USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 730 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 112 THR OG1 : rot 89:sc= 1.09 USER MOD Set 1.2: A 116 ASN : amide:sc= 0.438 K(o=1.5,f=1) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 142:sc= 0.864 (180deg=-1.36!) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ -158:sc= 1.26 (180deg=0.246) USER MOD Single : A 75 ASN : amide:sc= -0.0564 K(o=-0.056,f=-6.6!) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 30:sc= -0.109 USER MOD Single : A 81 ASN : amide:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 1.23 K(o=1.2,f=-0.89) USER MOD Single : A 90 HIS : no HE2:sc= -0.0929 K(o=-0.093,f=-3.9!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 161:sc= 1.05 USER MOD Single : A 110 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 113 GLN : amide:sc= -0.289 X(o=-0.29,f=-0.086) USER MOD Single : A 117 GLN : amide:sc= 0.809 K(o=0.81,f=-0.18) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0.043) USER MOD Single : A 122 LYS NZ :NH3+ 157:sc= -0.102 (180deg=-0.582) USER MOD Single : A 125 ASN : amide:sc= 0.921 K(o=0.92,f=-1.1) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 HIS : no HE2:sc= -0.0889 X(o=-0.089,f=-0.088) USER MOD Single : A 129 GLN : amide:sc= 0.47 X(o=0.47,f=0) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 GLN : amide:sc= -0.259 K(o=-0.26,f=-3.5!) USER MOD Single : A 141 SER OG : rot 113:sc= 1.1 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 HIS : no HE2:sc= -1.16 K(o=-1.2,f=-5!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 52 0.615 -16.154 -5.104 1.00 0.00 N ATOM 2 CA ALA A 52 0.771 -14.938 -5.871 1.00 0.00 C ATOM 3 C ALA A 52 0.450 -13.736 -4.995 1.00 0.00 C ATOM 4 O ALA A 52 0.818 -12.615 -5.326 1.00 0.00 O ATOM 5 CB ALA A 52 -0.169 -14.979 -7.078 1.00 0.00 C ATOM 0 HA ALA A 52 1.800 -14.852 -6.221 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.055 -14.064 -7.659 1.00 0.00 H new ATOM 0 HB2 ALA A 52 0.077 -15.838 -7.702 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.200 -15.064 -6.734 1.00 0.00 H new ATOM 11 N GLU A 53 -0.221 -13.958 -3.867 1.00 0.00 N ATOM 12 CA GLU A 53 -0.564 -12.913 -2.921 1.00 0.00 C ATOM 13 C GLU A 53 0.700 -12.443 -2.191 1.00 0.00 C ATOM 14 O GLU A 53 0.767 -11.325 -1.712 1.00 0.00 O ATOM 15 CB GLU A 53 -1.696 -13.362 -1.984 1.00 0.00 C ATOM 16 CG GLU A 53 -2.783 -14.117 -2.778 1.00 0.00 C ATOM 17 CD GLU A 53 -4.193 -13.979 -2.201 1.00 0.00 C ATOM 18 OE1 GLU A 53 -4.372 -14.077 -0.967 1.00 0.00 O ATOM 19 OE2 GLU A 53 -5.122 -13.774 -3.023 1.00 0.00 O ATOM 0 H GLU A 53 -0.544 -14.884 -3.586 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.961 -12.048 -3.452 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -1.295 -14.006 -1.201 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.134 -12.494 -1.490 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -2.786 -13.752 -3.805 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -2.520 -15.174 -2.816 1.00 0.00 H new ATOM 26 N ASN A 54 1.780 -13.225 -2.223 1.00 0.00 N ATOM 27 CA ASN A 54 3.111 -12.794 -1.814 1.00 0.00 C ATOM 28 C ASN A 54 3.834 -12.043 -2.946 1.00 0.00 C ATOM 29 O ASN A 54 5.069 -12.004 -2.963 1.00 0.00 O ATOM 30 CB ASN A 54 3.912 -14.001 -1.292 1.00 0.00 C ATOM 31 CG ASN A 54 3.608 -14.298 0.162 1.00 0.00 C ATOM 32 OD1 ASN A 54 4.312 -13.851 1.069 1.00 0.00 O ATOM 33 ND2 ASN A 54 2.550 -15.044 0.400 1.00 0.00 N ATOM 0 H ASN A 54 1.750 -14.194 -2.541 1.00 0.00 H new ATOM 0 HA ASN A 54 3.018 -12.080 -0.996 1.00 0.00 H new ATOM 0 HB2 ASN A 54 3.682 -14.878 -1.897 1.00 0.00 H new ATOM 0 HB3 ASN A 54 4.978 -13.806 -1.407 1.00 0.00 H new ATOM 0 HD21 ASN A 54 2.290 -15.269 1.360 1.00 0.00 H new ATOM 0 HD22 ASN A 54 1.990 -15.397 -0.376 1.00 0.00 H new ATOM 40 N ARG A 55 3.149 -11.471 -3.942 1.00 0.00 N ATOM 41 CA ARG A 55 3.804 -10.579 -4.906 1.00 0.00 C ATOM 42 C ARG A 55 4.039 -9.199 -4.301 1.00 0.00 C ATOM 43 O ARG A 55 3.179 -8.708 -3.572 1.00 0.00 O ATOM 44 CB ARG A 55 2.968 -10.413 -6.181 1.00 0.00 C ATOM 45 CG ARG A 55 3.332 -11.450 -7.226 1.00 0.00 C ATOM 46 CD ARG A 55 2.708 -11.114 -8.585 1.00 0.00 C ATOM 47 NE ARG A 55 3.759 -10.878 -9.589 1.00 0.00 N ATOM 48 CZ ARG A 55 4.514 -11.840 -10.138 1.00 0.00 C ATOM 49 NH1 ARG A 55 4.141 -13.119 -10.076 1.00 0.00 N ATOM 50 NH2 ARG A 55 5.662 -11.524 -10.724 1.00 0.00 N ATOM 0 H ARG A 55 2.151 -11.607 -4.102 1.00 0.00 H new ATOM 0 HA ARG A 55 4.758 -11.041 -5.159 1.00 0.00 H new ATOM 0 HB2 ARG A 55 1.909 -10.498 -5.936 1.00 0.00 H new ATOM 0 HB3 ARG A 55 3.121 -9.414 -6.590 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.416 -11.505 -7.325 1.00 0.00 H new ATOM 0 HG3 ARG A 55 2.992 -12.433 -6.900 1.00 0.00 H new ATOM 0 HD2 ARG A 55 2.064 -11.932 -8.909 1.00 0.00 H new ATOM 0 HD3 ARG A 55 2.078 -10.229 -8.494 1.00 0.00 H new ATOM 0 HE ARG A 55 3.924 -9.917 -9.887 1.00 0.00 H new ATOM 0 HH11 ARG A 55 3.272 -13.375 -9.607 1.00 0.00 H new ATOM 0 HH12 ARG A 55 4.725 -13.841 -10.498 1.00 0.00 H new ATOM 0 HH21 ARG A 55 5.968 -10.551 -10.756 1.00 0.00 H new ATOM 0 HH22 ARG A 55 6.239 -12.254 -11.143 1.00 0.00 H new ATOM 64 N PRO A 56 5.092 -8.478 -4.723 1.00 0.00 N ATOM 65 CA PRO A 56 5.165 -7.051 -4.487 1.00 0.00 C ATOM 66 C PRO A 56 3.977 -6.416 -5.207 1.00 0.00 C ATOM 67 O PRO A 56 3.847 -6.532 -6.432 1.00 0.00 O ATOM 68 CB PRO A 56 6.509 -6.565 -5.041 1.00 0.00 C ATOM 69 CG PRO A 56 7.209 -7.815 -5.568 1.00 0.00 C ATOM 70 CD PRO A 56 6.113 -8.878 -5.671 1.00 0.00 C ATOM 0 HA PRO A 56 5.113 -6.783 -3.432 1.00 0.00 H new ATOM 0 HB2 PRO A 56 6.364 -5.832 -5.835 1.00 0.00 H new ATOM 0 HB3 PRO A 56 7.102 -6.081 -4.265 1.00 0.00 H new ATOM 0 HG2 PRO A 56 7.669 -7.629 -6.539 1.00 0.00 H new ATOM 0 HG3 PRO A 56 8.004 -8.134 -4.894 1.00 0.00 H new ATOM 0 HD2 PRO A 56 5.710 -8.929 -6.683 1.00 0.00 H new ATOM 0 HD3 PRO A 56 6.503 -9.868 -5.433 1.00 0.00 H new ATOM 78 N GLY A 57 3.098 -5.766 -4.450 1.00 0.00 N ATOM 79 CA GLY A 57 1.924 -5.105 -4.988 1.00 0.00 C ATOM 80 C GLY A 57 0.690 -5.998 -5.032 1.00 0.00 C ATOM 81 O GLY A 57 -0.354 -5.517 -5.459 1.00 0.00 O ATOM 0 H GLY A 57 3.186 -5.685 -3.437 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.704 -4.224 -4.384 1.00 0.00 H new ATOM 0 HA3 GLY A 57 2.145 -4.754 -5.996 1.00 0.00 H new ATOM 85 N ALA A 58 0.767 -7.256 -4.599 1.00 0.00 N ATOM 86 CA ALA A 58 -0.407 -8.092 -4.426 1.00 0.00 C ATOM 87 C ALA A 58 -1.447 -7.460 -3.488 1.00 0.00 C ATOM 88 O ALA A 58 -1.081 -6.819 -2.493 1.00 0.00 O ATOM 89 CB ALA A 58 0.084 -9.402 -3.850 1.00 0.00 C ATOM 0 H ALA A 58 1.645 -7.718 -4.361 1.00 0.00 H new ATOM 0 HA ALA A 58 -0.909 -8.225 -5.384 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.762 -10.073 -3.699 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.792 -9.861 -4.541 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.576 -9.218 -2.895 1.00 0.00 H new ATOM 95 N PHE A 59 -2.728 -7.668 -3.793 1.00 0.00 N ATOM 96 CA PHE A 59 -3.886 -7.168 -3.058 1.00 0.00 C ATOM 97 C PHE A 59 -4.250 -8.129 -1.914 1.00 0.00 C ATOM 98 O PHE A 59 -4.542 -9.298 -2.174 1.00 0.00 O ATOM 99 CB PHE A 59 -5.080 -7.054 -4.030 1.00 0.00 C ATOM 100 CG PHE A 59 -5.252 -5.765 -4.823 1.00 0.00 C ATOM 101 CD1 PHE A 59 -4.255 -4.768 -4.883 1.00 0.00 C ATOM 102 CD2 PHE A 59 -6.489 -5.527 -5.457 1.00 0.00 C ATOM 103 CE1 PHE A 59 -4.512 -3.540 -5.512 1.00 0.00 C ATOM 104 CE2 PHE A 59 -6.719 -4.317 -6.136 1.00 0.00 C ATOM 105 CZ PHE A 59 -5.743 -3.307 -6.138 1.00 0.00 C ATOM 0 H PHE A 59 -2.999 -8.221 -4.606 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.649 -6.193 -2.633 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.006 -7.875 -4.744 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -5.992 -7.213 -3.455 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.287 -4.951 -4.441 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.264 -6.278 -5.421 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -3.755 -2.769 -5.513 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -7.651 -4.164 -6.659 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.940 -2.360 -6.618 1.00 0.00 H new ATOM 115 N ILE A 60 -4.299 -7.637 -0.666 1.00 0.00 N ATOM 116 CA ILE A 60 -4.728 -8.435 0.495 1.00 0.00 C ATOM 117 C ILE A 60 -6.229 -8.761 0.421 1.00 0.00 C ATOM 118 O ILE A 60 -6.631 -9.909 0.601 1.00 0.00 O ATOM 119 CB ILE A 60 -4.358 -7.711 1.815 1.00 0.00 C ATOM 120 CG1 ILE A 60 -2.822 -7.620 1.965 1.00 0.00 C ATOM 121 CG2 ILE A 60 -4.966 -8.437 3.028 1.00 0.00 C ATOM 122 CD1 ILE A 60 -2.353 -6.785 3.155 1.00 0.00 C ATOM 0 H ILE A 60 -4.043 -6.677 -0.433 1.00 0.00 H new ATOM 0 HA ILE A 60 -4.196 -9.386 0.477 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.770 -6.703 1.776 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -2.418 -8.628 2.062 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -2.404 -7.196 1.052 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.692 -7.910 3.942 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.052 -8.458 2.933 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.585 -9.457 3.070 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.263 -6.774 3.185 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -2.723 -5.765 3.052 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -2.737 -7.219 4.078 1.00 0.00 H new ATOM 134 N LYS A 61 -7.078 -7.758 0.151 1.00 0.00 N ATOM 135 CA LYS A 61 -8.483 -7.957 -0.181 1.00 0.00 C ATOM 136 C LYS A 61 -9.254 -8.776 0.867 1.00 0.00 C ATOM 137 O LYS A 61 -10.013 -9.682 0.527 1.00 0.00 O ATOM 138 CB LYS A 61 -8.479 -8.513 -1.618 1.00 0.00 C ATOM 139 CG LYS A 61 -9.550 -7.981 -2.554 1.00 0.00 C ATOM 140 CD LYS A 61 -10.990 -8.346 -2.197 1.00 0.00 C ATOM 141 CE LYS A 61 -11.387 -9.744 -2.692 1.00 0.00 C ATOM 142 NZ LYS A 61 -10.757 -10.859 -1.941 1.00 0.00 N ATOM 0 H LYS A 61 -6.798 -6.777 0.159 1.00 0.00 H new ATOM 0 HA LYS A 61 -9.053 -7.029 -0.153 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.505 -8.306 -2.061 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.581 -9.597 -1.565 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.469 -6.895 -2.588 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -9.341 -8.347 -3.559 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -11.115 -8.299 -1.115 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -11.665 -7.607 -2.628 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -12.470 -9.845 -2.629 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -11.119 -9.834 -3.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -11.442 -11.634 -1.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.926 -11.203 -2.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.461 -10.522 -1.003 1.00 0.00 H new ATOM 156 N GLN A 62 -9.148 -8.351 2.132 1.00 0.00 N ATOM 157 CA GLN A 62 -9.858 -8.892 3.298 1.00 0.00 C ATOM 158 C GLN A 62 -11.402 -8.797 3.241 1.00 0.00 C ATOM 159 O GLN A 62 -12.058 -9.084 4.246 1.00 0.00 O ATOM 160 CB GLN A 62 -9.314 -8.200 4.572 1.00 0.00 C ATOM 161 CG GLN A 62 -7.970 -8.787 5.042 1.00 0.00 C ATOM 162 CD GLN A 62 -8.122 -9.444 6.415 1.00 0.00 C ATOM 163 OE1 GLN A 62 -8.854 -10.415 6.577 1.00 0.00 O ATOM 164 NE2 GLN A 62 -7.526 -8.891 7.452 1.00 0.00 N ATOM 0 H GLN A 62 -8.531 -7.579 2.383 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.659 -9.964 3.308 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -9.192 -7.135 4.377 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.047 -8.295 5.373 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -7.614 -9.521 4.319 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.219 -7.998 5.091 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.917 -8.084 7.319 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -7.674 -9.270 8.387 1.00 0.00 H new ATOM 173 N GLY A 63 -12.013 -8.345 2.138 1.00 0.00 N ATOM 174 CA GLY A 63 -13.470 -8.284 1.996 1.00 0.00 C ATOM 175 C GLY A 63 -14.144 -7.249 2.910 1.00 0.00 C ATOM 176 O GLY A 63 -15.357 -7.310 3.139 1.00 0.00 O ATOM 0 H GLY A 63 -11.507 -8.011 1.318 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -13.714 -8.052 0.959 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.887 -9.268 2.209 1.00 0.00 H new ATOM 180 N ARG A 64 -13.370 -6.307 3.455 1.00 0.00 N ATOM 181 CA ARG A 64 -13.808 -5.261 4.382 1.00 0.00 C ATOM 182 C ARG A 64 -14.088 -3.968 3.631 1.00 0.00 C ATOM 183 O ARG A 64 -13.544 -3.748 2.550 1.00 0.00 O ATOM 184 CB ARG A 64 -12.788 -5.020 5.521 1.00 0.00 C ATOM 185 CG ARG A 64 -11.311 -5.243 5.160 1.00 0.00 C ATOM 186 CD ARG A 64 -10.429 -5.331 6.414 1.00 0.00 C ATOM 187 NE ARG A 64 -10.345 -4.048 7.122 1.00 0.00 N ATOM 188 CZ ARG A 64 -9.363 -3.654 7.946 1.00 0.00 C ATOM 189 NH1 ARG A 64 -8.223 -4.332 7.998 1.00 0.00 N ATOM 190 NH2 ARG A 64 -9.527 -2.599 8.744 1.00 0.00 N ATOM 0 H ARG A 64 -12.372 -6.251 3.252 1.00 0.00 H new ATOM 0 HA ARG A 64 -14.730 -5.608 4.848 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -12.904 -3.996 5.876 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -13.041 -5.676 6.354 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -11.212 -6.161 4.580 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -10.963 -4.427 4.527 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -10.830 -6.090 7.086 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.427 -5.654 6.130 1.00 0.00 H new ATOM 0 HE ARG A 64 -11.110 -3.390 6.972 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.092 -5.155 7.410 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.478 -4.030 8.626 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -10.406 -2.082 8.732 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.773 -2.308 9.367 1.00 0.00 H new ATOM 204 N LYS A 65 -14.904 -3.118 4.246 1.00 0.00 N ATOM 205 CA LYS A 65 -15.143 -1.726 3.886 1.00 0.00 C ATOM 206 C LYS A 65 -14.270 -0.871 4.783 1.00 0.00 C ATOM 207 O LYS A 65 -14.223 -1.153 5.983 1.00 0.00 O ATOM 208 CB LYS A 65 -16.606 -1.374 4.186 1.00 0.00 C ATOM 209 CG LYS A 65 -17.086 -0.132 3.422 1.00 0.00 C ATOM 210 CD LYS A 65 -18.251 0.583 4.110 1.00 0.00 C ATOM 211 CE LYS A 65 -19.238 -0.325 4.839 1.00 0.00 C ATOM 212 NZ LYS A 65 -20.123 0.449 5.707 1.00 0.00 N ATOM 0 H LYS A 65 -15.450 -3.401 5.060 1.00 0.00 H new ATOM 0 HA LYS A 65 -14.925 -1.561 2.831 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -17.240 -2.222 3.927 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -16.722 -1.204 5.256 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.254 0.564 3.313 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -17.390 -0.426 2.417 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -17.845 1.298 4.825 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -18.796 1.157 3.361 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -19.831 -0.880 4.112 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.692 -1.059 5.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.512 -0.170 6.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.586 1.222 6.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -20.902 0.846 5.143 1.00 0.00 H new ATOM 226 N LEU A 66 -13.588 0.124 4.223 1.00 0.00 N ATOM 227 CA LEU A 66 -12.741 1.034 4.968 1.00 0.00 C ATOM 228 C LEU A 66 -13.335 2.427 4.802 1.00 0.00 C ATOM 229 O LEU A 66 -13.689 2.847 3.698 1.00 0.00 O ATOM 230 CB LEU A 66 -11.310 1.017 4.415 1.00 0.00 C ATOM 231 CG LEU A 66 -10.467 -0.254 4.601 1.00 0.00 C ATOM 232 CD1 LEU A 66 -9.902 -0.289 6.014 1.00 0.00 C ATOM 233 CD2 LEU A 66 -11.179 -1.589 4.424 1.00 0.00 C ATOM 0 H LEU A 66 -13.613 0.319 3.222 1.00 0.00 H new ATOM 0 HA LEU A 66 -12.697 0.740 6.017 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.365 1.225 3.346 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.768 1.844 4.873 1.00 0.00 H new ATOM 0 HG LEU A 66 -9.725 -0.171 3.806 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -9.304 -1.191 6.145 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.276 0.588 6.177 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -10.721 -0.289 6.733 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -10.471 -2.403 4.582 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -11.990 -1.668 5.148 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.586 -1.653 3.415 1.00 0.00 H new ATOM 245 N ASP A 67 -13.389 3.183 5.884 1.00 0.00 N ATOM 246 CA ASP A 67 -13.985 4.525 5.917 1.00 0.00 C ATOM 247 C ASP A 67 -12.955 5.586 5.476 1.00 0.00 C ATOM 248 O ASP A 67 -12.851 6.679 6.030 1.00 0.00 O ATOM 249 CB ASP A 67 -14.708 4.804 7.252 1.00 0.00 C ATOM 250 CG ASP A 67 -16.184 4.394 7.222 1.00 0.00 C ATOM 251 OD1 ASP A 67 -16.661 3.712 6.277 1.00 0.00 O ATOM 252 OD2 ASP A 67 -16.909 4.745 8.181 1.00 0.00 O ATOM 0 H ASP A 67 -13.016 2.885 6.785 1.00 0.00 H new ATOM 0 HA ASP A 67 -14.786 4.585 5.180 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -14.202 4.266 8.054 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -14.635 5.866 7.485 1.00 0.00 H new ATOM 257 N ILE A 68 -12.216 5.299 4.400 1.00 0.00 N ATOM 258 CA ILE A 68 -11.301 6.227 3.718 1.00 0.00 C ATOM 259 C ILE A 68 -12.220 7.134 2.873 1.00 0.00 C ATOM 260 O ILE A 68 -13.330 6.721 2.508 1.00 0.00 O ATOM 261 CB ILE A 68 -10.304 5.444 2.802 1.00 0.00 C ATOM 262 CG1 ILE A 68 -9.662 4.209 3.492 1.00 0.00 C ATOM 263 CG2 ILE A 68 -9.195 6.358 2.238 1.00 0.00 C ATOM 264 CD1 ILE A 68 -8.839 3.285 2.583 1.00 0.00 C ATOM 0 H ILE A 68 -12.238 4.379 3.961 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.693 6.797 4.420 1.00 0.00 H new ATOM 0 HB ILE A 68 -10.916 5.075 1.979 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.018 4.561 4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -10.456 3.621 3.952 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -8.526 5.772 1.608 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -9.646 7.154 1.646 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -8.629 6.794 3.061 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -8.439 2.458 3.170 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -9.476 2.892 1.791 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -8.016 3.847 2.142 1.00 0.00 H new ATOM 276 N ASP A 69 -11.823 8.381 2.604 1.00 0.00 N ATOM 277 CA ASP A 69 -12.637 9.315 1.826 1.00 0.00 C ATOM 278 C ASP A 69 -12.199 9.347 0.363 1.00 0.00 C ATOM 279 O ASP A 69 -11.010 9.441 0.050 1.00 0.00 O ATOM 280 CB ASP A 69 -12.603 10.725 2.415 1.00 0.00 C ATOM 281 CG ASP A 69 -13.183 11.725 1.413 1.00 0.00 C ATOM 282 OD1 ASP A 69 -14.388 11.634 1.086 1.00 0.00 O ATOM 283 OD2 ASP A 69 -12.417 12.554 0.870 1.00 0.00 O ATOM 0 H ASP A 69 -10.933 8.768 2.918 1.00 0.00 H new ATOM 0 HA ASP A 69 -13.664 8.953 1.874 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -13.174 10.754 3.343 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -11.578 11.000 2.663 1.00 0.00 H new ATOM 288 N PHE A 70 -13.186 9.366 -0.528 1.00 0.00 N ATOM 289 CA PHE A 70 -13.063 9.357 -1.978 1.00 0.00 C ATOM 290 C PHE A 70 -13.700 10.591 -2.623 1.00 0.00 C ATOM 291 O PHE A 70 -13.672 10.700 -3.854 1.00 0.00 O ATOM 292 CB PHE A 70 -13.679 8.052 -2.495 1.00 0.00 C ATOM 293 CG PHE A 70 -12.898 6.848 -2.020 1.00 0.00 C ATOM 294 CD1 PHE A 70 -11.725 6.502 -2.705 1.00 0.00 C ATOM 295 CD2 PHE A 70 -13.248 6.159 -0.841 1.00 0.00 C ATOM 296 CE1 PHE A 70 -10.891 5.494 -2.203 1.00 0.00 C ATOM 297 CE2 PHE A 70 -12.403 5.154 -0.341 1.00 0.00 C ATOM 298 CZ PHE A 70 -11.215 4.828 -1.015 1.00 0.00 C ATOM 0 H PHE A 70 -14.162 9.390 -0.232 1.00 0.00 H new ATOM 0 HA PHE A 70 -12.010 9.403 -2.256 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -14.712 7.975 -2.155 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -13.703 8.066 -3.585 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -11.464 7.013 -3.620 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -14.164 6.403 -0.323 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -9.991 5.229 -2.737 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -12.668 4.630 0.565 1.00 0.00 H new ATOM 0 HZ PHE A 70 -10.556 4.069 -0.620 1.00 0.00 H new ATOM 308 N GLY A 71 -14.249 11.519 -1.833 1.00 0.00 N ATOM 309 CA GLY A 71 -14.889 12.745 -2.279 1.00 0.00 C ATOM 310 C GLY A 71 -16.392 12.642 -2.045 1.00 0.00 C ATOM 311 O GLY A 71 -16.841 12.806 -0.914 1.00 0.00 O ATOM 0 H GLY A 71 -14.256 11.424 -0.817 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -14.483 13.599 -1.737 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -14.684 12.912 -3.337 1.00 0.00 H new ATOM 315 N ALA A 72 -17.165 12.320 -3.082 1.00 0.00 N ATOM 316 CA ALA A 72 -18.602 12.077 -2.992 1.00 0.00 C ATOM 317 C ALA A 72 -18.877 10.653 -3.464 1.00 0.00 C ATOM 318 O ALA A 72 -18.868 9.711 -2.669 1.00 0.00 O ATOM 319 CB ALA A 72 -19.365 13.128 -3.822 1.00 0.00 C ATOM 0 H ALA A 72 -16.800 12.219 -4.029 1.00 0.00 H new ATOM 0 HA ALA A 72 -18.951 12.173 -1.964 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -20.436 12.940 -3.750 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -19.144 14.124 -3.439 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -19.054 13.063 -4.865 1.00 0.00 H new ATOM 325 N GLU A 73 -19.036 10.515 -4.780 1.00 0.00 N ATOM 326 CA GLU A 73 -19.494 9.343 -5.511 1.00 0.00 C ATOM 327 C GLU A 73 -18.742 8.092 -5.086 1.00 0.00 C ATOM 328 O GLU A 73 -19.348 7.043 -4.892 1.00 0.00 O ATOM 329 CB GLU A 73 -19.231 9.571 -7.002 1.00 0.00 C ATOM 330 CG GLU A 73 -19.860 10.804 -7.628 1.00 0.00 C ATOM 331 CD GLU A 73 -21.366 10.711 -7.898 1.00 0.00 C ATOM 332 OE1 GLU A 73 -22.043 9.803 -7.378 1.00 0.00 O ATOM 333 OE2 GLU A 73 -21.856 11.486 -8.754 1.00 0.00 O ATOM 0 H GLU A 73 -18.829 11.288 -5.412 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.555 9.201 -5.304 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -18.153 9.626 -7.152 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -19.584 8.696 -7.547 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -19.678 11.656 -6.973 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -19.352 11.012 -8.570 1.00 0.00 H new ATOM 340 N GLY A 74 -17.416 8.187 -4.957 1.00 0.00 N ATOM 341 CA GLY A 74 -16.590 7.032 -4.675 1.00 0.00 C ATOM 342 C GLY A 74 -16.922 6.407 -3.324 1.00 0.00 C ATOM 343 O GLY A 74 -16.913 5.185 -3.220 1.00 0.00 O ATOM 0 H GLY A 74 -16.898 9.061 -5.046 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -16.725 6.289 -5.461 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -15.540 7.325 -4.691 1.00 0.00 H new ATOM 347 N ASN A 75 -17.269 7.218 -2.318 1.00 0.00 N ATOM 348 CA ASN A 75 -17.645 6.733 -0.989 1.00 0.00 C ATOM 349 C ASN A 75 -18.933 5.934 -1.101 1.00 0.00 C ATOM 350 O ASN A 75 -19.035 4.823 -0.573 1.00 0.00 O ATOM 351 CB ASN A 75 -17.877 7.892 -0.009 1.00 0.00 C ATOM 352 CG ASN A 75 -16.680 8.805 0.105 1.00 0.00 C ATOM 353 OD1 ASN A 75 -15.627 8.422 0.593 1.00 0.00 O ATOM 354 ND2 ASN A 75 -16.815 10.012 -0.403 1.00 0.00 N ATOM 0 H ASN A 75 -17.296 8.234 -2.405 1.00 0.00 H new ATOM 0 HA ASN A 75 -16.829 6.117 -0.611 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -18.741 8.471 -0.335 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -18.116 7.489 0.975 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -16.027 10.659 -0.397 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -17.708 10.300 -0.803 1.00 0.00 H new ATOM 361 N ARG A 76 -19.915 6.511 -1.800 1.00 0.00 N ATOM 362 CA ARG A 76 -21.207 5.889 -2.049 1.00 0.00 C ATOM 363 C ARG A 76 -21.031 4.570 -2.786 1.00 0.00 C ATOM 364 O ARG A 76 -21.655 3.576 -2.418 1.00 0.00 O ATOM 365 CB ARG A 76 -22.096 6.855 -2.845 1.00 0.00 C ATOM 366 CG ARG A 76 -22.713 7.942 -1.958 1.00 0.00 C ATOM 367 CD ARG A 76 -24.116 7.570 -1.471 1.00 0.00 C ATOM 368 NE ARG A 76 -24.136 6.411 -0.562 1.00 0.00 N ATOM 369 CZ ARG A 76 -25.154 6.102 0.247 1.00 0.00 C ATOM 370 NH1 ARG A 76 -26.306 6.762 0.173 1.00 0.00 N ATOM 371 NH2 ARG A 76 -25.001 5.125 1.130 1.00 0.00 N ATOM 0 H ARG A 76 -19.827 7.439 -2.213 1.00 0.00 H new ATOM 0 HA ARG A 76 -21.692 5.672 -1.097 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -21.506 7.323 -3.632 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -22.892 6.293 -3.334 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -22.067 8.115 -1.098 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -22.761 8.878 -2.515 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -24.554 8.428 -0.962 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -24.746 7.355 -2.334 1.00 0.00 H new ATOM 0 HE ARG A 76 -23.317 5.803 -0.549 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -26.420 7.514 -0.507 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -27.075 6.517 0.796 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -24.116 4.621 1.185 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -25.768 4.877 1.755 1.00 0.00 H new ATOM 385 N TYR A 77 -20.206 4.557 -3.830 1.00 0.00 N ATOM 386 CA TYR A 77 -19.933 3.361 -4.601 1.00 0.00 C ATOM 387 C TYR A 77 -19.198 2.314 -3.772 1.00 0.00 C ATOM 388 O TYR A 77 -19.450 1.121 -3.917 1.00 0.00 O ATOM 389 CB TYR A 77 -19.113 3.766 -5.832 1.00 0.00 C ATOM 390 CG TYR A 77 -19.452 2.973 -7.064 1.00 0.00 C ATOM 391 CD1 TYR A 77 -20.775 3.004 -7.537 1.00 0.00 C ATOM 392 CD2 TYR A 77 -18.449 2.305 -7.791 1.00 0.00 C ATOM 393 CE1 TYR A 77 -21.112 2.336 -8.717 1.00 0.00 C ATOM 394 CE2 TYR A 77 -18.770 1.715 -9.024 1.00 0.00 C ATOM 395 CZ TYR A 77 -20.105 1.694 -9.465 1.00 0.00 C ATOM 396 OH TYR A 77 -20.409 1.079 -10.630 1.00 0.00 O ATOM 0 H TYR A 77 -19.709 5.384 -4.161 1.00 0.00 H new ATOM 0 HA TYR A 77 -20.873 2.904 -4.911 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -19.275 4.825 -6.035 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -18.053 3.642 -5.610 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -21.532 3.545 -6.988 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -17.442 2.247 -7.404 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -22.138 2.312 -9.054 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -17.992 1.278 -9.633 1.00 0.00 H new ATOM 0 HH TYR A 77 -19.597 0.689 -11.016 1.00 0.00 H new ATOM 406 N TYR A 78 -18.301 2.736 -2.877 1.00 0.00 N ATOM 407 CA TYR A 78 -17.549 1.828 -2.030 1.00 0.00 C ATOM 408 C TYR A 78 -18.509 0.996 -1.188 1.00 0.00 C ATOM 409 O TYR A 78 -18.459 -0.227 -1.243 1.00 0.00 O ATOM 410 CB TYR A 78 -16.563 2.609 -1.157 1.00 0.00 C ATOM 411 CG TYR A 78 -15.413 1.846 -0.544 1.00 0.00 C ATOM 412 CD1 TYR A 78 -15.176 0.482 -0.800 1.00 0.00 C ATOM 413 CD2 TYR A 78 -14.551 2.555 0.302 1.00 0.00 C ATOM 414 CE1 TYR A 78 -14.117 -0.184 -0.159 1.00 0.00 C ATOM 415 CE2 TYR A 78 -13.474 1.905 0.917 1.00 0.00 C ATOM 416 CZ TYR A 78 -13.290 0.525 0.733 1.00 0.00 C ATOM 417 OH TYR A 78 -12.339 -0.108 1.458 1.00 0.00 O ATOM 0 H TYR A 78 -18.081 3.720 -2.725 1.00 0.00 H new ATOM 0 HA TYR A 78 -16.968 1.148 -2.652 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -16.147 3.416 -1.760 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -17.126 3.074 -0.348 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -15.810 -0.054 -1.491 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -14.718 3.607 0.481 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.939 -1.232 -0.349 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -12.785 2.465 1.532 1.00 0.00 H new ATOM 0 HH TYR A 78 -12.014 -0.888 0.961 1.00 0.00 H new ATOM 427 N GLU A 79 -19.442 1.636 -0.481 1.00 0.00 N ATOM 428 CA GLU A 79 -20.464 0.976 0.337 1.00 0.00 C ATOM 429 C GLU A 79 -21.276 -0.045 -0.462 1.00 0.00 C ATOM 430 O GLU A 79 -21.835 -0.985 0.113 1.00 0.00 O ATOM 431 CB GLU A 79 -21.418 2.055 0.855 1.00 0.00 C ATOM 432 CG GLU A 79 -20.761 2.881 1.960 1.00 0.00 C ATOM 433 CD GLU A 79 -21.254 2.501 3.363 1.00 0.00 C ATOM 434 OE1 GLU A 79 -21.592 1.326 3.622 1.00 0.00 O ATOM 435 OE2 GLU A 79 -21.334 3.378 4.255 1.00 0.00 O ATOM 0 H GLU A 79 -19.510 2.653 -0.460 1.00 0.00 H new ATOM 0 HA GLU A 79 -19.965 0.444 1.147 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -21.714 2.709 0.034 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -22.327 1.590 1.235 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -19.680 2.748 1.912 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -20.961 3.938 1.784 1.00 0.00 H new ATOM 442 N ALA A 80 -21.336 0.111 -1.783 1.00 0.00 N ATOM 443 CA ALA A 80 -22.063 -0.803 -2.633 1.00 0.00 C ATOM 444 C ALA A 80 -21.331 -2.130 -2.878 1.00 0.00 C ATOM 445 O ALA A 80 -21.988 -3.169 -3.012 1.00 0.00 O ATOM 446 CB ALA A 80 -22.451 -0.104 -3.951 1.00 0.00 C ATOM 0 H ALA A 80 -20.881 0.874 -2.284 1.00 0.00 H new ATOM 0 HA ALA A 80 -22.973 -1.080 -2.101 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -22.999 -0.801 -4.585 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -23.080 0.759 -3.734 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -21.549 0.225 -4.468 1.00 0.00 H new ATOM 452 N ASN A 81 -19.996 -2.140 -2.931 1.00 0.00 N ATOM 453 CA ASN A 81 -19.229 -3.304 -3.405 1.00 0.00 C ATOM 454 C ASN A 81 -17.815 -3.364 -2.833 1.00 0.00 C ATOM 455 O ASN A 81 -16.892 -3.892 -3.444 1.00 0.00 O ATOM 456 CB ASN A 81 -19.256 -3.415 -4.942 1.00 0.00 C ATOM 457 CG ASN A 81 -19.350 -2.094 -5.674 1.00 0.00 C ATOM 458 OD1 ASN A 81 -20.387 -1.791 -6.254 1.00 0.00 O ATOM 459 ND2 ASN A 81 -18.311 -1.288 -5.621 1.00 0.00 N ATOM 0 H ASN A 81 -19.416 -1.349 -2.650 1.00 0.00 H new ATOM 0 HA ASN A 81 -19.734 -4.188 -3.014 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -18.355 -3.932 -5.270 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -20.104 -4.036 -5.232 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -18.351 -0.374 -6.073 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -17.466 -1.577 -5.128 1.00 0.00 H new ATOM 466 N TYR A 82 -17.634 -2.857 -1.623 1.00 0.00 N ATOM 467 CA TYR A 82 -16.365 -2.817 -0.911 1.00 0.00 C ATOM 468 C TYR A 82 -15.680 -4.171 -0.753 1.00 0.00 C ATOM 469 O TYR A 82 -14.457 -4.238 -0.718 1.00 0.00 O ATOM 470 CB TYR A 82 -16.626 -2.235 0.476 1.00 0.00 C ATOM 471 CG TYR A 82 -17.731 -2.931 1.246 1.00 0.00 C ATOM 472 CD1 TYR A 82 -17.418 -4.078 1.998 1.00 0.00 C ATOM 473 CD2 TYR A 82 -19.054 -2.437 1.224 1.00 0.00 C ATOM 474 CE1 TYR A 82 -18.414 -4.740 2.728 1.00 0.00 C ATOM 475 CE2 TYR A 82 -20.030 -3.041 2.034 1.00 0.00 C ATOM 476 CZ TYR A 82 -19.718 -4.208 2.771 1.00 0.00 C ATOM 477 OH TYR A 82 -20.672 -4.869 3.474 1.00 0.00 O ATOM 0 H TYR A 82 -18.399 -2.445 -1.088 1.00 0.00 H new ATOM 0 HA TYR A 82 -15.687 -2.207 -1.508 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -15.706 -2.286 1.058 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -16.880 -1.180 0.373 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -16.404 -4.450 2.013 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -19.313 -1.602 0.590 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -18.183 -5.654 3.255 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -21.020 -2.614 2.094 1.00 0.00 H new ATOM 0 HH TYR A 82 -21.520 -4.382 3.413 1.00 0.00 H new ATOM 487 N TRP A 83 -16.453 -5.253 -0.686 1.00 0.00 N ATOM 488 CA TRP A 83 -15.946 -6.615 -0.605 1.00 0.00 C ATOM 489 C TRP A 83 -15.005 -6.947 -1.768 1.00 0.00 C ATOM 490 O TRP A 83 -14.146 -7.813 -1.631 1.00 0.00 O ATOM 491 CB TRP A 83 -17.137 -7.567 -0.498 1.00 0.00 C ATOM 492 CG TRP A 83 -18.216 -7.436 -1.535 1.00 0.00 C ATOM 493 CD1 TRP A 83 -19.206 -6.517 -1.558 1.00 0.00 C ATOM 494 CD2 TRP A 83 -18.478 -8.313 -2.662 1.00 0.00 C ATOM 495 NE1 TRP A 83 -20.095 -6.803 -2.573 1.00 0.00 N ATOM 496 CE2 TRP A 83 -19.701 -7.922 -3.280 1.00 0.00 C ATOM 497 CE3 TRP A 83 -17.805 -9.422 -3.196 1.00 0.00 C ATOM 498 CZ2 TRP A 83 -20.261 -8.649 -4.342 1.00 0.00 C ATOM 499 CZ3 TRP A 83 -18.359 -10.166 -4.256 1.00 0.00 C ATOM 500 CH2 TRP A 83 -19.594 -9.791 -4.820 1.00 0.00 C ATOM 0 H TRP A 83 -17.472 -5.203 -0.687 1.00 0.00 H new ATOM 0 HA TRP A 83 -15.331 -6.730 0.287 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -16.757 -8.588 -0.533 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -17.592 -7.429 0.483 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -19.289 -5.680 -0.880 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -20.934 -6.259 -2.775 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -16.847 -9.710 -2.788 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -21.194 -8.335 -4.787 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -17.834 -11.029 -4.638 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -20.027 -10.378 -5.616 1.00 0.00 H new ATOM 511 N GLN A 84 -15.116 -6.217 -2.879 1.00 0.00 N ATOM 512 CA GLN A 84 -14.314 -6.413 -4.073 1.00 0.00 C ATOM 513 C GLN A 84 -12.963 -5.688 -4.021 1.00 0.00 C ATOM 514 O GLN A 84 -12.205 -5.787 -4.983 1.00 0.00 O ATOM 515 CB GLN A 84 -15.116 -5.981 -5.309 1.00 0.00 C ATOM 516 CG GLN A 84 -16.550 -6.557 -5.338 1.00 0.00 C ATOM 517 CD GLN A 84 -16.961 -7.154 -6.684 1.00 0.00 C ATOM 518 OE1 GLN A 84 -16.376 -6.910 -7.739 1.00 0.00 O ATOM 519 NE2 GLN A 84 -17.970 -8.004 -6.668 1.00 0.00 N ATOM 0 H GLN A 84 -15.787 -5.454 -2.969 1.00 0.00 H new ATOM 0 HA GLN A 84 -14.082 -7.476 -4.135 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.168 -4.893 -5.338 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -14.586 -6.298 -6.207 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -16.635 -7.327 -4.571 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -17.252 -5.766 -5.075 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -18.454 -8.205 -5.793 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -18.266 -8.460 -7.531 1.00 0.00 H new ATOM 528 N PHE A 85 -12.641 -4.957 -2.949 1.00 0.00 N ATOM 529 CA PHE A 85 -11.501 -4.043 -2.920 1.00 0.00 C ATOM 530 C PHE A 85 -10.411 -4.534 -1.960 1.00 0.00 C ATOM 531 O PHE A 85 -10.695 -5.305 -1.036 1.00 0.00 O ATOM 532 CB PHE A 85 -11.993 -2.641 -2.538 1.00 0.00 C ATOM 533 CG PHE A 85 -12.714 -1.906 -3.650 1.00 0.00 C ATOM 534 CD1 PHE A 85 -13.998 -2.315 -4.061 1.00 0.00 C ATOM 535 CD2 PHE A 85 -12.100 -0.806 -4.275 1.00 0.00 C ATOM 536 CE1 PHE A 85 -14.679 -1.596 -5.057 1.00 0.00 C ATOM 537 CE2 PHE A 85 -12.781 -0.094 -5.273 1.00 0.00 C ATOM 538 CZ PHE A 85 -14.078 -0.470 -5.644 1.00 0.00 C ATOM 0 H PHE A 85 -13.167 -4.985 -2.076 1.00 0.00 H new ATOM 0 HA PHE A 85 -11.049 -4.006 -3.911 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -12.662 -2.725 -1.681 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -11.139 -2.044 -2.219 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -14.459 -3.182 -3.610 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -11.103 -0.509 -3.986 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -15.664 -1.908 -5.371 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.304 0.746 -5.756 1.00 0.00 H new ATOM 0 HZ PHE A 85 -14.617 0.106 -6.382 1.00 0.00 H new ATOM 548 N PRO A 86 -9.148 -4.106 -2.159 1.00 0.00 N ATOM 549 CA PRO A 86 -8.039 -4.451 -1.281 1.00 0.00 C ATOM 550 C PRO A 86 -8.219 -3.823 0.106 1.00 0.00 C ATOM 551 O PRO A 86 -9.201 -3.133 0.380 1.00 0.00 O ATOM 552 CB PRO A 86 -6.771 -4.001 -2.007 1.00 0.00 C ATOM 553 CG PRO A 86 -7.258 -2.867 -2.894 1.00 0.00 C ATOM 554 CD PRO A 86 -8.669 -3.305 -3.273 1.00 0.00 C ATOM 0 HA PRO A 86 -7.982 -5.522 -1.084 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -6.006 -3.664 -1.308 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -6.334 -4.810 -2.592 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -7.260 -1.914 -2.365 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -6.625 -2.742 -3.773 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.314 -2.443 -3.440 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -8.664 -3.883 -4.197 1.00 0.00 H new ATOM 562 N ASP A 87 -7.262 -4.084 0.993 1.00 0.00 N ATOM 563 CA ASP A 87 -7.287 -3.626 2.385 1.00 0.00 C ATOM 564 C ASP A 87 -5.912 -3.083 2.770 1.00 0.00 C ATOM 565 O ASP A 87 -5.780 -1.977 3.293 1.00 0.00 O ATOM 566 CB ASP A 87 -7.697 -4.790 3.295 1.00 0.00 C ATOM 567 CG ASP A 87 -7.616 -4.383 4.762 1.00 0.00 C ATOM 568 OD1 ASP A 87 -8.108 -3.295 5.111 1.00 0.00 O ATOM 569 OD2 ASP A 87 -7.130 -5.183 5.587 1.00 0.00 O ATOM 0 H ASP A 87 -6.431 -4.629 0.763 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.015 -2.823 2.502 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.713 -5.105 3.056 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.047 -5.646 3.114 1.00 0.00 H new ATOM 574 N GLY A 88 -4.877 -3.832 2.398 1.00 0.00 N ATOM 575 CA GLY A 88 -3.510 -3.378 2.312 1.00 0.00 C ATOM 576 C GLY A 88 -2.840 -4.030 1.111 1.00 0.00 C ATOM 577 O GLY A 88 -3.483 -4.777 0.358 1.00 0.00 O ATOM 0 H GLY A 88 -4.983 -4.813 2.139 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.480 -2.293 2.215 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.972 -3.631 3.225 1.00 0.00 H new ATOM 581 N ILE A 89 -1.550 -3.744 0.950 1.00 0.00 N ATOM 582 CA ILE A 89 -0.692 -4.244 -0.117 1.00 0.00 C ATOM 583 C ILE A 89 0.549 -4.856 0.533 1.00 0.00 C ATOM 584 O ILE A 89 1.016 -4.385 1.572 1.00 0.00 O ATOM 585 CB ILE A 89 -0.331 -3.103 -1.098 1.00 0.00 C ATOM 586 CG1 ILE A 89 -1.555 -2.337 -1.637 1.00 0.00 C ATOM 587 CG2 ILE A 89 0.471 -3.650 -2.283 1.00 0.00 C ATOM 588 CD1 ILE A 89 -2.477 -3.146 -2.556 1.00 0.00 C ATOM 0 H ILE A 89 -1.052 -3.127 1.592 1.00 0.00 H new ATOM 0 HA ILE A 89 -1.204 -5.007 -0.704 1.00 0.00 H new ATOM 0 HB ILE A 89 0.265 -2.397 -0.520 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.139 -1.975 -0.791 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.204 -1.460 -2.181 1.00 0.00 H new ATOM 0 HG21 ILE A 89 0.717 -2.835 -2.963 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.390 -4.109 -1.919 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.123 -4.396 -2.811 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -3.307 -2.519 -2.882 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.916 -3.486 -3.426 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.865 -4.009 -2.014 1.00 0.00 H new ATOM 600 N HIS A 90 1.104 -5.873 -0.120 1.00 0.00 N ATOM 601 CA HIS A 90 2.323 -6.580 0.263 1.00 0.00 C ATOM 602 C HIS A 90 3.585 -5.864 -0.245 1.00 0.00 C ATOM 603 O HIS A 90 4.589 -6.517 -0.527 1.00 0.00 O ATOM 604 CB HIS A 90 2.251 -8.002 -0.311 1.00 0.00 C ATOM 605 CG HIS A 90 1.027 -8.773 0.096 1.00 0.00 C ATOM 606 ND1 HIS A 90 -0.232 -8.630 -0.438 1.00 0.00 N ATOM 607 CD2 HIS A 90 0.987 -9.799 0.997 1.00 0.00 C ATOM 608 CE1 HIS A 90 -1.012 -9.564 0.119 1.00 0.00 C ATOM 609 NE2 HIS A 90 -0.331 -10.263 1.046 1.00 0.00 N ATOM 0 H HIS A 90 0.694 -6.246 -0.976 1.00 0.00 H new ATOM 0 HA HIS A 90 2.391 -6.607 1.351 1.00 0.00 H new ATOM 0 HB2 HIS A 90 2.284 -7.944 -1.399 1.00 0.00 H new ATOM 0 HB3 HIS A 90 3.136 -8.554 0.006 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -0.519 -7.939 -1.131 1.00 0.00 H new ATOM 0 HD2 HIS A 90 1.821 -10.182 1.567 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -2.047 -9.734 -0.140 1.00 0.00 H new ATOM 617 N TYR A 91 3.529 -4.558 -0.503 1.00 0.00 N ATOM 618 CA TYR A 91 4.659 -3.777 -1.000 1.00 0.00 C ATOM 619 C TYR A 91 5.240 -2.994 0.179 1.00 0.00 C ATOM 620 O TYR A 91 4.637 -2.962 1.255 1.00 0.00 O ATOM 621 CB TYR A 91 4.168 -2.856 -2.122 1.00 0.00 C ATOM 622 CG TYR A 91 5.237 -2.379 -3.081 1.00 0.00 C ATOM 623 CD1 TYR A 91 5.605 -3.187 -4.172 1.00 0.00 C ATOM 624 CD2 TYR A 91 5.840 -1.123 -2.903 1.00 0.00 C ATOM 625 CE1 TYR A 91 6.581 -2.747 -5.082 1.00 0.00 C ATOM 626 CE2 TYR A 91 6.829 -0.678 -3.798 1.00 0.00 C ATOM 627 CZ TYR A 91 7.201 -1.493 -4.892 1.00 0.00 C ATOM 628 OH TYR A 91 8.132 -1.080 -5.791 1.00 0.00 O ATOM 0 H TYR A 91 2.683 -4.005 -0.370 1.00 0.00 H new ATOM 0 HA TYR A 91 5.442 -4.411 -1.415 1.00 0.00 H new ATOM 0 HB2 TYR A 91 3.401 -3.381 -2.691 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.691 -1.985 -1.672 1.00 0.00 H new ATOM 0 HD1 TYR A 91 5.135 -4.150 -4.311 1.00 0.00 H new ATOM 0 HD2 TYR A 91 5.543 -0.496 -2.075 1.00 0.00 H new ATOM 0 HE1 TYR A 91 6.856 -3.366 -5.923 1.00 0.00 H new ATOM 0 HE2 TYR A 91 7.302 0.282 -3.651 1.00 0.00 H new ATOM 0 HH TYR A 91 8.470 -0.198 -5.530 1.00 0.00 H new ATOM 638 N ASN A 92 6.383 -2.341 -0.001 1.00 0.00 N ATOM 639 CA ASN A 92 6.965 -1.457 1.005 1.00 0.00 C ATOM 640 C ASN A 92 8.039 -0.585 0.373 1.00 0.00 C ATOM 641 O ASN A 92 8.532 -0.881 -0.717 1.00 0.00 O ATOM 642 CB ASN A 92 7.557 -2.243 2.189 1.00 0.00 C ATOM 643 CG ASN A 92 8.264 -3.531 1.771 1.00 0.00 C ATOM 644 OD1 ASN A 92 9.136 -3.555 0.903 1.00 0.00 O ATOM 645 ND2 ASN A 92 7.848 -4.663 2.322 1.00 0.00 N ATOM 0 H ASN A 92 6.936 -2.410 -0.855 1.00 0.00 H new ATOM 0 HA ASN A 92 6.164 -0.829 1.393 1.00 0.00 H new ATOM 0 HB2 ASN A 92 8.264 -1.606 2.721 1.00 0.00 H new ATOM 0 HB3 ASN A 92 6.758 -2.487 2.889 1.00 0.00 H new ATOM 0 HD21 ASN A 92 8.251 -5.552 2.026 1.00 0.00 H new ATOM 0 HD22 ASN A 92 7.125 -4.645 3.042 1.00 0.00 H new ATOM 652 N GLY A 93 8.380 0.506 1.058 1.00 0.00 N ATOM 653 CA GLY A 93 9.369 1.481 0.637 1.00 0.00 C ATOM 654 C GLY A 93 10.441 1.523 1.700 1.00 0.00 C ATOM 655 O GLY A 93 11.291 0.629 1.741 1.00 0.00 O ATOM 0 H GLY A 93 7.955 0.738 1.956 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.795 1.204 -0.327 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.912 2.463 0.513 1.00 0.00 H new ATOM 659 N CYS A 94 10.331 2.492 2.612 1.00 0.00 N ATOM 660 CA CYS A 94 11.181 2.625 3.788 1.00 0.00 C ATOM 661 C CYS A 94 12.679 2.729 3.452 1.00 0.00 C ATOM 662 O CYS A 94 13.516 2.384 4.287 1.00 0.00 O ATOM 663 CB CYS A 94 10.847 1.486 4.778 1.00 0.00 C ATOM 664 SG CYS A 94 10.139 1.865 6.415 1.00 0.00 S ATOM 0 H CYS A 94 9.625 3.226 2.547 1.00 0.00 H new ATOM 0 HA CYS A 94 10.963 3.578 4.270 1.00 0.00 H new ATOM 0 HB2 CYS A 94 10.152 0.814 4.274 1.00 0.00 H new ATOM 0 HB3 CYS A 94 11.767 0.925 4.946 1.00 0.00 H new ATOM 669 N SER A 95 13.046 3.179 2.245 1.00 0.00 N ATOM 670 CA SER A 95 14.418 3.052 1.756 1.00 0.00 C ATOM 671 C SER A 95 14.957 4.319 1.077 1.00 0.00 C ATOM 672 O SER A 95 15.991 4.276 0.404 1.00 0.00 O ATOM 673 CB SER A 95 14.506 1.794 0.884 1.00 0.00 C ATOM 674 OG SER A 95 15.738 1.146 1.113 1.00 0.00 O ATOM 0 H SER A 95 12.409 3.634 1.591 1.00 0.00 H new ATOM 0 HA SER A 95 15.086 2.936 2.609 1.00 0.00 H new ATOM 0 HB2 SER A 95 13.681 1.120 1.115 1.00 0.00 H new ATOM 0 HB3 SER A 95 14.414 2.062 -0.169 1.00 0.00 H new ATOM 0 HG SER A 95 15.793 0.341 0.556 1.00 0.00 H new ATOM 680 N GLU A 96 14.291 5.454 1.269 1.00 0.00 N ATOM 681 CA GLU A 96 14.873 6.790 1.213 1.00 0.00 C ATOM 682 C GLU A 96 14.381 7.526 2.449 1.00 0.00 C ATOM 683 O GLU A 96 13.626 6.967 3.246 1.00 0.00 O ATOM 684 CB GLU A 96 14.519 7.512 -0.105 1.00 0.00 C ATOM 685 CG GLU A 96 15.569 7.201 -1.173 1.00 0.00 C ATOM 686 CD GLU A 96 15.434 8.075 -2.416 1.00 0.00 C ATOM 687 OE1 GLU A 96 14.479 7.870 -3.195 1.00 0.00 O ATOM 688 OE2 GLU A 96 16.358 8.873 -2.700 1.00 0.00 O ATOM 0 H GLU A 96 13.292 5.468 1.476 1.00 0.00 H new ATOM 0 HA GLU A 96 15.962 6.749 1.216 1.00 0.00 H new ATOM 0 HB2 GLU A 96 13.534 7.196 -0.449 1.00 0.00 H new ATOM 0 HB3 GLU A 96 14.467 8.588 0.063 1.00 0.00 H new ATOM 0 HG2 GLU A 96 16.563 7.336 -0.747 1.00 0.00 H new ATOM 0 HG3 GLU A 96 15.486 6.153 -1.462 1.00 0.00 H new ATOM 695 N ALA A 97 14.836 8.757 2.636 1.00 0.00 N ATOM 696 CA ALA A 97 14.354 9.669 3.660 1.00 0.00 C ATOM 697 C ALA A 97 13.785 10.941 3.022 1.00 0.00 C ATOM 698 O ALA A 97 13.261 11.800 3.735 1.00 0.00 O ATOM 699 CB ALA A 97 15.514 9.971 4.601 1.00 0.00 C ATOM 0 H ALA A 97 15.575 9.160 2.060 1.00 0.00 H new ATOM 0 HA ALA A 97 13.540 9.217 4.228 1.00 0.00 H new ATOM 0 HB1 ALA A 97 15.181 10.655 5.382 1.00 0.00 H new ATOM 0 HB2 ALA A 97 15.864 9.044 5.056 1.00 0.00 H new ATOM 0 HB3 ALA A 97 16.328 10.430 4.040 1.00 0.00 H new ATOM 705 N ASN A 98 13.862 11.052 1.690 1.00 0.00 N ATOM 706 CA ASN A 98 13.337 12.139 0.881 1.00 0.00 C ATOM 707 C ASN A 98 12.628 11.517 -0.323 1.00 0.00 C ATOM 708 O ASN A 98 13.194 11.425 -1.413 1.00 0.00 O ATOM 709 CB ASN A 98 14.452 13.117 0.473 1.00 0.00 C ATOM 710 CG ASN A 98 14.999 13.896 1.662 1.00 0.00 C ATOM 711 OD1 ASN A 98 15.976 13.488 2.288 1.00 0.00 O ATOM 712 ND2 ASN A 98 14.373 14.997 2.039 1.00 0.00 N ATOM 0 H ASN A 98 14.321 10.339 1.123 1.00 0.00 H new ATOM 0 HA ASN A 98 12.623 12.734 1.450 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.263 12.563 -0.000 1.00 0.00 H new ATOM 0 HB3 ASN A 98 14.066 13.815 -0.270 1.00 0.00 H new ATOM 0 HD21 ASN A 98 14.699 15.515 2.855 1.00 0.00 H new ATOM 0 HD22 ASN A 98 13.564 15.329 1.514 1.00 0.00 H new ATOM 719 N VAL A 99 11.387 11.056 -0.138 1.00 0.00 N ATOM 720 CA VAL A 99 10.572 10.488 -1.209 1.00 0.00 C ATOM 721 C VAL A 99 9.157 11.024 -1.082 1.00 0.00 C ATOM 722 O VAL A 99 8.766 11.490 -0.017 1.00 0.00 O ATOM 723 CB VAL A 99 10.671 8.959 -1.145 1.00 0.00 C ATOM 724 CG1 VAL A 99 9.881 8.409 0.043 1.00 0.00 C ATOM 725 CG2 VAL A 99 10.280 8.224 -2.417 1.00 0.00 C ATOM 0 H VAL A 99 10.919 11.068 0.768 1.00 0.00 H new ATOM 0 HA VAL A 99 10.928 10.782 -2.197 1.00 0.00 H new ATOM 0 HB VAL A 99 11.736 8.764 -1.016 1.00 0.00 H new ATOM 0 HG11 VAL A 99 9.967 7.323 0.066 1.00 0.00 H new ATOM 0 HG12 VAL A 99 10.280 8.824 0.969 1.00 0.00 H new ATOM 0 HG13 VAL A 99 8.832 8.688 -0.057 1.00 0.00 H new ATOM 0 HG21 VAL A 99 10.386 7.150 -2.264 1.00 0.00 H new ATOM 0 HG22 VAL A 99 9.244 8.454 -2.667 1.00 0.00 H new ATOM 0 HG23 VAL A 99 10.929 8.540 -3.234 1.00 0.00 H new ATOM 735 N THR A 100 8.382 10.924 -2.147 1.00 0.00 N ATOM 736 CA THR A 100 6.988 11.348 -2.169 1.00 0.00 C ATOM 737 C THR A 100 6.128 10.127 -2.464 1.00 0.00 C ATOM 738 O THR A 100 6.630 9.124 -2.979 1.00 0.00 O ATOM 739 CB THR A 100 6.793 12.473 -3.205 1.00 0.00 C ATOM 740 OG1 THR A 100 7.331 12.153 -4.477 1.00 0.00 O ATOM 741 CG2 THR A 100 7.443 13.776 -2.753 1.00 0.00 C ATOM 0 H THR A 100 8.705 10.541 -3.035 1.00 0.00 H new ATOM 0 HA THR A 100 6.688 11.760 -1.205 1.00 0.00 H new ATOM 0 HB THR A 100 5.712 12.590 -3.288 1.00 0.00 H new ATOM 0 HG1 THR A 100 7.178 12.899 -5.094 1.00 0.00 H new ATOM 0 HG21 THR A 100 7.284 14.544 -3.510 1.00 0.00 H new ATOM 0 HG22 THR A 100 6.998 14.097 -1.811 1.00 0.00 H new ATOM 0 HG23 THR A 100 8.513 13.620 -2.614 1.00 0.00 H new ATOM 749 N LYS A 101 4.816 10.199 -2.225 1.00 0.00 N ATOM 750 CA LYS A 101 3.926 9.126 -2.671 1.00 0.00 C ATOM 751 C LYS A 101 4.027 8.946 -4.183 1.00 0.00 C ATOM 752 O LYS A 101 4.002 7.825 -4.679 1.00 0.00 O ATOM 753 CB LYS A 101 2.476 9.399 -2.242 1.00 0.00 C ATOM 754 CG LYS A 101 2.323 9.208 -0.728 1.00 0.00 C ATOM 755 CD LYS A 101 0.979 9.683 -0.169 1.00 0.00 C ATOM 756 CE LYS A 101 -0.246 8.928 -0.710 1.00 0.00 C ATOM 757 NZ LYS A 101 -1.088 9.772 -1.583 1.00 0.00 N ATOM 0 H LYS A 101 4.356 10.968 -1.738 1.00 0.00 H new ATOM 0 HA LYS A 101 4.241 8.198 -2.195 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.193 10.415 -2.517 1.00 0.00 H new ATOM 0 HB3 LYS A 101 1.801 8.726 -2.770 1.00 0.00 H new ATOM 0 HG2 LYS A 101 2.449 8.151 -0.492 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.125 9.746 -0.222 1.00 0.00 H new ATOM 0 HD2 LYS A 101 0.998 9.586 0.917 1.00 0.00 H new ATOM 0 HD3 LYS A 101 0.863 10.744 -0.392 1.00 0.00 H new ATOM 0 HE2 LYS A 101 0.087 8.053 -1.267 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.844 8.565 0.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -1.900 9.218 -1.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.430 10.594 -1.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.527 10.098 -2.396 1.00 0.00 H new ATOM 771 N GLU A 102 4.252 10.027 -4.919 1.00 0.00 N ATOM 772 CA GLU A 102 4.323 9.983 -6.365 1.00 0.00 C ATOM 773 C GLU A 102 5.639 9.399 -6.879 1.00 0.00 C ATOM 774 O GLU A 102 5.791 9.196 -8.086 1.00 0.00 O ATOM 775 CB GLU A 102 4.134 11.411 -6.887 1.00 0.00 C ATOM 776 CG GLU A 102 2.695 11.643 -7.357 1.00 0.00 C ATOM 777 CD GLU A 102 1.687 11.449 -6.228 1.00 0.00 C ATOM 778 OE1 GLU A 102 1.515 12.400 -5.434 1.00 0.00 O ATOM 779 OE2 GLU A 102 1.077 10.364 -6.114 1.00 0.00 O ATOM 0 H GLU A 102 4.390 10.958 -4.525 1.00 0.00 H new ATOM 0 HA GLU A 102 3.538 9.321 -6.731 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.382 12.124 -6.101 1.00 0.00 H new ATOM 0 HB3 GLU A 102 4.823 11.594 -7.712 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.602 12.653 -7.756 1.00 0.00 H new ATOM 0 HG3 GLU A 102 2.464 10.956 -8.171 1.00 0.00 H new ATOM 786 N ALA A 103 6.580 9.130 -5.978 1.00 0.00 N ATOM 787 CA ALA A 103 7.814 8.417 -6.232 1.00 0.00 C ATOM 788 C ALA A 103 7.628 6.983 -5.723 1.00 0.00 C ATOM 789 O ALA A 103 7.598 6.038 -6.513 1.00 0.00 O ATOM 790 CB ALA A 103 8.946 9.193 -5.539 1.00 0.00 C ATOM 0 H ALA A 103 6.491 9.421 -5.004 1.00 0.00 H new ATOM 0 HA ALA A 103 8.076 8.349 -7.288 1.00 0.00 H new ATOM 0 HB1 ALA A 103 9.894 8.683 -5.710 1.00 0.00 H new ATOM 0 HB2 ALA A 103 8.998 10.202 -5.947 1.00 0.00 H new ATOM 0 HB3 ALA A 103 8.749 9.245 -4.468 1.00 0.00 H new ATOM 796 N PHE A 104 7.416 6.823 -4.415 1.00 0.00 N ATOM 797 CA PHE A 104 7.343 5.525 -3.753 1.00 0.00 C ATOM 798 C PHE A 104 6.081 4.752 -4.177 1.00 0.00 C ATOM 799 O PHE A 104 6.177 3.667 -4.754 1.00 0.00 O ATOM 800 CB PHE A 104 7.439 5.700 -2.223 1.00 0.00 C ATOM 801 CG PHE A 104 6.771 4.579 -1.452 1.00 0.00 C ATOM 802 CD1 PHE A 104 7.194 3.248 -1.628 1.00 0.00 C ATOM 803 CD2 PHE A 104 5.616 4.851 -0.699 1.00 0.00 C ATOM 804 CE1 PHE A 104 6.451 2.197 -1.068 1.00 0.00 C ATOM 805 CE2 PHE A 104 4.866 3.798 -0.157 1.00 0.00 C ATOM 806 CZ PHE A 104 5.287 2.469 -0.330 1.00 0.00 C ATOM 0 H PHE A 104 7.288 7.609 -3.777 1.00 0.00 H new ATOM 0 HA PHE A 104 8.194 4.922 -4.069 1.00 0.00 H new ATOM 0 HB2 PHE A 104 8.489 5.755 -1.935 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.981 6.649 -1.943 1.00 0.00 H new ATOM 0 HD1 PHE A 104 8.089 3.036 -2.193 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.306 5.873 -0.538 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.775 1.176 -1.205 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.962 4.009 0.395 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.718 1.659 0.103 1.00 0.00 H new ATOM 816 N VAL A 105 4.890 5.282 -3.883 1.00 0.00 N ATOM 817 CA VAL A 105 3.627 4.582 -4.107 1.00 0.00 C ATOM 818 C VAL A 105 3.423 4.371 -5.608 1.00 0.00 C ATOM 819 O VAL A 105 2.918 3.329 -6.002 1.00 0.00 O ATOM 820 CB VAL A 105 2.432 5.316 -3.457 1.00 0.00 C ATOM 821 CG1 VAL A 105 1.106 4.566 -3.602 1.00 0.00 C ATOM 822 CG2 VAL A 105 2.644 5.697 -2.002 1.00 0.00 C ATOM 0 H VAL A 105 4.777 6.213 -3.481 1.00 0.00 H new ATOM 0 HA VAL A 105 3.677 3.608 -3.620 1.00 0.00 H new ATOM 0 HB VAL A 105 2.372 6.241 -4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.311 5.137 -3.123 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.875 4.437 -4.659 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.187 3.588 -3.127 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.757 6.207 -1.626 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.822 4.798 -1.413 1.00 0.00 H new ATOM 0 HG23 VAL A 105 3.505 6.360 -1.921 1.00 0.00 H new ATOM 832 N THR A 106 3.874 5.287 -6.462 1.00 0.00 N ATOM 833 CA THR A 106 4.003 5.061 -7.893 1.00 0.00 C ATOM 834 C THR A 106 4.639 3.703 -8.208 1.00 0.00 C ATOM 835 O THR A 106 4.075 2.964 -9.013 1.00 0.00 O ATOM 836 CB THR A 106 4.774 6.234 -8.505 1.00 0.00 C ATOM 837 OG1 THR A 106 3.897 7.337 -8.582 1.00 0.00 O ATOM 838 CG2 THR A 106 5.381 5.951 -9.880 1.00 0.00 C ATOM 0 H THR A 106 4.164 6.221 -6.171 1.00 0.00 H new ATOM 0 HA THR A 106 3.012 5.019 -8.345 1.00 0.00 H new ATOM 0 HB THR A 106 5.627 6.433 -7.856 1.00 0.00 H new ATOM 0 HG1 THR A 106 4.417 8.162 -8.679 1.00 0.00 H new ATOM 0 HG21 THR A 106 5.907 6.837 -10.235 1.00 0.00 H new ATOM 0 HG22 THR A 106 6.081 5.119 -9.804 1.00 0.00 H new ATOM 0 HG23 THR A 106 4.588 5.695 -10.582 1.00 0.00 H new ATOM 846 N GLY A 107 5.773 3.357 -7.591 1.00 0.00 N ATOM 847 CA GLY A 107 6.415 2.066 -7.800 1.00 0.00 C ATOM 848 C GLY A 107 5.488 0.929 -7.373 1.00 0.00 C ATOM 849 O GLY A 107 5.310 -0.033 -8.123 1.00 0.00 O ATOM 0 H GLY A 107 6.266 3.964 -6.936 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.680 1.951 -8.851 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.343 2.019 -7.231 1.00 0.00 H new ATOM 853 N CYS A 108 4.850 1.075 -6.208 1.00 0.00 N ATOM 854 CA CYS A 108 3.864 0.125 -5.691 1.00 0.00 C ATOM 855 C CYS A 108 2.739 -0.084 -6.714 1.00 0.00 C ATOM 856 O CYS A 108 2.292 -1.207 -6.941 1.00 0.00 O ATOM 857 CB CYS A 108 3.303 0.646 -4.358 1.00 0.00 C ATOM 858 SG CYS A 108 2.148 -0.444 -3.495 1.00 0.00 S ATOM 0 H CYS A 108 5.008 1.870 -5.589 1.00 0.00 H new ATOM 0 HA CYS A 108 4.344 -0.838 -5.518 1.00 0.00 H new ATOM 0 HB2 CYS A 108 4.141 0.853 -3.692 1.00 0.00 H new ATOM 0 HB3 CYS A 108 2.802 1.596 -4.545 1.00 0.00 H new ATOM 863 N ILE A 109 2.285 0.986 -7.362 1.00 0.00 N ATOM 864 CA ILE A 109 1.177 0.987 -8.305 1.00 0.00 C ATOM 865 C ILE A 109 1.587 0.415 -9.655 1.00 0.00 C ATOM 866 O ILE A 109 0.812 -0.310 -10.276 1.00 0.00 O ATOM 867 CB ILE A 109 0.610 2.412 -8.373 1.00 0.00 C ATOM 868 CG1 ILE A 109 -0.327 2.533 -7.162 1.00 0.00 C ATOM 869 CG2 ILE A 109 -0.165 2.756 -9.649 1.00 0.00 C ATOM 870 CD1 ILE A 109 -0.362 3.963 -6.645 1.00 0.00 C ATOM 0 H ILE A 109 2.697 1.911 -7.237 1.00 0.00 H new ATOM 0 HA ILE A 109 0.382 0.324 -7.965 1.00 0.00 H new ATOM 0 HB ILE A 109 1.446 3.112 -8.373 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -1.332 2.218 -7.442 1.00 0.00 H new ATOM 0 HG13 ILE A 109 0.008 1.863 -6.370 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -0.521 3.785 -9.592 1.00 0.00 H new ATOM 0 HG22 ILE A 109 0.490 2.646 -10.513 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -1.016 2.083 -9.750 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.032 4.024 -5.787 1.00 0.00 H new ATOM 0 HD12 ILE A 109 0.641 4.266 -6.344 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -0.720 4.626 -7.433 1.00 0.00 H new ATOM 882 N ASN A 110 2.812 0.681 -10.088 1.00 0.00 N ATOM 883 CA ASN A 110 3.399 0.050 -11.268 1.00 0.00 C ATOM 884 C ASN A 110 3.634 -1.442 -11.058 1.00 0.00 C ATOM 885 O ASN A 110 3.964 -2.154 -12.004 1.00 0.00 O ATOM 886 CB ASN A 110 4.734 0.695 -11.624 1.00 0.00 C ATOM 887 CG ASN A 110 4.615 2.145 -12.053 1.00 0.00 C ATOM 888 OD1 ASN A 110 3.584 2.600 -12.542 1.00 0.00 O ATOM 889 ND2 ASN A 110 5.660 2.908 -11.827 1.00 0.00 N ATOM 0 H ASN A 110 3.434 1.346 -9.628 1.00 0.00 H new ATOM 0 HA ASN A 110 2.684 0.191 -12.079 1.00 0.00 H new ATOM 0 HB2 ASN A 110 5.398 0.634 -10.762 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.200 0.125 -12.427 1.00 0.00 H new ATOM 0 HD21 ASN A 110 5.626 3.901 -12.058 1.00 0.00 H new ATOM 0 HD22 ASN A 110 6.505 2.508 -11.420 1.00 0.00 H new ATOM 896 N ALA A 111 3.524 -1.919 -9.821 1.00 0.00 N ATOM 897 CA ALA A 111 3.731 -3.301 -9.444 1.00 0.00 C ATOM 898 C ALA A 111 2.378 -3.991 -9.213 1.00 0.00 C ATOM 899 O ALA A 111 2.172 -5.105 -9.699 1.00 0.00 O ATOM 900 CB ALA A 111 4.680 -3.301 -8.241 1.00 0.00 C ATOM 0 H ALA A 111 3.279 -1.325 -9.029 1.00 0.00 H new ATOM 0 HA ALA A 111 4.202 -3.890 -10.231 1.00 0.00 H new ATOM 0 HB1 ALA A 111 4.864 -4.327 -7.923 1.00 0.00 H new ATOM 0 HB2 ALA A 111 5.624 -2.834 -8.522 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.228 -2.742 -7.421 1.00 0.00 H new ATOM 906 N THR A 112 1.427 -3.327 -8.545 1.00 0.00 N ATOM 907 CA THR A 112 0.067 -3.823 -8.369 1.00 0.00 C ATOM 908 C THR A 112 -0.680 -3.846 -9.704 1.00 0.00 C ATOM 909 O THR A 112 -1.439 -4.779 -9.949 1.00 0.00 O ATOM 910 CB THR A 112 -0.678 -3.012 -7.292 1.00 0.00 C ATOM 911 OG1 THR A 112 -1.738 -3.754 -6.761 1.00 0.00 O ATOM 912 CG2 THR A 112 -1.300 -1.719 -7.812 1.00 0.00 C ATOM 0 H THR A 112 1.588 -2.419 -8.108 1.00 0.00 H new ATOM 0 HA THR A 112 0.115 -4.852 -8.014 1.00 0.00 H new ATOM 0 HB THR A 112 0.087 -2.777 -6.552 1.00 0.00 H new ATOM 0 HG1 THR A 112 -1.418 -4.283 -6.000 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.806 -1.205 -6.995 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.518 -1.076 -8.216 1.00 0.00 H new ATOM 0 HG23 THR A 112 -2.020 -1.951 -8.596 1.00 0.00 H new ATOM 920 N GLN A 113 -0.462 -2.883 -10.613 1.00 0.00 N ATOM 921 CA GLN A 113 -1.163 -2.924 -11.899 1.00 0.00 C ATOM 922 C GLN A 113 -0.881 -4.217 -12.665 1.00 0.00 C ATOM 923 O GLN A 113 -1.757 -4.705 -13.371 1.00 0.00 O ATOM 924 CB GLN A 113 -0.902 -1.680 -12.748 1.00 0.00 C ATOM 925 CG GLN A 113 0.531 -1.503 -13.264 1.00 0.00 C ATOM 926 CD GLN A 113 0.669 -0.153 -13.960 1.00 0.00 C ATOM 927 OE1 GLN A 113 0.888 -0.092 -15.167 1.00 0.00 O ATOM 928 NE2 GLN A 113 0.511 0.935 -13.227 1.00 0.00 N ATOM 0 H GLN A 113 0.172 -2.094 -10.487 1.00 0.00 H new ATOM 0 HA GLN A 113 -2.229 -2.919 -11.671 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -1.575 -1.703 -13.605 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -1.165 -0.801 -12.159 1.00 0.00 H new ATOM 0 HG2 GLN A 113 1.236 -1.568 -12.435 1.00 0.00 H new ATOM 0 HG3 GLN A 113 0.779 -2.307 -13.957 1.00 0.00 H new ATOM 0 HE21 GLN A 113 0.330 0.854 -12.226 1.00 0.00 H new ATOM 0 HE22 GLN A 113 0.570 1.856 -13.662 1.00 0.00 H new ATOM 937 N ALA A 114 0.304 -4.804 -12.485 1.00 0.00 N ATOM 938 CA ALA A 114 0.654 -6.098 -13.047 1.00 0.00 C ATOM 939 C ALA A 114 0.255 -7.264 -12.132 1.00 0.00 C ATOM 940 O ALA A 114 0.223 -8.405 -12.601 1.00 0.00 O ATOM 941 CB ALA A 114 2.159 -6.096 -13.298 1.00 0.00 C ATOM 0 H ALA A 114 1.054 -4.383 -11.936 1.00 0.00 H new ATOM 0 HA ALA A 114 0.103 -6.248 -13.975 1.00 0.00 H new ATOM 0 HB1 ALA A 114 2.459 -7.055 -13.721 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.410 -5.297 -13.996 1.00 0.00 H new ATOM 0 HB3 ALA A 114 2.685 -5.935 -12.357 1.00 0.00 H new ATOM 947 N ALA A 115 -0.070 -7.008 -10.858 1.00 0.00 N ATOM 948 CA ALA A 115 -0.726 -7.993 -10.005 1.00 0.00 C ATOM 949 C ALA A 115 -2.172 -8.200 -10.468 1.00 0.00 C ATOM 950 O ALA A 115 -2.663 -9.320 -10.371 1.00 0.00 O ATOM 951 CB ALA A 115 -0.685 -7.575 -8.522 1.00 0.00 C ATOM 0 H ALA A 115 0.115 -6.117 -10.397 1.00 0.00 H new ATOM 0 HA ALA A 115 -0.184 -8.934 -10.092 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -1.183 -8.332 -7.917 1.00 0.00 H new ATOM 0 HB2 ALA A 115 0.352 -7.477 -8.200 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -1.195 -6.619 -8.399 1.00 0.00 H new ATOM 957 N ASN A 116 -2.852 -7.160 -10.982 1.00 0.00 N ATOM 958 CA ASN A 116 -4.307 -7.190 -11.181 1.00 0.00 C ATOM 959 C ASN A 116 -4.752 -6.547 -12.508 1.00 0.00 C ATOM 960 O ASN A 116 -5.652 -5.701 -12.526 1.00 0.00 O ATOM 961 CB ASN A 116 -5.060 -6.564 -9.980 1.00 0.00 C ATOM 962 CG ASN A 116 -4.426 -6.717 -8.608 1.00 0.00 C ATOM 963 OD1 ASN A 116 -4.320 -7.815 -8.074 1.00 0.00 O ATOM 964 ND2 ASN A 116 -4.003 -5.617 -8.012 1.00 0.00 N ATOM 0 H ASN A 116 -2.412 -6.285 -11.268 1.00 0.00 H new ATOM 0 HA ASN A 116 -4.577 -8.244 -11.242 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -5.185 -5.499 -10.178 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -6.058 -7.001 -9.942 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -3.577 -5.670 -7.087 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -4.102 -4.715 -8.477 1.00 0.00 H new ATOM 971 N GLN A 117 -4.159 -6.918 -13.649 1.00 0.00 N ATOM 972 CA GLN A 117 -4.622 -6.392 -14.938 1.00 0.00 C ATOM 973 C GLN A 117 -6.100 -6.701 -15.170 1.00 0.00 C ATOM 974 O GLN A 117 -6.850 -5.812 -15.560 1.00 0.00 O ATOM 975 CB GLN A 117 -3.797 -6.952 -16.099 1.00 0.00 C ATOM 976 CG GLN A 117 -2.504 -6.177 -16.317 1.00 0.00 C ATOM 977 CD GLN A 117 -2.747 -4.736 -16.778 1.00 0.00 C ATOM 978 OE1 GLN A 117 -3.266 -4.496 -17.865 1.00 0.00 O ATOM 979 NE2 GLN A 117 -2.406 -3.758 -15.954 1.00 0.00 N ATOM 0 H GLN A 117 -3.374 -7.567 -13.707 1.00 0.00 H new ATOM 0 HA GLN A 117 -4.490 -5.311 -14.901 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -3.562 -7.998 -15.903 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -4.393 -6.924 -17.011 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -1.932 -6.165 -15.389 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -1.897 -6.694 -17.060 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -1.976 -3.975 -15.055 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -2.573 -2.787 -16.218 1.00 0.00 H new ATOM 988 N GLY A 118 -6.525 -7.933 -14.888 1.00 0.00 N ATOM 989 CA GLY A 118 -7.909 -8.387 -15.048 1.00 0.00 C ATOM 990 C GLY A 118 -8.912 -7.764 -14.071 1.00 0.00 C ATOM 991 O GLY A 118 -10.015 -8.290 -13.907 1.00 0.00 O ATOM 0 H GLY A 118 -5.903 -8.660 -14.534 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -8.232 -8.168 -16.066 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -7.936 -9.470 -14.931 1.00 0.00 H new ATOM 995 N GLU A 119 -8.542 -6.696 -13.367 1.00 0.00 N ATOM 996 CA GLU A 119 -9.308 -6.052 -12.336 1.00 0.00 C ATOM 997 C GLU A 119 -9.375 -4.569 -12.605 1.00 0.00 C ATOM 998 O GLU A 119 -10.471 -4.021 -12.650 1.00 0.00 O ATOM 999 CB GLU A 119 -8.636 -6.426 -11.030 1.00 0.00 C ATOM 1000 CG GLU A 119 -9.191 -5.650 -9.853 1.00 0.00 C ATOM 1001 CD GLU A 119 -8.792 -6.278 -8.519 1.00 0.00 C ATOM 1002 OE1 GLU A 119 -8.072 -7.305 -8.508 1.00 0.00 O ATOM 1003 OE2 GLU A 119 -9.269 -5.803 -7.473 1.00 0.00 O ATOM 0 H GLU A 119 -7.643 -6.240 -13.521 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.349 -6.374 -12.298 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.764 -7.494 -10.851 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -7.565 -6.243 -11.110 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.830 -4.622 -9.893 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -10.278 -5.609 -9.925 1.00 0.00 H new ATOM 1010 N PHE A 120 -8.234 -3.937 -12.857 1.00 0.00 N ATOM 1011 CA PHE A 120 -8.199 -2.515 -13.138 1.00 0.00 C ATOM 1012 C PHE A 120 -8.744 -2.130 -14.525 1.00 0.00 C ATOM 1013 O PHE A 120 -8.613 -0.965 -14.909 1.00 0.00 O ATOM 1014 CB PHE A 120 -6.762 -2.035 -12.969 1.00 0.00 C ATOM 1015 CG PHE A 120 -6.197 -2.147 -11.568 1.00 0.00 C ATOM 1016 CD1 PHE A 120 -6.801 -1.469 -10.492 1.00 0.00 C ATOM 1017 CD2 PHE A 120 -5.015 -2.875 -11.357 1.00 0.00 C ATOM 1018 CE1 PHE A 120 -6.135 -1.393 -9.257 1.00 0.00 C ATOM 1019 CE2 PHE A 120 -4.381 -2.841 -10.106 1.00 0.00 C ATOM 1020 CZ PHE A 120 -4.916 -2.064 -9.071 1.00 0.00 C ATOM 0 H PHE A 120 -7.321 -4.392 -12.871 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.867 -2.023 -12.432 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.125 -2.605 -13.645 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -6.707 -0.992 -13.282 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -7.771 -1.010 -10.615 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -4.593 -3.462 -12.159 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -6.562 -0.817 -8.449 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -3.480 -3.414 -9.941 1.00 0.00 H new ATOM 0 HZ PHE A 120 -4.391 -1.981 -8.131 1.00 0.00 H new ATOM 1030 N GLN A 121 -9.259 -3.078 -15.313 1.00 0.00 N ATOM 1031 CA GLN A 121 -9.640 -2.918 -16.708 1.00 0.00 C ATOM 1032 C GLN A 121 -11.019 -3.535 -17.022 1.00 0.00 C ATOM 1033 O GLN A 121 -11.299 -3.945 -18.156 1.00 0.00 O ATOM 1034 CB GLN A 121 -8.479 -3.509 -17.530 1.00 0.00 C ATOM 1035 CG GLN A 121 -7.800 -2.490 -18.422 1.00 0.00 C ATOM 1036 CD GLN A 121 -8.321 -2.542 -19.856 1.00 0.00 C ATOM 1037 OE1 GLN A 121 -9.525 -2.476 -20.098 1.00 0.00 O ATOM 1038 NE2 GLN A 121 -7.449 -2.724 -20.828 1.00 0.00 N ATOM 0 H GLN A 121 -9.428 -4.024 -14.972 1.00 0.00 H new ATOM 0 HA GLN A 121 -9.783 -1.869 -16.968 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -7.742 -3.936 -16.850 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -8.857 -4.326 -18.145 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -7.958 -1.491 -18.016 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -6.725 -2.668 -18.421 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -6.453 -2.777 -20.616 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -7.771 -2.812 -21.792 1.00 0.00 H new ATOM 1047 N LYS A 122 -11.903 -3.615 -16.025 1.00 0.00 N ATOM 1048 CA LYS A 122 -13.243 -4.180 -16.184 1.00 0.00 C ATOM 1049 C LYS A 122 -14.085 -3.333 -17.143 1.00 0.00 C ATOM 1050 O LYS A 122 -13.746 -2.179 -17.395 1.00 0.00 O ATOM 1051 CB LYS A 122 -13.911 -4.270 -14.805 1.00 0.00 C ATOM 1052 CG LYS A 122 -13.286 -5.365 -13.936 1.00 0.00 C ATOM 1053 CD LYS A 122 -14.364 -6.250 -13.300 1.00 0.00 C ATOM 1054 CE LYS A 122 -13.822 -7.038 -12.109 1.00 0.00 C ATOM 1055 NZ LYS A 122 -13.363 -6.147 -11.020 1.00 0.00 N ATOM 0 H LYS A 122 -11.707 -3.287 -15.079 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.165 -5.178 -16.616 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.824 -3.310 -14.297 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -14.975 -4.469 -14.930 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.619 -5.978 -14.542 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.678 -4.910 -13.154 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.199 -5.629 -12.975 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -14.753 -6.942 -14.047 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -14.598 -7.703 -11.731 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.994 -7.667 -12.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -13.373 -6.666 -10.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -12.396 -5.822 -11.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -13.997 -5.325 -10.953 1.00 0.00 H new ATOM 1069 N PRO A 123 -15.212 -3.859 -17.654 1.00 0.00 N ATOM 1070 CA PRO A 123 -16.039 -3.136 -18.614 1.00 0.00 C ATOM 1071 C PRO A 123 -16.897 -2.025 -18.008 1.00 0.00 C ATOM 1072 O PRO A 123 -17.591 -1.328 -18.744 1.00 0.00 O ATOM 1073 CB PRO A 123 -16.895 -4.196 -19.295 1.00 0.00 C ATOM 1074 CG PRO A 123 -17.031 -5.264 -18.217 1.00 0.00 C ATOM 1075 CD PRO A 123 -15.661 -5.240 -17.550 1.00 0.00 C ATOM 0 HA PRO A 123 -15.398 -2.600 -19.314 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -17.865 -3.800 -19.597 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -16.417 -4.587 -20.193 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -17.829 -5.029 -17.512 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -17.258 -6.242 -18.642 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -15.724 -5.557 -16.509 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -14.968 -5.918 -18.048 1.00 0.00 H new ATOM 1083 N ASP A 124 -16.875 -1.840 -16.693 1.00 0.00 N ATOM 1084 CA ASP A 124 -17.431 -0.664 -16.023 1.00 0.00 C ATOM 1085 C ASP A 124 -16.344 -0.167 -15.084 1.00 0.00 C ATOM 1086 O ASP A 124 -16.280 -0.543 -13.913 1.00 0.00 O ATOM 1087 CB ASP A 124 -18.760 -0.981 -15.325 1.00 0.00 C ATOM 1088 CG ASP A 124 -19.298 0.174 -14.471 1.00 0.00 C ATOM 1089 OD1 ASP A 124 -18.782 1.313 -14.535 1.00 0.00 O ATOM 1090 OD2 ASP A 124 -20.275 -0.071 -13.726 1.00 0.00 O ATOM 0 H ASP A 124 -16.463 -2.514 -16.048 1.00 0.00 H new ATOM 0 HA ASP A 124 -17.694 0.122 -16.730 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -19.503 -1.241 -16.079 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -18.628 -1.858 -14.692 1.00 0.00 H new ATOM 1095 N ASN A 125 -15.414 0.589 -15.662 1.00 0.00 N ATOM 1096 CA ASN A 125 -14.154 0.997 -15.049 1.00 0.00 C ATOM 1097 C ASN A 125 -14.261 2.426 -14.515 1.00 0.00 C ATOM 1098 O ASN A 125 -13.399 3.270 -14.773 1.00 0.00 O ATOM 1099 CB ASN A 125 -13.019 0.818 -16.082 1.00 0.00 C ATOM 1100 CG ASN A 125 -11.756 0.255 -15.451 1.00 0.00 C ATOM 1101 OD1 ASN A 125 -11.804 -0.705 -14.689 1.00 0.00 O ATOM 1102 ND2 ASN A 125 -10.602 0.795 -15.790 1.00 0.00 N ATOM 0 H ASN A 125 -15.523 0.949 -16.610 1.00 0.00 H new ATOM 0 HA ASN A 125 -13.923 0.370 -14.188 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -13.355 0.152 -16.877 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -12.795 1.779 -16.545 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -9.732 0.415 -15.417 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -10.579 1.593 -16.425 1.00 0.00 H new ATOM 1109 N LYS A 126 -15.374 2.736 -13.839 1.00 0.00 N ATOM 1110 CA LYS A 126 -15.756 4.117 -13.568 1.00 0.00 C ATOM 1111 C LYS A 126 -15.397 4.498 -12.140 1.00 0.00 C ATOM 1112 O LYS A 126 -14.250 4.847 -11.864 1.00 0.00 O ATOM 1113 CB LYS A 126 -17.234 4.334 -13.949 1.00 0.00 C ATOM 1114 CG LYS A 126 -17.481 5.754 -14.476 1.00 0.00 C ATOM 1115 CD LYS A 126 -17.211 6.876 -13.463 1.00 0.00 C ATOM 1116 CE LYS A 126 -17.329 8.199 -14.213 1.00 0.00 C ATOM 1117 NZ LYS A 126 -16.960 9.370 -13.408 1.00 0.00 N ATOM 0 H LYS A 126 -16.025 2.042 -13.471 1.00 0.00 H new ATOM 0 HA LYS A 126 -15.186 4.804 -14.194 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -17.524 3.608 -14.709 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -17.865 4.154 -13.078 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -16.852 5.916 -15.351 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -18.516 5.827 -14.810 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -17.927 6.834 -12.642 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -16.218 6.769 -13.026 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -16.693 8.163 -15.098 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -18.355 8.318 -14.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -17.064 10.232 -13.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -17.582 9.430 -12.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -15.972 9.279 -13.096 1.00 0.00 H new ATOM 1131 N LEU A 127 -16.353 4.462 -11.207 1.00 0.00 N ATOM 1132 CA LEU A 127 -16.055 4.877 -9.850 1.00 0.00 C ATOM 1133 C LEU A 127 -15.208 3.806 -9.221 1.00 0.00 C ATOM 1134 O LEU A 127 -14.293 4.144 -8.492 1.00 0.00 O ATOM 1135 CB LEU A 127 -17.301 5.084 -8.984 1.00 0.00 C ATOM 1136 CG LEU A 127 -17.678 6.534 -8.685 1.00 0.00 C ATOM 1137 CD1 LEU A 127 -16.521 7.418 -8.201 1.00 0.00 C ATOM 1138 CD2 LEU A 127 -18.328 7.217 -9.869 1.00 0.00 C ATOM 0 H LEU A 127 -17.313 4.157 -11.368 1.00 0.00 H new ATOM 0 HA LEU A 127 -15.547 5.840 -9.904 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.146 4.605 -9.478 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -17.150 4.566 -8.037 1.00 0.00 H new ATOM 0 HG LEU A 127 -18.387 6.437 -7.863 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -16.887 8.428 -8.015 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -16.109 7.006 -7.279 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.743 7.449 -8.964 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -18.577 8.245 -9.605 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -17.639 7.216 -10.713 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -19.238 6.683 -10.143 1.00 0.00 H new ATOM 1150 N HIS A 128 -15.491 2.534 -9.503 1.00 0.00 N ATOM 1151 CA HIS A 128 -14.760 1.444 -8.892 1.00 0.00 C ATOM 1152 C HIS A 128 -13.259 1.595 -9.174 1.00 0.00 C ATOM 1153 O HIS A 128 -12.467 1.419 -8.256 1.00 0.00 O ATOM 1154 CB HIS A 128 -15.379 0.100 -9.320 1.00 0.00 C ATOM 1155 CG HIS A 128 -14.393 -0.932 -9.786 1.00 0.00 C ATOM 1156 ND1 HIS A 128 -13.607 -1.741 -8.994 1.00 0.00 N ATOM 1157 CD2 HIS A 128 -14.138 -1.231 -11.094 1.00 0.00 C ATOM 1158 CE1 HIS A 128 -12.884 -2.521 -9.814 1.00 0.00 C ATOM 1159 NE2 HIS A 128 -13.214 -2.284 -11.098 1.00 0.00 N ATOM 0 H HIS A 128 -16.222 2.242 -10.151 1.00 0.00 H new ATOM 0 HA HIS A 128 -14.848 1.470 -7.806 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -15.940 -0.309 -8.480 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -16.095 0.285 -10.121 1.00 0.00 H new ATOM 0 HD1 HIS A 128 -13.580 -1.746 -7.974 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -14.567 -0.748 -11.960 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -12.143 -3.237 -9.490 1.00 0.00 H new ATOM 1167 N GLN A 129 -12.891 2.020 -10.388 1.00 0.00 N ATOM 1168 CA GLN A 129 -11.535 2.370 -10.794 1.00 0.00 C ATOM 1169 C GLN A 129 -10.995 3.552 -9.992 1.00 0.00 C ATOM 1170 O GLN A 129 -9.946 3.429 -9.360 1.00 0.00 O ATOM 1171 CB GLN A 129 -11.564 2.652 -12.295 1.00 0.00 C ATOM 1172 CG GLN A 129 -10.322 3.244 -12.943 1.00 0.00 C ATOM 1173 CD GLN A 129 -10.341 4.759 -13.142 1.00 0.00 C ATOM 1174 OE1 GLN A 129 -9.453 5.481 -12.683 1.00 0.00 O ATOM 1175 NE2 GLN A 129 -11.312 5.266 -13.883 1.00 0.00 N ATOM 0 H GLN A 129 -13.565 2.133 -11.145 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.852 1.546 -10.589 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -11.790 1.715 -12.805 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -12.395 3.330 -12.490 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.457 2.986 -12.332 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -10.179 2.770 -13.914 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -12.040 4.657 -14.256 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -11.333 6.266 -14.081 1.00 0.00 H new ATOM 1184 N GLN A 130 -11.683 4.700 -10.019 1.00 0.00 N ATOM 1185 CA GLN A 130 -11.196 5.891 -9.332 1.00 0.00 C ATOM 1186 C GLN A 130 -11.040 5.649 -7.820 1.00 0.00 C ATOM 1187 O GLN A 130 -10.031 6.057 -7.241 1.00 0.00 O ATOM 1188 CB GLN A 130 -12.109 7.104 -9.611 1.00 0.00 C ATOM 1189 CG GLN A 130 -11.668 7.916 -10.842 1.00 0.00 C ATOM 1190 CD GLN A 130 -11.897 9.417 -10.631 1.00 0.00 C ATOM 1191 OE1 GLN A 130 -10.954 10.203 -10.554 1.00 0.00 O ATOM 1192 NE2 GLN A 130 -13.144 9.834 -10.482 1.00 0.00 N ATOM 0 H GLN A 130 -12.571 4.824 -10.506 1.00 0.00 H new ATOM 0 HA GLN A 130 -10.206 6.117 -9.729 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -13.131 6.756 -9.759 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -12.117 7.755 -8.737 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -10.613 7.732 -11.043 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -12.222 7.581 -11.719 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -13.915 9.170 -10.549 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -13.334 10.820 -10.301 1.00 0.00 H new ATOM 1201 N VAL A 131 -12.004 4.965 -7.193 1.00 0.00 N ATOM 1202 CA VAL A 131 -11.918 4.484 -5.819 1.00 0.00 C ATOM 1203 C VAL A 131 -10.665 3.631 -5.703 1.00 0.00 C ATOM 1204 O VAL A 131 -9.829 3.943 -4.864 1.00 0.00 O ATOM 1205 CB VAL A 131 -13.175 3.688 -5.402 1.00 0.00 C ATOM 1206 CG1 VAL A 131 -13.056 3.097 -3.985 1.00 0.00 C ATOM 1207 CG2 VAL A 131 -14.446 4.540 -5.400 1.00 0.00 C ATOM 0 H VAL A 131 -12.887 4.727 -7.644 1.00 0.00 H new ATOM 0 HA VAL A 131 -11.863 5.335 -5.140 1.00 0.00 H new ATOM 0 HB VAL A 131 -13.244 2.898 -6.150 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -13.966 2.548 -3.742 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -12.202 2.421 -3.943 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -12.916 3.903 -3.265 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.295 3.926 -5.099 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -14.329 5.366 -4.699 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -14.621 4.935 -6.401 1.00 0.00 H new ATOM 1217 N LEU A 132 -10.518 2.584 -6.529 1.00 0.00 N ATOM 1218 CA LEU A 132 -9.428 1.621 -6.406 1.00 0.00 C ATOM 1219 C LEU A 132 -8.099 2.346 -6.348 1.00 0.00 C ATOM 1220 O LEU A 132 -7.267 2.011 -5.511 1.00 0.00 O ATOM 1221 CB LEU A 132 -9.397 0.588 -7.560 1.00 0.00 C ATOM 1222 CG LEU A 132 -9.615 -0.854 -7.082 1.00 0.00 C ATOM 1223 CD1 LEU A 132 -9.618 -1.862 -8.235 1.00 0.00 C ATOM 1224 CD2 LEU A 132 -8.581 -1.258 -6.023 1.00 0.00 C ATOM 0 H LEU A 132 -11.156 2.386 -7.300 1.00 0.00 H new ATOM 0 HA LEU A 132 -9.604 1.070 -5.482 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -10.166 0.843 -8.289 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -8.437 0.653 -8.073 1.00 0.00 H new ATOM 0 HG LEU A 132 -10.605 -0.876 -6.627 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -9.776 -2.866 -7.840 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -10.419 -1.616 -8.932 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -8.661 -1.823 -8.755 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -8.766 -2.285 -5.707 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -7.579 -1.183 -6.445 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -8.663 -0.594 -5.163 1.00 0.00 H new ATOM 1236 N TRP A 133 -7.914 3.336 -7.220 1.00 0.00 N ATOM 1237 CA TRP A 133 -6.711 4.138 -7.284 1.00 0.00 C ATOM 1238 C TRP A 133 -6.485 4.929 -5.998 1.00 0.00 C ATOM 1239 O TRP A 133 -5.455 4.737 -5.360 1.00 0.00 O ATOM 1240 CB TRP A 133 -6.726 5.005 -8.545 1.00 0.00 C ATOM 1241 CG TRP A 133 -5.468 4.921 -9.346 1.00 0.00 C ATOM 1242 CD1 TRP A 133 -4.684 5.973 -9.659 1.00 0.00 C ATOM 1243 CD2 TRP A 133 -4.801 3.736 -9.890 1.00 0.00 C ATOM 1244 NE1 TRP A 133 -3.619 5.543 -10.423 1.00 0.00 N ATOM 1245 CE2 TRP A 133 -3.699 4.187 -10.679 1.00 0.00 C ATOM 1246 CE3 TRP A 133 -4.933 2.334 -9.713 1.00 0.00 C ATOM 1247 CZ2 TRP A 133 -2.902 3.302 -11.420 1.00 0.00 C ATOM 1248 CZ3 TRP A 133 -4.139 1.442 -10.461 1.00 0.00 C ATOM 1249 CH2 TRP A 133 -3.159 1.923 -11.349 1.00 0.00 C ATOM 0 H TRP A 133 -8.615 3.602 -7.912 1.00 0.00 H new ATOM 0 HA TRP A 133 -5.848 3.477 -7.362 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -7.566 4.705 -9.172 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -6.896 6.043 -8.260 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -4.863 6.995 -9.358 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -2.869 6.148 -10.756 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -5.647 1.948 -9.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -2.100 3.677 -12.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -4.284 0.377 -10.352 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -2.607 1.235 -11.973 1.00 0.00 H new ATOM 1260 N ARG A 134 -7.424 5.783 -5.568 1.00 0.00 N ATOM 1261 CA ARG A 134 -7.239 6.532 -4.316 1.00 0.00 C ATOM 1262 C ARG A 134 -7.000 5.585 -3.139 1.00 0.00 C ATOM 1263 O ARG A 134 -6.219 5.908 -2.247 1.00 0.00 O ATOM 1264 CB ARG A 134 -8.432 7.472 -4.066 1.00 0.00 C ATOM 1265 CG ARG A 134 -8.456 8.131 -2.670 1.00 0.00 C ATOM 1266 CD ARG A 134 -7.223 9.012 -2.425 1.00 0.00 C ATOM 1267 NE ARG A 134 -7.090 9.418 -1.013 1.00 0.00 N ATOM 1268 CZ ARG A 134 -6.692 10.622 -0.586 1.00 0.00 C ATOM 1269 NH1 ARG A 134 -6.769 11.685 -1.381 1.00 0.00 N ATOM 1270 NH2 ARG A 134 -6.176 10.758 0.624 1.00 0.00 N ATOM 0 H ARG A 134 -8.300 5.971 -6.055 1.00 0.00 H new ATOM 0 HA ARG A 134 -6.348 7.152 -4.413 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.423 8.257 -4.823 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -9.355 6.909 -4.202 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -9.358 8.735 -2.570 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.505 7.356 -1.905 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -6.327 8.471 -2.730 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -7.286 9.902 -3.051 1.00 0.00 H new ATOM 0 HE ARG A 134 -7.321 8.723 -0.303 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -7.135 11.588 -2.328 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -6.462 12.597 -1.044 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -6.081 9.945 1.232 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -5.873 11.676 0.949 1.00 0.00 H new ATOM 1284 N LEU A 135 -7.667 4.432 -3.145 1.00 0.00 N ATOM 1285 CA LEU A 135 -7.566 3.424 -2.111 1.00 0.00 C ATOM 1286 C LEU A 135 -6.116 2.957 -2.101 1.00 0.00 C ATOM 1287 O LEU A 135 -5.429 3.197 -1.113 1.00 0.00 O ATOM 1288 CB LEU A 135 -8.617 2.319 -2.356 1.00 0.00 C ATOM 1289 CG LEU A 135 -9.091 1.550 -1.121 1.00 0.00 C ATOM 1290 CD1 LEU A 135 -10.586 1.216 -1.189 1.00 0.00 C ATOM 1291 CD2 LEU A 135 -8.380 0.221 -1.054 1.00 0.00 C ATOM 0 H LEU A 135 -8.309 4.174 -3.894 1.00 0.00 H new ATOM 0 HA LEU A 135 -7.798 3.799 -1.114 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -9.487 2.773 -2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -8.203 1.604 -3.066 1.00 0.00 H new ATOM 0 HG LEU A 135 -8.884 2.186 -0.260 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -10.878 0.670 -0.292 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -11.162 2.139 -1.256 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -10.782 0.601 -2.067 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -8.717 -0.328 -0.175 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -8.604 -0.357 -1.950 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -7.305 0.387 -0.989 1.00 0.00 H new ATOM 1303 N VAL A 136 -5.614 2.361 -3.190 1.00 0.00 N ATOM 1304 CA VAL A 136 -4.261 1.809 -3.251 1.00 0.00 C ATOM 1305 C VAL A 136 -3.163 2.873 -3.081 1.00 0.00 C ATOM 1306 O VAL A 136 -2.116 2.576 -2.500 1.00 0.00 O ATOM 1307 CB VAL A 136 -4.125 0.833 -4.441 1.00 0.00 C ATOM 1308 CG1 VAL A 136 -4.154 1.373 -5.847 1.00 0.00 C ATOM 1309 CG2 VAL A 136 -2.858 -0.014 -4.323 1.00 0.00 C ATOM 0 H VAL A 136 -6.141 2.249 -4.056 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.086 1.188 -2.373 1.00 0.00 H new ATOM 0 HB VAL A 136 -5.053 0.272 -4.330 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -4.046 0.551 -6.555 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -5.103 1.881 -6.022 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -3.334 2.079 -5.983 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.792 -0.690 -5.175 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.985 0.638 -4.308 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.893 -0.595 -3.401 1.00 0.00 H new ATOM 1319 N GLN A 137 -3.421 4.129 -3.457 1.00 0.00 N ATOM 1320 CA GLN A 137 -2.552 5.261 -3.131 1.00 0.00 C ATOM 1321 C GLN A 137 -2.351 5.405 -1.615 1.00 0.00 C ATOM 1322 O GLN A 137 -1.217 5.631 -1.172 1.00 0.00 O ATOM 1323 CB GLN A 137 -3.085 6.575 -3.733 1.00 0.00 C ATOM 1324 CG GLN A 137 -2.788 6.692 -5.236 1.00 0.00 C ATOM 1325 CD GLN A 137 -3.438 7.918 -5.870 1.00 0.00 C ATOM 1326 OE1 GLN A 137 -4.649 8.110 -5.818 1.00 0.00 O ATOM 1327 NE2 GLN A 137 -2.667 8.772 -6.519 1.00 0.00 N ATOM 0 H GLN A 137 -4.244 4.389 -4.000 1.00 0.00 H new ATOM 0 HA GLN A 137 -1.581 5.053 -3.580 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -4.161 6.635 -3.572 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -2.637 7.420 -3.210 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -1.709 6.739 -5.387 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -3.142 5.795 -5.743 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -1.660 8.617 -6.565 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -3.079 9.587 -6.974 1.00 0.00 H new ATOM 1336 N GLU A 138 -3.410 5.280 -0.810 1.00 0.00 N ATOM 1337 CA GLU A 138 -3.271 5.230 0.642 1.00 0.00 C ATOM 1338 C GLU A 138 -2.738 3.863 1.091 1.00 0.00 C ATOM 1339 O GLU A 138 -1.925 3.814 2.005 1.00 0.00 O ATOM 1340 CB GLU A 138 -4.583 5.604 1.354 1.00 0.00 C ATOM 1341 CG GLU A 138 -4.375 5.812 2.865 1.00 0.00 C ATOM 1342 CD GLU A 138 -3.385 6.939 3.207 1.00 0.00 C ATOM 1343 OE1 GLU A 138 -3.771 8.128 3.081 1.00 0.00 O ATOM 1344 OE2 GLU A 138 -2.224 6.658 3.590 1.00 0.00 O ATOM 0 H GLU A 138 -4.372 5.212 -1.143 1.00 0.00 H new ATOM 0 HA GLU A 138 -2.537 5.980 0.935 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -4.988 6.515 0.914 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -5.320 4.818 1.194 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -5.337 6.034 3.327 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -4.017 4.881 3.304 1.00 0.00 H new ATOM 1351 N LEU A 139 -3.114 2.749 0.454 1.00 0.00 N ATOM 1352 CA LEU A 139 -2.763 1.423 0.977 1.00 0.00 C ATOM 1353 C LEU A 139 -1.259 1.185 1.007 1.00 0.00 C ATOM 1354 O LEU A 139 -0.769 0.592 1.969 1.00 0.00 O ATOM 1355 CB LEU A 139 -3.393 0.258 0.200 1.00 0.00 C ATOM 1356 CG LEU A 139 -4.923 0.214 0.097 1.00 0.00 C ATOM 1357 CD1 LEU A 139 -5.390 -1.166 -0.365 1.00 0.00 C ATOM 1358 CD2 LEU A 139 -5.635 0.687 1.354 1.00 0.00 C ATOM 0 H LEU A 139 -3.653 2.737 -0.412 1.00 0.00 H new ATOM 0 HA LEU A 139 -3.169 1.437 1.988 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -2.989 0.273 -0.812 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -3.061 -0.672 0.662 1.00 0.00 H new ATOM 0 HG LEU A 139 -5.211 0.939 -0.665 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.478 -1.178 -0.432 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -4.963 -1.386 -1.344 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -5.062 -1.920 0.351 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.713 0.627 1.206 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -5.349 0.054 2.194 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.354 1.719 1.565 1.00 0.00 H new ATOM 1370 N CYS A 140 -0.528 1.596 -0.035 1.00 0.00 N ATOM 1371 CA CYS A 140 0.924 1.458 -0.016 1.00 0.00 C ATOM 1372 C CYS A 140 1.528 2.400 1.034 1.00 0.00 C ATOM 1373 O CYS A 140 2.533 2.058 1.656 1.00 0.00 O ATOM 1374 CB CYS A 140 1.518 1.724 -1.402 1.00 0.00 C ATOM 1375 SG CYS A 140 0.731 0.835 -2.780 1.00 0.00 S ATOM 0 H CYS A 140 -0.911 2.017 -0.882 1.00 0.00 H new ATOM 0 HA CYS A 140 1.173 0.432 0.256 1.00 0.00 H new ATOM 0 HB2 CYS A 140 1.460 2.794 -1.603 1.00 0.00 H new ATOM 0 HB3 CYS A 140 2.576 1.461 -1.381 1.00 0.00 H new ATOM 1380 N SER A 141 0.927 3.585 1.198 1.00 0.00 N ATOM 1381 CA SER A 141 1.236 4.586 2.209 1.00 0.00 C ATOM 1382 C SER A 141 1.007 4.087 3.650 1.00 0.00 C ATOM 1383 O SER A 141 1.964 3.598 4.253 1.00 0.00 O ATOM 1384 CB SER A 141 0.454 5.870 1.893 1.00 0.00 C ATOM 1385 OG SER A 141 0.715 6.315 0.576 1.00 0.00 O ATOM 0 H SER A 141 0.166 3.882 0.587 1.00 0.00 H new ATOM 0 HA SER A 141 2.304 4.801 2.167 1.00 0.00 H new ATOM 0 HB2 SER A 141 -0.614 5.688 2.014 1.00 0.00 H new ATOM 0 HB3 SER A 141 0.727 6.650 2.604 1.00 0.00 H new ATOM 0 HG SER A 141 -0.096 6.225 0.034 1.00 0.00 H new ATOM 1391 N LEU A 142 -0.200 4.295 4.208 1.00 0.00 N ATOM 1392 CA LEU A 142 -0.816 3.916 5.498 1.00 0.00 C ATOM 1393 C LEU A 142 0.107 3.669 6.706 1.00 0.00 C ATOM 1394 O LEU A 142 -0.162 2.847 7.593 1.00 0.00 O ATOM 1395 CB LEU A 142 -1.865 2.805 5.262 1.00 0.00 C ATOM 1396 CG LEU A 142 -3.273 3.295 5.655 1.00 0.00 C ATOM 1397 CD1 LEU A 142 -4.351 2.446 4.975 1.00 0.00 C ATOM 1398 CD2 LEU A 142 -3.474 3.327 7.174 1.00 0.00 C ATOM 0 H LEU A 142 -0.883 4.826 3.668 1.00 0.00 H new ATOM 0 HA LEU A 142 -1.308 4.823 5.849 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -1.857 2.507 4.214 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -1.605 1.922 5.846 1.00 0.00 H new ATOM 0 HG LEU A 142 -3.367 4.322 5.302 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -5.337 2.809 5.266 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -4.242 2.519 3.893 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -4.242 1.406 5.282 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -4.481 3.679 7.400 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -3.340 2.324 7.580 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -2.745 4.001 7.623 1.00 0.00 H new ATOM 1410 N LYS A 143 1.214 4.399 6.733 1.00 0.00 N ATOM 1411 CA LYS A 143 2.351 4.313 7.635 1.00 0.00 C ATOM 1412 C LYS A 143 3.326 5.397 7.187 1.00 0.00 C ATOM 1413 O LYS A 143 3.750 6.209 8.006 1.00 0.00 O ATOM 1414 CB LYS A 143 3.014 2.919 7.557 1.00 0.00 C ATOM 1415 CG LYS A 143 4.174 2.782 8.552 1.00 0.00 C ATOM 1416 CD LYS A 143 5.028 1.536 8.278 1.00 0.00 C ATOM 1417 CE LYS A 143 6.422 1.768 8.862 1.00 0.00 C ATOM 1418 NZ LYS A 143 7.307 0.597 8.725 1.00 0.00 N ATOM 0 H LYS A 143 1.350 5.144 6.050 1.00 0.00 H new ATOM 0 HA LYS A 143 2.044 4.455 8.671 1.00 0.00 H new ATOM 0 HB2 LYS A 143 2.268 2.150 7.760 1.00 0.00 H new ATOM 0 HB3 LYS A 143 3.381 2.747 6.545 1.00 0.00 H new ATOM 0 HG2 LYS A 143 4.803 3.671 8.499 1.00 0.00 H new ATOM 0 HG3 LYS A 143 3.777 2.733 9.566 1.00 0.00 H new ATOM 0 HD2 LYS A 143 4.570 0.656 8.729 1.00 0.00 H new ATOM 0 HD3 LYS A 143 5.092 1.349 7.206 1.00 0.00 H new ATOM 0 HE2 LYS A 143 6.880 2.623 8.365 1.00 0.00 H new ATOM 0 HE3 LYS A 143 6.330 2.025 9.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 8.236 0.814 9.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 6.888 -0.215 9.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 7.422 0.365 7.718 1.00 0.00 H new ATOM 1432 N HIS A 144 3.630 5.440 5.881 1.00 0.00 N ATOM 1433 CA HIS A 144 4.786 6.126 5.294 1.00 0.00 C ATOM 1434 C HIS A 144 6.088 5.564 5.894 1.00 0.00 C ATOM 1435 O HIS A 144 6.033 4.583 6.643 1.00 0.00 O ATOM 1436 CB HIS A 144 4.629 7.657 5.389 1.00 0.00 C ATOM 1437 CG HIS A 144 5.533 8.374 6.359 1.00 0.00 C ATOM 1438 ND1 HIS A 144 5.817 8.029 7.659 1.00 0.00 N ATOM 1439 CD2 HIS A 144 6.357 9.404 6.019 1.00 0.00 C ATOM 1440 CE1 HIS A 144 6.810 8.824 8.083 1.00 0.00 C ATOM 1441 NE2 HIS A 144 7.140 9.715 7.132 1.00 0.00 N ATOM 0 H HIS A 144 3.052 4.978 5.178 1.00 0.00 H new ATOM 0 HA HIS A 144 4.842 5.925 4.224 1.00 0.00 H new ATOM 0 HB2 HIS A 144 4.793 8.078 4.397 1.00 0.00 H new ATOM 0 HB3 HIS A 144 3.597 7.876 5.661 1.00 0.00 H new ATOM 0 HD1 HIS A 144 5.356 7.300 8.203 1.00 0.00 H new ATOM 0 HD2 HIS A 144 6.397 9.894 5.057 1.00 0.00 H new ATOM 0 HE1 HIS A 144 7.279 8.758 9.053 1.00 0.00 H new ATOM 1449 N CYS A 145 7.263 6.110 5.578 1.00 0.00 N ATOM 1450 CA CYS A 145 8.449 5.861 6.394 1.00 0.00 C ATOM 1451 C CYS A 145 9.431 7.038 6.446 1.00 0.00 C ATOM 1452 O CYS A 145 10.380 6.988 7.228 1.00 0.00 O ATOM 1453 CB CYS A 145 9.104 4.592 5.854 1.00 0.00 C ATOM 1454 SG CYS A 145 10.429 3.837 6.828 1.00 0.00 S ATOM 0 H CYS A 145 7.417 6.719 4.774 1.00 0.00 H new ATOM 0 HA CYS A 145 8.144 5.735 7.433 1.00 0.00 H new ATOM 0 HB2 CYS A 145 8.322 3.845 5.719 1.00 0.00 H new ATOM 0 HB3 CYS A 145 9.504 4.818 4.865 1.00 0.00 H new ATOM 1459 N GLU A 146 9.234 8.086 5.648 1.00 0.00 N ATOM 1460 CA GLU A 146 10.279 9.030 5.299 1.00 0.00 C ATOM 1461 C GLU A 146 10.026 10.382 5.978 1.00 0.00 C ATOM 1462 O GLU A 146 10.476 10.559 7.114 1.00 0.00 O ATOM 1463 CB GLU A 146 10.454 9.027 3.770 1.00 0.00 C ATOM 1464 CG GLU A 146 10.669 7.589 3.230 1.00 0.00 C ATOM 1465 CD GLU A 146 9.398 6.764 2.959 1.00 0.00 C ATOM 1466 OE1 GLU A 146 8.286 7.292 3.211 1.00 0.00 O ATOM 1467 OE2 GLU A 146 9.533 5.569 2.617 1.00 0.00 O ATOM 0 H GLU A 146 8.332 8.301 5.224 1.00 0.00 H new ATOM 0 HA GLU A 146 11.254 8.741 5.691 1.00 0.00 H new ATOM 0 HB2 GLU A 146 9.574 9.466 3.300 1.00 0.00 H new ATOM 0 HB3 GLU A 146 11.305 9.651 3.498 1.00 0.00 H new ATOM 0 HG2 GLU A 146 11.239 7.654 2.303 1.00 0.00 H new ATOM 0 HG3 GLU A 146 11.285 7.044 3.945 1.00 0.00 H new ATOM 1474 N PHE A 147 9.296 11.312 5.343 1.00 0.00 N ATOM 1475 CA PHE A 147 8.981 12.628 5.926 1.00 0.00 C ATOM 1476 C PHE A 147 7.492 12.981 5.891 1.00 0.00 C ATOM 1477 O PHE A 147 7.038 13.850 6.640 1.00 0.00 O ATOM 1478 CB PHE A 147 9.774 13.730 5.206 1.00 0.00 C ATOM 1479 CG PHE A 147 9.432 13.940 3.735 1.00 0.00 C ATOM 1480 CD1 PHE A 147 8.221 14.546 3.337 1.00 0.00 C ATOM 1481 CD2 PHE A 147 10.327 13.509 2.744 1.00 0.00 C ATOM 1482 CE1 PHE A 147 7.901 14.705 1.980 1.00 0.00 C ATOM 1483 CE2 PHE A 147 10.017 13.697 1.385 1.00 0.00 C ATOM 1484 CZ PHE A 147 8.813 14.302 0.999 1.00 0.00 C ATOM 0 H PHE A 147 8.907 11.174 4.410 1.00 0.00 H new ATOM 0 HA PHE A 147 9.268 12.563 6.975 1.00 0.00 H new ATOM 0 HB2 PHE A 147 9.615 14.670 5.734 1.00 0.00 H new ATOM 0 HB3 PHE A 147 10.836 13.497 5.283 1.00 0.00 H new ATOM 0 HD1 PHE A 147 7.529 14.893 4.090 1.00 0.00 H new ATOM 0 HD2 PHE A 147 11.255 13.033 3.025 1.00 0.00 H new ATOM 0 HE1 PHE A 147 6.953 15.137 1.694 1.00 0.00 H new ATOM 0 HE2 PHE A 147 10.716 13.371 0.629 1.00 0.00 H new ATOM 0 HZ PHE A 147 8.591 14.456 -0.047 1.00 0.00 H new ATOM 1494 N TRP A 148 6.734 12.383 4.976 1.00 0.00 N ATOM 1495 CA TRP A 148 5.347 12.711 4.657 1.00 0.00 C ATOM 1496 C TRP A 148 4.346 11.972 5.570 1.00 0.00 C ATOM 1497 O TRP A 148 3.330 11.438 5.114 1.00 0.00 O ATOM 1498 CB TRP A 148 5.145 12.451 3.156 1.00 0.00 C ATOM 1499 CG TRP A 148 5.690 11.152 2.629 1.00 0.00 C ATOM 1500 CD1 TRP A 148 6.986 10.889 2.332 1.00 0.00 C ATOM 1501 CD2 TRP A 148 4.973 9.908 2.371 1.00 0.00 C ATOM 1502 NE1 TRP A 148 7.113 9.567 1.961 1.00 0.00 N ATOM 1503 CE2 TRP A 148 5.905 8.922 1.940 1.00 0.00 C ATOM 1504 CE3 TRP A 148 3.635 9.491 2.500 1.00 0.00 C ATOM 1505 CZ2 TRP A 148 5.543 7.600 1.652 1.00 0.00 C ATOM 1506 CZ3 TRP A 148 3.261 8.166 2.224 1.00 0.00 C ATOM 1507 CH2 TRP A 148 4.201 7.220 1.784 1.00 0.00 C ATOM 0 H TRP A 148 7.090 11.615 4.406 1.00 0.00 H new ATOM 0 HA TRP A 148 5.143 13.763 4.858 1.00 0.00 H new ATOM 0 HB2 TRP A 148 4.077 12.486 2.943 1.00 0.00 H new ATOM 0 HB3 TRP A 148 5.608 13.267 2.601 1.00 0.00 H new ATOM 0 HD1 TRP A 148 7.794 11.604 2.379 1.00 0.00 H new ATOM 0 HE1 TRP A 148 8.001 9.122 1.730 1.00 0.00 H new ATOM 0 HE3 TRP A 148 2.885 10.201 2.816 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 6.287 6.885 1.333 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 2.231 7.869 2.353 1.00 0.00 H new ATOM 0 HH2 TRP A 148 3.893 6.212 1.550 1.00 0.00 H new