USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 895 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 81 ASN : amide:sc= 0.0234 K(o=-0.032,f=-6.6!) USER MOD Set 1.2: A 99 HIS : no HE2:sc= -0.81! C(o=-0.032!,f=-6.8!) USER MOD Set 1.3: A 115 TYR OH : rot 50:sc= 0.755 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0.0032) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 68:sc= 0.911 USER MOD Single : A 22 TYR OH : rot 61:sc= 0.899 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 81:sc= 1.26 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -165:sc= -0.042 (180deg=-0.292) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.61 USER MOD Single : A 60 LYS NZ :NH3+ -176:sc= 1.18 (180deg=0.962) USER MOD Single : A 61 SER OG : rot -82:sc= 0.259 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.122) USER MOD Single : A 74 GLN : amide:sc= -0.0782 K(o=-0.078,f=-0.84) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.00544 USER MOD Single : A 82 TYR OH : rot -155:sc= 1.26 USER MOD Single : A 83 LYS NZ :NH3+ -150:sc= 1.28 (180deg=1.23) USER MOD Single : A 84 HIS : no HD1:sc= 0.33 K(o=0.33,f=-4.2!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 114 SER OG : rot -84:sc= 1.2 USER MOD Single : A 118 SER OG : rot 104:sc= -0.973 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 97:sc= 1.29 USER MOD Single : A 123 ASN : amide:sc= -0.026 X(o=-0.026,f=0) USER MOD Single : A 124 SER OG : rot 180:sc=-0.000149 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -8.431 3.938 -12.951 1.00 0.00 N ATOM 21 CA PRO A 2 -7.569 4.039 -11.779 1.00 0.00 C ATOM 22 C PRO A 2 -8.347 4.569 -10.585 1.00 0.00 C ATOM 23 O PRO A 2 -8.843 5.693 -10.615 1.00 0.00 O ATOM 24 CB PRO A 2 -6.477 5.039 -12.191 1.00 0.00 C ATOM 25 CG PRO A 2 -6.655 5.255 -13.658 1.00 0.00 C ATOM 26 CD PRO A 2 -8.091 4.941 -13.966 1.00 0.00 C ATOM 0 HA PRO A 2 -7.161 3.073 -11.481 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.578 5.976 -11.643 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -5.484 4.646 -11.971 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -6.416 6.283 -13.930 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.986 4.611 -14.229 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.724 5.825 -13.888 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -8.212 4.550 -14.976 1.00 0.00 H new ATOM 34 N VAL A 3 -8.477 3.752 -9.552 1.00 0.00 N ATOM 35 CA VAL A 3 -9.229 4.144 -8.372 1.00 0.00 C ATOM 36 C VAL A 3 -8.489 5.236 -7.613 1.00 0.00 C ATOM 37 O VAL A 3 -7.546 4.962 -6.871 1.00 0.00 O ATOM 38 CB VAL A 3 -9.482 2.945 -7.435 1.00 0.00 C ATOM 39 CG1 VAL A 3 -10.385 3.343 -6.278 1.00 0.00 C ATOM 40 CG2 VAL A 3 -10.080 1.779 -8.206 1.00 0.00 C ATOM 0 H VAL A 3 -8.073 2.817 -9.507 1.00 0.00 H new ATOM 0 HA VAL A 3 -10.194 4.523 -8.710 1.00 0.00 H new ATOM 0 HB VAL A 3 -8.524 2.628 -7.023 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -10.549 2.481 -5.631 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -9.913 4.141 -5.706 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -11.342 3.692 -6.667 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -10.251 0.943 -7.527 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -11.027 2.085 -8.651 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -9.391 1.472 -8.993 1.00 0.00 H new ATOM 50 N GLU A 4 -8.901 6.474 -7.825 1.00 0.00 N ATOM 51 CA GLU A 4 -8.283 7.603 -7.158 1.00 0.00 C ATOM 52 C GLU A 4 -9.293 8.306 -6.270 1.00 0.00 C ATOM 53 O GLU A 4 -10.500 8.250 -6.513 1.00 0.00 O ATOM 54 CB GLU A 4 -7.719 8.601 -8.176 1.00 0.00 C ATOM 55 CG GLU A 4 -8.787 9.305 -9.001 1.00 0.00 C ATOM 56 CD GLU A 4 -8.236 10.457 -9.814 1.00 0.00 C ATOM 57 OE1 GLU A 4 -7.662 11.391 -9.214 1.00 0.00 O ATOM 58 OE2 GLU A 4 -8.379 10.440 -11.056 1.00 0.00 O ATOM 0 H GLU A 4 -9.663 6.722 -8.456 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.463 7.223 -6.548 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.128 9.350 -7.648 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.041 8.076 -8.849 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.255 8.584 -9.671 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.567 9.676 -8.336 1.00 0.00 H new ATOM 65 N LEU A 5 -8.796 8.952 -5.237 1.00 0.00 N ATOM 66 CA LEU A 5 -9.625 9.776 -4.389 1.00 0.00 C ATOM 67 C LEU A 5 -9.099 11.201 -4.430 1.00 0.00 C ATOM 68 O LEU A 5 -8.115 11.528 -3.769 1.00 0.00 O ATOM 69 CB LEU A 5 -9.600 9.244 -2.957 1.00 0.00 C ATOM 70 CG LEU A 5 -10.726 9.734 -2.050 1.00 0.00 C ATOM 71 CD1 LEU A 5 -12.024 9.017 -2.380 1.00 0.00 C ATOM 72 CD2 LEU A 5 -10.341 9.532 -0.597 1.00 0.00 C ATOM 0 H LEU A 5 -7.814 8.921 -4.964 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.655 9.755 -4.744 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.635 8.155 -2.993 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.647 9.518 -2.504 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.884 10.799 -2.219 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.816 9.378 -1.724 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.294 9.213 -3.418 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.894 7.944 -2.235 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -11.148 9.883 0.046 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.164 8.473 -0.411 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -9.433 10.095 -0.380 1.00 0.00 H new ATOM 84 N ARG A 6 -9.729 12.042 -5.232 1.00 0.00 N ATOM 85 CA ARG A 6 -9.278 13.414 -5.371 1.00 0.00 C ATOM 86 C ARG A 6 -9.867 14.273 -4.260 1.00 0.00 C ATOM 87 O ARG A 6 -10.852 13.884 -3.635 1.00 0.00 O ATOM 88 CB ARG A 6 -9.607 13.962 -6.765 1.00 0.00 C ATOM 89 CG ARG A 6 -11.085 14.007 -7.112 1.00 0.00 C ATOM 90 CD ARG A 6 -11.277 14.337 -8.587 1.00 0.00 C ATOM 91 NE ARG A 6 -12.666 14.644 -8.921 1.00 0.00 N ATOM 92 CZ ARG A 6 -13.227 14.375 -10.101 1.00 0.00 C ATOM 93 NH1 ARG A 6 -12.536 13.741 -11.042 1.00 0.00 N ATOM 94 NH2 ARG A 6 -14.479 14.748 -10.339 1.00 0.00 N ATOM 0 H ARG A 6 -10.547 11.801 -5.792 1.00 0.00 H new ATOM 0 HA ARG A 6 -8.193 13.443 -5.271 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -9.201 14.970 -6.846 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -9.095 13.351 -7.508 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -11.547 13.046 -6.885 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -11.586 14.755 -6.498 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -10.648 15.188 -8.849 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -10.941 13.494 -9.190 1.00 0.00 H new ATOM 0 HE ARG A 6 -13.242 15.092 -8.208 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -11.572 13.458 -10.864 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -12.969 13.537 -11.943 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -15.010 15.239 -9.620 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -14.910 14.543 -11.241 1.00 0.00 H new ATOM 108 N ALA A 7 -9.273 15.443 -4.034 1.00 0.00 N ATOM 109 CA ALA A 7 -9.531 16.244 -2.828 1.00 0.00 C ATOM 110 C ALA A 7 -10.890 16.948 -2.841 1.00 0.00 C ATOM 111 O ALA A 7 -11.033 18.060 -2.335 1.00 0.00 O ATOM 112 CB ALA A 7 -8.417 17.255 -2.637 1.00 0.00 C ATOM 0 H ALA A 7 -8.602 15.865 -4.675 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.557 15.549 -1.989 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.612 17.846 -1.742 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.467 16.733 -2.527 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -8.371 17.914 -3.504 1.00 0.00 H new ATOM 118 N ASN A 8 -11.877 16.274 -3.393 1.00 0.00 N ATOM 119 CA ASN A 8 -13.262 16.711 -3.354 1.00 0.00 C ATOM 120 C ASN A 8 -14.121 15.559 -3.843 1.00 0.00 C ATOM 121 O ASN A 8 -14.549 15.520 -4.997 1.00 0.00 O ATOM 122 CB ASN A 8 -13.494 17.965 -4.204 1.00 0.00 C ATOM 123 CG ASN A 8 -14.893 18.533 -4.028 1.00 0.00 C ATOM 124 OD1 ASN A 8 -15.811 18.206 -4.780 1.00 0.00 O ATOM 125 ND2 ASN A 8 -15.069 19.372 -3.017 1.00 0.00 N ATOM 0 H ASN A 8 -11.740 15.394 -3.890 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.529 16.984 -2.333 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -12.760 18.724 -3.935 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -13.332 17.724 -5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -15.991 19.771 -2.840 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.283 19.618 -2.416 1.00 0.00 H new ATOM 132 N TRP A 9 -14.320 14.588 -2.969 1.00 0.00 N ATOM 133 CA TRP A 9 -14.919 13.331 -3.356 1.00 0.00 C ATOM 134 C TRP A 9 -16.305 13.184 -2.747 1.00 0.00 C ATOM 135 O TRP A 9 -16.679 13.931 -1.838 1.00 0.00 O ATOM 136 CB TRP A 9 -14.018 12.178 -2.891 1.00 0.00 C ATOM 137 CG TRP A 9 -13.874 12.104 -1.393 1.00 0.00 C ATOM 138 CD1 TRP A 9 -14.813 11.661 -0.517 1.00 0.00 C ATOM 139 CD2 TRP A 9 -12.737 12.468 -0.601 1.00 0.00 C ATOM 140 NE1 TRP A 9 -14.350 11.747 0.768 1.00 0.00 N ATOM 141 CE2 TRP A 9 -13.074 12.230 0.745 1.00 0.00 C ATOM 142 CE3 TRP A 9 -11.470 12.971 -0.892 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -12.195 12.480 1.790 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -10.595 13.213 0.149 1.00 0.00 C ATOM 145 CH2 TRP A 9 -10.961 12.966 1.475 1.00 0.00 C ATOM 0 H TRP A 9 -14.072 14.651 -1.981 1.00 0.00 H new ATOM 0 HA TRP A 9 -15.020 13.306 -4.441 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -14.426 11.236 -3.257 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -13.031 12.293 -3.339 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -15.789 11.292 -0.796 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -14.873 11.492 1.606 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -11.178 13.168 -1.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -12.479 12.296 2.816 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -9.610 13.600 -0.066 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -10.252 13.164 2.266 1.00 0.00 H new ATOM 156 N SER A 10 -17.056 12.218 -3.248 1.00 0.00 N ATOM 157 CA SER A 10 -18.296 11.817 -2.619 1.00 0.00 C ATOM 158 C SER A 10 -18.029 10.579 -1.768 1.00 0.00 C ATOM 159 O SER A 10 -17.037 9.880 -1.986 1.00 0.00 O ATOM 160 CB SER A 10 -19.355 11.524 -3.683 1.00 0.00 C ATOM 161 OG SER A 10 -19.485 12.617 -4.578 1.00 0.00 O ATOM 0 H SER A 10 -16.824 11.696 -4.093 1.00 0.00 H new ATOM 0 HA SER A 10 -18.672 12.620 -1.985 1.00 0.00 H new ATOM 0 HB2 SER A 10 -19.082 10.625 -4.236 1.00 0.00 H new ATOM 0 HB3 SER A 10 -20.313 11.325 -3.204 1.00 0.00 H new ATOM 0 HG SER A 10 -20.166 12.409 -5.252 1.00 0.00 H new ATOM 167 N GLU A 11 -18.888 10.305 -0.800 1.00 0.00 N ATOM 168 CA GLU A 11 -18.683 9.155 0.072 1.00 0.00 C ATOM 169 C GLU A 11 -18.838 7.857 -0.716 1.00 0.00 C ATOM 170 O GLU A 11 -18.281 6.822 -0.352 1.00 0.00 O ATOM 171 CB GLU A 11 -19.647 9.193 1.258 1.00 0.00 C ATOM 172 CG GLU A 11 -19.548 10.478 2.063 1.00 0.00 C ATOM 173 CD GLU A 11 -20.253 10.391 3.399 1.00 0.00 C ATOM 174 OE1 GLU A 11 -21.480 10.157 3.418 1.00 0.00 O ATOM 175 OE2 GLU A 11 -19.575 10.562 4.441 1.00 0.00 O ATOM 0 H GLU A 11 -19.724 10.853 -0.598 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.668 9.198 0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -20.668 9.077 0.893 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -19.444 8.345 1.912 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.498 10.718 2.227 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.976 11.297 1.485 1.00 0.00 H new ATOM 182 N GLU A 12 -19.589 7.934 -1.807 1.00 0.00 N ATOM 183 CA GLU A 12 -19.726 6.826 -2.739 1.00 0.00 C ATOM 184 C GLU A 12 -18.379 6.526 -3.392 1.00 0.00 C ATOM 185 O GLU A 12 -18.017 5.365 -3.605 1.00 0.00 O ATOM 186 CB GLU A 12 -20.771 7.152 -3.815 1.00 0.00 C ATOM 187 CG GLU A 12 -22.141 7.538 -3.265 1.00 0.00 C ATOM 188 CD GLU A 12 -22.285 9.026 -2.983 1.00 0.00 C ATOM 189 OE1 GLU A 12 -21.573 9.551 -2.105 1.00 0.00 O ATOM 190 OE2 GLU A 12 -23.128 9.679 -3.626 1.00 0.00 O ATOM 0 H GLU A 12 -20.119 8.765 -2.069 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.060 5.947 -2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -20.397 7.969 -4.432 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -20.885 6.286 -4.468 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -22.908 7.236 -3.978 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -22.324 6.983 -2.345 1.00 0.00 H new ATOM 197 N ASP A 13 -17.633 7.586 -3.694 1.00 0.00 N ATOM 198 CA ASP A 13 -16.294 7.446 -4.261 1.00 0.00 C ATOM 199 C ASP A 13 -15.367 6.843 -3.221 1.00 0.00 C ATOM 200 O ASP A 13 -14.530 5.995 -3.533 1.00 0.00 O ATOM 201 CB ASP A 13 -15.730 8.797 -4.722 1.00 0.00 C ATOM 202 CG ASP A 13 -16.563 9.454 -5.806 1.00 0.00 C ATOM 203 OD1 ASP A 13 -16.797 8.820 -6.858 1.00 0.00 O ATOM 204 OD2 ASP A 13 -16.992 10.612 -5.609 1.00 0.00 O ATOM 0 H ASP A 13 -17.933 8.551 -3.556 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.363 6.794 -5.132 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -15.666 9.468 -3.865 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -14.714 8.653 -5.091 1.00 0.00 H new ATOM 209 N LEU A 14 -15.536 7.284 -1.979 1.00 0.00 N ATOM 210 CA LEU A 14 -14.770 6.751 -0.862 1.00 0.00 C ATOM 211 C LEU A 14 -15.017 5.249 -0.744 1.00 0.00 C ATOM 212 O LEU A 14 -14.077 4.466 -0.624 1.00 0.00 O ATOM 213 CB LEU A 14 -15.177 7.460 0.438 1.00 0.00 C ATOM 214 CG LEU A 14 -14.065 7.665 1.478 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.360 6.361 1.816 1.00 0.00 C ATOM 216 CD2 LEU A 14 -13.062 8.699 0.995 1.00 0.00 C ATOM 0 H LEU A 14 -16.201 8.013 -1.721 1.00 0.00 H new ATOM 0 HA LEU A 14 -13.708 6.925 -1.036 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.589 8.436 0.181 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -15.979 6.887 0.903 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.537 8.031 2.390 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.581 6.549 2.555 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -14.081 5.652 2.222 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -12.912 5.945 0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.283 8.829 1.746 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -12.613 8.361 0.061 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -13.570 9.649 0.831 1.00 0.00 H new ATOM 228 N GLU A 15 -16.288 4.854 -0.800 1.00 0.00 N ATOM 229 CA GLU A 15 -16.661 3.443 -0.748 1.00 0.00 C ATOM 230 C GLU A 15 -16.004 2.669 -1.888 1.00 0.00 C ATOM 231 O GLU A 15 -15.556 1.539 -1.707 1.00 0.00 O ATOM 232 CB GLU A 15 -18.179 3.287 -0.818 1.00 0.00 C ATOM 233 CG GLU A 15 -18.792 2.677 0.433 1.00 0.00 C ATOM 234 CD GLU A 15 -18.325 1.255 0.682 1.00 0.00 C ATOM 235 OE1 GLU A 15 -18.932 0.319 0.122 1.00 0.00 O ATOM 236 OE2 GLU A 15 -17.353 1.068 1.442 1.00 0.00 O ATOM 0 H GLU A 15 -17.078 5.494 -0.882 1.00 0.00 H new ATOM 0 HA GLU A 15 -16.309 3.035 0.199 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.628 4.265 -0.991 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -18.432 2.664 -1.676 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.538 3.294 1.295 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -19.878 2.687 0.342 1.00 0.00 H new ATOM 243 N THR A 16 -15.943 3.293 -3.059 1.00 0.00 N ATOM 244 CA THR A 16 -15.282 2.698 -4.213 1.00 0.00 C ATOM 245 C THR A 16 -13.806 2.433 -3.904 1.00 0.00 C ATOM 246 O THR A 16 -13.280 1.360 -4.200 1.00 0.00 O ATOM 247 CB THR A 16 -15.400 3.614 -5.449 1.00 0.00 C ATOM 248 OG1 THR A 16 -16.780 3.925 -5.701 1.00 0.00 O ATOM 249 CG2 THR A 16 -14.798 2.954 -6.682 1.00 0.00 C ATOM 0 H THR A 16 -16.345 4.214 -3.234 1.00 0.00 H new ATOM 0 HA THR A 16 -15.777 1.752 -4.433 1.00 0.00 H new ATOM 0 HB THR A 16 -14.848 4.530 -5.241 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.126 4.488 -4.977 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.896 3.623 -7.537 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.743 2.744 -6.504 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.323 2.022 -6.889 1.00 0.00 H new ATOM 257 N VAL A 17 -13.153 3.416 -3.287 1.00 0.00 N ATOM 258 CA VAL A 17 -11.767 3.270 -2.850 1.00 0.00 C ATOM 259 C VAL A 17 -11.643 2.145 -1.826 1.00 0.00 C ATOM 260 O VAL A 17 -10.776 1.280 -1.942 1.00 0.00 O ATOM 261 CB VAL A 17 -11.239 4.592 -2.246 1.00 0.00 C ATOM 262 CG1 VAL A 17 -9.851 4.419 -1.648 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.225 5.684 -3.304 1.00 0.00 C ATOM 0 H VAL A 17 -13.564 4.326 -3.078 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.164 3.021 -3.723 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.913 4.883 -1.440 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.513 5.368 -1.233 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.886 3.670 -0.857 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.158 4.095 -2.424 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.851 6.610 -2.866 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.577 5.384 -4.128 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -12.237 5.842 -3.677 1.00 0.00 H new ATOM 273 N ILE A 18 -12.528 2.158 -0.838 1.00 0.00 N ATOM 274 CA ILE A 18 -12.565 1.123 0.191 1.00 0.00 C ATOM 275 C ILE A 18 -12.689 -0.266 -0.437 1.00 0.00 C ATOM 276 O ILE A 18 -11.890 -1.162 -0.159 1.00 0.00 O ATOM 277 CB ILE A 18 -13.746 1.361 1.160 1.00 0.00 C ATOM 278 CG1 ILE A 18 -13.547 2.674 1.922 1.00 0.00 C ATOM 279 CG2 ILE A 18 -13.903 0.199 2.129 1.00 0.00 C ATOM 280 CD1 ILE A 18 -14.726 3.065 2.787 1.00 0.00 C ATOM 0 H ILE A 18 -13.238 2.882 -0.726 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.630 1.175 0.749 1.00 0.00 H new ATOM 0 HB ILE A 18 -14.661 1.431 0.572 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -12.661 2.587 2.550 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -13.353 3.473 1.206 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -14.741 0.394 2.798 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -14.091 -0.718 1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -12.990 0.087 2.714 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -14.509 4.005 3.294 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.611 3.185 2.163 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -14.908 2.286 3.528 1.00 0.00 H new ATOM 292 N ARG A 19 -13.674 -0.419 -1.309 1.00 0.00 N ATOM 293 CA ARG A 19 -13.938 -1.689 -1.976 1.00 0.00 C ATOM 294 C ARG A 19 -12.765 -2.112 -2.858 1.00 0.00 C ATOM 295 O ARG A 19 -12.550 -3.300 -3.083 1.00 0.00 O ATOM 296 CB ARG A 19 -15.221 -1.585 -2.804 1.00 0.00 C ATOM 297 CG ARG A 19 -16.481 -1.505 -1.956 1.00 0.00 C ATOM 298 CD ARG A 19 -17.665 -0.975 -2.750 1.00 0.00 C ATOM 299 NE ARG A 19 -17.903 -1.734 -3.980 1.00 0.00 N ATOM 300 CZ ARG A 19 -19.118 -2.020 -4.448 1.00 0.00 C ATOM 301 NH1 ARG A 19 -20.195 -1.677 -3.751 1.00 0.00 N ATOM 302 NH2 ARG A 19 -19.251 -2.655 -5.609 1.00 0.00 N ATOM 0 H ARG A 19 -14.313 0.331 -1.575 1.00 0.00 H new ATOM 0 HA ARG A 19 -14.066 -2.455 -1.211 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -15.163 -0.702 -3.441 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -15.290 -2.450 -3.464 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -16.719 -2.494 -1.565 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -16.301 -0.858 -1.097 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -18.559 -1.009 -2.128 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -17.490 0.071 -3.001 1.00 0.00 H new ATOM 0 HE ARG A 19 -17.094 -2.062 -4.508 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -20.092 -1.195 -2.858 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -21.125 -1.896 -4.109 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -18.423 -2.923 -6.141 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -20.181 -2.874 -5.967 1.00 0.00 H new ATOM 316 N ALA A 20 -12.003 -1.139 -3.342 1.00 0.00 N ATOM 317 CA ALA A 20 -10.846 -1.423 -4.181 1.00 0.00 C ATOM 318 C ALA A 20 -9.666 -1.910 -3.343 1.00 0.00 C ATOM 319 O ALA A 20 -8.910 -2.781 -3.771 1.00 0.00 O ATOM 320 CB ALA A 20 -10.455 -0.190 -4.982 1.00 0.00 C ATOM 0 H ALA A 20 -12.165 -0.147 -3.168 1.00 0.00 H new ATOM 0 HA ALA A 20 -11.119 -2.219 -4.874 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.589 -0.419 -5.603 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -11.288 0.110 -5.617 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.207 0.623 -4.300 1.00 0.00 H new ATOM 326 N VAL A 21 -9.519 -1.348 -2.147 1.00 0.00 N ATOM 327 CA VAL A 21 -8.435 -1.736 -1.251 1.00 0.00 C ATOM 328 C VAL A 21 -8.690 -3.121 -0.663 1.00 0.00 C ATOM 329 O VAL A 21 -7.812 -3.984 -0.678 1.00 0.00 O ATOM 330 CB VAL A 21 -8.246 -0.719 -0.103 1.00 0.00 C ATOM 331 CG1 VAL A 21 -7.130 -1.158 0.834 1.00 0.00 C ATOM 332 CG2 VAL A 21 -7.958 0.667 -0.658 1.00 0.00 C ATOM 0 H VAL A 21 -10.135 -0.624 -1.777 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.522 -1.755 -1.847 1.00 0.00 H new ATOM 0 HB VAL A 21 -9.174 -0.678 0.468 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -7.017 -0.426 1.633 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.377 -2.129 1.264 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.196 -1.234 0.277 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.828 1.369 0.166 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.048 0.637 -1.257 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -8.792 0.990 -1.282 1.00 0.00 H new ATOM 342 N TYR A 22 -9.901 -3.328 -0.156 1.00 0.00 N ATOM 343 CA TYR A 22 -10.277 -4.615 0.426 1.00 0.00 C ATOM 344 C TYR A 22 -10.491 -5.661 -0.660 1.00 0.00 C ATOM 345 O TYR A 22 -10.351 -6.857 -0.410 1.00 0.00 O ATOM 346 CB TYR A 22 -11.554 -4.485 1.260 1.00 0.00 C ATOM 347 CG TYR A 22 -11.389 -3.704 2.546 1.00 0.00 C ATOM 348 CD1 TYR A 22 -11.569 -2.331 2.571 1.00 0.00 C ATOM 349 CD2 TYR A 22 -11.074 -4.344 3.738 1.00 0.00 C ATOM 350 CE1 TYR A 22 -11.438 -1.612 3.740 1.00 0.00 C ATOM 351 CE2 TYR A 22 -10.944 -3.631 4.917 1.00 0.00 C ATOM 352 CZ TYR A 22 -11.127 -2.264 4.909 1.00 0.00 C ATOM 353 OH TYR A 22 -11.010 -1.548 6.077 1.00 0.00 O ATOM 0 H TYR A 22 -10.639 -2.624 -0.136 1.00 0.00 H new ATOM 0 HA TYR A 22 -9.459 -4.933 1.072 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -12.321 -4.003 0.654 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -11.918 -5.484 1.501 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -11.817 -1.813 1.656 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -10.928 -5.414 3.745 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -11.579 -0.541 3.737 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -10.701 -4.142 5.837 1.00 0.00 H new ATOM 0 HH TYR A 22 -11.865 -1.116 6.283 1.00 0.00 H new ATOM 586 N LEU A 37 -11.825 -1.906 11.034 1.00 0.00 N ATOM 587 CA LEU A 37 -11.008 -0.889 10.382 1.00 0.00 C ATOM 588 C LEU A 37 -11.869 0.278 9.912 1.00 0.00 C ATOM 589 O LEU A 37 -11.390 1.179 9.220 1.00 0.00 O ATOM 590 CB LEU A 37 -10.240 -1.487 9.202 1.00 0.00 C ATOM 591 CG LEU A 37 -9.182 -2.528 9.572 1.00 0.00 C ATOM 592 CD1 LEU A 37 -8.487 -3.041 8.321 1.00 0.00 C ATOM 593 CD2 LEU A 37 -8.170 -1.944 10.548 1.00 0.00 C ATOM 0 HA LEU A 37 -10.289 -0.517 11.112 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.955 -1.946 8.519 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.755 -0.677 8.658 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.678 -3.366 10.061 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.737 -3.781 8.599 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.221 -3.500 7.659 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.004 -2.210 7.807 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.427 -2.701 10.798 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.676 -1.087 10.090 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.682 -1.625 11.456 1.00 0.00 H new ATOM 605 N VAL A 38 -13.137 0.269 10.317 1.00 0.00 N ATOM 606 CA VAL A 38 -14.068 1.334 9.965 1.00 0.00 C ATOM 607 C VAL A 38 -13.564 2.692 10.471 1.00 0.00 C ATOM 608 O VAL A 38 -13.891 3.736 9.908 1.00 0.00 O ATOM 609 CB VAL A 38 -15.487 1.048 10.516 1.00 0.00 C ATOM 610 CG1 VAL A 38 -15.483 0.974 12.036 1.00 0.00 C ATOM 611 CG2 VAL A 38 -16.486 2.087 10.025 1.00 0.00 C ATOM 0 H VAL A 38 -13.543 -0.469 10.892 1.00 0.00 H new ATOM 0 HA VAL A 38 -14.128 1.369 8.877 1.00 0.00 H new ATOM 0 HB VAL A 38 -15.799 0.076 10.135 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -16.493 0.772 12.393 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -14.817 0.174 12.360 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -15.136 1.923 12.446 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -17.473 1.861 10.427 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -16.176 3.077 10.360 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -16.525 2.068 8.936 1.00 0.00 H new ATOM 621 N SER A 39 -12.746 2.668 11.520 1.00 0.00 N ATOM 622 CA SER A 39 -12.129 3.881 12.040 1.00 0.00 C ATOM 623 C SER A 39 -11.260 4.538 10.968 1.00 0.00 C ATOM 624 O SER A 39 -11.372 5.737 10.710 1.00 0.00 O ATOM 625 CB SER A 39 -11.285 3.548 13.270 1.00 0.00 C ATOM 626 OG SER A 39 -12.056 2.869 14.248 1.00 0.00 O ATOM 0 H SER A 39 -12.496 1.819 12.026 1.00 0.00 H new ATOM 0 HA SER A 39 -12.915 4.580 12.326 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.437 2.929 12.977 1.00 0.00 H new ATOM 0 HB3 SER A 39 -10.878 4.465 13.695 1.00 0.00 H new ATOM 0 HG SER A 39 -11.494 2.665 15.024 1.00 0.00 H new ATOM 632 N ALA A 40 -10.417 3.734 10.325 1.00 0.00 N ATOM 633 CA ALA A 40 -9.533 4.228 9.277 1.00 0.00 C ATOM 634 C ALA A 40 -10.346 4.681 8.073 1.00 0.00 C ATOM 635 O ALA A 40 -10.055 5.710 7.460 1.00 0.00 O ATOM 636 CB ALA A 40 -8.537 3.149 8.873 1.00 0.00 C ATOM 0 H ALA A 40 -10.329 2.735 10.513 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.978 5.083 9.662 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.883 3.532 8.089 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.938 2.864 9.738 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.076 2.277 8.502 1.00 0.00 H new ATOM 642 N GLU A 41 -11.375 3.908 7.751 1.00 0.00 N ATOM 643 CA GLU A 41 -12.284 4.249 6.666 1.00 0.00 C ATOM 644 C GLU A 41 -12.949 5.602 6.916 1.00 0.00 C ATOM 645 O GLU A 41 -13.083 6.415 6.001 1.00 0.00 O ATOM 646 CB GLU A 41 -13.344 3.157 6.504 1.00 0.00 C ATOM 647 CG GLU A 41 -12.772 1.822 6.052 1.00 0.00 C ATOM 648 CD GLU A 41 -13.811 0.721 5.989 1.00 0.00 C ATOM 649 OE1 GLU A 41 -14.892 0.949 5.406 1.00 0.00 O ATOM 650 OE2 GLU A 41 -13.549 -0.375 6.528 1.00 0.00 O ATOM 0 H GLU A 41 -11.601 3.036 8.229 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.706 4.321 5.744 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -13.861 3.019 7.454 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.089 3.488 5.780 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.319 1.942 5.068 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.977 1.524 6.735 1.00 0.00 H new ATOM 657 N SER A 42 -13.341 5.846 8.160 1.00 0.00 N ATOM 658 CA SER A 42 -13.983 7.100 8.530 1.00 0.00 C ATOM 659 C SER A 42 -12.995 8.265 8.452 1.00 0.00 C ATOM 660 O SER A 42 -13.330 9.334 7.940 1.00 0.00 O ATOM 661 CB SER A 42 -14.574 6.993 9.935 1.00 0.00 C ATOM 662 OG SER A 42 -15.511 5.930 10.009 1.00 0.00 O ATOM 0 H SER A 42 -13.225 5.189 8.932 1.00 0.00 H new ATOM 0 HA SER A 42 -14.789 7.295 7.822 1.00 0.00 H new ATOM 0 HB2 SER A 42 -13.775 6.830 10.659 1.00 0.00 H new ATOM 0 HB3 SER A 42 -15.060 7.931 10.202 1.00 0.00 H new ATOM 0 HG SER A 42 -15.035 5.081 10.124 1.00 0.00 H new ATOM 668 N LEU A 43 -11.776 8.050 8.938 1.00 0.00 N ATOM 669 CA LEU A 43 -10.743 9.082 8.898 1.00 0.00 C ATOM 670 C LEU A 43 -10.429 9.472 7.458 1.00 0.00 C ATOM 671 O LEU A 43 -10.188 10.644 7.155 1.00 0.00 O ATOM 672 CB LEU A 43 -9.468 8.601 9.596 1.00 0.00 C ATOM 673 CG LEU A 43 -9.606 8.318 11.091 1.00 0.00 C ATOM 674 CD1 LEU A 43 -8.292 7.802 11.655 1.00 0.00 C ATOM 675 CD2 LEU A 43 -10.050 9.573 11.832 1.00 0.00 C ATOM 0 H LEU A 43 -11.479 7.172 9.364 1.00 0.00 H new ATOM 0 HA LEU A 43 -11.122 9.957 9.426 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.124 7.692 9.102 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -8.692 9.353 9.456 1.00 0.00 H new ATOM 0 HG LEU A 43 -10.367 7.550 11.230 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.406 7.605 12.721 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -8.013 6.881 11.143 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -7.513 8.550 11.506 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -10.143 9.354 12.896 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -9.311 10.361 11.688 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -11.014 9.903 11.444 1.00 0.00 H new ATOM 687 N LEU A 44 -10.435 8.485 6.572 1.00 0.00 N ATOM 688 CA LEU A 44 -10.205 8.729 5.156 1.00 0.00 C ATOM 689 C LEU A 44 -11.413 9.414 4.527 1.00 0.00 C ATOM 690 O LEU A 44 -11.270 10.329 3.724 1.00 0.00 O ATOM 691 CB LEU A 44 -9.911 7.411 4.430 1.00 0.00 C ATOM 692 CG LEU A 44 -9.669 7.533 2.923 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.424 8.358 2.642 1.00 0.00 C ATOM 694 CD2 LEU A 44 -9.551 6.156 2.289 1.00 0.00 C ATOM 0 H LEU A 44 -10.597 7.507 6.810 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.342 9.387 5.057 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -9.034 6.952 4.886 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.747 6.731 4.593 1.00 0.00 H new ATOM 0 HG LEU A 44 -10.524 8.045 2.481 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.272 8.431 1.565 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.548 9.357 3.060 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.559 7.878 3.099 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -9.379 6.262 1.218 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.716 5.619 2.739 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.473 5.599 2.455 1.00 0.00 H new ATOM 706 N ARG A 45 -12.604 8.979 4.926 1.00 0.00 N ATOM 707 CA ARG A 45 -13.844 9.484 4.344 1.00 0.00 C ATOM 708 C ARG A 45 -14.097 10.932 4.748 1.00 0.00 C ATOM 709 O ARG A 45 -14.659 11.709 3.978 1.00 0.00 O ATOM 710 CB ARG A 45 -15.027 8.609 4.770 1.00 0.00 C ATOM 711 CG ARG A 45 -16.240 8.737 3.864 1.00 0.00 C ATOM 712 CD ARG A 45 -17.360 7.808 4.297 1.00 0.00 C ATOM 713 NE ARG A 45 -18.187 8.394 5.348 1.00 0.00 N ATOM 714 CZ ARG A 45 -18.515 7.770 6.477 1.00 0.00 C ATOM 715 NH1 ARG A 45 -18.043 6.554 6.733 1.00 0.00 N ATOM 716 NH2 ARG A 45 -19.310 8.367 7.355 1.00 0.00 N ATOM 0 H ARG A 45 -12.737 8.276 5.652 1.00 0.00 H new ATOM 0 HA ARG A 45 -13.742 9.446 3.259 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.708 7.567 4.790 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -15.315 8.874 5.787 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.596 9.767 3.875 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -15.954 8.509 2.837 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -17.985 7.569 3.436 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -16.934 6.870 4.653 1.00 0.00 H new ATOM 0 HE ARG A 45 -18.536 9.342 5.208 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -17.426 6.095 6.063 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -18.297 6.080 7.600 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -19.669 9.303 7.164 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -19.563 7.890 8.221 1.00 0.00 H new ATOM 730 N ASN A 46 -13.684 11.286 5.956 1.00 0.00 N ATOM 731 CA ASN A 46 -13.881 12.638 6.463 1.00 0.00 C ATOM 732 C ASN A 46 -12.817 13.578 5.904 1.00 0.00 C ATOM 733 O ASN A 46 -13.019 14.789 5.824 1.00 0.00 O ATOM 734 CB ASN A 46 -13.848 12.643 7.997 1.00 0.00 C ATOM 735 CG ASN A 46 -14.383 13.933 8.588 1.00 0.00 C ATOM 736 OD1 ASN A 46 -15.587 14.073 8.808 1.00 0.00 O ATOM 737 ND2 ASN A 46 -13.497 14.876 8.866 1.00 0.00 N ATOM 0 H ASN A 46 -13.210 10.657 6.604 1.00 0.00 H new ATOM 0 HA ASN A 46 -14.859 12.991 6.136 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -14.435 11.805 8.372 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -12.823 12.490 8.335 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -13.803 15.758 9.278 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -12.508 14.721 8.669 1.00 0.00 H new ATOM 744 N GLY A 47 -11.688 13.010 5.504 1.00 0.00 N ATOM 745 CA GLY A 47 -10.628 13.809 4.927 1.00 0.00 C ATOM 746 C GLY A 47 -9.581 14.207 5.946 1.00 0.00 C ATOM 747 O GLY A 47 -9.294 15.391 6.123 1.00 0.00 O ATOM 0 H GLY A 47 -11.488 12.012 5.569 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.152 13.249 4.122 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -11.056 14.707 4.481 1.00 0.00 H new ATOM 751 N LYS A 48 -9.027 13.222 6.638 1.00 0.00 N ATOM 752 CA LYS A 48 -7.970 13.477 7.604 1.00 0.00 C ATOM 753 C LYS A 48 -6.672 12.801 7.171 1.00 0.00 C ATOM 754 O LYS A 48 -5.607 13.419 7.169 1.00 0.00 O ATOM 755 CB LYS A 48 -8.392 12.992 8.995 1.00 0.00 C ATOM 756 CG LYS A 48 -7.344 13.242 10.070 1.00 0.00 C ATOM 757 CD LYS A 48 -7.867 12.897 11.458 1.00 0.00 C ATOM 758 CE LYS A 48 -8.964 13.855 11.906 1.00 0.00 C ATOM 759 NZ LYS A 48 -8.474 15.256 12.017 1.00 0.00 N ATOM 0 H LYS A 48 -9.292 12.241 6.548 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.796 14.552 7.650 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -9.318 13.491 9.279 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -8.606 11.924 8.949 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -6.456 12.647 9.858 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.040 14.288 10.045 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -8.253 11.878 11.457 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.045 12.926 12.173 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -9.791 13.816 11.197 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.356 13.531 12.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.159 15.822 12.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.556 15.265 12.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.364 15.662 11.066 1.00 0.00 H new ATOM 773 N ILE A 49 -6.767 11.535 6.791 1.00 0.00 N ATOM 774 CA ILE A 49 -5.600 10.788 6.337 1.00 0.00 C ATOM 775 C ILE A 49 -5.646 10.597 4.826 1.00 0.00 C ATOM 776 O ILE A 49 -6.701 10.745 4.208 1.00 0.00 O ATOM 777 CB ILE A 49 -5.499 9.409 7.024 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.736 8.558 6.707 1.00 0.00 C ATOM 779 CG2 ILE A 49 -5.334 9.578 8.529 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.668 7.150 7.262 1.00 0.00 C ATOM 0 H ILE A 49 -7.637 11.003 6.787 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.719 11.371 6.608 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.621 8.892 6.637 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.620 9.054 7.108 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.863 8.507 5.626 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -5.264 8.597 9.000 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.426 10.144 8.734 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.194 10.113 8.931 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.577 6.610 6.997 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -5.805 6.634 6.842 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.573 7.191 8.347 1.00 0.00 H new ATOM 792 N THR A 50 -4.506 10.275 4.236 1.00 0.00 N ATOM 793 CA THR A 50 -4.432 10.049 2.803 1.00 0.00 C ATOM 794 C THR A 50 -4.762 8.599 2.475 1.00 0.00 C ATOM 795 O THR A 50 -4.936 7.774 3.378 1.00 0.00 O ATOM 796 CB THR A 50 -3.029 10.379 2.259 1.00 0.00 C ATOM 797 OG1 THR A 50 -2.054 9.529 2.880 1.00 0.00 O ATOM 798 CG2 THR A 50 -2.674 11.833 2.519 1.00 0.00 C ATOM 0 H THR A 50 -3.619 10.164 4.728 1.00 0.00 H new ATOM 0 HA THR A 50 -5.160 10.708 2.330 1.00 0.00 H new ATOM 0 HB THR A 50 -3.032 10.210 1.182 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.164 9.742 2.529 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.679 12.041 2.126 1.00 0.00 H new ATOM 0 HG22 THR A 50 -3.401 12.479 2.026 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.687 12.024 3.592 1.00 0.00 H new ATOM 806 N VAL A 51 -4.841 8.283 1.188 1.00 0.00 N ATOM 807 CA VAL A 51 -5.080 6.914 0.761 1.00 0.00 C ATOM 808 C VAL A 51 -3.893 6.036 1.142 1.00 0.00 C ATOM 809 O VAL A 51 -4.063 4.887 1.543 1.00 0.00 O ATOM 810 CB VAL A 51 -5.338 6.831 -0.759 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.527 5.388 -1.210 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.553 7.668 -1.129 1.00 0.00 C ATOM 0 H VAL A 51 -4.743 8.954 0.426 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.975 6.554 1.269 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.463 7.228 -1.274 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.707 5.363 -2.285 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.630 4.814 -0.979 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.380 4.953 -0.689 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.726 7.603 -2.203 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.428 7.294 -0.597 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.377 8.707 -0.852 1.00 0.00 H new ATOM 822 N ARG A 52 -2.693 6.602 1.046 1.00 0.00 N ATOM 823 CA ARG A 52 -1.481 5.898 1.458 1.00 0.00 C ATOM 824 C ARG A 52 -1.543 5.531 2.942 1.00 0.00 C ATOM 825 O ARG A 52 -1.169 4.424 3.329 1.00 0.00 O ATOM 826 CB ARG A 52 -0.234 6.742 1.160 1.00 0.00 C ATOM 827 CG ARG A 52 1.009 6.267 1.896 1.00 0.00 C ATOM 828 CD ARG A 52 2.294 6.730 1.227 1.00 0.00 C ATOM 829 NE ARG A 52 2.325 8.169 0.986 1.00 0.00 N ATOM 830 CZ ARG A 52 3.384 8.938 1.223 1.00 0.00 C ATOM 831 NH1 ARG A 52 4.486 8.419 1.752 1.00 0.00 N ATOM 832 NH2 ARG A 52 3.340 10.228 0.926 1.00 0.00 N ATOM 0 H ARG A 52 -2.533 7.544 0.688 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.414 4.975 0.882 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.041 6.724 0.087 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.433 7.779 1.431 1.00 0.00 H new ATOM 0 HG2 ARG A 52 0.984 6.636 2.921 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.002 5.178 1.949 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.143 6.454 1.853 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.413 6.206 0.279 1.00 0.00 H new ATOM 0 HE ARG A 52 1.485 8.611 0.614 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.524 7.425 1.979 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.295 9.014 1.931 1.00 0.00 H new ATOM 0 HH21 ARG A 52 2.496 10.629 0.517 1.00 0.00 H new ATOM 0 HH22 ARG A 52 4.150 10.821 1.106 1.00 0.00 H new ATOM 846 N GLU A 53 -2.027 6.457 3.763 1.00 0.00 N ATOM 847 CA GLU A 53 -2.191 6.207 5.195 1.00 0.00 C ATOM 848 C GLU A 53 -3.195 5.081 5.437 1.00 0.00 C ATOM 849 O GLU A 53 -3.019 4.254 6.337 1.00 0.00 O ATOM 850 CB GLU A 53 -2.652 7.478 5.910 1.00 0.00 C ATOM 851 CG GLU A 53 -1.603 8.577 5.933 1.00 0.00 C ATOM 852 CD GLU A 53 -0.390 8.201 6.755 1.00 0.00 C ATOM 853 OE1 GLU A 53 0.525 7.552 6.213 1.00 0.00 O ATOM 854 OE2 GLU A 53 -0.351 8.552 7.955 1.00 0.00 O ATOM 0 H GLU A 53 -2.313 7.389 3.463 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.225 5.904 5.598 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.550 7.855 5.421 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.928 7.229 6.935 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.292 8.800 4.912 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.044 9.488 6.338 1.00 0.00 H new ATOM 861 N PHE A 54 -4.245 5.062 4.626 1.00 0.00 N ATOM 862 CA PHE A 54 -5.264 4.026 4.711 1.00 0.00 C ATOM 863 C PHE A 54 -4.676 2.671 4.322 1.00 0.00 C ATOM 864 O PHE A 54 -4.810 1.693 5.058 1.00 0.00 O ATOM 865 CB PHE A 54 -6.447 4.380 3.804 1.00 0.00 C ATOM 866 CG PHE A 54 -7.576 3.391 3.861 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.427 3.355 4.952 1.00 0.00 C ATOM 868 CD2 PHE A 54 -7.788 2.502 2.821 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.469 2.451 5.004 1.00 0.00 C ATOM 870 CE2 PHE A 54 -8.828 1.595 2.868 1.00 0.00 C ATOM 871 CZ PHE A 54 -9.671 1.570 3.961 1.00 0.00 C ATOM 0 H PHE A 54 -4.413 5.757 3.898 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.620 3.963 5.739 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.824 5.364 4.083 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -6.094 4.454 2.775 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -8.274 4.042 5.772 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.132 2.518 1.963 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -10.126 2.433 5.861 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.982 0.906 2.051 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.486 0.863 4.000 1.00 0.00 H new ATOM 881 N VAL A 55 -4.008 2.630 3.173 1.00 0.00 N ATOM 882 CA VAL A 55 -3.376 1.406 2.694 1.00 0.00 C ATOM 883 C VAL A 55 -2.355 0.894 3.707 1.00 0.00 C ATOM 884 O VAL A 55 -2.301 -0.301 3.989 1.00 0.00 O ATOM 885 CB VAL A 55 -2.684 1.614 1.327 1.00 0.00 C ATOM 886 CG1 VAL A 55 -1.979 0.346 0.875 1.00 0.00 C ATOM 887 CG2 VAL A 55 -3.689 2.057 0.277 1.00 0.00 C ATOM 0 H VAL A 55 -3.890 3.433 2.555 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.167 0.667 2.569 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.937 2.399 1.448 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -1.501 0.520 -0.089 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.224 0.068 1.610 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.706 -0.460 0.779 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.181 2.197 -0.677 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.461 1.295 0.168 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.147 2.997 0.586 1.00 0.00 H new ATOM 897 N ARG A 56 -1.567 1.813 4.256 1.00 0.00 N ATOM 898 CA ARG A 56 -0.568 1.481 5.269 1.00 0.00 C ATOM 899 C ARG A 56 -1.196 0.691 6.412 1.00 0.00 C ATOM 900 O ARG A 56 -0.736 -0.405 6.756 1.00 0.00 O ATOM 901 CB ARG A 56 0.066 2.766 5.811 1.00 0.00 C ATOM 902 CG ARG A 56 1.054 2.537 6.944 1.00 0.00 C ATOM 903 CD ARG A 56 1.628 3.846 7.465 1.00 0.00 C ATOM 904 NE ARG A 56 2.536 3.632 8.590 1.00 0.00 N ATOM 905 CZ ARG A 56 3.799 4.060 8.624 1.00 0.00 C ATOM 906 NH1 ARG A 56 4.294 4.773 7.620 1.00 0.00 N ATOM 907 NH2 ARG A 56 4.562 3.790 9.676 1.00 0.00 N ATOM 0 H ARG A 56 -1.601 2.803 4.014 1.00 0.00 H new ATOM 0 HA ARG A 56 0.201 0.863 4.806 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.576 3.279 4.996 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.725 3.430 6.161 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.558 2.008 7.758 1.00 0.00 H new ATOM 0 HG3 ARG A 56 1.865 1.897 6.596 1.00 0.00 H new ATOM 0 HD2 ARG A 56 2.159 4.355 6.661 1.00 0.00 H new ATOM 0 HD3 ARG A 56 0.814 4.502 7.775 1.00 0.00 H new ATOM 0 HE ARG A 56 2.182 3.123 9.400 1.00 0.00 H new ATOM 0 HH11 ARG A 56 3.708 4.997 6.816 1.00 0.00 H new ATOM 0 HH12 ARG A 56 5.261 5.097 7.653 1.00 0.00 H new ATOM 0 HH21 ARG A 56 4.183 3.256 10.458 1.00 0.00 H new ATOM 0 HH22 ARG A 56 5.528 4.117 9.703 1.00 0.00 H new ATOM 921 N ALA A 57 -2.260 1.250 6.978 1.00 0.00 N ATOM 922 CA ALA A 57 -2.952 0.625 8.094 1.00 0.00 C ATOM 923 C ALA A 57 -3.487 -0.747 7.707 1.00 0.00 C ATOM 924 O ALA A 57 -3.188 -1.739 8.363 1.00 0.00 O ATOM 925 CB ALA A 57 -4.085 1.516 8.584 1.00 0.00 C ATOM 0 H ALA A 57 -2.662 2.139 6.679 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.235 0.493 8.904 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -4.592 1.033 9.419 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -3.680 2.474 8.910 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -4.795 1.680 7.774 1.00 0.00 H new ATOM 931 N VAL A 58 -4.251 -0.799 6.621 1.00 0.00 N ATOM 932 CA VAL A 58 -4.895 -2.039 6.183 1.00 0.00 C ATOM 933 C VAL A 58 -3.864 -3.122 5.846 1.00 0.00 C ATOM 934 O VAL A 58 -4.084 -4.304 6.104 1.00 0.00 O ATOM 935 CB VAL A 58 -5.804 -1.790 4.956 1.00 0.00 C ATOM 936 CG1 VAL A 58 -6.472 -3.081 4.493 1.00 0.00 C ATOM 937 CG2 VAL A 58 -6.853 -0.736 5.278 1.00 0.00 C ATOM 0 H VAL A 58 -4.442 0.005 6.023 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.506 -2.390 7.014 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.177 -1.425 4.142 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.104 -2.874 3.630 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.708 -3.808 4.217 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -7.082 -3.485 5.301 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.484 -0.572 4.405 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.467 -1.077 6.111 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.360 0.197 5.549 1.00 0.00 H new ATOM 947 N ALA A 59 -2.729 -2.707 5.298 1.00 0.00 N ATOM 948 CA ALA A 59 -1.700 -3.642 4.861 1.00 0.00 C ATOM 949 C ALA A 59 -1.060 -4.392 6.025 1.00 0.00 C ATOM 950 O ALA A 59 -0.869 -5.604 5.952 1.00 0.00 O ATOM 951 CB ALA A 59 -0.630 -2.916 4.065 1.00 0.00 C ATOM 0 H ALA A 59 -2.497 -1.726 5.145 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.192 -4.380 4.228 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.131 -3.628 3.746 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.081 -2.450 3.189 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.171 -2.149 4.688 1.00 0.00 H new ATOM 957 N LYS A 60 -0.715 -3.679 7.090 1.00 0.00 N ATOM 958 CA LYS A 60 -0.001 -4.304 8.201 1.00 0.00 C ATOM 959 C LYS A 60 -0.935 -4.654 9.367 1.00 0.00 C ATOM 960 O LYS A 60 -0.469 -5.013 10.448 1.00 0.00 O ATOM 961 CB LYS A 60 1.137 -3.395 8.689 1.00 0.00 C ATOM 962 CG LYS A 60 0.673 -2.056 9.235 1.00 0.00 C ATOM 963 CD LYS A 60 1.825 -1.271 9.851 1.00 0.00 C ATOM 964 CE LYS A 60 2.858 -0.855 8.812 1.00 0.00 C ATOM 965 NZ LYS A 60 3.978 -0.078 9.417 1.00 0.00 N ATOM 0 H LYS A 60 -0.913 -2.685 7.210 1.00 0.00 H new ATOM 0 HA LYS A 60 0.419 -5.237 7.827 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.697 -3.917 9.465 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.826 -3.219 7.863 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.222 -1.472 8.433 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -0.101 -2.217 9.986 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.433 -0.383 10.347 1.00 0.00 H new ATOM 0 HD3 LYS A 60 2.307 -1.878 10.618 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.256 -1.743 8.321 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.375 -0.254 8.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.623 0.243 8.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.595 0.747 9.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.498 -0.682 10.085 1.00 0.00 H new ATOM 979 N SER A 61 -2.246 -4.566 9.153 1.00 0.00 N ATOM 980 CA SER A 61 -3.199 -4.849 10.223 1.00 0.00 C ATOM 981 C SER A 61 -3.751 -6.269 10.135 1.00 0.00 C ATOM 982 O SER A 61 -4.185 -6.836 11.141 1.00 0.00 O ATOM 983 CB SER A 61 -4.344 -3.832 10.216 1.00 0.00 C ATOM 984 OG SER A 61 -4.909 -3.703 8.925 1.00 0.00 O ATOM 0 H SER A 61 -2.668 -4.305 8.262 1.00 0.00 H new ATOM 0 HA SER A 61 -2.658 -4.763 11.165 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.114 -4.143 10.923 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.975 -2.863 10.552 1.00 0.00 H new ATOM 0 HG SER A 61 -4.366 -3.086 8.391 1.00 0.00 H new ATOM 990 N GLU A 62 -3.739 -6.852 8.940 1.00 0.00 N ATOM 991 CA GLU A 62 -4.214 -8.220 8.784 1.00 0.00 C ATOM 992 C GLU A 62 -3.162 -9.201 9.294 1.00 0.00 C ATOM 993 O GLU A 62 -2.033 -8.807 9.596 1.00 0.00 O ATOM 994 CB GLU A 62 -4.599 -8.532 7.330 1.00 0.00 C ATOM 995 CG GLU A 62 -3.451 -8.477 6.332 1.00 0.00 C ATOM 996 CD GLU A 62 -3.880 -8.904 4.937 1.00 0.00 C ATOM 997 OE1 GLU A 62 -4.069 -10.119 4.713 1.00 0.00 O ATOM 998 OE2 GLU A 62 -4.025 -8.029 4.054 1.00 0.00 O ATOM 0 H GLU A 62 -3.412 -6.408 8.082 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.119 -8.330 9.382 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.044 -9.526 7.294 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.368 -7.827 7.015 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -3.054 -7.463 6.293 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -2.643 -9.123 6.675 1.00 0.00 H new ATOM 1005 N LEU A 63 -3.528 -10.472 9.401 1.00 0.00 N ATOM 1006 CA LEU A 63 -2.629 -11.474 9.955 1.00 0.00 C ATOM 1007 C LEU A 63 -1.545 -11.850 8.949 1.00 0.00 C ATOM 1008 O LEU A 63 -1.589 -12.913 8.333 1.00 0.00 O ATOM 1009 CB LEU A 63 -3.409 -12.716 10.394 1.00 0.00 C ATOM 1010 CG LEU A 63 -4.445 -12.479 11.498 1.00 0.00 C ATOM 1011 CD1 LEU A 63 -5.150 -13.779 11.857 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -3.783 -11.878 12.730 1.00 0.00 C ATOM 0 H LEU A 63 -4.438 -10.832 9.112 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.144 -11.044 10.831 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -3.917 -13.133 9.524 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.699 -13.468 10.739 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.188 -11.774 11.125 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -5.882 -13.591 12.643 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -5.656 -14.174 10.976 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.417 -14.505 12.210 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.533 -11.716 13.504 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.019 -12.561 13.102 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -3.322 -10.926 12.467 1.00 0.00 H new ATOM 1024 N TYR A 64 -0.578 -10.958 8.785 1.00 0.00 N ATOM 1025 CA TYR A 64 0.533 -11.169 7.865 1.00 0.00 C ATOM 1026 C TYR A 64 1.367 -12.382 8.268 1.00 0.00 C ATOM 1027 O TYR A 64 2.011 -13.011 7.429 1.00 0.00 O ATOM 1028 CB TYR A 64 1.414 -9.915 7.803 1.00 0.00 C ATOM 1029 CG TYR A 64 1.963 -9.466 9.146 1.00 0.00 C ATOM 1030 CD1 TYR A 64 1.260 -8.575 9.945 1.00 0.00 C ATOM 1031 CD2 TYR A 64 3.186 -9.934 9.611 1.00 0.00 C ATOM 1032 CE1 TYR A 64 1.760 -8.160 11.165 1.00 0.00 C ATOM 1033 CE2 TYR A 64 3.692 -9.525 10.831 1.00 0.00 C ATOM 1034 CZ TYR A 64 2.975 -8.639 11.605 1.00 0.00 C ATOM 1035 OH TYR A 64 3.473 -8.232 12.822 1.00 0.00 O ATOM 0 H TYR A 64 -0.541 -10.069 9.284 1.00 0.00 H new ATOM 0 HA TYR A 64 0.118 -11.363 6.876 1.00 0.00 H new ATOM 0 HB2 TYR A 64 2.249 -10.105 7.128 1.00 0.00 H new ATOM 0 HB3 TYR A 64 0.834 -9.100 7.370 1.00 0.00 H new ATOM 0 HD1 TYR A 64 0.305 -8.199 9.607 1.00 0.00 H new ATOM 0 HD2 TYR A 64 3.751 -10.630 9.009 1.00 0.00 H new ATOM 0 HE1 TYR A 64 1.201 -7.463 11.771 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.645 -9.898 11.176 1.00 0.00 H new ATOM 0 HH TYR A 64 4.338 -8.664 12.982 1.00 0.00 H new ATOM 1045 N LYS A 65 1.325 -12.717 9.552 1.00 0.00 N ATOM 1046 CA LYS A 65 2.110 -13.819 10.094 1.00 0.00 C ATOM 1047 C LYS A 65 1.417 -15.154 9.808 1.00 0.00 C ATOM 1048 O LYS A 65 1.967 -16.226 10.061 1.00 0.00 O ATOM 1049 CB LYS A 65 2.292 -13.613 11.602 1.00 0.00 C ATOM 1050 CG LYS A 65 3.385 -14.464 12.226 1.00 0.00 C ATOM 1051 CD LYS A 65 4.754 -14.109 11.671 1.00 0.00 C ATOM 1052 CE LYS A 65 5.862 -14.857 12.397 1.00 0.00 C ATOM 1053 NZ LYS A 65 6.036 -14.379 13.794 1.00 0.00 N ATOM 0 H LYS A 65 0.749 -12.236 10.243 1.00 0.00 H new ATOM 0 HA LYS A 65 3.090 -13.840 9.617 1.00 0.00 H new ATOM 0 HB2 LYS A 65 2.516 -12.563 11.788 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.349 -13.831 12.102 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.383 -14.325 13.307 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.178 -15.518 12.039 1.00 0.00 H new ATOM 0 HD2 LYS A 65 4.789 -14.347 10.608 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.918 -13.035 11.763 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.635 -15.923 12.405 1.00 0.00 H new ATOM 0 HE3 LYS A 65 6.799 -14.735 11.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 6.929 -14.749 14.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.059 -13.339 13.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 5.242 -14.714 14.377 1.00 0.00 H new ATOM 1185 N PHE A 73 6.300 -20.404 -0.478 1.00 0.00 N ATOM 1186 CA PHE A 73 7.700 -20.024 -0.333 1.00 0.00 C ATOM 1187 C PHE A 73 7.842 -18.542 -0.010 1.00 0.00 C ATOM 1188 O PHE A 73 7.063 -17.714 -0.488 1.00 0.00 O ATOM 1189 CB PHE A 73 8.478 -20.354 -1.608 1.00 0.00 C ATOM 1190 CG PHE A 73 8.479 -21.815 -1.952 1.00 0.00 C ATOM 1191 CD1 PHE A 73 9.321 -22.694 -1.289 1.00 0.00 C ATOM 1192 CD2 PHE A 73 7.637 -22.309 -2.933 1.00 0.00 C ATOM 1193 CE1 PHE A 73 9.324 -24.038 -1.600 1.00 0.00 C ATOM 1194 CE2 PHE A 73 7.636 -23.653 -3.249 1.00 0.00 C ATOM 1195 CZ PHE A 73 8.478 -24.519 -2.581 1.00 0.00 C ATOM 0 HA PHE A 73 8.113 -20.596 0.498 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.050 -19.794 -2.440 1.00 0.00 H new ATOM 0 HB3 PHE A 73 9.508 -20.016 -1.493 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.982 -22.322 -0.520 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.974 -21.636 -3.457 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.986 -24.713 -1.078 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.977 -24.027 -4.019 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.476 -25.571 -2.825 1.00 0.00 H new ATOM 1205 N GLN A 74 8.862 -18.226 0.784 1.00 0.00 N ATOM 1206 CA GLN A 74 9.134 -16.859 1.231 1.00 0.00 C ATOM 1207 C GLN A 74 9.195 -15.880 0.057 1.00 0.00 C ATOM 1208 O GLN A 74 8.701 -14.756 0.148 1.00 0.00 O ATOM 1209 CB GLN A 74 10.457 -16.829 2.001 1.00 0.00 C ATOM 1210 CG GLN A 74 10.731 -15.509 2.702 1.00 0.00 C ATOM 1211 CD GLN A 74 9.700 -15.202 3.766 1.00 0.00 C ATOM 1212 OE1 GLN A 74 9.129 -16.106 4.373 1.00 0.00 O ATOM 1213 NE2 GLN A 74 9.453 -13.924 3.998 1.00 0.00 N ATOM 0 H GLN A 74 9.527 -18.913 1.138 1.00 0.00 H new ATOM 0 HA GLN A 74 8.316 -16.546 1.880 1.00 0.00 H new ATOM 0 HB2 GLN A 74 10.453 -17.629 2.742 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.273 -17.038 1.310 1.00 0.00 H new ATOM 0 HG2 GLN A 74 11.721 -15.540 3.156 1.00 0.00 H new ATOM 0 HG3 GLN A 74 10.742 -14.705 1.967 1.00 0.00 H new ATOM 0 HE21 GLN A 74 9.949 -13.205 3.472 1.00 0.00 H new ATOM 0 HE22 GLN A 74 8.766 -13.657 4.703 1.00 0.00 H new ATOM 1222 N THR A 75 9.793 -16.319 -1.043 1.00 0.00 N ATOM 1223 CA THR A 75 9.913 -15.497 -2.238 1.00 0.00 C ATOM 1224 C THR A 75 8.534 -15.061 -2.746 1.00 0.00 C ATOM 1225 O THR A 75 8.330 -13.908 -3.136 1.00 0.00 O ATOM 1226 CB THR A 75 10.641 -16.278 -3.347 1.00 0.00 C ATOM 1227 OG1 THR A 75 11.776 -16.957 -2.790 1.00 0.00 O ATOM 1228 CG2 THR A 75 11.093 -15.351 -4.464 1.00 0.00 C ATOM 0 H THR A 75 10.205 -17.248 -1.131 1.00 0.00 H new ATOM 0 HA THR A 75 10.488 -14.608 -1.978 1.00 0.00 H new ATOM 0 HB THR A 75 9.947 -17.005 -3.769 1.00 0.00 H new ATOM 0 HG1 THR A 75 12.238 -17.455 -3.496 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.604 -15.930 -5.233 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.225 -14.856 -4.899 1.00 0.00 H new ATOM 0 HG23 THR A 75 11.774 -14.601 -4.061 1.00 0.00 H new ATOM 1236 N ARG A 76 7.577 -15.982 -2.700 1.00 0.00 N ATOM 1237 CA ARG A 76 6.246 -15.713 -3.221 1.00 0.00 C ATOM 1238 C ARG A 76 5.446 -14.898 -2.214 1.00 0.00 C ATOM 1239 O ARG A 76 4.506 -14.197 -2.579 1.00 0.00 O ATOM 1240 CB ARG A 76 5.511 -17.017 -3.558 1.00 0.00 C ATOM 1241 CG ARG A 76 6.350 -18.023 -4.341 1.00 0.00 C ATOM 1242 CD ARG A 76 7.059 -17.397 -5.538 1.00 0.00 C ATOM 1243 NE ARG A 76 6.135 -16.816 -6.511 1.00 0.00 N ATOM 1244 CZ ARG A 76 5.917 -17.330 -7.723 1.00 0.00 C ATOM 1245 NH1 ARG A 76 6.478 -18.482 -8.070 1.00 0.00 N ATOM 1246 NH2 ARG A 76 5.139 -16.686 -8.585 1.00 0.00 N ATOM 0 H ARG A 76 7.699 -16.916 -2.309 1.00 0.00 H new ATOM 0 HA ARG A 76 6.349 -15.138 -4.141 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.177 -17.483 -2.631 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.617 -16.779 -4.135 1.00 0.00 H new ATOM 0 HG2 ARG A 76 7.092 -18.466 -3.676 1.00 0.00 H new ATOM 0 HG3 ARG A 76 5.708 -18.833 -4.688 1.00 0.00 H new ATOM 0 HD2 ARG A 76 7.740 -16.623 -5.185 1.00 0.00 H new ATOM 0 HD3 ARG A 76 7.667 -18.156 -6.031 1.00 0.00 H new ATOM 0 HE ARG A 76 5.629 -15.970 -6.249 1.00 0.00 H new ATOM 0 HH11 ARG A 76 7.077 -18.977 -7.409 1.00 0.00 H new ATOM 0 HH12 ARG A 76 6.310 -18.872 -8.997 1.00 0.00 H new ATOM 0 HH21 ARG A 76 4.709 -15.800 -8.320 1.00 0.00 H new ATOM 0 HH22 ARG A 76 4.971 -17.078 -9.512 1.00 0.00 H new ATOM 1260 N VAL A 77 5.832 -14.988 -0.946 1.00 0.00 N ATOM 1261 CA VAL A 77 5.239 -14.160 0.098 1.00 0.00 C ATOM 1262 C VAL A 77 5.545 -12.691 -0.181 1.00 0.00 C ATOM 1263 O VAL A 77 4.709 -11.810 0.031 1.00 0.00 O ATOM 1264 CB VAL A 77 5.767 -14.551 1.499 1.00 0.00 C ATOM 1265 CG1 VAL A 77 5.165 -13.669 2.584 1.00 0.00 C ATOM 1266 CG2 VAL A 77 5.482 -16.017 1.786 1.00 0.00 C ATOM 0 H VAL A 77 6.555 -15.628 -0.616 1.00 0.00 H new ATOM 0 HA VAL A 77 4.161 -14.322 0.090 1.00 0.00 H new ATOM 0 HB VAL A 77 6.846 -14.397 1.504 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.556 -13.970 3.556 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.427 -12.628 2.394 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.080 -13.777 2.580 1.00 0.00 H new ATOM 0 HG21 VAL A 77 5.860 -16.274 2.775 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.407 -16.192 1.752 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.975 -16.637 1.037 1.00 0.00 H new ATOM 1276 N ILE A 78 6.747 -12.443 -0.687 1.00 0.00 N ATOM 1277 CA ILE A 78 7.144 -11.108 -1.108 1.00 0.00 C ATOM 1278 C ILE A 78 6.274 -10.646 -2.275 1.00 0.00 C ATOM 1279 O ILE A 78 5.809 -9.507 -2.308 1.00 0.00 O ATOM 1280 CB ILE A 78 8.632 -11.074 -1.516 1.00 0.00 C ATOM 1281 CG1 ILE A 78 9.507 -11.512 -0.338 1.00 0.00 C ATOM 1282 CG2 ILE A 78 9.030 -9.683 -1.994 1.00 0.00 C ATOM 1283 CD1 ILE A 78 10.976 -11.629 -0.678 1.00 0.00 C ATOM 0 H ILE A 78 7.466 -13.155 -0.816 1.00 0.00 H new ATOM 0 HA ILE A 78 7.005 -10.432 -0.265 1.00 0.00 H new ATOM 0 HB ILE A 78 8.783 -11.768 -2.342 1.00 0.00 H new ATOM 0 HG12 ILE A 78 9.388 -10.797 0.476 1.00 0.00 H new ATOM 0 HG13 ILE A 78 9.151 -12.475 0.029 1.00 0.00 H new ATOM 0 HG21 ILE A 78 10.083 -9.683 -2.276 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.423 -9.407 -2.856 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.869 -8.963 -1.192 1.00 0.00 H new ATOM 0 HD11 ILE A 78 11.530 -11.943 0.206 1.00 0.00 H new ATOM 0 HD12 ILE A 78 11.109 -12.366 -1.470 1.00 0.00 H new ATOM 0 HD13 ILE A 78 11.349 -10.662 -1.016 1.00 0.00 H new ATOM 1295 N GLU A 79 6.048 -11.549 -3.227 1.00 0.00 N ATOM 1296 CA GLU A 79 5.153 -11.277 -4.343 1.00 0.00 C ATOM 1297 C GLU A 79 3.758 -10.914 -3.833 1.00 0.00 C ATOM 1298 O GLU A 79 3.080 -10.051 -4.397 1.00 0.00 O ATOM 1299 CB GLU A 79 5.064 -12.504 -5.255 1.00 0.00 C ATOM 1300 CG GLU A 79 4.247 -12.263 -6.508 1.00 0.00 C ATOM 1301 CD GLU A 79 3.951 -13.538 -7.272 1.00 0.00 C ATOM 1302 OE1 GLU A 79 4.892 -14.142 -7.817 1.00 0.00 O ATOM 1303 OE2 GLU A 79 2.769 -13.939 -7.341 1.00 0.00 O ATOM 0 H GLU A 79 6.474 -12.476 -3.245 1.00 0.00 H new ATOM 0 HA GLU A 79 5.552 -10.435 -4.909 1.00 0.00 H new ATOM 0 HB2 GLU A 79 6.071 -12.810 -5.540 1.00 0.00 H new ATOM 0 HB3 GLU A 79 4.625 -13.331 -4.697 1.00 0.00 H new ATOM 0 HG2 GLU A 79 3.308 -11.782 -6.236 1.00 0.00 H new ATOM 0 HG3 GLU A 79 4.783 -11.572 -7.158 1.00 0.00 H new ATOM 1310 N LEU A 80 3.346 -11.570 -2.751 1.00 0.00 N ATOM 1311 CA LEU A 80 2.020 -11.373 -2.184 1.00 0.00 C ATOM 1312 C LEU A 80 1.825 -9.948 -1.675 1.00 0.00 C ATOM 1313 O LEU A 80 0.804 -9.325 -1.964 1.00 0.00 O ATOM 1314 CB LEU A 80 1.763 -12.371 -1.052 1.00 0.00 C ATOM 1315 CG LEU A 80 1.656 -13.836 -1.485 1.00 0.00 C ATOM 1316 CD1 LEU A 80 1.439 -14.730 -0.275 1.00 0.00 C ATOM 1317 CD2 LEU A 80 0.527 -14.012 -2.489 1.00 0.00 C ATOM 0 H LEU A 80 3.919 -12.247 -2.248 1.00 0.00 H new ATOM 0 HA LEU A 80 1.300 -11.545 -2.984 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.567 -12.283 -0.322 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.840 -12.091 -0.545 1.00 0.00 H new ATOM 0 HG LEU A 80 2.591 -14.126 -1.965 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.365 -15.768 -0.598 1.00 0.00 H new ATOM 0 HD12 LEU A 80 2.279 -14.623 0.412 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.518 -14.441 0.231 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.465 -15.059 -2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.415 -13.707 -2.034 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.722 -13.396 -3.367 1.00 0.00 H new ATOM 1329 N ASN A 81 2.793 -9.422 -0.929 1.00 0.00 N ATOM 1330 CA ASN A 81 2.640 -8.083 -0.363 1.00 0.00 C ATOM 1331 C ASN A 81 2.869 -7.011 -1.426 1.00 0.00 C ATOM 1332 O ASN A 81 2.288 -5.928 -1.357 1.00 0.00 O ATOM 1333 CB ASN A 81 3.534 -7.862 0.880 1.00 0.00 C ATOM 1334 CG ASN A 81 5.039 -7.765 0.624 1.00 0.00 C ATOM 1335 OD1 ASN A 81 5.499 -7.285 -0.411 1.00 0.00 O ATOM 1336 ND2 ASN A 81 5.816 -8.211 1.598 1.00 0.00 N ATOM 0 H ASN A 81 3.672 -9.888 -0.705 1.00 0.00 H new ATOM 0 HA ASN A 81 1.610 -7.995 -0.017 1.00 0.00 H new ATOM 0 HB2 ASN A 81 3.211 -6.946 1.375 1.00 0.00 H new ATOM 0 HB3 ASN A 81 3.358 -8.680 1.578 1.00 0.00 H new ATOM 0 HD21 ASN A 81 6.830 -8.163 1.504 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.400 -8.603 2.443 1.00 0.00 H new ATOM 1343 N TYR A 82 3.683 -7.333 -2.425 1.00 0.00 N ATOM 1344 CA TYR A 82 3.959 -6.416 -3.516 1.00 0.00 C ATOM 1345 C TYR A 82 2.685 -6.163 -4.320 1.00 0.00 C ATOM 1346 O TYR A 82 2.345 -5.019 -4.628 1.00 0.00 O ATOM 1347 CB TYR A 82 5.056 -6.990 -4.422 1.00 0.00 C ATOM 1348 CG TYR A 82 6.056 -5.956 -4.888 1.00 0.00 C ATOM 1349 CD1 TYR A 82 5.644 -4.823 -5.574 1.00 0.00 C ATOM 1350 CD2 TYR A 82 7.413 -6.111 -4.634 1.00 0.00 C ATOM 1351 CE1 TYR A 82 6.553 -3.872 -5.988 1.00 0.00 C ATOM 1352 CE2 TYR A 82 8.328 -5.163 -5.049 1.00 0.00 C ATOM 1353 CZ TYR A 82 7.892 -4.046 -5.726 1.00 0.00 C ATOM 1354 OH TYR A 82 8.794 -3.093 -6.132 1.00 0.00 O ATOM 0 H TYR A 82 4.164 -8.229 -2.498 1.00 0.00 H new ATOM 0 HA TYR A 82 4.307 -5.469 -3.104 1.00 0.00 H new ATOM 0 HB2 TYR A 82 5.584 -7.778 -3.885 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.592 -7.453 -5.293 1.00 0.00 H new ATOM 0 HD1 TYR A 82 4.595 -4.683 -5.787 1.00 0.00 H new ATOM 0 HD2 TYR A 82 7.758 -6.986 -4.104 1.00 0.00 H new ATOM 0 HE1 TYR A 82 6.214 -2.993 -6.516 1.00 0.00 H new ATOM 0 HE2 TYR A 82 9.380 -5.297 -4.844 1.00 0.00 H new ATOM 0 HH TYR A 82 9.676 -3.504 -6.244 1.00 0.00 H new ATOM 1364 N LYS A 83 1.964 -7.235 -4.631 1.00 0.00 N ATOM 1365 CA LYS A 83 0.726 -7.114 -5.389 1.00 0.00 C ATOM 1366 C LYS A 83 -0.413 -6.655 -4.481 1.00 0.00 C ATOM 1367 O LYS A 83 -1.443 -6.183 -4.955 1.00 0.00 O ATOM 1368 CB LYS A 83 0.365 -8.440 -6.070 1.00 0.00 C ATOM 1369 CG LYS A 83 -0.090 -9.527 -5.108 1.00 0.00 C ATOM 1370 CD LYS A 83 -0.451 -10.810 -5.842 1.00 0.00 C ATOM 1371 CE LYS A 83 0.777 -11.476 -6.434 1.00 0.00 C ATOM 1372 NZ LYS A 83 0.429 -12.680 -7.235 1.00 0.00 N ATOM 0 H LYS A 83 2.213 -8.190 -4.372 1.00 0.00 H new ATOM 0 HA LYS A 83 0.878 -6.365 -6.166 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -0.426 -8.259 -6.798 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.232 -8.800 -6.624 1.00 0.00 H new ATOM 0 HG2 LYS A 83 0.702 -9.730 -4.387 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -0.953 -9.175 -4.543 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -0.943 -11.498 -5.154 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -1.164 -10.588 -6.636 1.00 0.00 H new ATOM 0 HE2 LYS A 83 1.307 -10.762 -7.065 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.458 -11.759 -5.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.212 -13.363 -7.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.433 -13.117 -6.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.264 -12.403 -8.224 1.00 0.00 H new ATOM 1386 N HIS A 84 -0.221 -6.797 -3.176 1.00 0.00 N ATOM 1387 CA HIS A 84 -1.207 -6.350 -2.196 1.00 0.00 C ATOM 1388 C HIS A 84 -1.174 -4.833 -2.081 1.00 0.00 C ATOM 1389 O HIS A 84 -2.182 -4.197 -1.791 1.00 0.00 O ATOM 1390 CB HIS A 84 -0.911 -6.984 -0.830 1.00 0.00 C ATOM 1391 CG HIS A 84 -1.943 -6.728 0.235 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -2.107 -5.509 0.857 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -2.832 -7.563 0.820 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -3.044 -5.613 1.781 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -3.501 -6.849 1.784 1.00 0.00 N ATOM 0 H HIS A 84 0.613 -7.220 -2.768 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.199 -6.660 -2.524 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -0.809 -8.061 -0.962 1.00 0.00 H new ATOM 0 HB3 HIS A 84 0.051 -6.614 -0.477 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -2.988 -8.603 0.574 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -3.381 -4.816 2.428 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -4.229 -7.214 2.399 1.00 0.00 H new ATOM 1404 N LEU A 85 0.000 -4.266 -2.303 1.00 0.00 N ATOM 1405 CA LEU A 85 0.198 -2.838 -2.129 1.00 0.00 C ATOM 1406 C LEU A 85 0.183 -2.091 -3.454 1.00 0.00 C ATOM 1407 O LEU A 85 -0.539 -1.115 -3.602 1.00 0.00 O ATOM 1408 CB LEU A 85 1.518 -2.591 -1.406 1.00 0.00 C ATOM 1409 CG LEU A 85 1.569 -3.133 0.019 1.00 0.00 C ATOM 1410 CD1 LEU A 85 2.990 -3.110 0.548 1.00 0.00 C ATOM 1411 CD2 LEU A 85 0.651 -2.324 0.918 1.00 0.00 C ATOM 0 H LEU A 85 0.831 -4.774 -2.605 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.631 -2.457 -1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.324 -3.044 -1.983 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.709 -1.518 -1.380 1.00 0.00 H new ATOM 0 HG LEU A 85 1.226 -4.168 0.011 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.006 -3.500 1.566 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.625 -3.728 -0.087 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.362 -2.086 0.547 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.695 -2.719 1.933 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.970 -1.282 0.920 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.372 -2.390 0.547 1.00 0.00 H new ATOM 1423 N LEU A 86 0.977 -2.555 -4.410 1.00 0.00 N ATOM 1424 CA LEU A 86 1.189 -1.815 -5.650 1.00 0.00 C ATOM 1425 C LEU A 86 0.580 -2.525 -6.854 1.00 0.00 C ATOM 1426 O LEU A 86 0.628 -2.006 -7.970 1.00 0.00 O ATOM 1427 CB LEU A 86 2.688 -1.632 -5.878 1.00 0.00 C ATOM 1428 CG LEU A 86 3.432 -0.909 -4.755 1.00 0.00 C ATOM 1429 CD1 LEU A 86 4.930 -1.084 -4.921 1.00 0.00 C ATOM 1430 CD2 LEU A 86 3.070 0.568 -4.739 1.00 0.00 C ATOM 0 H LEU A 86 1.484 -3.438 -4.352 1.00 0.00 H new ATOM 0 HA LEU A 86 0.694 -0.849 -5.549 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.141 -2.613 -6.019 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.834 -1.077 -6.805 1.00 0.00 H new ATOM 0 HG LEU A 86 3.132 -1.347 -3.803 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.449 -0.565 -4.115 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.178 -2.145 -4.888 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.241 -0.669 -5.880 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.609 1.066 -3.933 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.344 1.020 -5.692 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.997 0.678 -4.580 1.00 0.00 H new ATOM 1442 N GLY A 87 0.023 -3.711 -6.630 1.00 0.00 N ATOM 1443 CA GLY A 87 -0.499 -4.506 -7.732 1.00 0.00 C ATOM 1444 C GLY A 87 0.585 -4.867 -8.730 1.00 0.00 C ATOM 1445 O GLY A 87 0.326 -5.007 -9.928 1.00 0.00 O ATOM 0 H GLY A 87 -0.077 -4.137 -5.709 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -0.951 -5.418 -7.340 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -1.289 -3.951 -8.238 1.00 0.00 H new ATOM 1449 N ARG A 88 1.800 -5.020 -8.223 1.00 0.00 N ATOM 1450 CA ARG A 88 2.969 -5.262 -9.049 1.00 0.00 C ATOM 1451 C ARG A 88 3.754 -6.456 -8.516 1.00 0.00 C ATOM 1452 O ARG A 88 3.754 -6.715 -7.316 1.00 0.00 O ATOM 1453 CB ARG A 88 3.839 -3.995 -9.070 1.00 0.00 C ATOM 1454 CG ARG A 88 5.296 -4.226 -9.447 1.00 0.00 C ATOM 1455 CD ARG A 88 6.080 -2.922 -9.456 1.00 0.00 C ATOM 1456 NE ARG A 88 7.514 -3.138 -9.250 1.00 0.00 N ATOM 1457 CZ ARG A 88 8.459 -2.284 -9.640 1.00 0.00 C ATOM 1458 NH1 ARG A 88 8.136 -1.207 -10.346 1.00 0.00 N ATOM 1459 NH2 ARG A 88 9.730 -2.511 -9.332 1.00 0.00 N ATOM 0 H ARG A 88 2.001 -4.979 -7.224 1.00 0.00 H new ATOM 0 HA ARG A 88 2.659 -5.496 -10.067 1.00 0.00 H new ATOM 0 HB2 ARG A 88 3.405 -3.285 -9.774 1.00 0.00 H new ATOM 0 HB3 ARG A 88 3.803 -3.530 -8.085 1.00 0.00 H new ATOM 0 HG2 ARG A 88 5.750 -4.921 -8.741 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.349 -4.691 -10.431 1.00 0.00 H new ATOM 0 HD2 ARG A 88 5.924 -2.413 -10.407 1.00 0.00 H new ATOM 0 HD3 ARG A 88 5.697 -2.264 -8.675 1.00 0.00 H new ATOM 0 HE ARG A 88 7.807 -3.994 -8.779 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.162 -1.031 -10.591 1.00 0.00 H new ATOM 0 HH12 ARG A 88 8.862 -0.555 -10.643 1.00 0.00 H new ATOM 0 HH21 ARG A 88 9.985 -3.341 -8.796 1.00 0.00 H new ATOM 0 HH22 ARG A 88 10.452 -1.856 -9.632 1.00 0.00 H new ATOM 1473 N ALA A 89 4.395 -7.190 -9.411 1.00 0.00 N ATOM 1474 CA ALA A 89 5.226 -8.317 -9.021 1.00 0.00 C ATOM 1475 C ALA A 89 6.699 -7.920 -9.078 1.00 0.00 C ATOM 1476 O ALA A 89 7.061 -7.003 -9.819 1.00 0.00 O ATOM 1477 CB ALA A 89 4.952 -9.512 -9.926 1.00 0.00 C ATOM 0 H ALA A 89 4.355 -7.024 -10.417 1.00 0.00 H new ATOM 0 HA ALA A 89 4.983 -8.603 -7.998 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.581 -10.349 -9.623 1.00 0.00 H new ATOM 0 HB2 ALA A 89 3.903 -9.798 -9.844 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.176 -9.245 -10.959 1.00 0.00 H new ATOM 1483 N PRO A 90 7.560 -8.575 -8.280 1.00 0.00 N ATOM 1484 CA PRO A 90 9.004 -8.317 -8.294 1.00 0.00 C ATOM 1485 C PRO A 90 9.591 -8.454 -9.698 1.00 0.00 C ATOM 1486 O PRO A 90 9.518 -9.523 -10.313 1.00 0.00 O ATOM 1487 CB PRO A 90 9.585 -9.385 -7.354 1.00 0.00 C ATOM 1488 CG PRO A 90 8.483 -10.369 -7.131 1.00 0.00 C ATOM 1489 CD PRO A 90 7.201 -9.610 -7.302 1.00 0.00 C ATOM 0 HA PRO A 90 9.239 -7.300 -7.979 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.456 -9.866 -7.799 1.00 0.00 H new ATOM 0 HB3 PRO A 90 9.911 -8.943 -6.413 1.00 0.00 H new ATOM 0 HG2 PRO A 90 8.546 -11.192 -7.843 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.547 -10.805 -6.134 1.00 0.00 H new ATOM 0 HD2 PRO A 90 6.398 -10.250 -7.668 1.00 0.00 H new ATOM 0 HD3 PRO A 90 6.860 -9.176 -6.362 1.00 0.00 H new ATOM 1497 N TYR A 91 10.170 -7.370 -10.198 1.00 0.00 N ATOM 1498 CA TYR A 91 10.694 -7.333 -11.555 1.00 0.00 C ATOM 1499 C TYR A 91 12.000 -8.111 -11.641 1.00 0.00 C ATOM 1500 O TYR A 91 12.239 -8.851 -12.597 1.00 0.00 O ATOM 1501 CB TYR A 91 10.905 -5.881 -12.002 1.00 0.00 C ATOM 1502 CG TYR A 91 11.547 -5.746 -13.365 1.00 0.00 C ATOM 1503 CD1 TYR A 91 10.782 -5.780 -14.525 1.00 0.00 C ATOM 1504 CD2 TYR A 91 12.921 -5.589 -13.491 1.00 0.00 C ATOM 1505 CE1 TYR A 91 11.370 -5.664 -15.768 1.00 0.00 C ATOM 1506 CE2 TYR A 91 13.514 -5.474 -14.730 1.00 0.00 C ATOM 1507 CZ TYR A 91 12.736 -5.514 -15.864 1.00 0.00 C ATOM 1508 OH TYR A 91 13.332 -5.406 -17.099 1.00 0.00 O ATOM 0 H TYR A 91 10.289 -6.500 -9.679 1.00 0.00 H new ATOM 0 HA TYR A 91 9.970 -7.801 -12.222 1.00 0.00 H new ATOM 0 HB2 TYR A 91 9.942 -5.371 -12.013 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.527 -5.371 -11.266 1.00 0.00 H new ATOM 0 HD1 TYR A 91 9.711 -5.899 -14.452 1.00 0.00 H new ATOM 0 HD2 TYR A 91 13.535 -5.556 -12.603 1.00 0.00 H new ATOM 0 HE1 TYR A 91 10.763 -5.691 -16.661 1.00 0.00 H new ATOM 0 HE2 TYR A 91 14.584 -5.353 -14.810 1.00 0.00 H new ATOM 0 HH TYR A 91 14.300 -5.305 -16.987 1.00 0.00 H new ATOM 1518 N ASP A 92 12.840 -7.942 -10.635 1.00 0.00 N ATOM 1519 CA ASP A 92 14.111 -8.646 -10.576 1.00 0.00 C ATOM 1520 C ASP A 92 14.251 -9.373 -9.248 1.00 0.00 C ATOM 1521 O ASP A 92 13.348 -9.328 -8.408 1.00 0.00 O ATOM 1522 CB ASP A 92 15.287 -7.685 -10.790 1.00 0.00 C ATOM 1523 CG ASP A 92 15.275 -6.514 -9.833 1.00 0.00 C ATOM 1524 OD1 ASP A 92 15.521 -6.721 -8.628 1.00 0.00 O ATOM 1525 OD2 ASP A 92 15.038 -5.376 -10.288 1.00 0.00 O ATOM 0 H ASP A 92 12.665 -7.321 -9.845 1.00 0.00 H new ATOM 0 HA ASP A 92 14.129 -9.381 -11.381 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.222 -8.233 -10.674 1.00 0.00 H new ATOM 0 HB3 ASP A 92 15.262 -7.311 -11.813 1.00 0.00 H new ATOM 1530 N GLU A 93 15.370 -10.053 -9.065 1.00 0.00 N ATOM 1531 CA GLU A 93 15.585 -10.848 -7.870 1.00 0.00 C ATOM 1532 C GLU A 93 16.184 -9.993 -6.759 1.00 0.00 C ATOM 1533 O GLU A 93 16.109 -10.347 -5.584 1.00 0.00 O ATOM 1534 CB GLU A 93 16.490 -12.035 -8.191 1.00 0.00 C ATOM 1535 CG GLU A 93 16.639 -13.027 -7.053 1.00 0.00 C ATOM 1536 CD GLU A 93 17.440 -14.240 -7.459 1.00 0.00 C ATOM 1537 OE1 GLU A 93 18.686 -14.176 -7.416 1.00 0.00 O ATOM 1538 OE2 GLU A 93 16.828 -15.262 -7.834 1.00 0.00 O ATOM 0 H GLU A 93 16.144 -10.070 -9.730 1.00 0.00 H new ATOM 0 HA GLU A 93 14.625 -11.228 -7.520 1.00 0.00 H new ATOM 0 HB2 GLU A 93 16.093 -12.555 -9.063 1.00 0.00 H new ATOM 0 HB3 GLU A 93 17.477 -11.662 -8.465 1.00 0.00 H new ATOM 0 HG2 GLU A 93 17.124 -12.539 -6.208 1.00 0.00 H new ATOM 0 HG3 GLU A 93 15.652 -13.342 -6.715 1.00 0.00 H new ATOM 1545 N SER A 94 16.750 -8.855 -7.132 1.00 0.00 N ATOM 1546 CA SER A 94 17.347 -7.949 -6.165 1.00 0.00 C ATOM 1547 C SER A 94 16.270 -7.367 -5.252 1.00 0.00 C ATOM 1548 O SER A 94 16.495 -7.182 -4.053 1.00 0.00 O ATOM 1549 CB SER A 94 18.107 -6.835 -6.885 1.00 0.00 C ATOM 1550 OG SER A 94 19.081 -7.378 -7.762 1.00 0.00 O ATOM 0 H SER A 94 16.808 -8.537 -8.100 1.00 0.00 H new ATOM 0 HA SER A 94 18.054 -8.505 -5.550 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.408 -6.216 -7.448 1.00 0.00 H new ATOM 0 HB3 SER A 94 18.590 -6.186 -6.154 1.00 0.00 H new ATOM 0 HG SER A 94 19.556 -6.650 -8.215 1.00 0.00 H new ATOM 1556 N GLU A 95 15.095 -7.097 -5.822 1.00 0.00 N ATOM 1557 CA GLU A 95 13.944 -6.668 -5.032 1.00 0.00 C ATOM 1558 C GLU A 95 13.587 -7.737 -4.000 1.00 0.00 C ATOM 1559 O GLU A 95 13.233 -7.431 -2.859 1.00 0.00 O ATOM 1560 CB GLU A 95 12.734 -6.384 -5.930 1.00 0.00 C ATOM 1561 CG GLU A 95 12.949 -5.241 -6.908 1.00 0.00 C ATOM 1562 CD GLU A 95 11.697 -4.899 -7.695 1.00 0.00 C ATOM 1563 OE1 GLU A 95 10.907 -4.055 -7.228 1.00 0.00 O ATOM 1564 OE2 GLU A 95 11.502 -5.463 -8.792 1.00 0.00 O ATOM 0 H GLU A 95 14.917 -7.168 -6.824 1.00 0.00 H new ATOM 0 HA GLU A 95 14.212 -5.746 -4.517 1.00 0.00 H new ATOM 0 HB2 GLU A 95 12.489 -7.287 -6.489 1.00 0.00 H new ATOM 0 HB3 GLU A 95 11.873 -6.155 -5.302 1.00 0.00 H new ATOM 0 HG2 GLU A 95 13.282 -4.359 -6.361 1.00 0.00 H new ATOM 0 HG3 GLU A 95 13.747 -5.507 -7.601 1.00 0.00 H new ATOM 1571 N VAL A 96 13.703 -8.995 -4.407 1.00 0.00 N ATOM 1572 CA VAL A 96 13.453 -10.121 -3.519 1.00 0.00 C ATOM 1573 C VAL A 96 14.502 -10.162 -2.412 1.00 0.00 C ATOM 1574 O VAL A 96 14.168 -10.223 -1.229 1.00 0.00 O ATOM 1575 CB VAL A 96 13.472 -11.458 -4.290 1.00 0.00 C ATOM 1576 CG1 VAL A 96 13.247 -12.633 -3.350 1.00 0.00 C ATOM 1577 CG2 VAL A 96 12.432 -11.452 -5.400 1.00 0.00 C ATOM 0 H VAL A 96 13.971 -9.261 -5.355 1.00 0.00 H new ATOM 0 HA VAL A 96 12.463 -9.985 -3.083 1.00 0.00 H new ATOM 0 HB VAL A 96 14.457 -11.572 -4.742 1.00 0.00 H new ATOM 0 HG11 VAL A 96 13.265 -13.563 -3.919 1.00 0.00 H new ATOM 0 HG12 VAL A 96 14.035 -12.653 -2.597 1.00 0.00 H new ATOM 0 HG13 VAL A 96 12.279 -12.527 -2.860 1.00 0.00 H new ATOM 0 HG21 VAL A 96 12.462 -12.403 -5.931 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.441 -11.307 -4.969 1.00 0.00 H new ATOM 0 HG23 VAL A 96 12.647 -10.641 -6.096 1.00 0.00 H new ATOM 1587 N ILE A 97 15.766 -10.105 -2.815 1.00 0.00 N ATOM 1588 CA ILE A 97 16.890 -10.119 -1.884 1.00 0.00 C ATOM 1589 C ILE A 97 16.756 -9.009 -0.843 1.00 0.00 C ATOM 1590 O ILE A 97 16.964 -9.233 0.351 1.00 0.00 O ATOM 1591 CB ILE A 97 18.225 -9.957 -2.638 1.00 0.00 C ATOM 1592 CG1 ILE A 97 18.421 -11.126 -3.604 1.00 0.00 C ATOM 1593 CG2 ILE A 97 19.391 -9.865 -1.662 1.00 0.00 C ATOM 1594 CD1 ILE A 97 19.648 -11.000 -4.476 1.00 0.00 C ATOM 0 H ILE A 97 16.041 -10.048 -3.795 1.00 0.00 H new ATOM 0 HA ILE A 97 16.881 -11.082 -1.374 1.00 0.00 H new ATOM 0 HB ILE A 97 18.193 -9.029 -3.209 1.00 0.00 H new ATOM 0 HG12 ILE A 97 18.488 -12.051 -3.031 1.00 0.00 H new ATOM 0 HG13 ILE A 97 17.541 -11.209 -4.242 1.00 0.00 H new ATOM 0 HG21 ILE A 97 20.322 -9.751 -2.217 1.00 0.00 H new ATOM 0 HG22 ILE A 97 19.251 -9.004 -1.008 1.00 0.00 H new ATOM 0 HG23 ILE A 97 19.435 -10.774 -1.062 1.00 0.00 H new ATOM 0 HD11 ILE A 97 19.718 -11.867 -5.133 1.00 0.00 H new ATOM 0 HD12 ILE A 97 19.576 -10.094 -5.077 1.00 0.00 H new ATOM 0 HD13 ILE A 97 20.537 -10.949 -3.848 1.00 0.00 H new ATOM 1606 N PHE A 98 16.395 -7.817 -1.308 1.00 0.00 N ATOM 1607 CA PHE A 98 16.206 -6.669 -0.428 1.00 0.00 C ATOM 1608 C PHE A 98 15.144 -6.960 0.629 1.00 0.00 C ATOM 1609 O PHE A 98 15.316 -6.623 1.798 1.00 0.00 O ATOM 1610 CB PHE A 98 15.810 -5.436 -1.244 1.00 0.00 C ATOM 1611 CG PHE A 98 15.614 -4.199 -0.414 1.00 0.00 C ATOM 1612 CD1 PHE A 98 16.706 -3.483 0.053 1.00 0.00 C ATOM 1613 CD2 PHE A 98 14.340 -3.748 -0.108 1.00 0.00 C ATOM 1614 CE1 PHE A 98 16.529 -2.344 0.814 1.00 0.00 C ATOM 1615 CE2 PHE A 98 14.158 -2.609 0.653 1.00 0.00 C ATOM 1616 CZ PHE A 98 15.252 -1.906 1.114 1.00 0.00 C ATOM 0 H PHE A 98 16.227 -7.621 -2.295 1.00 0.00 H new ATOM 0 HA PHE A 98 17.150 -6.472 0.080 1.00 0.00 H new ATOM 0 HB2 PHE A 98 16.580 -5.243 -1.991 1.00 0.00 H new ATOM 0 HB3 PHE A 98 14.888 -5.650 -1.784 1.00 0.00 H new ATOM 0 HD1 PHE A 98 17.705 -3.820 -0.181 1.00 0.00 H new ATOM 0 HD2 PHE A 98 13.480 -4.293 -0.468 1.00 0.00 H new ATOM 0 HE1 PHE A 98 17.387 -1.796 1.174 1.00 0.00 H new ATOM 0 HE2 PHE A 98 13.160 -2.269 0.887 1.00 0.00 H new ATOM 0 HZ PHE A 98 15.111 -1.015 1.708 1.00 0.00 H new ATOM 1626 N HIS A 99 14.058 -7.600 0.213 1.00 0.00 N ATOM 1627 CA HIS A 99 12.962 -7.904 1.124 1.00 0.00 C ATOM 1628 C HIS A 99 13.321 -9.045 2.066 1.00 0.00 C ATOM 1629 O HIS A 99 12.906 -9.056 3.223 1.00 0.00 O ATOM 1630 CB HIS A 99 11.683 -8.224 0.349 1.00 0.00 C ATOM 1631 CG HIS A 99 10.966 -7.000 -0.118 1.00 0.00 C ATOM 1632 ND1 HIS A 99 10.297 -6.171 0.739 1.00 0.00 N ATOM 1633 CD2 HIS A 99 10.831 -6.456 -1.348 1.00 0.00 C ATOM 1634 CE1 HIS A 99 9.778 -5.167 0.070 1.00 0.00 C ATOM 1635 NE2 HIS A 99 10.085 -5.311 -1.208 1.00 0.00 N ATOM 0 H HIS A 99 13.913 -7.917 -0.745 1.00 0.00 H new ATOM 0 HA HIS A 99 12.783 -7.017 1.731 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.931 -8.844 -0.512 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.017 -8.810 0.983 1.00 0.00 H new ATOM 0 HD1 HIS A 99 10.214 -6.311 1.746 1.00 0.00 H new ATOM 0 HD2 HIS A 99 11.235 -6.849 -2.270 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.198 -4.360 0.493 1.00 0.00 H new ATOM 1644 N LEU A 100 14.106 -9.996 1.578 1.00 0.00 N ATOM 1645 CA LEU A 100 14.585 -11.085 2.419 1.00 0.00 C ATOM 1646 C LEU A 100 15.396 -10.532 3.586 1.00 0.00 C ATOM 1647 O LEU A 100 15.157 -10.874 4.744 1.00 0.00 O ATOM 1648 CB LEU A 100 15.435 -12.064 1.605 1.00 0.00 C ATOM 1649 CG LEU A 100 14.682 -12.822 0.507 1.00 0.00 C ATOM 1650 CD1 LEU A 100 15.632 -13.692 -0.297 1.00 0.00 C ATOM 1651 CD2 LEU A 100 13.572 -13.668 1.113 1.00 0.00 C ATOM 0 H LEU A 100 14.423 -10.036 0.609 1.00 0.00 H new ATOM 0 HA LEU A 100 13.721 -11.621 2.811 1.00 0.00 H new ATOM 0 HB2 LEU A 100 16.257 -11.513 1.147 1.00 0.00 H new ATOM 0 HB3 LEU A 100 15.879 -12.790 2.287 1.00 0.00 H new ATOM 0 HG LEU A 100 14.235 -12.091 -0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 100 15.075 -14.220 -1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 100 16.394 -13.066 -0.762 1.00 0.00 H new ATOM 0 HD13 LEU A 100 16.110 -14.415 0.364 1.00 0.00 H new ATOM 0 HD21 LEU A 100 13.046 -14.200 0.320 1.00 0.00 H new ATOM 0 HD22 LEU A 100 14.002 -14.387 1.810 1.00 0.00 H new ATOM 0 HD23 LEU A 100 12.871 -13.023 1.643 1.00 0.00 H new ATOM 1663 N ASP A 101 16.341 -9.657 3.268 1.00 0.00 N ATOM 1664 CA ASP A 101 17.180 -9.027 4.283 1.00 0.00 C ATOM 1665 C ASP A 101 16.351 -8.102 5.167 1.00 0.00 C ATOM 1666 O ASP A 101 16.563 -8.020 6.381 1.00 0.00 O ATOM 1667 CB ASP A 101 18.311 -8.239 3.620 1.00 0.00 C ATOM 1668 CG ASP A 101 19.207 -7.549 4.629 1.00 0.00 C ATOM 1669 OD1 ASP A 101 20.038 -8.236 5.258 1.00 0.00 O ATOM 1670 OD2 ASP A 101 19.093 -6.315 4.792 1.00 0.00 O ATOM 0 H ASP A 101 16.547 -9.366 2.313 1.00 0.00 H new ATOM 0 HA ASP A 101 17.610 -9.811 4.906 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.910 -8.914 3.009 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.885 -7.494 2.948 1.00 0.00 H new ATOM 1675 N LEU A 102 15.395 -7.421 4.547 1.00 0.00 N ATOM 1676 CA LEU A 102 14.527 -6.488 5.251 1.00 0.00 C ATOM 1677 C LEU A 102 13.708 -7.213 6.316 1.00 0.00 C ATOM 1678 O LEU A 102 13.601 -6.746 7.451 1.00 0.00 O ATOM 1679 CB LEU A 102 13.604 -5.780 4.252 1.00 0.00 C ATOM 1680 CG LEU A 102 12.846 -4.566 4.792 1.00 0.00 C ATOM 1681 CD1 LEU A 102 13.816 -3.529 5.337 1.00 0.00 C ATOM 1682 CD2 LEU A 102 11.986 -3.958 3.697 1.00 0.00 C ATOM 0 H LEU A 102 15.201 -7.500 3.549 1.00 0.00 H new ATOM 0 HA LEU A 102 15.145 -5.742 5.750 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.201 -5.461 3.397 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.877 -6.503 3.882 1.00 0.00 H new ATOM 0 HG LEU A 102 12.200 -4.894 5.606 1.00 0.00 H new ATOM 0 HD11 LEU A 102 13.258 -2.673 5.717 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.402 -3.968 6.145 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.485 -3.202 4.541 1.00 0.00 H new ATOM 0 HD21 LEU A 102 11.451 -3.095 4.092 1.00 0.00 H new ATOM 0 HD22 LEU A 102 12.621 -3.644 2.868 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.269 -4.699 3.344 1.00 0.00 H new ATOM 1694 N TYR A 103 13.153 -8.366 5.953 1.00 0.00 N ATOM 1695 CA TYR A 103 12.380 -9.174 6.888 1.00 0.00 C ATOM 1696 C TYR A 103 13.247 -9.636 8.060 1.00 0.00 C ATOM 1697 O TYR A 103 12.826 -9.566 9.215 1.00 0.00 O ATOM 1698 CB TYR A 103 11.768 -10.393 6.187 1.00 0.00 C ATOM 1699 CG TYR A 103 11.069 -11.344 7.136 1.00 0.00 C ATOM 1700 CD1 TYR A 103 9.798 -11.061 7.623 1.00 0.00 C ATOM 1701 CD2 TYR A 103 11.691 -12.512 7.564 1.00 0.00 C ATOM 1702 CE1 TYR A 103 9.165 -11.917 8.504 1.00 0.00 C ATOM 1703 CE2 TYR A 103 11.064 -13.372 8.446 1.00 0.00 C ATOM 1704 CZ TYR A 103 9.804 -13.069 8.915 1.00 0.00 C ATOM 1705 OH TYR A 103 9.178 -13.920 9.801 1.00 0.00 O ATOM 0 H TYR A 103 13.225 -8.761 5.016 1.00 0.00 H new ATOM 0 HA TYR A 103 11.574 -8.548 7.271 1.00 0.00 H new ATOM 0 HB2 TYR A 103 11.055 -10.051 5.436 1.00 0.00 H new ATOM 0 HB3 TYR A 103 12.554 -10.932 5.658 1.00 0.00 H new ATOM 0 HD1 TYR A 103 9.297 -10.158 7.308 1.00 0.00 H new ATOM 0 HD2 TYR A 103 12.680 -12.751 7.201 1.00 0.00 H new ATOM 0 HE1 TYR A 103 8.175 -11.686 8.869 1.00 0.00 H new ATOM 0 HE2 TYR A 103 11.559 -14.277 8.766 1.00 0.00 H new ATOM 0 HH TYR A 103 9.762 -14.685 9.988 1.00 0.00 H new ATOM 1715 N GLU A 104 14.454 -10.102 7.756 1.00 0.00 N ATOM 1716 CA GLU A 104 15.358 -10.622 8.778 1.00 0.00 C ATOM 1717 C GLU A 104 15.672 -9.566 9.831 1.00 0.00 C ATOM 1718 O GLU A 104 15.588 -9.825 11.032 1.00 0.00 O ATOM 1719 CB GLU A 104 16.669 -11.107 8.154 1.00 0.00 C ATOM 1720 CG GLU A 104 16.499 -12.241 7.157 1.00 0.00 C ATOM 1721 CD GLU A 104 17.824 -12.734 6.617 1.00 0.00 C ATOM 1722 OE1 GLU A 104 18.310 -12.174 5.612 1.00 0.00 O ATOM 1723 OE2 GLU A 104 18.397 -13.677 7.202 1.00 0.00 O ATOM 0 H GLU A 104 14.830 -10.131 6.808 1.00 0.00 H new ATOM 0 HA GLU A 104 14.850 -11.460 9.255 1.00 0.00 H new ATOM 0 HB2 GLU A 104 17.154 -10.268 7.655 1.00 0.00 H new ATOM 0 HB3 GLU A 104 17.338 -11.434 8.950 1.00 0.00 H new ATOM 0 HG2 GLU A 104 15.974 -13.068 7.636 1.00 0.00 H new ATOM 0 HG3 GLU A 104 15.875 -11.904 6.330 1.00 0.00 H new ATOM 1730 N ASN A 105 16.018 -8.373 9.374 1.00 0.00 N ATOM 1731 CA ASN A 105 16.497 -7.328 10.269 1.00 0.00 C ATOM 1732 C ASN A 105 15.361 -6.463 10.804 1.00 0.00 C ATOM 1733 O ASN A 105 15.235 -6.273 12.014 1.00 0.00 O ATOM 1734 CB ASN A 105 17.519 -6.447 9.546 1.00 0.00 C ATOM 1735 CG ASN A 105 18.761 -7.212 9.126 1.00 0.00 C ATOM 1736 OD1 ASN A 105 19.180 -8.161 9.789 1.00 0.00 O ATOM 1737 ND2 ASN A 105 19.358 -6.804 8.020 1.00 0.00 N ATOM 0 H ASN A 105 15.977 -8.103 8.391 1.00 0.00 H new ATOM 0 HA ASN A 105 16.967 -7.820 11.120 1.00 0.00 H new ATOM 0 HB2 ASN A 105 17.053 -6.007 8.664 1.00 0.00 H new ATOM 0 HB3 ASN A 105 17.808 -5.623 10.199 1.00 0.00 H new ATOM 0 HD21 ASN A 105 20.197 -7.280 7.688 1.00 0.00 H new ATOM 0 HD22 ASN A 105 18.980 -6.013 7.498 1.00 0.00 H new ATOM 1744 N GLU A 106 14.531 -5.950 9.910 1.00 0.00 N ATOM 1745 CA GLU A 106 13.516 -4.972 10.287 1.00 0.00 C ATOM 1746 C GLU A 106 12.186 -5.635 10.632 1.00 0.00 C ATOM 1747 O GLU A 106 11.469 -5.181 11.527 1.00 0.00 O ATOM 1748 CB GLU A 106 13.315 -3.972 9.153 1.00 0.00 C ATOM 1749 CG GLU A 106 14.576 -3.204 8.790 1.00 0.00 C ATOM 1750 CD GLU A 106 15.086 -2.348 9.926 1.00 0.00 C ATOM 1751 OE1 GLU A 106 14.416 -1.354 10.273 1.00 0.00 O ATOM 1752 OE2 GLU A 106 16.168 -2.651 10.470 1.00 0.00 O ATOM 0 H GLU A 106 14.538 -6.192 8.919 1.00 0.00 H new ATOM 0 HA GLU A 106 13.870 -4.455 11.179 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.956 -4.502 8.271 1.00 0.00 H new ATOM 0 HB3 GLU A 106 12.537 -3.264 9.438 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.353 -3.909 8.495 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.375 -2.571 7.926 1.00 0.00 H new ATOM 1759 N GLY A 107 11.857 -6.703 9.919 1.00 0.00 N ATOM 1760 CA GLY A 107 10.606 -7.399 10.152 1.00 0.00 C ATOM 1761 C GLY A 107 9.662 -7.282 8.971 1.00 0.00 C ATOM 1762 O GLY A 107 9.945 -6.562 8.017 1.00 0.00 O ATOM 0 H GLY A 107 12.436 -7.102 9.180 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.808 -8.451 10.351 1.00 0.00 H new ATOM 0 HA3 GLY A 107 10.125 -6.993 11.042 1.00 0.00 H new ATOM 1766 N PHE A 108 8.533 -7.976 9.039 1.00 0.00 N ATOM 1767 CA PHE A 108 7.567 -7.979 7.947 1.00 0.00 C ATOM 1768 C PHE A 108 6.751 -6.689 7.971 1.00 0.00 C ATOM 1769 O PHE A 108 6.306 -6.197 6.932 1.00 0.00 O ATOM 1770 CB PHE A 108 6.644 -9.197 8.056 1.00 0.00 C ATOM 1771 CG PHE A 108 5.908 -9.517 6.784 1.00 0.00 C ATOM 1772 CD1 PHE A 108 6.481 -10.350 5.839 1.00 0.00 C ATOM 1773 CD2 PHE A 108 4.653 -8.986 6.531 1.00 0.00 C ATOM 1774 CE1 PHE A 108 5.818 -10.655 4.668 1.00 0.00 C ATOM 1775 CE2 PHE A 108 3.985 -9.287 5.360 1.00 0.00 C ATOM 1776 CZ PHE A 108 4.570 -10.120 4.426 1.00 0.00 C ATOM 0 H PHE A 108 8.263 -8.546 9.841 1.00 0.00 H new ATOM 0 HA PHE A 108 8.104 -8.038 7.000 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.235 -10.064 8.350 1.00 0.00 H new ATOM 0 HB3 PHE A 108 5.918 -9.021 8.850 1.00 0.00 H new ATOM 0 HD1 PHE A 108 7.461 -10.767 6.021 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.193 -8.331 7.256 1.00 0.00 H new ATOM 0 HE1 PHE A 108 6.275 -11.311 3.942 1.00 0.00 H new ATOM 0 HE2 PHE A 108 3.006 -8.871 5.175 1.00 0.00 H new ATOM 0 HZ PHE A 108 4.051 -10.352 3.508 1.00 0.00 H new ATOM 1786 N ASP A 109 6.571 -6.143 9.166 1.00 0.00 N ATOM 1787 CA ASP A 109 5.856 -4.883 9.333 1.00 0.00 C ATOM 1788 C ASP A 109 6.602 -3.756 8.625 1.00 0.00 C ATOM 1789 O ASP A 109 5.987 -2.884 8.014 1.00 0.00 O ATOM 1790 CB ASP A 109 5.678 -4.551 10.820 1.00 0.00 C ATOM 1791 CG ASP A 109 6.993 -4.261 11.517 1.00 0.00 C ATOM 1792 OD1 ASP A 109 7.745 -5.216 11.793 1.00 0.00 O ATOM 1793 OD2 ASP A 109 7.280 -3.076 11.787 1.00 0.00 O ATOM 0 H ASP A 109 6.911 -6.553 10.036 1.00 0.00 H new ATOM 0 HA ASP A 109 4.868 -4.987 8.885 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.021 -3.687 10.919 1.00 0.00 H new ATOM 0 HB3 ASP A 109 5.184 -5.386 11.318 1.00 0.00 H new ATOM 1798 N ALA A 110 7.929 -3.796 8.695 1.00 0.00 N ATOM 1799 CA ALA A 110 8.762 -2.806 8.031 1.00 0.00 C ATOM 1800 C ALA A 110 8.956 -3.175 6.569 1.00 0.00 C ATOM 1801 O ALA A 110 9.201 -2.313 5.724 1.00 0.00 O ATOM 1802 CB ALA A 110 10.105 -2.684 8.728 1.00 0.00 C ATOM 0 H ALA A 110 8.450 -4.508 9.208 1.00 0.00 H new ATOM 0 HA ALA A 110 8.259 -1.841 8.084 1.00 0.00 H new ATOM 0 HB1 ALA A 110 10.714 -1.939 8.217 1.00 0.00 H new ATOM 0 HB2 ALA A 110 9.951 -2.379 9.763 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.615 -3.647 8.706 1.00 0.00 H new ATOM 1808 N ASP A 111 8.839 -4.468 6.281 1.00 0.00 N ATOM 1809 CA ASP A 111 8.925 -4.963 4.914 1.00 0.00 C ATOM 1810 C ASP A 111 7.823 -4.337 4.071 1.00 0.00 C ATOM 1811 O ASP A 111 8.069 -3.823 2.982 1.00 0.00 O ATOM 1812 CB ASP A 111 8.818 -6.489 4.886 1.00 0.00 C ATOM 1813 CG ASP A 111 9.132 -7.058 3.520 1.00 0.00 C ATOM 1814 OD1 ASP A 111 10.319 -7.062 3.141 1.00 0.00 O ATOM 1815 OD2 ASP A 111 8.200 -7.499 2.819 1.00 0.00 O ATOM 0 H ASP A 111 8.684 -5.194 6.981 1.00 0.00 H new ATOM 0 HA ASP A 111 9.893 -4.684 4.498 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.502 -6.913 5.621 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.811 -6.787 5.179 1.00 0.00 H new ATOM 1820 N ILE A 112 6.611 -4.361 4.608 1.00 0.00 N ATOM 1821 CA ILE A 112 5.471 -3.701 3.985 1.00 0.00 C ATOM 1822 C ILE A 112 5.606 -2.180 4.084 1.00 0.00 C ATOM 1823 O ILE A 112 5.231 -1.442 3.169 1.00 0.00 O ATOM 1824 CB ILE A 112 4.147 -4.149 4.652 1.00 0.00 C ATOM 1825 CG1 ILE A 112 3.815 -5.594 4.261 1.00 0.00 C ATOM 1826 CG2 ILE A 112 2.997 -3.216 4.293 1.00 0.00 C ATOM 1827 CD1 ILE A 112 2.529 -6.113 4.875 1.00 0.00 C ATOM 0 H ILE A 112 6.390 -4.836 5.483 1.00 0.00 H new ATOM 0 HA ILE A 112 5.453 -3.988 2.934 1.00 0.00 H new ATOM 0 HB ILE A 112 4.283 -4.101 5.732 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.741 -5.659 3.175 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.638 -6.241 4.564 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.084 -3.561 4.778 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.229 -2.206 4.631 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.855 -3.213 3.212 1.00 0.00 H new ATOM 0 HD11 ILE A 112 2.361 -7.141 4.553 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.606 -6.081 5.962 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.695 -5.490 4.552 1.00 0.00 H new ATOM 1839 N ASP A 113 6.170 -1.725 5.192 1.00 0.00 N ATOM 1840 CA ASP A 113 6.262 -0.298 5.480 1.00 0.00 C ATOM 1841 C ASP A 113 7.179 0.416 4.491 1.00 0.00 C ATOM 1842 O ASP A 113 6.958 1.579 4.169 1.00 0.00 O ATOM 1843 CB ASP A 113 6.767 -0.079 6.905 1.00 0.00 C ATOM 1844 CG ASP A 113 6.430 1.297 7.432 1.00 0.00 C ATOM 1845 OD1 ASP A 113 5.253 1.514 7.779 1.00 0.00 O ATOM 1846 OD2 ASP A 113 7.334 2.155 7.514 1.00 0.00 O ATOM 0 H ASP A 113 6.574 -2.325 5.911 1.00 0.00 H new ATOM 0 HA ASP A 113 5.262 0.125 5.379 1.00 0.00 H new ATOM 0 HB2 ASP A 113 6.332 -0.833 7.561 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.848 -0.220 6.930 1.00 0.00 H new ATOM 1851 N SER A 114 8.188 -0.298 3.996 1.00 0.00 N ATOM 1852 CA SER A 114 9.172 0.276 3.080 1.00 0.00 C ATOM 1853 C SER A 114 8.505 0.907 1.856 1.00 0.00 C ATOM 1854 O SER A 114 8.985 1.909 1.326 1.00 0.00 O ATOM 1855 CB SER A 114 10.173 -0.798 2.640 1.00 0.00 C ATOM 1856 OG SER A 114 9.531 -1.842 1.924 1.00 0.00 O ATOM 0 H SER A 114 8.346 -1.281 4.216 1.00 0.00 H new ATOM 0 HA SER A 114 9.701 1.066 3.614 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.943 -0.346 2.015 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.675 -1.210 3.515 1.00 0.00 H new ATOM 0 HG SER A 114 9.160 -2.493 2.556 1.00 0.00 H new ATOM 1862 N TYR A 115 7.393 0.322 1.423 1.00 0.00 N ATOM 1863 CA TYR A 115 6.644 0.847 0.289 1.00 0.00 C ATOM 1864 C TYR A 115 6.011 2.184 0.655 1.00 0.00 C ATOM 1865 O TYR A 115 6.236 3.195 -0.005 1.00 0.00 O ATOM 1866 CB TYR A 115 5.539 -0.126 -0.129 1.00 0.00 C ATOM 1867 CG TYR A 115 6.015 -1.506 -0.528 1.00 0.00 C ATOM 1868 CD1 TYR A 115 6.220 -2.491 0.427 1.00 0.00 C ATOM 1869 CD2 TYR A 115 6.230 -1.831 -1.859 1.00 0.00 C ATOM 1870 CE1 TYR A 115 6.621 -3.761 0.067 1.00 0.00 C ATOM 1871 CE2 TYR A 115 6.636 -3.099 -2.227 1.00 0.00 C ATOM 1872 CZ TYR A 115 6.829 -4.058 -1.261 1.00 0.00 C ATOM 1873 OH TYR A 115 7.225 -5.324 -1.625 1.00 0.00 O ATOM 0 H TYR A 115 6.991 -0.517 1.841 1.00 0.00 H new ATOM 0 HA TYR A 115 7.338 0.979 -0.541 1.00 0.00 H new ATOM 0 HB2 TYR A 115 4.834 -0.226 0.696 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.991 0.308 -0.965 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.063 -2.260 1.470 1.00 0.00 H new ATOM 0 HD2 TYR A 115 6.077 -1.080 -2.620 1.00 0.00 H new ATOM 0 HE1 TYR A 115 6.771 -4.518 0.823 1.00 0.00 H new ATOM 0 HE2 TYR A 115 6.801 -3.336 -3.268 1.00 0.00 H new ATOM 0 HH TYR A 115 6.633 -5.984 -1.208 1.00 0.00 H new ATOM 1883 N ILE A 116 5.240 2.170 1.736 1.00 0.00 N ATOM 1884 CA ILE A 116 4.497 3.341 2.192 1.00 0.00 C ATOM 1885 C ILE A 116 5.443 4.472 2.588 1.00 0.00 C ATOM 1886 O ILE A 116 5.147 5.655 2.390 1.00 0.00 O ATOM 1887 CB ILE A 116 3.606 2.970 3.401 1.00 0.00 C ATOM 1888 CG1 ILE A 116 2.601 1.879 3.013 1.00 0.00 C ATOM 1889 CG2 ILE A 116 2.887 4.192 3.951 1.00 0.00 C ATOM 1890 CD1 ILE A 116 1.661 2.278 1.891 1.00 0.00 C ATOM 0 H ILE A 116 5.112 1.346 2.323 1.00 0.00 H new ATOM 0 HA ILE A 116 3.871 3.682 1.367 1.00 0.00 H new ATOM 0 HB ILE A 116 4.252 2.582 4.188 1.00 0.00 H new ATOM 0 HG12 ILE A 116 3.148 0.985 2.714 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.011 1.614 3.890 1.00 0.00 H new ATOM 0 HG21 ILE A 116 2.269 3.899 4.800 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.620 4.931 4.274 1.00 0.00 H new ATOM 0 HG23 ILE A 116 2.256 4.623 3.174 1.00 0.00 H new ATOM 0 HD11 ILE A 116 0.982 1.454 1.675 1.00 0.00 H new ATOM 0 HD12 ILE A 116 1.085 3.153 2.192 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.240 2.514 0.998 1.00 0.00 H new ATOM 1902 N ASP A 117 6.590 4.090 3.127 1.00 0.00 N ATOM 1903 CA ASP A 117 7.578 5.041 3.610 1.00 0.00 C ATOM 1904 C ASP A 117 8.358 5.667 2.450 1.00 0.00 C ATOM 1905 O ASP A 117 9.160 6.576 2.650 1.00 0.00 O ATOM 1906 CB ASP A 117 8.531 4.337 4.585 1.00 0.00 C ATOM 1907 CG ASP A 117 9.512 5.280 5.250 1.00 0.00 C ATOM 1908 OD1 ASP A 117 9.116 5.987 6.202 1.00 0.00 O ATOM 1909 OD2 ASP A 117 10.687 5.312 4.829 1.00 0.00 O ATOM 0 H ASP A 117 6.862 3.114 3.242 1.00 0.00 H new ATOM 0 HA ASP A 117 7.062 5.848 4.130 1.00 0.00 H new ATOM 0 HB2 ASP A 117 7.946 3.832 5.353 1.00 0.00 H new ATOM 0 HB3 ASP A 117 9.085 3.567 4.048 1.00 0.00 H new ATOM 1914 N SER A 118 8.121 5.183 1.239 1.00 0.00 N ATOM 1915 CA SER A 118 8.781 5.730 0.063 1.00 0.00 C ATOM 1916 C SER A 118 7.890 6.774 -0.613 1.00 0.00 C ATOM 1917 O SER A 118 6.913 6.433 -1.285 1.00 0.00 O ATOM 1918 CB SER A 118 9.133 4.618 -0.925 1.00 0.00 C ATOM 1919 OG SER A 118 9.885 5.128 -2.012 1.00 0.00 O ATOM 0 H SER A 118 7.478 4.415 1.046 1.00 0.00 H new ATOM 0 HA SER A 118 9.704 6.212 0.384 1.00 0.00 H new ATOM 0 HB2 SER A 118 9.703 3.841 -0.416 1.00 0.00 H new ATOM 0 HB3 SER A 118 8.220 4.153 -1.296 1.00 0.00 H new ATOM 0 HG SER A 118 10.827 4.883 -1.902 1.00 0.00 H new ATOM 1925 N PRO A 119 8.221 8.064 -0.443 1.00 0.00 N ATOM 1926 CA PRO A 119 7.406 9.168 -0.955 1.00 0.00 C ATOM 1927 C PRO A 119 7.316 9.180 -2.478 1.00 0.00 C ATOM 1928 O PRO A 119 6.226 9.273 -3.037 1.00 0.00 O ATOM 1929 CB PRO A 119 8.133 10.421 -0.452 1.00 0.00 C ATOM 1930 CG PRO A 119 9.526 9.977 -0.175 1.00 0.00 C ATOM 1931 CD PRO A 119 9.423 8.545 0.261 1.00 0.00 C ATOM 0 HA PRO A 119 6.373 9.092 -0.614 1.00 0.00 H new ATOM 0 HB2 PRO A 119 8.114 11.214 -1.199 1.00 0.00 H new ATOM 0 HB3 PRO A 119 7.660 10.817 0.446 1.00 0.00 H new ATOM 0 HG2 PRO A 119 10.150 10.071 -1.064 1.00 0.00 H new ATOM 0 HG3 PRO A 119 9.984 10.590 0.602 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.309 7.974 -0.018 1.00 0.00 H new ATOM 0 HD3 PRO A 119 9.317 8.460 1.343 1.00 0.00 H new ATOM 1939 N GLU A 120 8.462 9.068 -3.140 1.00 0.00 N ATOM 1940 CA GLU A 120 8.518 9.163 -4.595 1.00 0.00 C ATOM 1941 C GLU A 120 7.755 8.021 -5.260 1.00 0.00 C ATOM 1942 O GLU A 120 6.855 8.258 -6.066 1.00 0.00 O ATOM 1943 CB GLU A 120 9.970 9.171 -5.080 1.00 0.00 C ATOM 1944 CG GLU A 120 10.099 9.204 -6.595 1.00 0.00 C ATOM 1945 CD GLU A 120 11.536 9.291 -7.062 1.00 0.00 C ATOM 1946 OE1 GLU A 120 12.215 8.244 -7.118 1.00 0.00 O ATOM 1947 OE2 GLU A 120 11.996 10.409 -7.375 1.00 0.00 O ATOM 0 H GLU A 120 9.365 8.911 -2.693 1.00 0.00 H new ATOM 0 HA GLU A 120 8.042 10.101 -4.879 1.00 0.00 H new ATOM 0 HB2 GLU A 120 10.481 10.037 -4.660 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.478 8.285 -4.698 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.640 8.308 -7.013 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.544 10.058 -6.983 1.00 0.00 H new ATOM 1954 N TYR A 121 8.101 6.792 -4.903 1.00 0.00 N ATOM 1955 CA TYR A 121 7.543 5.622 -5.569 1.00 0.00 C ATOM 1956 C TYR A 121 6.064 5.440 -5.251 1.00 0.00 C ATOM 1957 O TYR A 121 5.338 4.791 -6.003 1.00 0.00 O ATOM 1958 CB TYR A 121 8.338 4.368 -5.208 1.00 0.00 C ATOM 1959 CG TYR A 121 9.763 4.418 -5.712 1.00 0.00 C ATOM 1960 CD1 TYR A 121 10.032 4.457 -7.075 1.00 0.00 C ATOM 1961 CD2 TYR A 121 10.837 4.443 -4.831 1.00 0.00 C ATOM 1962 CE1 TYR A 121 11.330 4.519 -7.544 1.00 0.00 C ATOM 1963 CE2 TYR A 121 12.137 4.503 -5.293 1.00 0.00 C ATOM 1964 CZ TYR A 121 12.378 4.542 -6.649 1.00 0.00 C ATOM 1965 OH TYR A 121 13.671 4.613 -7.114 1.00 0.00 O ATOM 0 H TYR A 121 8.764 6.579 -4.158 1.00 0.00 H new ATOM 0 HA TYR A 121 7.623 5.786 -6.644 1.00 0.00 H new ATOM 0 HB2 TYR A 121 8.344 4.245 -4.125 1.00 0.00 H new ATOM 0 HB3 TYR A 121 7.839 3.493 -5.625 1.00 0.00 H new ATOM 0 HD1 TYR A 121 9.213 4.439 -7.779 1.00 0.00 H new ATOM 0 HD2 TYR A 121 10.652 4.415 -3.767 1.00 0.00 H new ATOM 0 HE1 TYR A 121 11.523 4.549 -8.606 1.00 0.00 H new ATOM 0 HE2 TYR A 121 12.961 4.519 -4.595 1.00 0.00 H new ATOM 0 HH TYR A 121 14.291 4.622 -6.355 1.00 0.00 H new ATOM 1975 N THR A 122 5.613 6.006 -4.141 1.00 0.00 N ATOM 1976 CA THR A 122 4.194 6.015 -3.846 1.00 0.00 C ATOM 1977 C THR A 122 3.501 7.128 -4.625 1.00 0.00 C ATOM 1978 O THR A 122 2.418 6.934 -5.161 1.00 0.00 O ATOM 1979 CB THR A 122 3.914 6.196 -2.345 1.00 0.00 C ATOM 1980 OG1 THR A 122 4.572 5.170 -1.594 1.00 0.00 O ATOM 1981 CG2 THR A 122 2.419 6.146 -2.070 1.00 0.00 C ATOM 0 H THR A 122 6.202 6.458 -3.441 1.00 0.00 H new ATOM 0 HA THR A 122 3.799 5.045 -4.148 1.00 0.00 H new ATOM 0 HB THR A 122 4.297 7.170 -2.041 1.00 0.00 H new ATOM 0 HG1 THR A 122 5.426 5.510 -1.255 1.00 0.00 H new ATOM 0 HG21 THR A 122 2.241 6.276 -1.003 1.00 0.00 H new ATOM 0 HG22 THR A 122 1.921 6.944 -2.621 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.022 5.182 -2.389 1.00 0.00 H new ATOM 1989 N ASN A 123 4.150 8.286 -4.713 1.00 0.00 N ATOM 1990 CA ASN A 123 3.557 9.448 -5.373 1.00 0.00 C ATOM 1991 C ASN A 123 3.389 9.200 -6.867 1.00 0.00 C ATOM 1992 O ASN A 123 2.413 9.644 -7.470 1.00 0.00 O ATOM 1993 CB ASN A 123 4.417 10.697 -5.150 1.00 0.00 C ATOM 1994 CG ASN A 123 3.789 11.948 -5.736 1.00 0.00 C ATOM 1995 OD1 ASN A 123 3.006 12.632 -5.074 1.00 0.00 O ATOM 1996 ND2 ASN A 123 4.133 12.268 -6.972 1.00 0.00 N ATOM 0 H ASN A 123 5.085 8.446 -4.337 1.00 0.00 H new ATOM 0 HA ASN A 123 2.574 9.612 -4.933 1.00 0.00 H new ATOM 0 HB2 ASN A 123 4.574 10.840 -4.081 1.00 0.00 H new ATOM 0 HB3 ASN A 123 5.399 10.543 -5.598 1.00 0.00 H new ATOM 0 HD21 ASN A 123 3.747 13.105 -7.408 1.00 0.00 H new ATOM 0 HD22 ASN A 123 4.784 11.677 -7.489 1.00 0.00 H new ATOM 2003 N SER A 124 4.338 8.484 -7.456 1.00 0.00 N ATOM 2004 CA SER A 124 4.310 8.209 -8.886 1.00 0.00 C ATOM 2005 C SER A 124 3.133 7.311 -9.262 1.00 0.00 C ATOM 2006 O SER A 124 2.605 7.393 -10.372 1.00 0.00 O ATOM 2007 CB SER A 124 5.634 7.580 -9.319 1.00 0.00 C ATOM 2008 OG SER A 124 5.989 6.501 -8.471 1.00 0.00 O ATOM 0 H SER A 124 5.137 8.083 -6.965 1.00 0.00 H new ATOM 0 HA SER A 124 4.176 9.154 -9.413 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.553 7.227 -10.347 1.00 0.00 H new ATOM 0 HB3 SER A 124 6.421 8.334 -9.302 1.00 0.00 H new ATOM 0 HG SER A 124 6.839 6.115 -8.770 1.00 0.00 H new ATOM 2014 N PHE A 125 2.716 6.458 -8.335 1.00 0.00 N ATOM 2015 CA PHE A 125 1.569 5.596 -8.566 1.00 0.00 C ATOM 2016 C PHE A 125 0.302 6.285 -8.065 1.00 0.00 C ATOM 2017 O PHE A 125 -0.755 6.213 -8.697 1.00 0.00 O ATOM 2018 CB PHE A 125 1.764 4.252 -7.854 1.00 0.00 C ATOM 2019 CG PHE A 125 1.149 3.084 -8.577 1.00 0.00 C ATOM 2020 CD1 PHE A 125 -0.220 3.008 -8.779 1.00 0.00 C ATOM 2021 CD2 PHE A 125 1.951 2.062 -9.062 1.00 0.00 C ATOM 2022 CE1 PHE A 125 -0.777 1.937 -9.448 1.00 0.00 C ATOM 2023 CE2 PHE A 125 1.400 0.988 -9.733 1.00 0.00 C ATOM 2024 CZ PHE A 125 0.033 0.925 -9.927 1.00 0.00 C ATOM 0 H PHE A 125 3.154 6.346 -7.421 1.00 0.00 H new ATOM 0 HA PHE A 125 1.472 5.407 -9.635 1.00 0.00 H new ATOM 0 HB2 PHE A 125 2.831 4.069 -7.730 1.00 0.00 H new ATOM 0 HB3 PHE A 125 1.334 4.316 -6.855 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -0.859 3.796 -8.408 1.00 0.00 H new ATOM 0 HD2 PHE A 125 3.020 2.106 -8.913 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.846 1.890 -9.597 1.00 0.00 H new ATOM 0 HE2 PHE A 125 2.036 0.199 -10.105 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.401 0.087 -10.452 1.00 0.00 H new ATOM 2034 N GLY A 126 0.425 6.971 -6.937 1.00 0.00 N ATOM 2035 CA GLY A 126 -0.691 7.704 -6.380 1.00 0.00 C ATOM 2036 C GLY A 126 -0.684 7.718 -4.863 1.00 0.00 C ATOM 2037 O GLY A 126 -0.767 6.671 -4.225 1.00 0.00 O ATOM 0 H GLY A 126 1.287 7.032 -6.395 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.667 8.729 -6.749 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -1.623 7.261 -6.731 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.586 8.911 -4.285 1.00 0.00 N ATOM 2042 CA ASP A 127 -0.667 9.073 -2.834 1.00 0.00 C ATOM 2043 C ASP A 127 -2.135 9.105 -2.427 1.00 0.00 C ATOM 2044 O ASP A 127 -2.513 8.691 -1.327 1.00 0.00 O ATOM 2045 CB ASP A 127 0.049 10.362 -2.398 1.00 0.00 C ATOM 2046 CG ASP A 127 -0.033 10.626 -0.901 1.00 0.00 C ATOM 2047 OD1 ASP A 127 0.589 9.875 -0.118 1.00 0.00 O ATOM 2048 OD2 ASP A 127 -0.689 11.612 -0.502 1.00 0.00 O ATOM 0 H ASP A 127 -0.450 9.782 -4.798 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.173 8.236 -2.340 1.00 0.00 H new ATOM 0 HB2 ASP A 127 1.097 10.303 -2.692 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -0.385 11.207 -2.932 1.00 0.00 H new ATOM 2053 N TRP A 128 -2.956 9.588 -3.353 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.401 9.566 -3.200 1.00 0.00 C ATOM 2055 C TRP A 128 -5.023 8.590 -4.197 1.00 0.00 C ATOM 2056 O TRP A 128 -6.227 8.613 -4.444 1.00 0.00 O ATOM 2057 CB TRP A 128 -4.985 10.967 -3.403 1.00 0.00 C ATOM 2058 CG TRP A 128 -4.731 11.898 -2.260 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -3.686 12.763 -2.123 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.543 12.056 -1.091 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -3.802 13.456 -0.942 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -4.932 13.040 -0.291 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.728 11.466 -0.646 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -5.466 13.444 0.930 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -7.256 11.866 0.568 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.628 12.849 1.341 1.00 0.00 C ATOM 0 H TRP A 128 -2.637 10.004 -4.228 1.00 0.00 H new ATOM 0 HA TRP A 128 -4.635 9.235 -2.188 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -4.564 11.398 -4.311 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -6.060 10.883 -3.559 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -2.885 12.885 -2.837 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -3.151 14.166 -0.605 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -7.223 10.711 -1.239 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.981 14.199 1.531 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -8.168 11.412 0.926 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -7.069 13.144 2.281 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.192 7.725 -4.759 1.00 0.00 N ATOM 2078 CA VAL A 129 -4.645 6.737 -5.728 1.00 0.00 C ATOM 2079 C VAL A 129 -4.372 5.334 -5.200 1.00 0.00 C ATOM 2080 O VAL A 129 -3.334 5.090 -4.586 1.00 0.00 O ATOM 2081 CB VAL A 129 -3.943 6.918 -7.095 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.442 5.902 -8.112 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -4.138 8.330 -7.624 1.00 0.00 C ATOM 0 H VAL A 129 -3.193 7.687 -4.559 1.00 0.00 H new ATOM 0 HA VAL A 129 -5.716 6.879 -5.874 1.00 0.00 H new ATOM 0 HB VAL A 129 -2.877 6.749 -6.939 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -3.929 6.056 -9.062 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.239 4.894 -7.749 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.515 6.027 -8.255 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.635 8.431 -8.586 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -5.203 8.528 -7.749 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.716 9.045 -6.917 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.310 4.426 -5.418 1.00 0.00 N ATOM 2094 CA VAL A 130 -5.155 3.047 -4.983 1.00 0.00 C ATOM 2095 C VAL A 130 -4.371 2.248 -6.016 1.00 0.00 C ATOM 2096 O VAL A 130 -4.823 2.077 -7.151 1.00 0.00 O ATOM 2097 CB VAL A 130 -6.521 2.364 -4.749 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -6.338 0.932 -4.263 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -7.359 3.164 -3.764 1.00 0.00 C ATOM 0 H VAL A 130 -6.190 4.620 -5.896 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.611 3.068 -4.039 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.050 2.331 -5.701 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.314 0.474 -4.106 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.786 0.362 -5.010 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -5.783 0.934 -3.325 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.317 2.666 -3.613 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -6.833 3.235 -2.812 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.529 4.165 -4.160 1.00 0.00 H new ATOM 2109 N PRO A 131 -3.181 1.760 -5.644 1.00 0.00 N ATOM 2110 CA PRO A 131 -2.344 0.963 -6.531 1.00 0.00 C ATOM 2111 C PRO A 131 -2.894 -0.448 -6.720 1.00 0.00 C ATOM 2112 O PRO A 131 -2.643 -1.349 -5.917 1.00 0.00 O ATOM 2113 CB PRO A 131 -0.975 0.933 -5.829 1.00 0.00 C ATOM 2114 CG PRO A 131 -1.084 1.888 -4.685 1.00 0.00 C ATOM 2115 CD PRO A 131 -2.543 1.957 -4.339 1.00 0.00 C ATOM 0 HA PRO A 131 -2.296 1.386 -7.534 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -0.737 -0.071 -5.479 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -0.179 1.230 -6.512 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -0.497 1.544 -3.833 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.702 2.871 -4.960 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -2.829 1.184 -3.625 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.811 2.916 -3.895 1.00 0.00 H new ATOM 2123 N TYR A 132 -3.681 -0.618 -7.769 1.00 0.00 N ATOM 2124 CA TYR A 132 -4.270 -1.909 -8.082 1.00 0.00 C ATOM 2125 C TYR A 132 -3.379 -2.672 -9.054 1.00 0.00 C ATOM 2126 O TYR A 132 -2.343 -2.161 -9.481 1.00 0.00 O ATOM 2127 CB TYR A 132 -5.680 -1.729 -8.664 1.00 0.00 C ATOM 2128 CG TYR A 132 -5.730 -0.896 -9.931 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -5.639 0.491 -9.879 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -5.871 -1.496 -11.176 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -5.685 1.252 -11.029 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -5.916 -0.739 -12.331 1.00 0.00 C ATOM 2133 CZ TYR A 132 -5.823 0.633 -12.252 1.00 0.00 C ATOM 2134 OH TYR A 132 -5.866 1.391 -13.400 1.00 0.00 O ATOM 0 H TYR A 132 -3.928 0.126 -8.421 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.353 -2.488 -7.162 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -6.103 -2.712 -8.872 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -6.315 -1.262 -7.911 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -5.531 0.980 -8.922 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -5.947 -2.571 -11.242 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -5.613 2.328 -10.971 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -6.024 -1.221 -13.292 1.00 0.00 H new ATOM 0 HH TYR A 132 -5.965 0.802 -14.177 1.00 0.00 H new ATOM 2144 N TYR A 133 -3.780 -3.893 -9.403 1.00 0.00 N ATOM 2145 CA TYR A 133 -2.998 -4.722 -10.316 1.00 0.00 C ATOM 2146 C TYR A 133 -2.789 -3.999 -11.647 1.00 0.00 C ATOM 2147 O TYR A 133 -3.736 -3.484 -12.241 1.00 0.00 O ATOM 2148 CB TYR A 133 -3.677 -6.087 -10.535 1.00 0.00 C ATOM 2149 CG TYR A 133 -5.059 -6.018 -11.162 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -6.189 -5.791 -10.387 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -5.230 -6.186 -12.532 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -7.447 -5.731 -10.959 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -6.483 -6.127 -13.110 1.00 0.00 C ATOM 2154 CZ TYR A 133 -7.588 -5.899 -12.320 1.00 0.00 C ATOM 2155 OH TYR A 133 -8.838 -5.834 -12.895 1.00 0.00 O ATOM 0 H TYR A 133 -4.639 -4.329 -9.068 1.00 0.00 H new ATOM 0 HA TYR A 133 -2.022 -4.901 -9.866 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -3.036 -6.698 -11.170 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -3.754 -6.597 -9.575 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -6.084 -5.659 -9.320 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -4.367 -6.366 -13.156 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -8.315 -5.553 -10.342 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -6.596 -6.259 -14.176 1.00 0.00 H new ATOM 0 HH TYR A 133 -8.761 -5.972 -13.862 1.00 0.00 H new ATOM 2165 N ARG A 134 -1.545 -3.962 -12.106 1.00 0.00 N ATOM 2166 CA ARG A 134 -1.188 -3.226 -13.320 1.00 0.00 C ATOM 2167 C ARG A 134 -1.585 -3.996 -14.583 1.00 0.00 C ATOM 2168 O ARG A 134 -0.813 -4.090 -15.537 1.00 0.00 O ATOM 2169 CB ARG A 134 0.316 -2.940 -13.338 1.00 0.00 C ATOM 2170 CG ARG A 134 0.809 -2.165 -12.127 1.00 0.00 C ATOM 2171 CD ARG A 134 2.275 -1.787 -12.273 1.00 0.00 C ATOM 2172 NE ARG A 134 2.479 -0.786 -13.323 1.00 0.00 N ATOM 2173 CZ ARG A 134 3.326 -0.929 -14.342 1.00 0.00 C ATOM 2174 NH1 ARG A 134 4.067 -2.022 -14.455 1.00 0.00 N ATOM 2175 NH2 ARG A 134 3.442 0.031 -15.248 1.00 0.00 N ATOM 0 H ARG A 134 -0.760 -4.434 -11.656 1.00 0.00 H new ATOM 0 HA ARG A 134 -1.739 -2.285 -13.312 1.00 0.00 H new ATOM 0 HB2 ARG A 134 0.855 -3.885 -13.396 1.00 0.00 H new ATOM 0 HB3 ARG A 134 0.559 -2.378 -14.240 1.00 0.00 H new ATOM 0 HG2 ARG A 134 0.210 -1.263 -12.001 1.00 0.00 H new ATOM 0 HG3 ARG A 134 0.674 -2.766 -11.228 1.00 0.00 H new ATOM 0 HD2 ARG A 134 2.646 -1.399 -11.324 1.00 0.00 H new ATOM 0 HD3 ARG A 134 2.859 -2.678 -12.503 1.00 0.00 H new ATOM 0 HE ARG A 134 1.937 0.077 -13.271 1.00 0.00 H new ATOM 0 HH11 ARG A 134 3.992 -2.763 -13.758 1.00 0.00 H new ATOM 0 HH12 ARG A 134 4.712 -2.122 -15.239 1.00 0.00 H new ATOM 0 HH21 ARG A 134 2.883 0.880 -15.166 1.00 0.00 H new ATOM 0 HH22 ARG A 134 4.090 -0.079 -16.028 1.00 0.00 H new