOM 0 HA ARG A 36 6.133 -4.118 80.376 1.00 0.00 H new ATOM 0 HB2 ARG A 36 3.885 -4.117 82.409 1.00 0.00 H new ATOM 0 HB3 ARG A 36 5.568 -3.688 82.639 1.00 0.00 H new ATOM 0 HG2 ARG A 36 5.218 -1.690 81.103 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.515 -2.096 81.017 1.00 0.00 H new ATOM 0 HD2 ARG A 36 3.102 -1.463 83.238 1.00 0.00 H new ATOM 0 HD3 ARG A 36 4.722 -1.866 83.771 1.00 0.00 H new ATOM 0 HE ARG A 36 5.144 0.287 81.995 1.00 0.00 H new ATOM 0 HH11 ARG A 36 3.159 -0.413 84.782 1.00 0.00 H new ATOM 0 HH12 ARG A 36 3.141 1.261 85.347 1.00 0.00 H new ATOM 0 HH21 ARG A 36 5.125 2.425 82.709 1.00 0.00 H new ATOM 0 HH22 ARG A 36 4.248 2.858 84.180 1.00 0.00 H new ATOM 564 N LYS A 37 5.916 -6.528 81.222 1.00 0.00 N ATOM 565 CA LYS A 37 5.802 -8.008 81.385 1.00 0.00 C ATOM 566 C LYS A 37 5.601 -8.341 82.873 1.00 0.00 C ATOM 567 O LYS A 37 5.817 -7.501 83.723 1.00 0.00 O ATOM 568 CB LYS A 37 7.081 -8.683 80.862 1.00 0.00 C ATOM 569 CG LYS A 37 8.142 -7.621 80.552 1.00 0.00 C ATOM 570 CD LYS A 37 8.705 -7.066 81.862 1.00 0.00 C ATOM 571 CE LYS A 37 9.382 -5.722 81.596 1.00 0.00 C ATOM 572 NZ LYS A 37 10.097 -5.777 80.289 1.00 0.00 N ATOM 0 H LYS A 37 6.822 -6.134 81.477 1.00 0.00 H new ATOM 0 HA LYS A 37 4.948 -8.377 80.816 1.00 0.00 H new ATOM 0 HB2 LYS A 37 7.462 -9.384 81.604 1.00 0.00 H new ATOM 0 HB3 LYS A 37 6.857 -9.259 79.964 1.00 0.00 H new ATOM 0 HG2 LYS A 37 8.943 -8.056 79.954 1.00 0.00 H new ATOM 0 HG3 LYS A 37 7.705 -6.816 79.962 1.00 0.00 H new ATOM 0 HD2 LYS A 37 7.904 -6.944 82.592 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.421 -7.768 82.289 1.00 0.00 H new ATOM 0 HE2 LYS A 37 8.639 -4.924 81.583 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.084 -5.491 82.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 10.851 -5.060 80.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 10.514 -6.721 80.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 9.425 -5.588 79.518 1.00 0.00 H new ATOM 586 N PRO A 38 5.177 -9.553 83.143 1.00 0.00 N ATOM 587 CA PRO A 38 4.925 -10.002 84.527 1.00 0.00 C ATOM 588 C PRO A 38 6.224 -10.082 85.343 1.00 0.00 C ATOM 589 O PRO A 38 6.281 -10.773 86.339 1.00 0.00 O ATOM 590 CB PRO A 38 4.310 -11.404 84.377 1.00 0.00 C ATOM 591 CG PRO A 38 4.377 -11.789 82.874 1.00 0.00 C ATOM 592 CD PRO A 38 4.897 -10.566 82.102 1.00 0.00 C ATOM 0 HA PRO A 38 4.275 -9.307 85.058 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.856 -12.128 84.982 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.278 -11.409 84.728 1.00 0.00 H new ATOM 0 HG2 PRO A 38 5.038 -12.643 82.727 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.392 -12.081 82.510 1.00 0.00 H new ATOM 0 HD2 PRO A 38 5.795 -10.809 81.535 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.157 -10.205 81.388 1.00 0.00 H new ATOM 600 N LEU A 39 7.265 -9.398 84.946 1.00 0.00 N ATOM 601 CA LEU A 39 8.537 -9.472 85.733 1.00 0.00 C ATOM 602 C LEU A 39 8.799 -8.128 86.415 1.00 0.00 C ATOM 603 O LEU A 39 9.594 -8.028 87.330 1.00 0.00 O ATOM 604 CB LEU A 39 9.698 -9.836 84.794 1.00 0.00 C ATOM 605 CG LEU A 39 10.965 -10.267 85.580 1.00 0.00 C ATOM 606 CD1 LEU A 39 10.606 -10.948 86.907 1.00 0.00 C ATOM 607 CD2 LEU A 39 11.781 -11.250 84.729 1.00 0.00 C ATOM 0 H LEU A 39 7.293 -8.798 84.122 1.00 0.00 H new ATOM 0 HA LEU A 39 8.451 -10.241 86.501 1.00 0.00 H new ATOM 0 HB2 LEU A 39 9.389 -10.645 84.132 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.936 -8.980 84.163 1.00 0.00 H new ATOM 0 HG LEU A 39 11.543 -9.369 85.798 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.520 -11.235 87.428 1.00 0.00 H new ATOM 0 HD12 LEU A 39 10.036 -10.257 87.528 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.007 -11.837 86.709 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.672 -11.555 85.279 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.175 -12.128 84.505 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.077 -10.767 83.798 1.00 0.00 H new ATOM 619 N HIS A 40 8.127 -7.094 85.989 1.00 0.00 N ATOM 620 CA HIS A 40 8.332 -5.766 86.633 1.00 0.00 C ATOM 621 C HIS A 40 7.541 -5.737 87.942 1.00 0.00 C ATOM 622 O HIS A 40 8.032 -5.307 88.967 1.00 0.00 O ATOM 623 CB HIS A 40 7.835 -4.653 85.706 1.00 0.00 C ATOM 624 CG HIS A 40 8.245 -3.315 86.265 1.00 0.00 C ATOM 625 ND1 HIS A 40 7.868 -2.896 87.531 1.00 0.00 N ATOM 626 CD2 HIS A 40 8.997 -2.291 85.740 1.00 0.00 C ATOM 627 CE1 HIS A 40 8.387 -1.669 87.725 1.00 0.00 C ATOM 628 NE2 HIS A 40 9.085 -1.254 86.664 1.00 0.00 N ATOM 0 H HIS A 40 7.449 -7.110 85.227 1.00 0.00 H new ATOM 0 HA HIS A 40 9.392 -5.608 86.830 1.00 0.00 H new ATOM 0 HB2 HIS A 40 8.250 -4.785 84.707 1.00 0.00 H new ATOM 0 HB3 HIS A 40 6.750 -4.702 85.610 1.00 0.00 H new ATOM 0 HD2 HIS A 40 9.450 -2.291 84.760 1.00 0.00 H new ATOM 0 HE1 HIS A 40 8.255 -1.091 88.628 1.00 0.00 H new ATOM 0 HE2 HIS A 40 9.577 -0.367 86.555 1.00 0.00 H new ATOM 636 N TYR A 41 6.325 -6.212 87.914 1.00 0.00 N ATOM 637 CA TYR A 41 5.500 -6.238 89.154 1.00 0.00 C ATOM 638 C TYR A 41 6.099 -7.262 90.108 1.00 0.00 C ATOM 639 O TYR A 41 6.159 -7.060 91.305 1.00 0.00 O ATOM 640 CB TYR A 41 4.074 -6.659 88.809 1.00 0.00 C ATOM 641 CG TYR A 41 3.633 -5.945 87.560 1.00 0.00 C ATOM 642 CD1 TYR A 41 3.964 -6.465 86.303 1.00 0.00 C ATOM 643 CD2 TYR A 41 2.899 -4.760 87.658 1.00 0.00 C ATOM 644 CE1 TYR A 41 3.559 -5.797 85.144 1.00 0.00 C ATOM 645 CE2 TYR A 41 2.495 -4.094 86.500 1.00 0.00 C ATOM 646 CZ TYR A 41 2.825 -4.612 85.242 1.00 0.00 C ATOM 647 OH TYR A 41 2.427 -3.954 84.102 1.00 0.00 O ATOM 0 H TYR A 41 5.867 -6.584 87.082 1.00 0.00 H new ATOM 0 HA TYR A 41 5.486 -5.249 89.613 1.00 0.00 H new ATOM 0 HB2 TYR A 41 4.027 -7.738 88.661 1.00 0.00 H new ATOM 0 HB3 TYR A 41 3.403 -6.421 89.634 1.00 0.00 H new ATOM 0 HD1 TYR A 41 4.531 -7.381 86.229 1.00 0.00 H new ATOM 0 HD2 TYR A 41 2.645 -4.360 88.628 1.00 0.00 H new ATOM 0 HE1 TYR A 41 3.813 -6.196 84.173 1.00 0.00 H new ATOM 0 HE2 TYR A 41 1.927 -3.178 86.574 1.00 0.00 H new ATOM 0 HH TYR A 41 2.143 -3.045 84.331 1.00 0.00 H new ATOM 657 N ALA A 42 6.553 -8.362 89.580 1.00 0.00 N ATOM 658 CA ALA A 42 7.159 -9.398 90.446 1.00 0.00 C ATOM 659 C ALA A 42 8.463 -8.843 91.010 1.00 0.00 C ATOM 660 O ALA A 42 8.711 -8.899 92.192 1.00 0.00 O ATOM 661 CB ALA A 42 7.431 -10.657 89.621 1.00 0.00 C ATOM 0 H ALA A 42 6.529 -8.585 88.585 1.00 0.00 H new ATOM 0 HA ALA A 42 6.485 -9.658 91.262 1.00 0.00 H new ATOM 0 HB1 ALA A 42 7.877 -11.420 90.258 1.00 0.00 H new ATOM 0 HB2 ALA A 42 6.494 -11.031 89.209 1.00 0.00 H new ATOM 0 HB3 ALA A 42 8.116 -10.418 88.807 1.00 0.00 H new ATOM 667 N ALA A 43 9.293 -8.280 90.182 1.00 0.00 N ATOM 668 CA ALA A 43 10.558 -7.702 90.702 1.00 0.00 C ATOM 669 C ALA A 43 10.210 -6.504 91.587 1.00 0.00 C ATOM 670 O ALA A 43 10.633 -6.407 92.722 1.00 0.00 O ATOM 671 CB ALA A 43 11.434 -7.241 89.538 1.00 0.00 C ATOM 0 H ALA A 43 9.152 -8.195 89.175 1.00 0.00 H new ATOM 0 HA ALA A 43 11.103 -8.451 91.276 1.00 0.00 H new ATOM 0 HB1 ALA A 43 12.361 -6.818 89.925 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.664 -8.092 88.896 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.903 -6.484 88.961 1.00 0.00 H new ATOM 677 N ASP A 44 9.436 -5.590 91.064 1.00 0.00 N ATOM 678 CA ASP A 44 9.050 -4.384 91.844 1.00 0.00 C ATOM 679 C ASP A 44 8.352 -4.783 93.148 1.00 0.00 C ATOM 680 O ASP A 44 8.476 -4.118 94.152 1.00 0.00 O ATOM 681 CB ASP A 44 8.100 -3.524 91.009 1.00 0.00 C ATOM 682 CG ASP A 44 7.749 -2.252 91.784 1.00 0.00 C ATOM 683 OD1 ASP A 44 6.804 -2.293 92.554 1.00 0.00 O ATOM 684 OD2 ASP A 44 8.431 -1.259 91.592 1.00 0.00 O ATOM 0 H ASP A 44 9.052 -5.631 90.120 1.00 0.00 H new ATOM 0 HA ASP A 44 9.952 -3.822 92.086 1.00 0.00 H new ATOM 0 HB2 ASP A 44 8.566 -3.266 90.058 1.00 0.00 H new ATOM 0 HB3 ASP A 44 7.194 -4.084 90.778 1.00 0.00 H new ATOM 689 N CYS A 45 7.612 -5.855 93.150 1.00 0.00 N ATOM 690 CA CYS A 45 6.908 -6.257 94.403 1.00 0.00 C ATOM 691 C CYS A 45 6.464 -7.714 94.305 1.00 0.00 C ATOM 692 O CYS A 45 5.289 -8.019 94.384 1.00 0.00 O ATOM 693 CB CYS A 45 5.663 -5.388 94.592 1.00 0.00 C ATOM 694 SG CYS A 45 6.141 -3.697 95.028 1.00 0.00 S ATOM 0 H CYS A 45 7.463 -6.467 92.347 1.00 0.00 H new ATOM 0 HA CYS A 45 7.590 -6.131 95.244 1.00 0.00 H new ATOM 0 HB2 CYS A 45 5.072 -5.382 93.676 1.00 0.00 H new ATOM 0 HB3 CYS A 45 5.032 -5.809 95.375 1.00 0.00 H new ATOM 0 HG CYS A 45 7.397 -3.515 94.747 1.00 0.00 H new ATOM 700 N GLY A 46 7.388 -8.617 94.134 1.00 0.00 N ATOM 701 CA GLY A 46 7.012 -10.061 94.030 1.00 0.00 C ATOM 702 C GLY A 46 7.539 -10.821 95.245 1.00 0.00 C ATOM 703 O GLY A 46 7.917 -11.972 95.145 1.00 0.00 O ATOM 0 H GLY A 46 8.387 -8.422 94.061 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.928 -10.161 93.969 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.423 -10.488 93.116 1.00 0.00 H new ATOM 707 N GLN A 47 7.587 -10.191 96.387 1.00 0.00 N ATOM 708 CA GLN A 47 8.118 -10.893 97.590 1.00 0.00 C ATOM 709 C GLN A 47 9.435 -11.567 97.200 1.00 0.00 C ATOM 710 O GLN A 47 9.940 -12.429 97.890 1.00 0.00 O ATOM 711 CB GLN A 47 7.112 -11.945 98.075 1.00 0.00 C ATOM 712 CG GLN A 47 5.685 -11.492 97.751 1.00 0.00 C ATOM 713 CD GLN A 47 5.482 -10.040 98.192 1.00 0.00 C ATOM 714 OE1 GLN A 47 6.164 -9.560 99.076 1.00 0.00 O ATOM 715 NE2 GLN A 47 4.562 -9.317 97.612 1.00 0.00 N ATOM 0 H GLN A 47 7.284 -9.229 96.539 1.00 0.00 H new ATOM 0 HA GLN A 47 8.282 -10.182 98.400 1.00 0.00 H new ATOM 0 HB2 GLN A 47 7.316 -12.903 97.597 1.00 0.00 H new ATOM 0 HB3 GLN A 47 7.220 -12.096 99.149 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.500 -11.585 96.681 1.00 0.00 H new ATOM 0 HG3 GLN A 47 4.967 -12.138 98.256 1.00 0.00 H new ATOM 0 HE21 GLN A 47 3.989 -9.720 96.870 1.00 0.00 H new ATOM 0 HE22 GLN A 47 4.416 -8.350 97.901 1.00 0.00 H new ATOM 724 N LEU A 48 9.985 -11.159 96.086 1.00 0.00 N ATOM 725 CA LEU A 48 11.265 -11.732 95.595 1.00 0.00 C ATOM 726 C LEU A 48 11.094 -13.219 95.270 1.00 0.00 C ATOM 727 O LEU A 48 12.003 -13.877 94.804 1.00 0.00 O ATOM 728 CB LEU A 48 12.356 -11.532 96.646 1.00 0.00 C ATOM 729 CG LEU A 48 12.859 -10.064 96.669 1.00 0.00 C ATOM 730 CD1 LEU A 48 12.112 -9.166 95.670 1.00 0.00 C ATOM 731 CD2 LEU A 48 12.691 -9.482 98.077 1.00 0.00 C ATOM 0 H LEU A 48 9.588 -10.436 95.486 1.00 0.00 H new ATOM 0 HA LEU A 48 11.559 -11.217 94.681 1.00 0.00 H new ATOM 0 HB2 LEU A 48 11.970 -11.801 97.629 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.191 -12.201 96.438 1.00 0.00 H new ATOM 0 HG LEU A 48 13.910 -10.085 96.379 1.00 0.00 H new ATOM 0 HD11 LEU A 48 12.505 -8.151 95.729 1.00 0.00 H new ATOM 0 HD12 LEU A 48 12.252 -9.551 94.660 1.00 0.00 H new ATOM 0 HD13 LEU A 48 11.049 -9.158 95.912 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.045 -8.451 98.089 1.00 0.00 H new ATOM 0 HD22 LEU A 48 11.638 -9.507 98.358 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.270 -10.073 98.787 1.00 0.00 H new ATOM 743 N GLU A 49 9.931 -13.751 95.493 1.00 0.00 N ATOM 744 CA GLU A 49 9.684 -15.176 95.168 1.00 0.00 C ATOM 745 C GLU A 49 9.042 -15.268 93.783 1.00 0.00 C ATOM 746 O GLU A 49 9.290 -16.183 93.023 1.00 0.00 O ATOM 747 CB GLU A 49 8.726 -15.782 96.188 1.00 0.00 C ATOM 748 CG GLU A 49 9.207 -15.496 97.614 1.00 0.00 C ATOM 749 CD GLU A 49 8.436 -16.375 98.604 1.00 0.00 C ATOM 750 OE1 GLU A 49 8.347 -17.569 98.366 1.00 0.00 O ATOM 751 OE2 GLU A 49 7.946 -15.838 99.585 1.00 0.00 O ATOM 0 H GLU A 49 9.133 -13.255 95.890 1.00 0.00 H new ATOM 0 HA GLU A 49 10.630 -15.717 95.187 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.727 -15.371 96.046 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.653 -16.858 96.032 1.00 0.00 H new ATOM 0 HG2 GLU A 49 10.276 -15.693 97.694 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.058 -14.443 97.854 1.00 0.00 H new ATOM 758 N ILE A 50 8.185 -14.336 93.475 1.00 0.00 N ATOM 759 CA ILE A 50 7.471 -14.361 92.169 1.00 0.00 C ATOM 760 C ILE A 50 8.418 -14.138 90.993 1.00 0.00 C ATOM 761 O ILE A 50 8.233 -14.702 89.939 1.00 0.00 O ATOM 762 CB ILE A 50 6.412 -13.259 92.157 1.00 0.00 C ATOM 763 CG1 ILE A 50 5.477 -13.417 93.378 1.00 0.00 C ATOM 764 CG2 ILE A 50 5.625 -13.336 90.847 1.00 0.00 C ATOM 765 CD1 ILE A 50 4.009 -13.224 92.979 1.00 0.00 C ATOM 0 H ILE A 50 7.946 -13.550 94.079 1.00 0.00 H new ATOM 0 HA ILE A 50 7.017 -15.346 92.059 1.00 0.00 H new ATOM 0 HB ILE A 50 6.889 -12.281 92.222 1.00 0.00 H new ATOM 0 HG12 ILE A 50 5.611 -14.406 93.817 1.00 0.00 H new ATOM 0 HG13 ILE A 50 5.748 -12.690 94.143 1.00 0.00 H new ATOM 0 HG21 ILE A 50 4.867 -12.553 90.831 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.305 -13.201 90.006 1.00 0.00 H new ATOM 0 HG23 ILE A 50 5.142 -14.310 90.770 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.375 -13.341 93.858 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.873 -12.225 92.564 1.00 0.00 H new ATOM 0 HD13 ILE A 50 3.734 -13.968 92.232 1.00 0.00 H new ATOM 777 N LEU A 51 9.400 -13.302 91.128 1.00 0.00 N ATOM 778 CA LEU A 51 10.287 -13.056 89.960 1.00 0.00 C ATOM 779 C LEU A 51 10.962 -14.368 89.543 1.00 0.00 C ATOM 780 O LEU A 51 10.905 -14.758 88.398 1.00 0.00 O ATOM 781 CB LEU A 51 11.350 -11.963 90.221 1.00 0.00 C ATOM 782 CG LEU A 51 11.554 -11.641 91.709 1.00 0.00 C ATOM 783 CD1 LEU A 51 10.256 -11.154 92.370 1.00 0.00 C ATOM 784 CD2 LEU A 51 12.091 -12.876 92.417 1.00 0.00 C ATOM 0 H LEU A 51 9.627 -12.785 91.978 1.00 0.00 H new ATOM 0 HA LEU A 51 9.658 -12.683 89.152 1.00 0.00 H new ATOM 0 HB2 LEU A 51 12.300 -12.284 89.795 1.00 0.00 H new ATOM 0 HB3 LEU A 51 11.057 -11.052 89.698 1.00 0.00 H new ATOM 0 HG LEU A 51 12.275 -10.828 91.793 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.443 -10.937 93.422 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.909 -10.250 91.869 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.494 -11.929 92.289 1.00 0.00 H new ATOM 0 HD21 LEU A 51 12.238 -12.654 93.474 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.378 -13.694 92.314 1.00 0.00 H new ATOM 0 HD23 LEU A 51 13.042 -13.166 91.971 1.00 0.00 H new ATOM 796 N GLU A 52 11.595 -15.055 90.450 1.00 0.00 N ATOM 797 CA GLU A 52 12.258 -16.336 90.078 1.00 0.00 C ATOM 798 C GLU A 52 11.238 -17.291 89.448 1.00 0.00 C ATOM 799 O GLU A 52 11.590 -18.171 88.686 1.00 0.00 O ATOM 800 CB GLU A 52 12.829 -17.014 91.328 1.00 0.00 C ATOM 801 CG GLU A 52 13.616 -16.013 92.173 1.00 0.00 C ATOM 802 CD GLU A 52 14.220 -16.735 93.377 1.00 0.00 C ATOM 803 OE1 GLU A 52 14.659 -17.860 93.209 1.00 0.00 O ATOM 804 OE2 GLU A 52 14.239 -16.148 94.447 1.00 0.00 O ATOM 0 H GLU A 52 11.683 -14.787 91.430 1.00 0.00 H new ATOM 0 HA GLU A 52 13.056 -16.114 89.370 1.00 0.00 H new ATOM 0 HB2 GLU A 52 12.018 -17.439 91.920 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.477 -17.840 91.036 1.00 0.00 H new ATOM 0 HG2 GLU A 52 14.404 -15.555 91.575 1.00 0.00 H new ATOM 0 HG3 GLU A 52 12.962 -15.208 92.508 1.00 0.00 H new ATOM 811 N PHE A 53 9.986 -17.159 89.796 1.00 0.00 N ATOM 812 CA PHE A 53 8.960 -18.094 89.257 1.00 0.00 C ATOM 813 C PHE A 53 8.800 -17.968 87.743 1.00 0.00 C ATOM 814 O PHE A 53 9.331 -18.749 86.991 1.00 0.00 O ATOM 815 CB PHE A 53 7.607 -17.823 89.903 1.00 0.00 C ATOM 816 CG PHE A 53 6.614 -18.788 89.309 1.00 0.00 C ATOM 817 CD1 PHE A 53 6.800 -20.163 89.478 1.00 0.00 C ATOM 818 CD2 PHE A 53 5.531 -18.313 88.563 1.00 0.00 C ATOM 819 CE1 PHE A 53 5.902 -21.067 88.904 1.00 0.00 C ATOM 820 CE2 PHE A 53 4.629 -19.217 87.992 1.00 0.00 C ATOM 821 CZ PHE A 53 4.817 -20.596 88.163 1.00 0.00 C ATOM 0 H PHE A 53 9.631 -16.444 90.430 1.00 0.00 H new ATOM 0 HA PHE A 53 9.305 -19.102 89.490 1.00 0.00 H new ATOM 0 HB2 PHE A 53 7.666 -17.952 90.984 1.00 0.00 H new ATOM 0 HB3 PHE A 53 7.296 -16.794 89.722 1.00 0.00 H new ATOM 0 HD1 PHE A 53 7.639 -20.527 90.053 1.00 0.00 H new ATOM 0 HD2 PHE A 53 5.391 -17.251 88.428 1.00 0.00 H new ATOM 0 HE1 PHE A 53 6.047 -22.129 89.034 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.788 -18.853 87.420 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.122 -21.294 87.721 1.00 0.00 H new ATOM 831 N LEU A 54 8.018 -17.030 87.290 1.00 0.00 N ATOM 832 CA LEU A 54 7.789 -16.908 85.827 1.00 0.00 C ATOM 833 C LEU A 54 9.128 -16.824 85.085 1.00 0.00 C ATOM 834 O LEU A 54 9.181 -16.867 83.872 1.00 0.00 O ATOM 835 CB LEU A 54 6.884 -15.694 85.527 1.00 0.00 C ATOM 836 CG LEU A 54 7.580 -14.346 85.799 1.00 0.00 C ATOM 837 CD1 LEU A 54 8.387 -14.410 87.091 1.00 0.00 C ATOM 838 CD2 LEU A 54 8.494 -13.971 84.623 1.00 0.00 C ATOM 0 H LEU A 54 7.530 -16.346 87.868 1.00 0.00 H new ATOM 0 HA LEU A 54 7.272 -17.798 85.468 1.00 0.00 H new ATOM 0 HB2 LEU A 54 6.569 -15.731 84.484 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.982 -15.761 86.135 1.00 0.00 H new ATOM 0 HG LEU A 54 6.813 -13.579 85.907 1.00 0.00 H new ATOM 0 HD11 LEU A 54 8.871 -13.449 87.266 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.722 -14.638 87.924 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.146 -15.188 87.008 1.00 0.00 H new ATOM 0 HD21 LEU A 54 8.979 -13.017 84.829 1.00 0.00 H new ATOM 0 HD22 LEU A 54 9.253 -14.743 84.491 1.00 0.00 H new ATOM 0 HD23 LEU A 54 7.900 -13.887 83.713 1.00 0.00 H new ATOM 850 N LEU A 55 10.217 -16.753 85.804 1.00 0.00 N ATOM 851 CA LEU A 55 11.555 -16.720 85.143 1.00 0.00 C ATOM 852 C LEU A 55 12.034 -18.165 85.012 1.00 0.00 C ATOM 853 O LEU A 55 12.667 -18.551 84.049 1.00 0.00 O ATOM 854 CB LEU A 55 12.537 -15.924 86.013 1.00 0.00 C ATOM 855 CG LEU A 55 13.454 -15.056 85.144 1.00 0.00 C ATOM 856 CD1 LEU A 55 14.111 -13.994 86.029 1.00 0.00 C ATOM 857 CD2 LEU A 55 14.539 -15.929 84.499 1.00 0.00 C ATOM 0 H LEU A 55 10.238 -16.716 86.823 1.00 0.00 H new ATOM 0 HA LEU A 55 11.495 -16.244 84.164 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.984 -15.293 86.709 1.00 0.00 H new ATOM 0 HB3 LEU A 55 13.137 -16.609 86.612 1.00 0.00 H new ATOM 0 HG LEU A 55 12.870 -14.577 84.358 1.00 0.00 H new ATOM 0 HD11 LEU A 55 14.766 -13.369 85.422 1.00 0.00 H new ATOM 0 HD12 LEU A 55 13.340 -13.374 86.486 1.00 0.00 H new ATOM 0 HD13 LEU A 55 14.695 -14.481 86.810 1.00 0.00 H new ATOM 0 HD21 LEU A 55 15.188 -15.307 83.883 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.131 -16.409 85.278 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.070 -16.692 83.877 1.00 0.00 H new ATOM 869 N LEU A 56 11.703 -18.967 85.983 1.00 0.00 N ATOM 870 CA LEU A 56 12.087 -20.396 85.957 1.00 0.00 C ATOM 871 C LEU A 56 11.640 -20.980 84.623 1.00 0.00 C ATOM 872 O LEU A 56 12.388 -21.640 83.934 1.00 0.00 O ATOM 873 CB LEU A 56 11.367 -21.113 87.111 1.00 0.00 C ATOM 874 CG LEU A 56 12.187 -22.308 87.610 1.00 0.00 C ATOM 875 CD1 LEU A 56 12.636 -23.165 86.423 1.00 0.00 C ATOM 876 CD2 LEU A 56 13.415 -21.815 88.387 1.00 0.00 C ATOM 0 H LEU A 56 11.173 -18.683 86.807 1.00 0.00 H new ATOM 0 HA LEU A 56 13.164 -20.518 86.071 1.00 0.00 H new ATOM 0 HB2 LEU A 56 11.200 -20.414 87.931 1.00 0.00 H new ATOM 0 HB3 LEU A 56 10.387 -21.454 86.778 1.00 0.00 H new ATOM 0 HG LEU A 56 11.565 -22.911 88.272 1.00 0.00 H new ATOM 0 HD11 LEU A 56 13.218 -24.012 86.785 1.00 0.00 H new ATOM 0 HD12 LEU A 56 11.761 -23.530 85.886 1.00 0.00 H new ATOM 0 HD13 LEU A 56 13.249 -22.564 85.752 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.991 -22.671 88.738 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.036 -21.202 87.734 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.091 -21.221 89.242 1.00 0.00 H new ATOM 888 N LYS A 57 10.421 -20.719 84.253 1.00 0.00 N ATOM 889 CA LYS A 57 9.907 -21.232 82.958 1.00 0.00 C ATOM 890 C LYS A 57 10.655 -20.529 81.824 1.00 0.00 C ATOM 891 O LYS A 57 11.795 -20.834 81.535 1.00 0.00 O ATOM 892 CB LYS A 57 8.407 -20.935 82.849 1.00 0.00 C ATOM 893 CG LYS A 57 7.638 -21.741 83.906 1.00 0.00 C ATOM 894 CD LYS A 57 7.246 -23.108 83.338 1.00 0.00 C ATOM 895 CE LYS A 57 6.912 -24.063 84.486 1.00 0.00 C ATOM 896 NZ LYS A 57 5.880 -23.442 85.364 1.00 0.00 N ATOM 0 H LYS A 57 9.755 -20.169 84.795 1.00 0.00 H new ATOM 0 HA LYS A 57 10.061 -22.309 82.894 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.227 -19.869 82.989 1.00 0.00 H new ATOM 0 HB3 LYS A 57 8.048 -21.190 81.852 1.00 0.00 H new ATOM 0 HG2 LYS A 57 8.254 -21.871 84.796 1.00 0.00 H new ATOM 0 HG3 LYS A 57 6.745 -21.196 84.213 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.387 -23.005 82.675 1.00 0.00 H new ATOM 0 HD3 LYS A 57 8.063 -23.513 82.740 1.00 0.00 H new ATOM 0 HE2 LYS A 57 6.546 -25.010 84.090 1.00 0.00 H new ATOM 0 HE3 LYS A 57 7.810 -24.284 85.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.421 -24.180 85.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 6.331 -22.747 85.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.166 -22.965 84.777 1.00 0.00 H new ATOM 910 N GLY A 58 10.030 -19.580 81.185 1.00 0.00 N ATOM 911 CA GLY A 58 10.716 -18.855 80.086 1.00 0.00 C ATOM 912 C GLY A 58 11.823 -17.982 80.680 1.00 0.00 C ATOM 913 O GLY A 58 12.699 -18.464 81.371 1.00 0.00 O ATOM 0 H GLY A 58 9.075 -19.277 81.378 1.00 0.00 H new ATOM 0 HA2 GLY A 58 11.137 -19.564 79.373 1.00 0.00 H new ATOM 0 HA3 GLY A 58 10.003 -18.238 79.539 1.00 0.00 H new ATOM 917 N ALA A 59 11.795 -16.702 80.427 1.00 0.00 N ATOM 918 CA ALA A 59 12.853 -15.819 80.990 1.00 0.00 C ATOM 919 C ALA A 59 12.757 -14.419 80.384 1.00 0.00 C ATOM 920 O ALA A 59 13.597 -14.018 79.601 1.00 0.00 O ATOM 921 CB ALA A 59 14.229 -16.417 80.681 1.00 0.00 C ATOM 0 H ALA A 59 11.090 -16.233 79.859 1.00 0.00 H new ATOM 0 HA ALA A 59 12.715 -15.744 82.069 1.00 0.00 H new ATOM 0 HB1 ALA A 59 15.006 -15.773 81.092 1.00 0.00 H new ATOM 0 HB2 ALA A 59 14.304 -17.408 81.129 1.00 0.00 H new ATOM 0 HB3 ALA A 59 14.357 -16.497 79.601 1.00 0.00 H new ATOM 927 N ASP A 60 11.768 -13.653 80.757 1.00 0.00 N ATOM 928 CA ASP A 60 11.674 -12.273 80.213 1.00 0.00 C ATOM 929 C ASP A 60 12.826 -11.479 80.822 1.00 0.00 C ATOM 930 O ASP A 60 12.967 -10.288 80.632 1.00 0.00 O ATOM 931 CB ASP A 60 10.338 -11.641 80.607 1.00 0.00 C ATOM 932 CG ASP A 60 10.274 -10.213 80.069 1.00 0.00 C ATOM 933 OD1 ASP A 60 10.754 -9.321 80.751 1.00 0.00 O ATOM 934 OD2 ASP A 60 9.747 -10.031 78.983 1.00 0.00 O ATOM 0 H ASP A 60 11.030 -13.921 81.408 1.00 0.00 H new ATOM 0 HA ASP A 60 11.733 -12.278 79.125 1.00 0.00 H new ATOM 0 HB2 ASP A 60 9.513 -12.230 80.207 1.00 0.00 H new ATOM 0 HB3 ASP A 60 10.230 -11.638 81.692 1.00 0.00 H new ATOM 939 N ILE A 61 13.649 -12.173 81.554 1.00 0.00 N ATOM 940 CA ILE A 61 14.830 -11.560 82.217 1.00 0.00 C ATOM 941 C ILE A 61 15.632 -10.739 81.211 1.00 0.00 C ATOM 942 O ILE A 61 16.531 -10.004 81.566 1.00 0.00 O ATOM 943 CB ILE A 61 15.696 -12.706 82.734 1.00 0.00 C ATOM 944 CG1 ILE A 61 16.753 -12.179 83.708 1.00 0.00 C ATOM 945 CG2 ILE A 61 16.380 -13.387 81.543 1.00 0.00 C ATOM 946 CD1 ILE A 61 17.875 -13.210 83.863 1.00 0.00 C ATOM 0 H ILE A 61 13.547 -13.173 81.725 1.00 0.00 H new ATOM 0 HA ILE A 61 14.515 -10.900 83.026 1.00 0.00 H new ATOM 0 HB ILE A 61 15.068 -13.423 83.262 1.00 0.00 H new ATOM 0 HG12 ILE A 61 17.161 -11.237 83.342 1.00 0.00 H new ATOM 0 HG13 ILE A 61 16.298 -11.974 84.677 1.00 0.00 H new ATOM 0 HG21 ILE A 61 17.002 -14.208 81.901 1.00 0.00 H new ATOM 0 HG22 ILE A 61 15.623 -13.776 80.862 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.003 -12.663 81.018 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.625 -12.830 84.557 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.462 -14.142 84.249 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.338 -13.393 82.893 1.00 0.00 H new ATOM 958 N ASN A 62 15.327 -10.871 79.957 1.00 0.00 N ATOM 959 CA ASN A 62 16.086 -10.116 78.928 1.00 0.00 C ATOM 960 C ASN A 62 15.154 -9.738 77.773 1.00 0.00 C ATOM 961 O ASN A 62 15.263 -8.675 77.196 1.00 0.00 O ATOM 962 CB ASN A 62 17.243 -10.986 78.426 1.00 0.00 C ATOM 963 CG ASN A 62 16.738 -12.403 78.130 1.00 0.00 C ATOM 964 OD1 ASN A 62 15.491 -12.706 78.370 1.00 0.00 O flip ATOM 965 ND2 ASN A 62 17.489 -13.246 77.678 1.00 0.00 N flip ATOM 0 H ASN A 62 14.584 -11.470 79.598 1.00 0.00 H new ATOM 0 HA ASN A 62 16.489 -9.199 79.358 1.00 0.00 H new ATOM 0 HB2 ASN A 62 17.675 -10.549 77.526 1.00 0.00 H new ATOM 0 HB3 ASN A 62 18.035 -11.021 79.174 1.00 0.00 H new ATOM 0 HD21 ASN A 62 18.464 -13.012 77.489 1.00 0.00 H new ATOM 0 HD22 ASN A 62 17.144 -14.187 77.487 1.00 0.00 H new ATOM 972 N ALA A 63 14.223 -10.601 77.463 1.00 0.00 N ATOM 973 CA ALA A 63 13.225 -10.335 76.376 1.00 0.00 C ATOM 974 C ALA A 63 13.192 -8.852 75.951 1.00 0.00 C ATOM 975 O ALA A 63 13.391 -8.557 74.790 1.00 0.00 O ATOM 976 CB ALA A 63 11.833 -10.763 76.849 1.00 0.00 C ATOM 0 H ALA A 63 14.107 -11.502 77.927 1.00 0.00 H new ATOM 0 HA ALA A 63 13.529 -10.914 75.504 1.00 0.00 H new ATOM 0 HB1 ALA A 63 11.106 -10.571 76.060 1.00 0.00 H new ATOM 0 HB2 ALA A 63 11.840 -11.827 77.084 1.00 0.00 H new ATOM 0 HB3 ALA A 63 11.561 -10.196 77.739 1.00 0.00 H new ATOM 982 N PRO A 64 12.913 -7.961 76.889 1.00 0.00 N ATOM 983 CA PRO A 64 12.812 -6.520 76.637 1.00 0.00 C ATOM 984 C PRO A 64 13.388 -6.070 75.292 1.00 0.00 C ATOM 985 O PRO A 64 14.471 -6.448 74.896 1.00 0.00 O ATOM 986 CB PRO A 64 13.496 -5.917 77.857 1.00 0.00 C ATOM 987 CG PRO A 64 13.283 -6.960 78.997 1.00 0.00 C ATOM 988 CD PRO A 64 12.753 -8.259 78.327 1.00 0.00 C ATOM 0 HA PRO A 64 11.781 -6.182 76.528 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.556 -5.747 77.671 1.00 0.00 H new ATOM 0 HB3 PRO A 64 13.060 -4.953 78.118 1.00 0.00 H new ATOM 0 HG2 PRO A 64 14.217 -7.151 79.525 1.00 0.00 H new ATOM 0 HG3 PRO A 64 12.571 -6.587 79.734 1.00 0.00 H new ATOM 0 HD2 PRO A 64 13.328 -9.135 78.627 1.00 0.00 H new ATOM 0 HD3 PRO A 64 11.713 -8.456 78.588 1.00 0.00 H new ATOM 996 N ASP A 65 12.651 -5.234 74.610 1.00 0.00 N ATOM 997 CA ASP A 65 13.097 -4.690 73.297 1.00 0.00 C ATOM 998 C ASP A 65 12.587 -3.253 73.203 1.00 0.00 C ATOM 999 O ASP A 65 13.315 -2.336 72.879 1.00 0.00 O ATOM 1000 CB ASP A 65 12.503 -5.522 72.156 1.00 0.00 C ATOM 1001 CG ASP A 65 13.304 -6.813 71.987 1.00 0.00 C ATOM 1002 OD1 ASP A 65 14.508 -6.771 72.181 1.00 0.00 O ATOM 1003 OD2 ASP A 65 12.701 -7.824 71.668 1.00 0.00 O ATOM 0 H ASP A 65 11.738 -4.899 74.917 1.00 0.00 H new ATOM 0 HA ASP A 65 14.184 -4.724 73.217 1.00 0.00 H new ATOM 0 HB2 ASP A 65 11.460 -5.755 72.368 1.00 0.00 H new ATOM 0 HB3 ASP A 65 12.519 -4.949 71.229 1.00 0.00 H new ATOM 1008 N LYS A 66 11.333 -3.057 73.510 1.00 0.00 N ATOM 1009 CA LYS A 66 10.745 -1.698 73.474 1.00 0.00 C ATOM 1010 C LYS A 66 10.974 -1.046 74.836 1.00 0.00 C ATOM 1011 O LYS A 66 11.049 0.159 74.965 1.00 0.00 O ATOM 1012 CB LYS A 66 9.250 -1.831 73.208 1.00 0.00 C ATOM 1013 CG LYS A 66 8.713 -0.538 72.600 1.00 0.00 C ATOM 1014 CD LYS A 66 8.718 0.594 73.639 1.00 0.00 C ATOM 1015 CE LYS A 66 7.511 1.510 73.412 1.00 0.00 C ATOM 1016 NZ LYS A 66 7.561 2.064 72.029 1.00 0.00 N ATOM 0 H LYS A 66 10.686 -3.795 73.788 1.00 0.00 H new ATOM 0 HA LYS A 66 11.202 -1.090 72.693 1.00 0.00 H new ATOM 0 HB2 LYS A 66 9.065 -2.665 72.531 1.00 0.00 H new ATOM 0 HB3 LYS A 66 8.725 -2.052 74.137 1.00 0.00 H new ATOM 0 HG2 LYS A 66 9.322 -0.253 71.742 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.699 -0.697 72.233 1.00 0.00 H new ATOM 0 HD2 LYS A 66 8.686 0.177 74.645 1.00 0.00 H new ATOM 0 HD3 LYS A 66 9.642 1.168 73.561 1.00 0.00 H new ATOM 0 HE2 LYS A 66 6.586 0.953 73.559 1.00 0.00 H new ATOM 0 HE3 LYS A 66 7.514 2.321 74.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.905 2.867 71.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 8.527 2.385 71.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.286 1.326 71.349 1.00 0.00 H new ATOM 1030 N HIS A 67 11.092 -1.852 75.853 1.00 0.00 N ATOM 1031 CA HIS A 67 11.322 -1.322 77.217 1.00 0.00 C ATOM 1032 C HIS A 67 12.805 -0.976 77.372 1.00 0.00 C ATOM 1033 O HIS A 67 13.231 -0.472 78.390 1.00 0.00 O ATOM 1034 CB HIS A 67 10.927 -2.397 78.228 1.00 0.00 C ATOM 1035 CG HIS A 67 9.696 -3.110 77.738 1.00 0.00 C ATOM 1036 ND1 HIS A 67 9.694 -3.867 76.577 1.00 0.00 N ATOM 1037 CD2 HIS A 67 8.419 -3.183 78.236 1.00 0.00 C ATOM 1038 CE1 HIS A 67 8.451 -4.359 76.415 1.00 0.00 C ATOM 1039 NE2 HIS A 67 7.635 -3.973 77.400 1.00 0.00 N ATOM 0 H HIS A 67 11.037 -2.869 75.792 1.00 0.00 H new ATOM 0 HA HIS A 67 10.726 -0.425 77.386 1.00 0.00 H new ATOM 0 HB2 HIS A 67 11.744 -3.106 78.360 1.00 0.00 H new ATOM 0 HB3 HIS A 67 10.737 -1.945 79.201 1.00 0.00 H new ATOM 0 HD2 HIS A 67 8.075 -2.701 79.139 1.00 0.00 H new ATOM 0 HE1 HIS A 67 8.151 -4.988 75.590 1.00 0.00 H new ATOM 0 HE2 HIS A 67 6.649 -4.207 77.515 1.00 0.00 H new ATOM 1047 N HIS A 68 13.583 -1.234 76.354 1.00 0.00 N ATOM 1048 CA HIS A 68 15.042 -0.917 76.403 1.00 0.00 C ATOM 1049 C HIS A 68 15.607 -1.126 77.810 1.00 0.00 C ATOM 1050 O HIS A 68 16.505 -0.425 78.229 1.00 0.00 O ATOM 1051 CB HIS A 68 15.250 0.546 76.011 1.00 0.00 C ATOM 1052 CG HIS A 68 16.722 0.838 75.966 1.00 0.00 C ATOM 1053 ND1 HIS A 68 17.578 0.163 75.113 1.00 0.00 N ATOM 1054 CD2 HIS A 68 17.511 1.710 76.676 1.00 0.00 C ATOM 1055 CE1 HIS A 68 18.820 0.630 75.331 1.00 0.00 C ATOM 1056 NE2 HIS A 68 18.835 1.577 76.273 1.00 0.00 N ATOM 0 H HIS A 68 13.267 -1.656 75.481 1.00 0.00 H new ATOM 0 HA HIS A 68 15.559 -1.584 75.712 1.00 0.00 H new ATOM 0 HB2 HIS A 68 14.798 0.743 75.039 1.00 0.00 H new ATOM 0 HB3 HIS A 68 14.758 1.201 76.730 1.00 0.00 H new ATOM 0 HD2 HIS A 68 17.157 2.395 77.432 1.00 0.00 H new ATOM 0 HE1 HIS A 68 19.698 0.282 74.808 1.00 0.00 H new ATOM 0 HE2 HIS A 68 19.644 2.092 76.622 1.00 0.00 H new ATOM 1064 N ILE A 69 15.098 -2.068 78.553 1.00 0.00 N ATOM 1065 CA ILE A 69 15.631 -2.270 79.928 1.00 0.00 C ATOM 1066 C ILE A 69 15.281 -3.681 80.434 1.00 0.00 C ATOM 1067 O ILE A 69 14.335 -4.296 79.982 1.00 0.00 O ATOM 1068 CB ILE A 69 15.009 -1.193 80.843 1.00 0.00 C ATOM 1069 CG1 ILE A 69 16.101 -0.492 81.658 1.00 0.00 C ATOM 1070 CG2 ILE A 69 13.981 -1.813 81.797 1.00 0.00 C ATOM 1071 CD1 ILE A 69 16.886 -1.511 82.490 1.00 0.00 C ATOM 0 H ILE A 69 14.347 -2.699 78.273 1.00 0.00 H new ATOM 0 HA ILE A 69 16.717 -2.178 79.931 1.00 0.00 H new ATOM 0 HB ILE A 69 14.506 -0.464 80.208 1.00 0.00 H new ATOM 0 HG12 ILE A 69 16.778 0.039 80.989 1.00 0.00 H new ATOM 0 HG13 ILE A 69 15.652 0.253 82.314 1.00 0.00 H new ATOM 0 HG21 ILE A 69 13.557 -1.034 82.431 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.186 -2.283 81.219 1.00 0.00 H new ATOM 0 HG23 ILE A 69 14.469 -2.563 82.420 1.00 0.00 H new ATOM 0 HD11 ILE A 69 17.657 -0.996 83.063 1.00 0.00 H new ATOM 0 HD12 ILE A 69 16.208 -2.023 83.173 1.00 0.00 H new ATOM 0 HD13 ILE A 69 17.352 -2.240 81.827 1.00 0.00 H new ATOM 1083 N THR A 70 16.027 -4.183 81.393 1.00 0.00 N ATOM 1084 CA THR A 70 15.735 -5.533 81.961 1.00 0.00 C ATOM 1085 C THR A 70 15.287 -5.333 83.425 1.00 0.00 C ATOM 1086 O THR A 70 15.570 -4.303 84.006 1.00 0.00 O ATOM 1087 CB THR A 70 16.984 -6.429 81.869 1.00 0.00 C ATOM 1088 OG1 THR A 70 17.000 -7.348 82.947 1.00 0.00 O ATOM 1089 CG2 THR A 70 18.253 -5.576 81.898 1.00 0.00 C ATOM 0 H THR A 70 16.830 -3.709 81.806 1.00 0.00 H new ATOM 0 HA THR A 70 14.944 -6.031 81.400 1.00 0.00 H new ATOM 0 HB THR A 70 16.950 -6.979 80.928 1.00 0.00 H new ATOM 0 HG1 THR A 70 16.933 -8.262 82.599 1.00 0.00 H new ATOM 0 HG21 THR A 70 19.128 -6.223 81.832 1.00 0.00 H new ATOM 0 HG22 THR A 70 18.247 -4.886 81.054 1.00 0.00 H new ATOM 0 HG23 THR A 70 18.290 -5.010 82.829 1.00 0.00 H new ATOM 1097 N PRO A 71 14.551 -6.287 83.956 1.00 0.00 N ATOM 1098 CA PRO A 71 13.999 -6.198 85.326 1.00 0.00 C ATOM 1099 C PRO A 71 15.059 -6.114 86.430 1.00 0.00 C ATOM 1100 O PRO A 71 14.750 -5.676 87.519 1.00 0.00 O ATOM 1101 CB PRO A 71 13.183 -7.486 85.508 1.00 0.00 C ATOM 1102 CG PRO A 71 13.300 -8.312 84.204 1.00 0.00 C ATOM 1103 CD PRO A 71 14.198 -7.523 83.239 1.00 0.00 C ATOM 0 HA PRO A 71 13.419 -5.280 85.421 1.00 0.00 H new ATOM 0 HB2 PRO A 71 13.558 -8.058 86.357 1.00 0.00 H new ATOM 0 HB3 PRO A 71 12.140 -7.250 85.718 1.00 0.00 H new ATOM 0 HG2 PRO A 71 13.726 -9.294 84.409 1.00 0.00 H new ATOM 0 HG3 PRO A 71 12.316 -8.477 83.765 1.00 0.00 H new ATOM 0 HD2 PRO A 71 15.089 -8.093 82.977 1.00 0.00 H new ATOM 0 HD3 PRO A 71 13.676 -7.302 82.308 1.00 0.00 H new ATOM 1111 N LEU A 72 16.279 -6.543 86.238 1.00 0.00 N ATOM 1112 CA LEU A 72 17.203 -6.451 87.401 1.00 0.00 C ATOM 1113 C LEU A 72 17.254 -5.002 87.877 1.00 0.00 C ATOM 1114 O LEU A 72 17.277 -4.732 89.062 1.00 0.00 O ATOM 1115 CB LEU A 72 18.639 -6.940 87.105 1.00 0.00 C ATOM 1116 CG LEU A 72 18.745 -7.835 85.862 1.00 0.00 C ATOM 1117 CD1 LEU A 72 17.551 -8.795 85.744 1.00 0.00 C ATOM 1118 CD2 LEU A 72 18.860 -6.953 84.619 1.00 0.00 C ATOM 0 H LEU A 72 16.659 -6.933 85.375 1.00 0.00 H new ATOM 0 HA LEU A 72 16.806 -7.115 88.169 1.00 0.00 H new ATOM 0 HB2 LEU A 72 19.288 -6.074 86.974 1.00 0.00 H new ATOM 0 HB3 LEU A 72 19.011 -7.489 87.970 1.00 0.00 H new ATOM 0 HG LEU A 72 19.637 -8.454 85.955 1.00 0.00 H new ATOM 0 HD11 LEU A 72 17.665 -9.410 84.851 1.00 0.00 H new ATOM 0 HD12 LEU A 72 17.512 -9.437 86.624 1.00 0.00 H new ATOM 0 HD13 LEU A 72 16.628 -8.220 85.673 1.00 0.00 H new ATOM 0 HD21 LEU A 72 18.936 -7.582 83.732 1.00 0.00 H new ATOM 0 HD22 LEU A 72 17.977 -6.319 84.540 1.00 0.00 H new ATOM 0 HD23 LEU A 72 19.750 -6.328 84.697 1.00 0.00 H new ATOM 1130 N LEU A 73 17.268 -4.063 86.975 1.00 0.00 N ATOM 1131 CA LEU A 73 17.315 -2.645 87.413 1.00 0.00 C ATOM 1132 C LEU A 73 15.996 -2.280 88.088 1.00 0.00 C ATOM 1133 O LEU A 73 15.938 -1.387 88.907 1.00 0.00 O ATOM 1134 CB LEU A 73 17.556 -1.725 86.212 1.00 0.00 C ATOM 1135 CG LEU A 73 18.935 -2.035 85.599 1.00 0.00 C ATOM 1136 CD1 LEU A 73 18.815 -3.138 84.535 1.00 0.00 C ATOM 1137 CD2 LEU A 73 19.521 -0.762 84.966 1.00 0.00 C ATOM 0 H LEU A 73 17.249 -4.214 85.966 1.00 0.00 H new ATOM 0 HA LEU A 73 18.135 -2.517 88.120 1.00 0.00 H new ATOM 0 HB2 LEU A 73 16.774 -1.869 85.467 1.00 0.00 H new ATOM 0 HB3 LEU A 73 17.511 -0.682 86.524 1.00 0.00 H new ATOM 0 HG LEU A 73 19.599 -2.384 86.390 1.00 0.00 H new ATOM 0 HD11 LEU A 73 19.798 -3.344 84.112 1.00 0.00 H new ATOM 0 HD12 LEU A 73 18.420 -4.044 84.994 1.00 0.00 H new ATOM 0 HD13 LEU A 73 18.142 -2.808 83.744 1.00 0.00 H new ATOM 0 HD21 LEU A 73 20.496 -0.986 84.534 1.00 0.00 H new ATOM 0 HD22 LEU A 73 18.852 -0.403 84.184 1.00 0.00 H new ATOM 0 HD23 LEU A 73 19.631 0.007 85.731 1.00 0.00 H new ATOM 1149 N SER A 74 14.928 -2.956 87.769 1.00 0.00 N ATOM 1150 CA SER A 74 13.643 -2.609 88.431 1.00 0.00 C ATOM 1151 C SER A 74 13.802 -2.738 89.949 1.00 0.00 C ATOM 1152 O SER A 74 13.437 -1.854 90.702 1.00 0.00 O ATOM 1153 CB SER A 74 12.531 -3.540 87.949 1.00 0.00 C ATOM 1154 OG SER A 74 11.490 -3.559 88.915 1.00 0.00 O ATOM 0 H SER A 74 14.889 -3.718 87.093 1.00 0.00 H new ATOM 0 HA SER A 74 13.377 -1.583 88.176 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.146 -3.200 86.988 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.922 -4.546 87.798 1.00 0.00 H new ATOM 0 HG SER A 74 10.773 -4.153 88.611 1.00 0.00 H new ATOM 1160 N ALA A 75 14.348 -3.832 90.402 1.00 0.00 N ATOM 1161 CA ALA A 75 14.530 -4.022 91.877 1.00 0.00 C ATOM 1162 C ALA A 75 15.623 -3.083 92.390 1.00 0.00 C ATOM 1163 O ALA A 75 15.574 -2.611 93.508 1.00 0.00 O ATOM 1164 CB ALA A 75 14.916 -5.474 92.164 1.00 0.00 C ATOM 0 H ALA A 75 14.677 -4.603 89.821 1.00 0.00 H new ATOM 0 HA ALA A 75 13.595 -3.791 92.387 1.00 0.00 H new ATOM 0 HB1 ALA A 75 15.048 -5.610 93.237 1.00 0.00 H new ATOM 0 HB2 ALA A 75 14.127 -6.137 91.808 1.00 0.00 H new ATOM 0 HB3 ALA A 75 15.848 -5.711 91.651 1.00 0.00 H new ATOM 1170 N VAL A 76 16.609 -2.812 91.585 1.00 0.00 N ATOM 1171 CA VAL A 76 17.708 -1.909 92.021 1.00 0.00 C ATOM 1172 C VAL A 76 17.122 -0.681 92.743 1.00 0.00 C ATOM 1173 O VAL A 76 17.354 -0.482 93.918 1.00 0.00 O ATOM 1174 CB VAL A 76 18.514 -1.499 90.777 1.00 0.00 C ATOM 1175 CG1 VAL A 76 19.371 -0.254 91.042 1.00 0.00 C ATOM 1176 CG2 VAL A 76 19.431 -2.664 90.378 1.00 0.00 C ATOM 0 H VAL A 76 16.702 -3.179 90.638 1.00 0.00 H new ATOM 0 HA VAL A 76 18.369 -2.416 92.724 1.00 0.00 H new ATOM 0 HB VAL A 76 17.813 -1.262 89.976 1.00 0.00 H new ATOM 0 HG11 VAL A 76 19.926 0.005 90.140 1.00 0.00 H new ATOM 0 HG12 VAL A 76 18.726 0.579 91.323 1.00 0.00 H new ATOM 0 HG13 VAL A 76 20.071 -0.460 91.852 1.00 0.00 H new ATOM 0 HG21 VAL A 76 20.009 -2.387 89.496 1.00 0.00 H new ATOM 0 HG22 VAL A 76 20.110 -2.891 91.200 1.00 0.00 H new ATOM 0 HG23 VAL A 76 18.826 -3.543 90.154 1.00 0.00 H new ATOM 1186 N TYR A 77 16.373 0.145 92.057 1.00 0.00 N ATOM 1187 CA TYR A 77 15.788 1.352 92.723 1.00 0.00 C ATOM 1188 C TYR A 77 14.589 0.956 93.593 1.00 0.00 C ATOM 1189 O TYR A 77 13.597 1.658 93.634 1.00 0.00 O ATOM 1190 CB TYR A 77 15.321 2.359 91.662 1.00 0.00 C ATOM 1191 CG TYR A 77 16.109 2.167 90.393 1.00 0.00 C ATOM 1192 CD1 TYR A 77 17.343 2.804 90.236 1.00 0.00 C ATOM 1193 CD2 TYR A 77 15.601 1.362 89.369 1.00 0.00 C ATOM 1194 CE1 TYR A 77 18.072 2.634 89.054 1.00 0.00 C ATOM 1195 CE2 TYR A 77 16.327 1.193 88.185 1.00 0.00 C ATOM 1196 CZ TYR A 77 17.564 1.829 88.027 1.00 0.00 C ATOM 1197 OH TYR A 77 18.280 1.666 86.858 1.00 0.00 O ATOM 0 H TYR A 77 16.141 0.038 91.069 1.00 0.00 H new ATOM 0 HA TYR A 77 16.556 1.803 93.351 1.00 0.00 H new ATOM 0 HB2 TYR A 77 14.258 2.225 91.464 1.00 0.00 H new ATOM 0 HB3 TYR A 77 15.451 3.376 92.031 1.00 0.00 H new ATOM 0 HD1 TYR A 77 17.734 3.427 91.027 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.647 0.870 89.492 1.00 0.00 H new ATOM 0 HE1 TYR A 77 19.027 3.124 88.934 1.00 0.00 H new ATOM 0 HE2 TYR A 77 15.933 0.572 87.394 1.00 0.00 H new ATOM 0 HH TYR A 77 17.695 1.835 86.090 1.00 0.00 H new ATOM 1207 N GLU A 78 14.655 -0.150 94.288 1.00 0.00 N ATOM 1208 CA GLU A 78 13.491 -0.547 95.140 1.00 0.00 C ATOM 1209 C GLU A 78 13.946 -0.815 96.571 1.00 0.00 C ATOM 1210 O GLU A 78 13.158 -0.781 97.496 1.00 0.00 O ATOM 1211 CB GLU A 78 12.837 -1.807 94.575 1.00 0.00 C ATOM 1212 CG GLU A 78 11.469 -1.995 95.230 1.00 0.00 C ATOM 1213 CD GLU A 78 10.587 -2.830 94.313 1.00 0.00 C ATOM 1214 OE1 GLU A 78 10.832 -4.021 94.211 1.00 0.00 O ATOM 1215 OE2 GLU A 78 9.683 -2.263 93.723 1.00 0.00 O ATOM 0 H GLU A 78 15.451 -0.788 94.304 1.00 0.00 H new ATOM 0 HA GLU A 78 12.770 0.270 95.141 1.00 0.00 H new ATOM 0 HB2 GLU A 78 12.728 -1.722 93.494 1.00 0.00 H new ATOM 0 HB3 GLU A 78 13.468 -2.676 94.765 1.00 0.00 H new ATOM 0 HG2 GLU A 78 11.579 -2.488 96.196 1.00 0.00 H new ATOM 0 HG3 GLU A 78 11.006 -1.026 95.417 1.00 0.00 H new ATOM 1222 N GLY A 79 15.200 -1.088 96.769 1.00 0.00 N ATOM 1223 CA GLY A 79 15.676 -1.363 98.150 1.00 0.00 C ATOM 1224 C GLY A 79 15.549 -2.858 98.430 1.00 0.00 C ATOM 1225 O GLY A 79 16.058 -3.359 99.413 1.00 0.00 O ATOM 0 H GLY A 79 15.913 -1.133 96.041 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.713 -1.046 98.261 1.00 0.00 H new ATOM 0 HA3 GLY A 79 15.089 -0.794 98.871 1.00 0.00 H new ATOM 1229 N HIS A 80 14.892 -3.582 97.560 1.00 0.00 N ATOM 1230 CA HIS A 80 14.757 -5.047 97.767 1.00 0.00 C ATOM 1231 C HIS A 80 16.074 -5.702 97.377 1.00 0.00 C ATOM 1232 O HIS A 80 16.708 -6.366 98.170 1.00 0.00 O ATOM 1233 CB HIS A 80 13.649 -5.605 96.869 1.00 0.00 C ATOM 1234 CG HIS A 80 12.302 -5.467 97.526 1.00 0.00 C ATOM 1235 ND1 HIS A 80 11.403 -6.523 97.576 1.00 0.00 N ATOM 1236 CD2 HIS A 80 11.676 -4.414 98.144 1.00 0.00 C ATOM 1237 CE1 HIS A 80 10.297 -6.089 98.199 1.00 0.00 C ATOM 1238 NE2 HIS A 80 10.407 -4.809 98.567 1.00 0.00 N ATOM 0 H HIS A 80 14.445 -3.219 96.718 1.00 0.00 H new ATOM 0 HA HIS A 80 14.510 -5.250 98.809 1.00 0.00 H new ATOM 0 HB2 HIS A 80 13.648 -5.077 95.915 1.00 0.00 H new ATOM 0 HB3 HIS A 80 13.846 -6.655 96.652 1.00 0.00 H new ATOM 0 HD2 HIS A 80 12.101 -3.431 98.282 1.00 0.00 H new ATOM 0 HE1 HIS A 80 9.425 -6.699 98.381 1.00 0.00 H new ATOM 0 HE2 HIS A 80 9.712 -4.242 99.053 1.00 0.00 H new ATOM 1246 N VAL A 81 16.482 -5.511 96.150 1.00 0.00 N ATOM 1247 CA VAL A 81 17.759 -6.112 95.666 1.00 0.00 C ATOM 1248 C VAL A 81 17.944 -7.519 96.233 1.00 0.00 C ATOM 1249 O VAL A 81 18.990 -8.122 96.095 1.00 0.00 O ATOM 1250 CB VAL A 81 18.944 -5.205 96.025 1.00 0.00 C ATOM 1251 CG1 VAL A 81 19.091 -4.119 94.952 1.00 0.00 C ATOM 1252 CG2 VAL A 81 18.697 -4.535 97.384 1.00 0.00 C ATOM 0 H VAL A 81 15.979 -4.958 95.456 1.00 0.00 H new ATOM 0 HA VAL A 81 17.715 -6.197 94.580 1.00 0.00 H new ATOM 0 HB VAL A 81 19.852 -5.806 96.077 1.00 0.00 H new ATOM 0 HG11 VAL A 81 19.932 -3.472 95.202 1.00 0.00 H new ATOM 0 HG12 VAL A 81 19.269 -4.586 93.983 1.00 0.00 H new ATOM 0 HG13 VAL A 81 18.177 -3.526 94.907 1.00 0.00 H new ATOM 0 HG21 VAL A 81 19.542 -3.893 97.632 1.00 0.00 H new ATOM 0 HG22 VAL A 81 17.788 -3.935 97.334 1.00 0.00 H new ATOM 0 HG23 VAL A 81 18.585 -5.300 98.152 1.00 0.00 H new ATOM 1262 N SER A 82 16.928 -8.084 96.814 1.00 0.00 N ATOM 1263 CA SER A 82 17.063 -9.474 97.300 1.00 0.00 C ATOM 1264 C SER A 82 16.921 -10.357 96.063 1.00 0.00 C ATOM 1265 O SER A 82 17.352 -11.491 96.026 1.00 0.00 O ATOM 1266 CB SER A 82 15.967 -9.790 98.325 1.00 0.00 C ATOM 1267 OG SER A 82 16.565 -10.019 99.595 1.00 0.00 O ATOM 0 H SER A 82 16.020 -7.647 96.971 1.00 0.00 H new ATOM 0 HA SER A 82 18.018 -9.639 97.800 1.00 0.00 H new ATOM 0 HB2 SER A 82 15.261 -8.962 98.387 1.00 0.00 H new ATOM 0 HB3 SER A 82 15.402 -10.668 98.012 1.00 0.00 H new ATOM 0 HG SER A 82 15.868 -10.220 100.254 1.00 0.00 H new ATOM 1273 N CYS A 83 16.320 -9.805 95.037 1.00 0.00 N ATOM 1274 CA CYS A 83 16.132 -10.550 93.764 1.00 0.00 C ATOM 1275 C CYS A 83 17.400 -10.419 92.912 1.00 0.00 C ATOM 1276 O CYS A 83 17.943 -11.399 92.452 1.00 0.00 O ATOM 1277 CB CYS A 83 14.936 -9.962 93.007 1.00 0.00 C ATOM 1278 SG CYS A 83 14.714 -8.230 93.484 1.00 0.00 S ATOM 0 H CYS A 83 15.948 -8.855 95.033 1.00 0.00 H new ATOM 0 HA CYS A 83 15.944 -11.603 93.974 1.00 0.00 H new ATOM 0 HB2 CYS A 83 15.100 -10.036 91.932 1.00 0.00 H new ATOM 0 HB3 CYS A 83 14.034 -10.531 93.232 1.00 0.00 H new ATOM 0 HG CYS A 83 13.567 -7.803 93.046 1.00 0.00 H new ATOM 1284 N VAL A 84 17.881 -9.219 92.694 1.00 0.00 N ATOM 1285 CA VAL A 84 19.117 -9.056 91.872 1.00 0.00 C ATOM 1286 C VAL A 84 20.123 -10.134 92.267 1.00 0.00 C ATOM 1287 O VAL A 84 20.746 -10.755 91.435 1.00 0.00 O ATOM 1288 CB VAL A 84 19.740 -7.684 92.123 1.00 0.00 C ATOM 1289 CG1 VAL A 84 18.764 -6.589 91.688 1.00 0.00 C ATOM 1290 CG2 VAL A 84 20.053 -7.533 93.608 1.00 0.00 C ATOM 0 H VAL A 84 17.474 -8.353 93.047 1.00 0.00 H new ATOM 0 HA VAL A 84 18.858 -9.146 90.817 1.00 0.00 H new ATOM 0 HB VAL A 84 20.661 -7.593 91.548 1.00 0.00 H new ATOM 0 HG11 VAL A 84 19.211 -5.611 91.868 1.00 0.00 H new ATOM 0 HG12 VAL A 84 18.545 -6.698 90.626 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.840 -6.677 92.260 1.00 0.00 H new ATOM 0 HG21 VAL A 84 20.498 -6.554 93.788 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.133 -7.625 94.185 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.752 -8.311 93.913 1.00 0.00 H new ATOM 1300 N LYS A 85 20.281 -10.356 93.540 1.00 0.00 N ATOM 1301 CA LYS A 85 21.245 -11.385 94.006 1.00 0.00 C ATOM 1302 C LYS A 85 20.991 -12.720 93.278 1.00 0.00 C ATOM 1303 O LYS A 85 21.722 -13.095 92.381 1.00 0.00 O ATOM 1304 CB LYS A 85 21.075 -11.562 95.522 1.00 0.00 C ATOM 1305 CG LYS A 85 22.367 -11.170 96.253 1.00 0.00 C ATOM 1306 CD LYS A 85 22.504 -9.646 96.263 1.00 0.00 C ATOM 1307 CE LYS A 85 23.847 -9.254 96.883 1.00 0.00 C ATOM 1308 NZ LYS A 85 23.941 -9.806 98.265 1.00 0.00 N ATOM 0 H LYS A 85 19.780 -9.865 94.281 1.00 0.00 H new ATOM 0 HA LYS A 85 22.264 -11.067 93.784 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.248 -10.947 95.876 1.00 0.00 H new ATOM 0 HB3 LYS A 85 20.821 -12.598 95.748 1.00 0.00 H new ATOM 0 HG2 LYS A 85 22.350 -11.551 97.274 1.00 0.00 H new ATOM 0 HG3 LYS A 85 23.228 -11.620 95.759 1.00 0.00 H new ATOM 0 HD2 LYS A 85 22.434 -9.258 95.247 1.00 0.00 H new ATOM 0 HD3 LYS A 85 21.687 -9.201 96.831 1.00 0.00 H new ATOM 0 HE2 LYS A 85 24.666 -9.635 96.272 1.00 0.00 H new ATOM 0 HE3 LYS A 85 23.945 -8.169 96.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 24.697 -9.316 98.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 23.036 -9.665 98.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 24.155 -10.823 98.219 1.00 0.00 H new ATOM 1322 N LEU A 86 19.974 -13.448 93.660 1.00 0.00 N ATOM 1323 CA LEU A 86 19.705 -14.756 92.986 1.00 0.00 C ATOM 1324 C LEU A 86 19.403 -14.535 91.498 1.00 0.00 C ATOM 1325 O LEU A 86 19.217 -15.468 90.745 1.00 0.00 O ATOM 1326 CB LEU A 86 18.565 -15.492 93.726 1.00 0.00 C ATOM 1327 CG LEU A 86 17.191 -15.318 93.055 1.00 0.00 C ATOM 1328 CD1 LEU A 86 16.922 -13.848 92.719 1.00 0.00 C ATOM 1329 CD2 LEU A 86 17.099 -16.187 91.790 1.00 0.00 C ATOM 0 H LEU A 86 19.322 -13.197 94.403 1.00 0.00 H new ATOM 0 HA LEU A 86 20.589 -15.392 93.033 1.00 0.00 H new ATOM 0 HB2 LEU A 86 18.803 -16.554 93.780 1.00 0.00 H new ATOM 0 HB3 LEU A 86 18.510 -15.125 94.751 1.00 0.00 H new ATOM 0 HG LEU A 86 16.427 -15.645 93.760 1.00 0.00 H new ATOM 0 HD11 LEU A 86 15.944 -13.756 92.246 1.00 0.00 H new ATOM 0 HD12 LEU A 86 16.939 -13.256 93.634 1.00 0.00 H new ATOM 0 HD13 LEU A 86 17.691 -13.484 92.037 1.00 0.00 H new ATOM 0 HD21 LEU A 86 16.121 -16.053 91.327 1.00 0.00 H new ATOM 0 HD22 LEU A 86 17.877 -15.890 91.087 1.00 0.00 H new ATOM 0 HD23 LEU A 86 17.233 -17.235 92.058 1.00 0.00 H new ATOM 1341 N LEU A 87 19.364 -13.306 91.060 1.00 0.00 N ATOM 1342 CA LEU A 87 19.065 -13.042 89.622 1.00 0.00 C ATOM 1343 C LEU A 87 20.281 -13.352 88.743 1.00 0.00 C ATOM 1344 O LEU A 87 20.314 -14.360 88.067 1.00 0.00 O ATOM 1345 CB LEU A 87 18.678 -11.572 89.447 1.00 0.00 C ATOM 1346 CG LEU A 87 17.292 -11.465 88.807 1.00 0.00 C ATOM 1347 CD1 LEU A 87 16.862 -9.996 88.768 1.00 0.00 C ATOM 1348 CD2 LEU A 87 17.338 -12.029 87.382 1.00 0.00 C ATOM 0 H LEU A 87 19.525 -12.477 91.632 1.00 0.00 H new ATOM 0 HA LEU A 87 18.242 -13.688 89.316 1.00 0.00 H new ATOM 0 HB2 LEU A 87 18.680 -11.070 90.414 1.00 0.00 H new ATOM 0 HB3 LEU A 87 19.415 -11.066 88.824 1.00 0.00 H new ATOM 0 HG LEU A 87 16.574 -12.037 89.395 1.00 0.00 H new ATOM 0 HD11 LEU A 87 15.875 -9.918 88.312 1.00 0.00 H new ATOM 0 HD12 LEU A 87 16.826 -9.600 89.783 1.00 0.00 H new ATOM 0 HD13 LEU A 87 17.579 -9.422 88.181 1.00 0.00 H new ATOM 0 HD21 LEU A 87 16.350 -11.952 86.928 1.00 0.00 H new ATOM 0 HD22 LEU A 87 18.055 -11.461 86.789 1.00 0.00 H new ATOM 0 HD23 LEU A 87 17.642 -13.075 87.414 1.00 0.00 H new ATOM 1360 N LEU A 88 21.270 -12.491 88.710 1.00 0.00 N ATOM 1361 CA LEU A 88 22.437 -12.775 87.825 1.00 0.00 C ATOM 1362 C LEU A 88 22.911 -14.201 88.056 1.00 0.00 C ATOM 1363 O LEU A 88 23.650 -14.756 87.267 1.00 0.00 O ATOM 1364 CB LEU A 88 23.591 -11.774 88.034 1.00 0.00 C ATOM 1365 CG LEU A 88 24.252 -11.916 89.415 1.00 0.00 C ATOM 1366 CD1 LEU A 88 23.188 -11.896 90.504 1.00 0.00 C ATOM 1367 CD2 LEU A 88 25.065 -13.218 89.501 1.00 0.00 C ATOM 0 H LEU A 88 21.319 -11.624 89.245 1.00 0.00 H new ATOM 0 HA LEU A 88 22.111 -12.660 86.791 1.00 0.00 H new ATOM 0 HB2 LEU A 88 24.342 -11.924 87.258 1.00 0.00 H new ATOM 0 HB3 LEU A 88 23.212 -10.759 87.919 1.00 0.00 H new ATOM 0 HG LEU A 88 24.932 -11.076 89.559 1.00 0.00 H new ATOM 0 HD11 LEU A 88 23.664 -11.997 91.479 1.00 0.00 H new ATOM 0 HD12 LEU A 88 22.642 -10.953 90.462 1.00 0.00 H new ATOM 0 HD13 LEU A 88 22.495 -12.723 90.351 1.00 0.00 H new ATOM 0 HD21 LEU A 88 25.523 -13.296 90.487 1.00 0.00 H new ATOM 0 HD22 LEU A 88 24.405 -14.070 89.339 1.00 0.00 H new ATOM 0 HD23 LEU A 88 25.844 -13.212 88.738 1.00 0.00 H new ATOM 1379 N SER A 89 22.471 -14.816 89.116 1.00 0.00 N ATOM 1380 CA SER A 89 22.880 -16.222 89.366 1.00 0.00 C ATOM 1381 C SER A 89 22.514 -17.044 88.127 1.00 0.00 C ATOM 1382 O SER A 89 22.923 -18.177 87.966 1.00 0.00 O ATOM 1383 CB SER A 89 22.137 -16.766 90.587 1.00 0.00 C ATOM 1384 OG SER A 89 22.740 -17.986 90.999 1.00 0.00 O ATOM 0 H SER A 89 21.850 -14.409 89.815 1.00 0.00 H new ATOM 0 HA SER A 89 23.951 -16.280 89.558 1.00 0.00 H new ATOM 0 HB2 SER A 89 22.168 -16.040 91.399 1.00 0.00 H new ATOM 0 HB3 SER A 89 21.087 -16.930 90.345 1.00 0.00 H new ATOM 0 HG SER A 89 23.131 -18.436 90.222 1.00 0.00 H new ATOM 1390 N LYS A 90 21.752 -16.452 87.240 1.00 0.00 N ATOM 1391 CA LYS A 90 21.348 -17.147 85.982 1.00 0.00 C ATOM 1392 C LYS A 90 22.018 -16.441 84.805 1.00 0.00 C ATOM 1393 O LYS A 90 22.165 -16.985 83.729 1.00 0.00 O ATOM 1394 CB LYS A 90 19.830 -17.046 85.800 1.00 0.00 C ATOM 1395 CG LYS A 90 19.112 -17.669 86.996 1.00 0.00 C ATOM 1396 CD LYS A 90 17.606 -17.417 86.874 1.00 0.00 C ATOM 1397 CE LYS A 90 17.093 -18.003 85.555 1.00 0.00 C ATOM 1398 NZ LYS A 90 15.635 -18.289 85.673 1.00 0.00 N ATOM 0 H LYS A 90 21.389 -15.504 87.338 1.00 0.00 H new ATOM 0 HA LYS A 90 21.645 -18.195 86.031 1.00 0.00 H new ATOM 0 HB2 LYS A 90 19.538 -16.001 85.695 1.00 0.00 H new ATOM 0 HB3 LYS A 90 19.532 -17.554 84.883 1.00 0.00 H new ATOM 0 HG2 LYS A 90 19.310 -18.740 87.036 1.00 0.00 H new ATOM 0 HG3 LYS A 90 19.489 -17.240 87.924 1.00 0.00 H new ATOM 0 HD2 LYS A 90 17.082 -17.872 87.714 1.00 0.00 H new ATOM 0 HD3 LYS A 90 17.402 -16.347 86.912 1.00 0.00 H new ATOM 0 HE2 LYS A 90 17.272 -17.303 84.739 1.00 0.00 H new ATOM 0 HE3 LYS A 90 17.636 -18.917 85.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 15.188 -18.207 84.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 15.499 -19.253 86.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 15.199 -17.606 86.325 1.00 0.00 H new ATOM 1412 N GLY A 91 22.401 -15.217 85.015 1.00 0.00 N ATOM 1413 CA GLY A 91 23.046 -14.417 83.940 1.00 0.00 C ATOM 1414 C GLY A 91 22.471 -13.002 83.988 1.00 0.00 C ATOM 1415 O GLY A 91 22.913 -12.169 84.755 1.00 0.00 O ATOM 0 H GLY A 91 22.293 -14.727 85.903 1.00 0.00 H new ATOM 0 HA2 GLY A 91 24.127 -14.393 84.080 1.00 0.00 H new ATOM 0 HA3 GLY A 91 22.861 -14.870 82.966 1.00 0.00 H new ATOM 1419 N ALA A 92 21.468 -12.734 83.198 1.00 0.00 N ATOM 1420 CA ALA A 92 20.834 -11.382 83.211 1.00 0.00 C ATOM 1421 C ALA A 92 21.883 -10.271 83.135 1.00 0.00 C ATOM 1422 O ALA A 92 21.539 -9.107 83.135 1.00 0.00 O ATOM 1423 CB ALA A 92 20.058 -11.217 84.520 1.00 0.00 C ATOM 0 H ALA A 92 21.057 -13.396 82.540 1.00 0.00 H new ATOM 0 HA ALA A 92 20.178 -11.304 82.344 1.00 0.00 H new ATOM 0 HB1 ALA A 92 19.589 -10.233 84.544 1.00 0.00 H new ATOM 0 HB2 ALA A 92 19.289 -11.987 84.587 1.00 0.00 H new ATOM 0 HB3 ALA A 92 20.742 -11.313 85.363 1.00 0.00 H new ATOM 1429 N ASP A 93 23.144 -10.601 83.086 1.00 0.00 N ATOM 1430 CA ASP A 93 24.184 -9.530 83.036 1.00 0.00 C ATOM 1431 C ASP A 93 23.701 -8.343 83.884 1.00 0.00 C ATOM 1432 O ASP A 93 23.109 -8.525 84.928 1.00 0.00 O ATOM 1433 CB ASP A 93 24.386 -9.099 81.575 1.00 0.00 C ATOM 1434 CG ASP A 93 25.869 -8.822 81.310 1.00 0.00 C ATOM 1435 OD1 ASP A 93 26.693 -9.551 81.838 1.00 0.00 O ATOM 1436 OD2 ASP A 93 26.155 -7.889 80.578 1.00 0.00 O ATOM 0 H ASP A 93 23.499 -11.557 83.078 1.00 0.00 H new ATOM 0 HA ASP A 93 25.133 -9.893 83.431 1.00 0.00 H new ATOM 0 HB2 ASP A 93 24.028 -9.880 80.904 1.00 0.00 H new ATOM 0 HB3 ASP A 93 23.798 -8.205 81.366 1.00 0.00 H new ATOM 1441 N LYS A 94 23.916 -7.138 83.441 1.00 0.00 N ATOM 1442 CA LYS A 94 23.431 -5.964 84.224 1.00 0.00 C ATOM 1443 C LYS A 94 23.283 -4.762 83.288 1.00 0.00 C ATOM 1444 O LYS A 94 22.454 -3.899 83.496 1.00 0.00 O ATOM 1445 CB LYS A 94 24.403 -5.640 85.372 1.00 0.00 C ATOM 1446 CG LYS A 94 25.779 -5.239 84.824 1.00 0.00 C ATOM 1447 CD LYS A 94 26.585 -6.488 84.437 1.00 0.00 C ATOM 1448 CE LYS A 94 26.984 -6.401 82.961 1.00 0.00 C ATOM 1449 NZ LYS A 94 27.868 -7.545 82.617 1.00 0.00 N ATOM 0 H LYS A 94 24.404 -6.913 82.574 1.00 0.00 H new ATOM 0 HA LYS A 94 22.462 -6.200 84.664 1.00 0.00 H new ATOM 0 HB2 LYS A 94 23.998 -4.830 85.979 1.00 0.00 H new ATOM 0 HB3 LYS A 94 24.505 -6.508 86.024 1.00 0.00 H new ATOM 0 HG2 LYS A 94 25.657 -4.593 83.955 1.00 0.00 H new ATOM 0 HG3 LYS A 94 26.323 -4.665 85.574 1.00 0.00 H new ATOM 0 HD2 LYS A 94 27.475 -6.567 85.061 1.00 0.00 H new ATOM 0 HD3 LYS A 94 25.992 -7.385 84.612 1.00 0.00 H new ATOM 0 HE2 LYS A 94 26.094 -6.414 82.332 1.00 0.00 H new ATOM 0 HE3 LYS A 94 27.498 -5.460 82.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 28.139 -7.485 81.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 28.723 -7.514 83.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 27.362 -8.438 82.787 1.00 0.00 H new ATOM 1463 N THR A 95 24.070 -4.714 82.246 1.00 0.00 N ATOM 1464 CA THR A 95 23.978 -3.591 81.272 1.00 0.00 C ATOM 1465 C THR A 95 23.678 -4.179 79.895 1.00 0.00 C ATOM 1466 O THR A 95 24.085 -3.652 78.879 1.00 0.00 O ATOM 1467 CB THR A 95 25.317 -2.849 81.219 1.00 0.00 C ATOM 1468 OG1 THR A 95 26.373 -3.795 81.287 1.00 0.00 O ATOM 1469 CG2 THR A 95 25.433 -1.877 82.393 1.00 0.00 C ATOM 0 H THR A 95 24.780 -5.413 82.027 1.00 0.00 H new ATOM 0 HA THR A 95 23.193 -2.896 81.572 1.00 0.00 H new ATOM 0 HB THR A 95 25.376 -2.285 80.288 1.00 0.00 H new ATOM 0 HG1 THR A 95 27.234 -3.328 81.252 1.00 0.00 H new ATOM 0 HG21 THR A 95 26.390 -1.357 82.342 1.00 0.00 H new ATOM 0 HG22 THR A 95 24.622 -1.150 82.345 1.00 0.00 H new ATOM 0 HG23 THR A 95 25.370 -2.430 83.330 1.00 0.00 H new ATOM 1477 N VAL A 96 22.972 -5.275 79.857 1.00 0.00 N ATOM 1478 CA VAL A 96 22.648 -5.910 78.557 1.00 0.00 C ATOM 1479 C VAL A 96 21.476 -5.163 77.915 1.00 0.00 C ATOM 1480 O VAL A 96 21.078 -5.453 76.805 1.00 0.00 O ATOM 1481 CB VAL A 96 22.285 -7.389 78.800 1.00 0.00 C ATOM 1482 CG1 VAL A 96 21.122 -7.833 77.902 1.00 0.00 C ATOM 1483 CG2 VAL A 96 23.505 -8.266 78.505 1.00 0.00 C ATOM 0 H VAL A 96 22.605 -5.758 80.677 1.00 0.00 H new ATOM 0 HA VAL A 96 23.504 -5.863 77.884 1.00 0.00 H new ATOM 0 HB VAL A 96 21.980 -7.497 79.841 1.00 0.00 H new ATOM 0 HG11 VAL A 96 20.891 -8.880 78.098 1.00 0.00 H new ATOM 0 HG12 VAL A 96 20.245 -7.222 78.114 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.404 -7.713 76.856 1.00 0.00 H new ATOM 0 HG21 VAL A 96 23.251 -9.312 78.676 1.00 0.00 H new ATOM 0 HG22 VAL A 96 23.807 -8.131 77.467 1.00 0.00 H new ATOM 0 HG23 VAL A 96 24.326 -7.980 79.162 1.00 0.00 H new ATOM 1493 N LYS A 97 20.917 -4.200 78.599 1.00 0.00 N ATOM 1494 CA LYS A 97 19.773 -3.454 78.002 1.00 0.00 C ATOM 1495 C LYS A 97 19.595 -2.083 78.675 1.00 0.00 C ATOM 1496 O LYS A 97 18.768 -1.296 78.261 1.00 0.00 O ATOM 1497 CB LYS A 97 18.496 -4.286 78.164 1.00 0.00 C ATOM 1498 CG LYS A 97 17.750 -4.365 76.825 1.00 0.00 C ATOM 1499 CD LYS A 97 18.493 -5.307 75.869 1.00 0.00 C ATOM 1500 CE LYS A 97 17.541 -5.763 74.763 1.00 0.00 C ATOM 1501 NZ LYS A 97 16.965 -4.568 74.083 1.00 0.00 N ATOM 0 H LYS A 97 21.199 -3.901 79.533 1.00 0.00 H new ATOM 0 HA LYS A 97 19.976 -3.284 76.945 1.00 0.00 H new ATOM 0 HB2 LYS A 97 18.746 -5.289 78.510 1.00 0.00 H new ATOM 0 HB3 LYS A 97 17.854 -3.838 78.922 1.00 0.00 H new ATOM 0 HG2 LYS A 97 16.733 -4.723 76.986 1.00 0.00 H new ATOM 0 HG3 LYS A 97 17.672 -3.372 76.383 1.00 0.00 H new ATOM 0 HD2 LYS A 97 19.354 -4.798 75.436 1.00 0.00 H new ATOM 0 HD3 LYS A 97 18.874 -6.170 76.415 1.00 0.00 H new ATOM 0 HE2 LYS A 97 18.073 -6.384 74.043 1.00 0.00 H new ATOM 0 HE3 LYS A 97 16.744 -6.376 75.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 16.527 -4.857 73.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 16.245 -4.133 74.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 17.720 -3.879 73.894 1.00 0.00 H new ATOM 1515 N GLY A 98 20.361 -1.771 79.686 1.00 0.00 N ATOM 1516 CA GLY A 98 20.211 -0.437 80.327 1.00 0.00 C ATOM 1517 C GLY A 98 20.920 0.591 79.450 1.00 0.00 C ATOM 1518 O GLY A 98 21.495 0.238 78.439 1.00 0.00 O ATOM 0 H GLY A 98 21.076 -2.376 80.091 1.00 0.00 H new ATOM 0 HA2 GLY A 98 19.157 -0.183 80.435 1.00 0.00 H new ATOM 0 HA3 GLY A 98 20.641 -0.445 81.328 1.00 0.00 H new ATOM 1522 N PRO A 99 20.881 1.830 79.858 1.00 0.00 N ATOM 1523 CA PRO A 99 21.546 2.902 79.107 1.00 0.00 C ATOM 1524 C PRO A 99 23.007 2.523 78.930 1.00 0.00 C ATOM 1525 O PRO A 99 23.428 2.073 77.883 1.00 0.00 O ATOM 1526 CB PRO A 99 21.387 4.155 79.986 1.00 0.00 C ATOM 1527 CG PRO A 99 20.572 3.743 81.241 1.00 0.00 C ATOM 1528 CD PRO A 99 20.193 2.259 81.088 1.00 0.00 C ATOM 0 HA PRO A 99 21.130 3.072 78.114 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.362 4.548 80.274 1.00 0.00 H new ATOM 0 HB3 PRO A 99 20.874 4.945 79.438 1.00 0.00 H new ATOM 0 HG2 PRO A 99 21.160 3.896 82.146 1.00 0.00 H new ATOM 0 HG3 PRO A 99 19.677 4.358 81.335 1.00 0.00 H new ATOM 0 HD2 PRO A 99 20.518 1.675 81.949 1.00 0.00 H new ATOM 0 HD3 PRO A 99 19.114 2.131 81.005 1.00 0.00 H new ATOM 1536 N ASP A 100 23.773 2.679 79.959 1.00 0.00 N ATOM 1537 CA ASP A 100 25.204 2.308 79.884 1.00 0.00 C ATOM 1538 C ASP A 100 25.632 1.739 81.231 1.00 0.00 C ATOM 1539 O ASP A 100 24.978 0.885 81.804 1.00 0.00 O ATOM 1540 CB ASP A 100 26.039 3.548 79.560 1.00 0.00 C ATOM 1541 CG ASP A 100 27.456 3.122 79.168 1.00 0.00 C ATOM 1542 OD1 ASP A 100 27.661 2.818 78.005 1.00 0.00 O ATOM 1543 OD2 ASP A 100 28.312 3.106 80.038 1.00 0.00 O ATOM 0 H ASP A 100 23.469 3.051 80.859 1.00 0.00 H new ATOM 0 HA ASP A 100 25.355 1.564 79.102 1.00 0.00 H new ATOM 0 HB2 ASP A 100 25.578 4.107 78.746 1.00 0.00 H new ATOM 0 HB3 ASP A 100 26.073 4.212 80.424 1.00 0.00 H new ATOM 1548 N GLY A 101 26.719 2.214 81.745 1.00 0.00 N ATOM 1549 CA GLY A 101 27.202 1.712 83.053 1.00 0.00 C ATOM 1550 C GLY A 101 26.163 2.012 84.136 1.00 0.00 C ATOM 1551 O GLY A 101 26.367 1.718 85.302 1.00 0.00 O ATOM 0 H GLY A 101 27.300 2.934 81.315 1.00 0.00 H new ATOM 0 HA2 GLY A 101 27.384 0.639 82.997 1.00 0.00 H new ATOM 0 HA3 GLY A 101 28.152 2.183 83.306 1.00 0.00 H new ATOM 1555 N LEU A 102 25.038 2.580 83.773 1.00 0.00 N ATOM 1556 CA LEU A 102 24.012 2.880 84.808 1.00 0.00 C ATOM 1557 C LEU A 102 23.844 1.653 85.665 1.00 0.00 C ATOM 1558 O LEU A 102 24.238 1.633 86.815 1.00 0.00 O ATOM 1559 CB LEU A 102 22.668 3.246 84.160 1.00 0.00 C ATOM 1560 CG LEU A 102 21.652 3.765 85.208 1.00 0.00 C ATOM 1561 CD1 LEU A 102 20.326 4.096 84.518 1.00 0.00 C ATOM 1562 CD2 LEU A 102 21.382 2.707 86.285 1.00 0.00 C ATOM 0 H LEU A 102 24.792 2.844 82.819 1.00 0.00 H new ATOM 0 HA LEU A 102 24.336 3.731 85.407 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.827 4.009 83.398 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.257 2.372 83.655 1.00 0.00 H new ATOM 0 HG LEU A 102 22.077 4.654 85.675 1.00 0.00 H new ATOM 0 HD11 LEU A 102 19.613 4.461 85.257 1.00 0.00 H new ATOM 0 HD12 LEU A 102 20.491 4.864 83.762 1.00 0.00 H new ATOM 0 HD13 LEU A 102 19.929 3.199 84.043 1.00 0.00 H new ATOM 0 HD21 LEU A 102 20.666 3.098 87.007 1.00 0.00 H new ATOM 0 HD22 LEU A 102 20.975 1.809 85.819 1.00 0.00 H new ATOM 0 HD23 LEU A 102 22.313 2.461 86.795 1.00 0.00 H new ATOM 1574 N THR A 103 23.245 0.632 85.128 1.00 0.00 N ATOM 1575 CA THR A 103 23.024 -0.591 85.934 1.00 0.00 C ATOM 1576 C THR A 103 23.092 -0.218 87.417 1.00 0.00 C ATOM 1577 O THR A 103 22.242 0.482 87.935 1.00 0.00 O ATOM 1578 CB THR A 103 24.101 -1.635 85.614 1.00 0.00 C ATOM 1579 OG1 THR A 103 24.168 -2.577 86.674 1.00 0.00 O ATOM 1580 CG2 THR A 103 25.462 -0.956 85.459 1.00 0.00 C ATOM 0 H THR A 103 22.900 0.593 84.169 1.00 0.00 H new ATOM 0 HA THR A 103 22.048 -1.015 85.699 1.00 0.00 H new ATOM 0 HB THR A 103 23.844 -2.138 84.682 1.00 0.00 H new ATOM 0 HG1 THR A 103 25.100 -2.842 86.818 1.00 0.00 H new ATOM 0 HG21 THR A 103 26.219 -1.706 85.232 1.00 0.00 H new ATOM 0 HG22 THR A 103 25.416 -0.230 84.647 1.00 0.00 H new ATOM 0 HG23 THR A 103 25.722 -0.447 86.387 1.00 0.00 H new ATOM 1588 N ALA A 104 24.100 -0.669 88.096 1.00 0.00 N ATOM 1589 CA ALA A 104 24.224 -0.347 89.547 1.00 0.00 C ATOM 1590 C ALA A 104 25.056 0.934 89.761 1.00 0.00 C ATOM 1591 O ALA A 104 24.923 1.612 90.766 1.00 0.00 O ATOM 1592 CB ALA A 104 24.894 -1.529 90.253 1.00 0.00 C ATOM 0 H ALA A 104 24.848 -1.248 87.714 1.00 0.00 H new ATOM 0 HA ALA A 104 23.231 -0.172 89.961 1.00 0.00 H new ATOM 0 HB1 ALA A 104 24.992 -1.310 91.316 1.00 0.00 H new ATOM 0 HB2 ALA A 104 24.285 -2.424 90.122 1.00 0.00 H new ATOM 0 HB3 ALA A 104 25.882 -1.696 89.824 1.00 0.00 H new ATOM 1598 N LEU A 105 25.930 1.252 88.843 1.00 0.00 N ATOM 1599 CA LEU A 105 26.802 2.450 89.003 1.00 0.00 C ATOM 1600 C LEU A 105 25.999 3.739 89.162 1.00 0.00 C ATOM 1601 O LEU A 105 25.950 4.315 90.231 1.00 0.00 O ATOM 1602 CB LEU A 105 27.687 2.584 87.773 1.00 0.00 C ATOM 1603 CG LEU A 105 28.308 1.227 87.433 1.00 0.00 C ATOM 1604 CD1 LEU A 105 29.351 1.411 86.328 1.00 0.00 C ATOM 1605 CD2 LEU A 105 28.979 0.639 88.682 1.00 0.00 C ATOM 0 H LEU A 105 26.077 0.727 87.981 1.00 0.00 H new ATOM 0 HA LEU A 105 27.392 2.307 89.908 1.00 0.00 H new ATOM 0 HB2 LEU A 105 27.101 2.948 86.929 1.00 0.00 H new ATOM 0 HB3 LEU A 105 28.472 3.318 87.956 1.00 0.00 H new ATOM 0 HG LEU A 105 27.529 0.546 87.090 1.00 0.00 H new ATOM 0 HD11 LEU A 105 29.796 0.446 86.083 1.00 0.00 H new ATOM 0 HD12 LEU A 105 28.872 1.826 85.441 1.00 0.00 H new ATOM 0 HD13 LEU A 105 30.129 2.092 86.672 1.00 0.00 H new ATOM 0 HD21 LEU A 105 29.420 -0.327 88.437 1.00 0.00 H new ATOM 0 HD22 LEU A 105 29.759 1.317 89.029 1.00 0.00 H new ATOM 0 HD23 LEU A 105 28.235 0.509 89.468 1.00 0.00 H new ATOM 1617 N GLU A 106 25.406 4.228 88.105 1.00 0.00 N ATOM 1618 CA GLU A 106 24.659 5.504 88.204 1.00 0.00 C ATOM 1619 C GLU A 106 23.278 5.269 88.811 1.00 0.00 C ATOM 1620 O GLU A 106 22.466 6.171 88.888 1.00 0.00 O ATOM 1621 CB GLU A 106 24.499 6.107 86.807 1.00 0.00 C ATOM 1622 CG GLU A 106 25.841 6.077 86.070 1.00 0.00 C ATOM 1623 CD GLU A 106 26.812 7.065 86.723 1.00 0.00 C ATOM 1624 OE1 GLU A 106 26.544 8.254 86.669 1.00 0.00 O ATOM 1625 OE2 GLU A 106 27.809 6.614 87.263 1.00 0.00 O ATOM 0 H GLU A 106 25.410 3.796 87.181 1.00 0.00 H new ATOM 0 HA GLU A 106 25.215 6.188 88.845 1.00 0.00 H new ATOM 0 HB2 GLU A 106 23.752 5.548 86.243 1.00 0.00 H new ATOM 0 HB3 GLU A 106 24.139 7.133 86.883 1.00 0.00 H new ATOM 0 HG2 GLU A 106 26.259 5.071 86.097 1.00 0.00 H new ATOM 0 HG3 GLU A 106 25.696 6.334 85.021 1.00 0.00 H new ATOM 1632 N ALA A 107 22.990 4.072 89.241 1.00 0.00 N ATOM 1633 CA ALA A 107 21.644 3.821 89.832 1.00 0.00 C ATOM 1634 C ALA A 107 21.542 4.406 91.251 1.00 0.00 C ATOM 1635 O ALA A 107 20.612 5.128 91.554 1.00 0.00 O ATOM 1636 CB ALA A 107 21.374 2.318 89.887 1.00 0.00 C ATOM 0 H ALA A 107 23.616 3.268 89.211 1.00 0.00 H new ATOM 0 HA ALA A 107 20.903 4.310 89.200 1.00 0.00 H new ATOM 0 HB1 ALA A 107 20.389 2.141 90.320 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.407 1.905 88.879 1.00 0.00 H new ATOM 0 HB3 ALA A 107 22.133 1.834 90.502 1.00 0.00 H new ATOM 1642 N THR A 108 22.457 4.097 92.137 1.00 0.00 N ATOM 1643 CA THR A 108 22.335 4.648 93.521 1.00 0.00 C ATOM 1644 C THR A 108 23.697 4.731 94.215 1.00 0.00 C ATOM 1645 O THR A 108 24.727 4.887 93.590 1.00 0.00 O ATOM 1646 CB THR A 108 21.431 3.730 94.335 1.00 0.00 C ATOM 1647 OG1 THR A 108 21.288 4.248 95.650 1.00 0.00 O ATOM 1648 CG2 THR A 108 22.069 2.345 94.396 1.00 0.00 C ATOM 0 H THR A 108 23.266 3.500 91.967 1.00 0.00 H new ATOM 0 HA THR A 108 21.920 5.654 93.454 1.00 0.00 H new ATOM 0 HB THR A 108 20.448 3.666 93.869 1.00 0.00 H new ATOM 0 HG1 THR A 108 20.705 3.658 96.172 1.00 0.00 H new ATOM 0 HG21 THR A 108 21.433 1.677 94.976 1.00 0.00 H new ATOM 0 HG22 THR A 108 22.183 1.952 93.386 1.00 0.00 H new ATOM 0 HG23 THR A 108 23.048 2.416 94.870 1.00 0.00 H new ATOM 1656 N ASP A 109 23.693 4.623 95.524 1.00 0.00 N ATOM 1657 CA ASP A 109 24.956 4.689 96.304 1.00 0.00 C ATOM 1658 C ASP A 109 24.929 3.639 97.421 1.00 0.00 C ATOM 1659 O ASP A 109 25.897 3.465 98.135 1.00 0.00 O ATOM 1660 CB ASP A 109 25.104 6.079 96.930 1.00 0.00 C ATOM 1661 CG ASP A 109 26.521 6.242 97.486 1.00 0.00 C ATOM 1662 OD1 ASP A 109 27.450 5.813 96.823 1.00 0.00 O ATOM 1663 OD2 ASP A 109 26.651 6.793 98.567 1.00 0.00 O ATOM 0 H ASP A 109 22.852 4.490 96.086 1.00 0.00 H new ATOM 0 HA ASP A 109 25.796 4.495 95.637 1.00 0.00 H new ATOM 0 HB2 ASP A 109 24.904 6.848 96.184 1.00 0.00 H new ATOM 0 HB3 ASP A 109 24.372 6.210 97.727 1.00 0.00 H new ATOM 1668 N ASN A 110 23.838 2.931 97.586 1.00 0.00 N ATOM 1669 CA ASN A 110 23.795 1.902 98.670 1.00 0.00 C ATOM 1670 C ASN A 110 24.615 0.689 98.218 1.00 0.00 C ATOM 1671 O ASN A 110 24.649 0.353 97.055 1.00 0.00 O ATOM 1672 CB ASN A 110 22.344 1.508 98.984 1.00 0.00 C ATOM 1673 CG ASN A 110 21.710 0.819 97.783 1.00 0.00 C ATOM 1674 OD1 ASN A 110 22.334 0.825 96.648 1.00 0.00 O flip ATOM 1675 ND2 ASN A 110 20.632 0.268 97.883 1.00 0.00 N flip ATOM 0 H ASN A 110 22.989 3.019 97.027 1.00 0.00 H new ATOM 0 HA ASN A 110 24.223 2.307 99.587 1.00 0.00 H new ATOM 0 HB2 ASN A 110 22.320 0.843 99.848 1.00 0.00 H new ATOM 0 HB3 ASN A 110 21.768 2.395 99.248 1.00 0.00 H new ATOM 0 HD21 ASN A 110 20.142 0.264 98.778 1.00 0.00 H new ATOM 0 HD22 ASN A 110 20.217 -0.191 97.072 1.00 0.00 H new ATOM 1682 N GLN A 111 25.321 0.070 99.126 1.00 0.00 N ATOM 1683 CA GLN A 111 26.208 -1.078 98.757 1.00 0.00 C ATOM 1684 C GLN A 111 25.424 -2.331 98.338 1.00 0.00 C ATOM 1685 O GLN A 111 26.011 -3.342 98.010 1.00 0.00 O ATOM 1686 CB GLN A 111 27.097 -1.421 99.955 1.00 0.00 C ATOM 1687 CG GLN A 111 27.968 -2.636 99.613 1.00 0.00 C ATOM 1688 CD GLN A 111 29.278 -2.577 100.401 1.00 0.00 C ATOM 1689 OE1 GLN A 111 30.348 -2.600 99.826 1.00 0.00 O ATOM 1690 NE2 GLN A 111 29.239 -2.506 101.703 1.00 0.00 N ATOM 0 H GLN A 111 25.323 0.311 100.117 1.00 0.00 H new ATOM 0 HA GLN A 111 26.802 -0.768 97.897 1.00 0.00 H new ATOM 0 HB2 GLN A 111 27.727 -0.569 100.210 1.00 0.00 H new ATOM 0 HB3 GLN A 111 26.482 -1.635 100.829 1.00 0.00 H new ATOM 0 HG2 GLN A 111 27.433 -3.556 99.849 1.00 0.00 H new ATOM 0 HG3 GLN A 111 28.178 -2.655 98.543 1.00 0.00 H new ATOM 0 HE21 GLN A 111 28.341 -2.487 102.186 1.00 0.00 H new ATOM 0 HE22 GLN A 111 30.107 -2.470 102.238 1.00 0.00 H new ATOM 1699 N ALA A 112 24.125 -2.297 98.333 1.00 0.00 N ATOM 1700 CA ALA A 112 23.371 -3.518 97.924 1.00 0.00 C ATOM 1701 C ALA A 112 23.265 -3.550 96.399 1.00 0.00 C ATOM 1702 O ALA A 112 23.531 -4.552 95.748 1.00 0.00 O ATOM 1703 CB ALA A 112 21.976 -3.492 98.549 1.00 0.00 C ATOM 0 H ALA A 112 23.555 -1.491 98.590 1.00 0.00 H new ATOM 0 HA ALA A 112 23.893 -4.411 98.269 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.426 -4.384 98.249 1.00 0.00 H new ATOM 0 HB2 ALA A 112 22.064 -3.468 99.635 1.00 0.00 H new ATOM 0 HB3 ALA A 112 21.441 -2.605 98.209 1.00 0.00 H new ATOM 1709 N ILE A 113 22.920 -2.449 95.827 1.00 0.00 N ATOM 1710 CA ILE A 113 22.825 -2.369 94.347 1.00 0.00 C ATOM 1711 C ILE A 113 24.236 -2.497 93.798 1.00 0.00 C ATOM 1712 O ILE A 113 24.510 -3.252 92.879 1.00 0.00 O ATOM 1713 CB ILE A 113 22.266 -0.996 93.967 1.00 0.00 C ATOM 1714 CG1 ILE A 113 20.736 -1.013 93.975 1.00 0.00 C ATOM 1715 CG2 ILE A 113 22.759 -0.592 92.576 1.00 0.00 C ATOM 1716 CD1 ILE A 113 20.200 -0.939 95.411 1.00 0.00 C ATOM 0 H ILE A 113 22.695 -1.585 96.321 1.00 0.00 H new ATOM 0 HA ILE A 113 22.179 -3.151 93.948 1.00 0.00 H new ATOM 0 HB ILE A 113 22.617 -0.273 94.703 1.00 0.00 H new ATOM 0 HG12 ILE A 113 20.355 -0.172 93.396 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.375 -1.922 93.493 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.355 0.386 92.317 1.00 0.00 H new ATOM 0 HG22 ILE A 113 23.848 -0.547 92.575 1.00 0.00 H new ATOM 0 HG23 ILE A 113 22.426 -1.328 91.844 1.00 0.00 H new ATOM 0 HD11 ILE A 113 19.110 -0.952 95.394 1.00 0.00 H new ATOM 0 HD12 ILE A 113 20.564 -1.794 95.980 1.00 0.00 H new ATOM 0 HD13 ILE A 113 20.544 -0.018 95.881 1.00 0.00 H new ATOM 1728 N LYS A 114 25.142 -1.765 94.367 1.00 0.00 N ATOM 1729 CA LYS A 114 26.531 -1.846 93.895 1.00 0.00 C ATOM 1730 C LYS A 114 26.959 -3.308 93.961 1.00 0.00 C ATOM 1731 O LYS A 114 27.928 -3.714 93.359 1.00 0.00 O ATOM 1732 CB LYS A 114 27.432 -0.972 94.771 1.00 0.00 C ATOM 1733 CG LYS A 114 26.831 0.434 94.884 1.00 0.00 C ATOM 1734 CD LYS A 114 26.815 1.113 93.511 1.00 0.00 C ATOM 1735 CE LYS A 114 26.305 2.548 93.659 1.00 0.00 C ATOM 1736 NZ LYS A 114 27.381 3.403 94.237 1.00 0.00 N ATOM 0 H LYS A 114 24.976 -1.117 95.137 1.00 0.00 H new ATOM 0 HA LYS A 114 26.614 -1.482 92.871 1.00 0.00 H new ATOM 0 HB2 LYS A 114 27.534 -1.415 95.761 1.00 0.00 H new ATOM 0 HB3 LYS A 114 28.432 -0.918 94.341 1.00 0.00 H new ATOM 0 HG2 LYS A 114 25.817 0.374 95.280 1.00 0.00 H new ATOM 0 HG3 LYS A 114 27.413 1.031 95.587 1.00 0.00 H new ATOM 0 HD2 LYS A 114 27.817 1.114 93.082 1.00 0.00 H new ATOM 0 HD3 LYS A 114 26.175 0.557 92.826 1.00 0.00 H new ATOM 0 HE2 LYS A 114 25.999 2.938 92.688 1.00 0.00 H new ATOM 0 HE3 LYS A 114 25.425 2.568 94.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 27.162 4.404 94.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 27.442 3.238 95.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 28.291 3.164 93.793 1.00 0.00 H new ATOM 1750 N ALA A 115 26.218 -4.115 94.673 1.00 0.00 N ATOM 1751 CA ALA A 115 26.568 -5.553 94.751 1.00 0.00 C ATOM 1752 C ALA A 115 26.506 -6.135 93.347 1.00 0.00 C ATOM 1753 O ALA A 115 27.316 -6.957 92.980 1.00 0.00 O ATOM 1754 CB ALA A 115 25.584 -6.293 95.663 1.00 0.00 C ATOM 0 H ALA A 115 25.390 -3.837 95.200 1.00 0.00 H new ATOM 0 HA ALA A 115 27.570 -5.667 95.166 1.00 0.00 H new ATOM 0 HB1 ALA A 115 25.854 -7.348 95.710 1.00 0.00 H new ATOM 0 HB2 ALA A 115 25.622 -5.864 96.664 1.00 0.00 H new ATOM 0 HB3 ALA A 115 24.574 -6.195 95.265 1.00 0.00 H new ATOM 1760 N LEU A 116 25.568 -5.708 92.542 1.00 0.00 N ATOM 1761 CA LEU A 116 25.514 -6.252 91.153 1.00 0.00 C ATOM 1762 C LEU A 116 26.702 -5.752 90.327 1.00 0.00 C ATOM 1763 O LEU A 116 27.098 -6.386 89.369 1.00 0.00 O ATOM 1764 CB LEU A 116 24.204 -5.854 90.456 1.00 0.00 C ATOM 1765 CG LEU A 116 23.206 -7.022 90.459 1.00 0.00 C ATOM 1766 CD1 LEU A 116 21.964 -6.619 89.658 1.00 0.00 C ATOM 1767 CD2 LEU A 116 23.840 -8.256 89.793 1.00 0.00 C ATOM 0 H LEU A 116 24.852 -5.021 92.779 1.00 0.00 H new ATOM 0 HA LEU A 116 25.560 -7.339 91.225 1.00 0.00 H new ATOM 0 HB2 LEU A 116 23.765 -4.994 90.961 1.00 0.00 H new ATOM 0 HB3 LEU A 116 24.411 -5.550 89.430 1.00 0.00 H new ATOM 0 HG LEU A 116 22.937 -7.260 91.488 1.00 0.00 H new ATOM 0 HD11 LEU A 116 21.250 -7.443 89.655 1.00 0.00 H new ATOM 0 HD12 LEU A 116 21.505 -5.742 90.115 1.00 0.00 H new ATOM 0 HD13 LEU A 116 22.252 -6.385 88.633 1.00 0.00 H new ATOM 0 HD21 LEU A 116 23.126 -9.080 89.799 1.00 0.00 H new ATOM 0 HD22 LEU A 116 24.109 -8.016 88.764 1.00 0.00 H new ATOM 0 HD23 LEU A 116 24.735 -8.547 90.343 1.00 0.00 H new ATOM 1779 N LEU A 117 27.291 -4.638 90.671 1.00 0.00 N ATOM 1780 CA LEU A 117 28.451 -4.167 89.864 1.00 0.00 C ATOM 1781 C LEU A 117 29.683 -4.965 90.283 1.00 0.00 C ATOM 1782 O LEU A 117 30.753 -4.840 89.718 1.00 0.00 O ATOM 1783 CB LEU A 117 28.657 -2.660 90.087 1.00 0.00 C ATOM 1784 CG LEU A 117 29.631 -2.385 91.250 1.00 0.00 C ATOM 1785 CD1 LEU A 117 31.089 -2.528 90.791 1.00 0.00 C ATOM 1786 CD2 LEU A 117 29.415 -0.956 91.759 1.00 0.00 C ATOM 0 H LEU A 117 27.026 -4.046 91.458 1.00 0.00 H new ATOM 0 HA LEU A 117 28.271 -4.323 88.800 1.00 0.00 H new ATOM 0 HB2 LEU A 117 29.043 -2.206 89.174 1.00 0.00 H new ATOM 0 HB3 LEU A 117 27.697 -2.188 90.297 1.00 0.00 H new ATOM 0 HG LEU A 117 29.437 -3.110 92.041 1.00 0.00 H new ATOM 0 HD11 LEU A 117 31.756 -2.329 91.630 1.00 0.00 H new ATOM 0 HD12 LEU A 117 31.258 -3.541 90.426 1.00 0.00 H new ATOM 0 HD13 LEU A 117 31.290 -1.816 89.991 1.00 0.00 H new ATOM 0 HD21 LEU A 117 30.101 -0.755 92.582 1.00 0.00 H new ATOM 0 HD22 LEU A 117 29.602 -0.250 90.950 1.00 0.00 H new ATOM 0 HD23 LEU A 117 28.388 -0.845 92.108 1.00 0.00 H new ATOM 1798 N GLN A 118 29.519 -5.808 91.260 1.00 0.00 N ATOM 1799 CA GLN A 118 30.643 -6.645 91.739 1.00 0.00 C ATOM 1800 C GLN A 118 30.951 -7.743 90.714 1.00 0.00 C ATOM 1801 O GLN A 118 31.813 -8.560 90.991 1.00 0.00 O ATOM 1802 CB GLN A 118 30.256 -7.258 93.089 1.00 0.00 C ATOM 1803 CG GLN A 118 29.629 -8.652 92.919 1.00 0.00 C ATOM 1804 CD GLN A 118 28.654 -8.702 91.731 1.00 0.00 C ATOM 1805 OE1 GLN A 118 28.359 -7.698 91.118 1.00 0.00 O ATOM 1806 NE2 GLN A 118 28.141 -9.851 91.381 1.00 0.00 N ATOM 1807 OXT GLN A 118 30.317 -7.746 89.671 1.00 0.00 O ATOM 0 H GLN A 118 28.638 -5.953 91.753 1.00 0.00 H new ATOM 0 HA GLN A 118 31.539 -6.036 91.862 1.00 0.00 H new ATOM 0 HB2 GLN A 118 31.140 -7.331 93.723 1.00 0.00 H new ATOM 0 HB3 GLN A 118 29.551 -6.601 93.599 1.00 0.00 H new ATOM 0 HG2 GLN A 118 30.418 -9.389 92.772 1.00 0.00 H new ATOM 0 HG3 GLN A 118 29.102 -8.927 93.833 1.00 0.00 H new ATOM 0 HE21 GLN A 118 28.387 -10.697 91.895 1.00 0.00 H new ATOM 0 HE22 GLN A 118 27.494 -9.902 90.594 1.00 0.00 H new