USER MOD reduce.3.24.130724 H: found=0, std=0, add=951, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 949 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.294 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -163:sc= -0.0178 (180deg=-0.251) USER MOD Single : A 10 ASN : amide:sc= -3.43! C(o=-3.4!,f=-4.9!) USER MOD Single : A 13 ASN : amide:sc= -0.108 X(o=-0.11,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.255 X(o=-0.25,f=-0.017) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -4.37! C(o=-4.4!,f=-7.7!) USER MOD Single : A 25 THR OG1 : rot -41:sc= 0.678 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.831 K(o=-0.83,f=-3.4!) USER MOD Single : A 54 HIS : no HD1:sc= -0.444 K(o=-0.44,f=-1.3) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.144 X(o=-0.14,f=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -1.9! C(o=-1.9!,f=-2.4!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 77:sc= 1.47 USER MOD Single : A 80 SER OG : rot 37:sc= 1.16 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -13:sc= -0.318 USER MOD Single : A 92 HIS : no HD1:sc= -2.34! K(o=-2.3!,f=-0.77) USER MOD Single : A 95 LYS NZ :NH3+ -107:sc= -0.41 (180deg=-2.5!) USER MOD Single : A 97 ASN : amide:sc= -1.52 K(o=-1.5,f=-0.37) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 MET CE :methyl -134:sc= -0.204 (180deg=-1.22) USER MOD Single : A 103 ASN : amide:sc= -0.461 K(o=-0.46,f=-5.1!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -1.45! C(o=-1.4!,f=-1.8!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot -10:sc= 0.929 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.896 -12.424 -9.095 1.00 0.00 N ATOM 2 CA GLY A 1 5.846 -12.596 -8.011 1.00 0.00 C ATOM 3 C GLY A 1 5.864 -11.414 -7.063 1.00 0.00 C ATOM 4 O GLY A 1 5.835 -11.586 -5.844 1.00 0.00 O ATOM 0 H1 GLY A 1 4.922 -13.259 -9.715 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.939 -12.313 -8.703 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.146 -11.577 -9.644 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.598 -13.500 -7.455 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.844 -12.740 -8.426 1.00 0.00 H new ATOM 8 N SER A 2 5.913 -10.209 -7.622 1.00 0.00 N ATOM 9 CA SER A 2 5.940 -8.993 -6.817 1.00 0.00 C ATOM 10 C SER A 2 5.082 -9.151 -5.565 1.00 0.00 C ATOM 11 O SER A 2 5.545 -8.920 -4.449 1.00 0.00 O ATOM 12 CB SER A 2 5.448 -7.800 -7.639 1.00 0.00 C ATOM 13 OG SER A 2 5.845 -6.575 -7.049 1.00 0.00 O ATOM 0 H SER A 2 5.935 -10.049 -8.629 1.00 0.00 H new ATOM 0 HA SER A 2 6.970 -8.813 -6.510 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.845 -7.864 -8.652 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.361 -7.833 -7.719 1.00 0.00 H new ATOM 0 HG SER A 2 5.520 -5.829 -7.594 1.00 0.00 H new ATOM 19 N SER A 3 3.828 -9.546 -5.761 1.00 0.00 N ATOM 20 CA SER A 3 2.902 -9.731 -4.650 1.00 0.00 C ATOM 21 C SER A 3 2.462 -11.188 -4.547 1.00 0.00 C ATOM 22 O SER A 3 2.111 -11.814 -5.546 1.00 0.00 O ATOM 23 CB SER A 3 1.680 -8.827 -4.820 1.00 0.00 C ATOM 24 OG SER A 3 0.863 -8.851 -3.662 1.00 0.00 O ATOM 0 H SER A 3 3.430 -9.744 -6.679 1.00 0.00 H new ATOM 0 HA SER A 3 3.419 -9.460 -3.729 1.00 0.00 H new ATOM 0 HB2 SER A 3 2.004 -7.806 -5.019 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.101 -9.152 -5.684 1.00 0.00 H new ATOM 0 HG SER A 3 0.090 -8.264 -3.795 1.00 0.00 H new ATOM 30 N GLY A 4 2.483 -11.722 -3.329 1.00 0.00 N ATOM 31 CA GLY A 4 2.084 -13.101 -3.117 1.00 0.00 C ATOM 32 C GLY A 4 2.084 -13.485 -1.650 1.00 0.00 C ATOM 33 O GLY A 4 3.101 -13.929 -1.118 1.00 0.00 O ATOM 0 H GLY A 4 2.769 -11.224 -2.486 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.087 -13.255 -3.530 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.760 -13.760 -3.662 1.00 0.00 H new ATOM 37 N SER A 5 0.940 -13.313 -0.995 1.00 0.00 N ATOM 38 CA SER A 5 0.813 -13.639 0.420 1.00 0.00 C ATOM 39 C SER A 5 -0.639 -13.938 0.781 1.00 0.00 C ATOM 40 O SER A 5 -1.564 -13.413 0.162 1.00 0.00 O ATOM 41 CB SER A 5 1.338 -12.488 1.280 1.00 0.00 C ATOM 42 OG SER A 5 2.631 -12.086 0.860 1.00 0.00 O ATOM 0 H SER A 5 0.088 -12.950 -1.422 1.00 0.00 H new ATOM 0 HA SER A 5 1.409 -14.530 0.617 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.653 -11.642 1.219 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.371 -12.796 2.325 1.00 0.00 H new ATOM 0 HG SER A 5 2.944 -11.348 1.424 1.00 0.00 H new ATOM 48 N SER A 6 -0.830 -14.784 1.788 1.00 0.00 N ATOM 49 CA SER A 6 -2.169 -15.156 2.230 1.00 0.00 C ATOM 50 C SER A 6 -2.838 -14.001 2.968 1.00 0.00 C ATOM 51 O SER A 6 -3.876 -13.496 2.543 1.00 0.00 O ATOM 52 CB SER A 6 -2.106 -16.387 3.137 1.00 0.00 C ATOM 53 OG SER A 6 -1.738 -17.542 2.403 1.00 0.00 O ATOM 0 H SER A 6 -0.075 -15.225 2.313 1.00 0.00 H new ATOM 0 HA SER A 6 -2.763 -15.393 1.348 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.386 -16.216 3.938 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.076 -16.545 3.608 1.00 0.00 H new ATOM 0 HG SER A 6 -1.703 -18.315 3.005 1.00 0.00 H new ATOM 59 N GLY A 7 -2.234 -13.587 4.078 1.00 0.00 N ATOM 60 CA GLY A 7 -2.785 -12.494 4.858 1.00 0.00 C ATOM 61 C GLY A 7 -4.032 -12.896 5.620 1.00 0.00 C ATOM 62 O GLY A 7 -4.885 -13.612 5.095 1.00 0.00 O ATOM 0 H GLY A 7 -1.374 -13.989 4.451 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.032 -12.138 5.561 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.021 -11.661 4.195 1.00 0.00 H new ATOM 66 N LYS A 8 -4.139 -12.437 6.862 1.00 0.00 N ATOM 67 CA LYS A 8 -5.290 -12.753 7.699 1.00 0.00 C ATOM 68 C LYS A 8 -6.013 -11.482 8.132 1.00 0.00 C ATOM 69 O LYS A 8 -5.420 -10.409 8.243 1.00 0.00 O ATOM 70 CB LYS A 8 -4.849 -13.547 8.931 1.00 0.00 C ATOM 71 CG LYS A 8 -4.132 -12.705 9.972 1.00 0.00 C ATOM 72 CD LYS A 8 -2.630 -12.699 9.747 1.00 0.00 C ATOM 73 CE LYS A 8 -2.002 -14.026 10.146 1.00 0.00 C ATOM 74 NZ LYS A 8 -2.055 -14.245 11.618 1.00 0.00 N ATOM 0 H LYS A 8 -3.441 -11.844 7.312 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.979 -13.360 7.111 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.724 -14.008 9.389 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -4.191 -14.357 8.615 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -4.510 -11.683 9.938 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -4.350 -13.092 10.967 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -2.419 -12.496 8.697 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -2.178 -11.893 10.324 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.520 -14.840 9.639 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -0.965 -14.052 9.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -1.382 -14.993 11.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.803 -13.364 12.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -3.016 -14.532 11.892 1.00 0.00 H new ATOM 88 N PRO A 9 -7.325 -11.603 8.385 1.00 0.00 N ATOM 89 CA PRO A 9 -8.156 -10.474 8.812 1.00 0.00 C ATOM 90 C PRO A 9 -7.826 -10.014 10.228 1.00 0.00 C ATOM 91 O PRO A 9 -7.947 -10.780 11.183 1.00 0.00 O ATOM 92 CB PRO A 9 -9.578 -11.037 8.751 1.00 0.00 C ATOM 93 CG PRO A 9 -9.411 -12.508 8.920 1.00 0.00 C ATOM 94 CD PRO A 9 -8.097 -12.852 8.274 1.00 0.00 C ATOM 0 HA PRO A 9 -8.003 -9.596 8.185 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -10.204 -10.617 9.538 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -10.057 -10.800 7.801 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -9.411 -12.782 9.975 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -10.231 -13.051 8.450 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -7.602 -13.677 8.785 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -8.227 -13.153 7.234 1.00 0.00 H new ATOM 102 N ASN A 10 -7.409 -8.758 10.355 1.00 0.00 N ATOM 103 CA ASN A 10 -7.061 -8.197 11.656 1.00 0.00 C ATOM 104 C ASN A 10 -8.272 -7.529 12.301 1.00 0.00 C ATOM 105 O ASN A 10 -9.377 -7.566 11.759 1.00 0.00 O ATOM 106 CB ASN A 10 -5.924 -7.184 11.509 1.00 0.00 C ATOM 107 CG ASN A 10 -4.922 -7.590 10.446 1.00 0.00 C ATOM 108 OD1 ASN A 10 -4.335 -8.670 10.511 1.00 0.00 O ATOM 109 ND2 ASN A 10 -4.721 -6.722 9.461 1.00 0.00 N ATOM 0 H ASN A 10 -7.304 -8.110 9.574 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.732 -9.012 12.300 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -6.340 -6.208 11.258 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -5.412 -7.076 12.465 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -4.057 -6.939 8.717 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -5.230 -5.838 9.448 1.00 0.00 H new ATOM 116 N LEU A 11 -8.056 -6.920 13.462 1.00 0.00 N ATOM 117 CA LEU A 11 -9.129 -6.243 14.182 1.00 0.00 C ATOM 118 C LEU A 11 -9.794 -5.189 13.303 1.00 0.00 C ATOM 119 O LEU A 11 -11.016 -5.046 13.305 1.00 0.00 O ATOM 120 CB LEU A 11 -8.584 -5.593 15.455 1.00 0.00 C ATOM 121 CG LEU A 11 -9.619 -5.230 16.520 1.00 0.00 C ATOM 122 CD1 LEU A 11 -10.715 -4.360 15.924 1.00 0.00 C ATOM 123 CD2 LEU A 11 -10.212 -6.488 17.138 1.00 0.00 C ATOM 0 H LEU A 11 -7.148 -6.881 13.925 1.00 0.00 H new ATOM 0 HA LEU A 11 -9.878 -6.987 14.453 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -7.855 -6.270 15.901 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -8.047 -4.687 15.175 1.00 0.00 H new ATOM 0 HG LEU A 11 -9.120 -4.663 17.306 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.443 -4.111 16.696 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -10.277 -3.443 15.529 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.211 -4.901 15.119 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -10.947 -6.211 17.894 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.696 -7.081 16.362 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -9.419 -7.075 17.601 1.00 0.00 H new ATOM 135 N GLY A 12 -8.981 -4.454 12.551 1.00 0.00 N ATOM 136 CA GLY A 12 -9.509 -3.423 11.676 1.00 0.00 C ATOM 137 C GLY A 12 -9.989 -3.979 10.350 1.00 0.00 C ATOM 138 O GLY A 12 -9.850 -3.334 9.312 1.00 0.00 O ATOM 0 H GLY A 12 -7.966 -4.554 12.532 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -10.335 -2.916 12.174 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -8.738 -2.674 11.495 1.00 0.00 H new ATOM 142 N ASN A 13 -10.554 -5.181 10.384 1.00 0.00 N ATOM 143 CA ASN A 13 -11.055 -5.825 9.175 1.00 0.00 C ATOM 144 C ASN A 13 -10.084 -5.632 8.014 1.00 0.00 C ATOM 145 O ASN A 13 -10.495 -5.492 6.863 1.00 0.00 O ATOM 146 CB ASN A 13 -12.429 -5.263 8.804 1.00 0.00 C ATOM 147 CG ASN A 13 -13.422 -5.364 9.945 1.00 0.00 C ATOM 148 OD1 ASN A 13 -13.768 -6.460 10.387 1.00 0.00 O ATOM 149 ND2 ASN A 13 -13.886 -4.217 10.428 1.00 0.00 N ATOM 0 H ASN A 13 -10.677 -5.729 11.235 1.00 0.00 H new ATOM 0 HA ASN A 13 -11.149 -6.893 9.374 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -12.324 -4.219 8.509 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -12.817 -5.801 7.939 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -14.557 -4.221 11.196 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -13.571 -3.332 10.031 1.00 0.00 H new ATOM 156 N GLY A 14 -8.791 -5.626 8.326 1.00 0.00 N ATOM 157 CA GLY A 14 -7.781 -5.450 7.298 1.00 0.00 C ATOM 158 C GLY A 14 -7.085 -6.749 6.941 1.00 0.00 C ATOM 159 O GLY A 14 -7.700 -7.815 6.957 1.00 0.00 O ATOM 0 H GLY A 14 -8.425 -5.740 9.271 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.245 -5.033 6.404 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -7.041 -4.727 7.640 1.00 0.00 H new ATOM 163 N ALA A 15 -5.800 -6.659 6.615 1.00 0.00 N ATOM 164 CA ALA A 15 -5.020 -7.836 6.252 1.00 0.00 C ATOM 165 C ALA A 15 -3.555 -7.665 6.641 1.00 0.00 C ATOM 166 O ALA A 15 -2.886 -6.739 6.183 1.00 0.00 O ATOM 167 CB ALA A 15 -5.144 -8.112 4.761 1.00 0.00 C ATOM 0 H ALA A 15 -5.277 -5.784 6.595 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.417 -8.689 6.802 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.557 -8.993 4.504 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.190 -8.287 4.509 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.774 -7.254 4.200 1.00 0.00 H new ATOM 173 N ASP A 16 -3.064 -8.563 7.487 1.00 0.00 N ATOM 174 CA ASP A 16 -1.678 -8.512 7.937 1.00 0.00 C ATOM 175 C ASP A 16 -0.752 -9.171 6.920 1.00 0.00 C ATOM 176 O ASP A 16 -0.826 -10.378 6.687 1.00 0.00 O ATOM 177 CB ASP A 16 -1.535 -9.199 9.296 1.00 0.00 C ATOM 178 CG ASP A 16 -0.115 -9.146 9.825 1.00 0.00 C ATOM 179 OD1 ASP A 16 0.615 -8.196 9.471 1.00 0.00 O ATOM 180 OD2 ASP A 16 0.266 -10.055 10.592 1.00 0.00 O ATOM 0 H ASP A 16 -3.605 -9.335 7.875 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.392 -7.465 8.036 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -2.205 -8.723 10.013 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.849 -10.239 9.209 1.00 0.00 H new ATOM 185 N LEU A 17 0.119 -8.370 6.315 1.00 0.00 N ATOM 186 CA LEU A 17 1.060 -8.875 5.321 1.00 0.00 C ATOM 187 C LEU A 17 2.495 -8.768 5.826 1.00 0.00 C ATOM 188 O LEU A 17 2.826 -7.920 6.654 1.00 0.00 O ATOM 189 CB LEU A 17 0.909 -8.102 4.009 1.00 0.00 C ATOM 190 CG LEU A 17 -0.500 -7.610 3.677 1.00 0.00 C ATOM 191 CD1 LEU A 17 -0.450 -6.525 2.613 1.00 0.00 C ATOM 192 CD2 LEU A 17 -1.375 -8.768 3.220 1.00 0.00 C ATOM 0 H LEU A 17 0.193 -7.369 6.495 1.00 0.00 H new ATOM 0 HA LEU A 17 0.835 -9.927 5.144 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.575 -7.240 4.040 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.251 -8.740 3.194 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.938 -7.184 4.580 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.462 -6.187 2.390 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.141 -5.685 2.978 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.007 -6.924 1.708 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -2.374 -8.399 2.988 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.940 -9.223 2.330 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -1.438 -9.512 4.014 1.00 0.00 H new ATOM 204 N PRO A 18 3.369 -9.647 5.314 1.00 0.00 N ATOM 205 CA PRO A 18 4.784 -9.671 5.697 1.00 0.00 C ATOM 206 C PRO A 18 5.546 -8.459 5.172 1.00 0.00 C ATOM 207 O PRO A 18 6.618 -8.123 5.674 1.00 0.00 O ATOM 208 CB PRO A 18 5.307 -10.954 5.045 1.00 0.00 C ATOM 209 CG PRO A 18 4.393 -11.193 3.893 1.00 0.00 C ATOM 210 CD PRO A 18 3.044 -10.686 4.322 1.00 0.00 C ATOM 0 HA PRO A 18 4.914 -9.643 6.779 1.00 0.00 H new ATOM 0 HB2 PRO A 18 6.339 -10.838 4.714 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.289 -11.790 5.745 1.00 0.00 H new ATOM 0 HG2 PRO A 18 4.742 -10.669 3.003 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.350 -12.253 3.643 1.00 0.00 H new ATOM 0 HD2 PRO A 18 2.483 -10.278 3.482 1.00 0.00 H new ATOM 0 HD3 PRO A 18 2.436 -11.480 4.756 1.00 0.00 H new ATOM 218 N ASN A 19 4.985 -7.805 4.161 1.00 0.00 N ATOM 219 CA ASN A 19 5.613 -6.629 3.568 1.00 0.00 C ATOM 220 C ASN A 19 5.096 -5.350 4.220 1.00 0.00 C ATOM 221 O ASN A 19 5.825 -4.365 4.342 1.00 0.00 O ATOM 222 CB ASN A 19 5.350 -6.589 2.061 1.00 0.00 C ATOM 223 CG ASN A 19 6.308 -7.472 1.284 1.00 0.00 C ATOM 224 OD1 ASN A 19 5.887 -8.343 0.522 1.00 0.00 O ATOM 225 ND2 ASN A 19 7.603 -7.250 1.474 1.00 0.00 N ATOM 0 H ASN A 19 4.097 -8.069 3.735 1.00 0.00 H new ATOM 0 HA ASN A 19 6.687 -6.696 3.740 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.326 -6.907 1.865 1.00 0.00 H new ATOM 0 HB3 ASN A 19 5.438 -5.562 1.707 1.00 0.00 H new ATOM 0 HD21 ASN A 19 8.295 -7.812 0.979 1.00 0.00 H new ATOM 0 HD22 ASN A 19 7.906 -6.517 2.115 1.00 0.00 H new ATOM 232 N TYR A 20 3.836 -5.373 4.637 1.00 0.00 N ATOM 233 CA TYR A 20 3.220 -4.215 5.275 1.00 0.00 C ATOM 234 C TYR A 20 1.840 -4.565 5.823 1.00 0.00 C ATOM 235 O TYR A 20 1.224 -5.546 5.405 1.00 0.00 O ATOM 236 CB TYR A 20 3.109 -3.058 4.281 1.00 0.00 C ATOM 237 CG TYR A 20 2.706 -3.492 2.890 1.00 0.00 C ATOM 238 CD1 TYR A 20 1.401 -3.882 2.613 1.00 0.00 C ATOM 239 CD2 TYR A 20 3.629 -3.513 1.852 1.00 0.00 C ATOM 240 CE1 TYR A 20 1.028 -4.280 1.344 1.00 0.00 C ATOM 241 CE2 TYR A 20 3.265 -3.908 0.579 1.00 0.00 C ATOM 242 CZ TYR A 20 1.963 -4.291 0.330 1.00 0.00 C ATOM 243 OH TYR A 20 1.597 -4.686 -0.936 1.00 0.00 O ATOM 0 H TYR A 20 3.220 -6.181 4.545 1.00 0.00 H new ATOM 0 HA TYR A 20 3.854 -3.910 6.107 1.00 0.00 H new ATOM 0 HB2 TYR A 20 2.380 -2.339 4.654 1.00 0.00 H new ATOM 0 HB3 TYR A 20 4.068 -2.542 4.228 1.00 0.00 H new ATOM 0 HD1 TYR A 20 0.666 -3.874 3.404 1.00 0.00 H new ATOM 0 HD2 TYR A 20 4.649 -3.215 2.043 1.00 0.00 H new ATOM 0 HE1 TYR A 20 0.010 -4.581 1.147 1.00 0.00 H new ATOM 0 HE2 TYR A 20 3.995 -3.917 -0.217 1.00 0.00 H new ATOM 0 HH TYR A 20 2.373 -4.635 -1.532 1.00 0.00 H new ATOM 253 N ARG A 21 1.359 -3.754 6.760 1.00 0.00 N ATOM 254 CA ARG A 21 0.052 -3.976 7.366 1.00 0.00 C ATOM 255 C ARG A 21 -0.876 -2.793 7.105 1.00 0.00 C ATOM 256 O ARG A 21 -0.468 -1.637 7.209 1.00 0.00 O ATOM 257 CB ARG A 21 0.196 -4.203 8.872 1.00 0.00 C ATOM 258 CG ARG A 21 0.815 -3.026 9.608 1.00 0.00 C ATOM 259 CD ARG A 21 1.470 -3.464 10.909 1.00 0.00 C ATOM 260 NE ARG A 21 2.328 -2.423 11.467 1.00 0.00 N ATOM 261 CZ ARG A 21 1.867 -1.296 11.997 1.00 0.00 C ATOM 262 NH1 ARG A 21 0.562 -1.065 12.040 1.00 0.00 N ATOM 263 NH2 ARG A 21 2.712 -0.396 12.485 1.00 0.00 N ATOM 0 H ARG A 21 1.855 -2.937 7.116 1.00 0.00 H new ATOM 0 HA ARG A 21 -0.385 -4.865 6.912 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -0.787 -4.409 9.296 1.00 0.00 H new ATOM 0 HB3 ARG A 21 0.808 -5.089 9.041 1.00 0.00 H new ATOM 0 HG2 ARG A 21 1.557 -2.546 8.970 1.00 0.00 H new ATOM 0 HG3 ARG A 21 0.046 -2.282 9.819 1.00 0.00 H new ATOM 0 HD2 ARG A 21 0.698 -3.725 11.633 1.00 0.00 H new ATOM 0 HD3 ARG A 21 2.059 -4.364 10.733 1.00 0.00 H new ATOM 0 HE ARG A 21 3.337 -2.569 11.449 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -0.090 -1.754 11.665 1.00 0.00 H new ATOM 0 HH12 ARG A 21 0.211 -0.199 12.448 1.00 0.00 H new ATOM 0 HH21 ARG A 21 3.717 -0.570 12.453 1.00 0.00 H new ATOM 0 HH22 ARG A 21 2.357 0.469 12.892 1.00 0.00 H new ATOM 277 N TRP A 22 -2.125 -3.092 6.767 1.00 0.00 N ATOM 278 CA TRP A 22 -3.111 -2.053 6.491 1.00 0.00 C ATOM 279 C TRP A 22 -4.487 -2.457 7.009 1.00 0.00 C ATOM 280 O TRP A 22 -4.861 -3.629 6.959 1.00 0.00 O ATOM 281 CB TRP A 22 -3.180 -1.773 4.989 1.00 0.00 C ATOM 282 CG TRP A 22 -3.657 -2.946 4.187 1.00 0.00 C ATOM 283 CD1 TRP A 22 -2.884 -3.833 3.493 1.00 0.00 C ATOM 284 CD2 TRP A 22 -5.014 -3.358 3.995 1.00 0.00 C ATOM 285 NE1 TRP A 22 -3.680 -4.772 2.881 1.00 0.00 N ATOM 286 CE2 TRP A 22 -4.990 -4.503 3.174 1.00 0.00 C ATOM 287 CE3 TRP A 22 -6.248 -2.872 4.437 1.00 0.00 C ATOM 288 CZ2 TRP A 22 -6.152 -5.166 2.788 1.00 0.00 C ATOM 289 CZ3 TRP A 22 -7.400 -3.532 4.053 1.00 0.00 C ATOM 290 CH2 TRP A 22 -7.346 -4.669 3.236 1.00 0.00 C ATOM 0 H TRP A 22 -2.479 -4.044 6.677 1.00 0.00 H new ATOM 0 HA TRP A 22 -2.801 -1.145 7.009 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -3.846 -0.928 4.815 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -2.192 -1.478 4.636 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -1.806 -3.801 3.434 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -3.348 -5.544 2.302 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -6.300 -1.997 5.067 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -6.113 -6.042 2.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -8.359 -3.165 4.389 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -8.264 -5.163 2.954 1.00 0.00 H new ATOM 301 N THR A 23 -5.238 -1.479 7.506 1.00 0.00 N ATOM 302 CA THR A 23 -6.572 -1.733 8.034 1.00 0.00 C ATOM 303 C THR A 23 -7.621 -0.904 7.301 1.00 0.00 C ATOM 304 O THR A 23 -7.314 0.150 6.746 1.00 0.00 O ATOM 305 CB THR A 23 -6.649 -1.422 9.541 1.00 0.00 C ATOM 306 OG1 THR A 23 -6.222 -0.077 9.785 1.00 0.00 O ATOM 307 CG2 THR A 23 -5.784 -2.386 10.338 1.00 0.00 C ATOM 0 H THR A 23 -4.944 -0.503 7.554 1.00 0.00 H new ATOM 0 HA THR A 23 -6.777 -2.792 7.879 1.00 0.00 H new ATOM 0 HB THR A 23 -7.684 -1.539 9.861 1.00 0.00 H new ATOM 0 HG1 THR A 23 -6.275 0.114 10.745 1.00 0.00 H new ATOM 0 HG21 THR A 23 -5.855 -2.146 11.399 1.00 0.00 H new ATOM 0 HG22 THR A 23 -6.129 -3.407 10.173 1.00 0.00 H new ATOM 0 HG23 THR A 23 -4.747 -2.297 10.014 1.00 0.00 H new ATOM 315 N GLN A 24 -8.859 -1.388 7.305 1.00 0.00 N ATOM 316 CA GLN A 24 -9.953 -0.690 6.640 1.00 0.00 C ATOM 317 C GLN A 24 -11.163 -0.572 7.561 1.00 0.00 C ATOM 318 O GLN A 24 -11.485 -1.500 8.304 1.00 0.00 O ATOM 319 CB GLN A 24 -10.345 -1.420 5.354 1.00 0.00 C ATOM 320 CG GLN A 24 -10.948 -2.794 5.595 1.00 0.00 C ATOM 321 CD GLN A 24 -10.965 -3.651 4.344 1.00 0.00 C ATOM 322 OE1 GLN A 24 -10.514 -3.226 3.280 1.00 0.00 O ATOM 323 NE2 GLN A 24 -11.485 -4.867 4.466 1.00 0.00 N ATOM 0 H GLN A 24 -9.129 -2.260 7.761 1.00 0.00 H new ATOM 0 HA GLN A 24 -9.611 0.314 6.389 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -11.061 -0.810 4.803 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.463 -1.525 4.722 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -10.380 -3.304 6.373 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -11.966 -2.680 5.967 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -11.848 -5.179 5.367 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -11.522 -5.489 3.659 1.00 0.00 H new ATOM 332 N THR A 25 -11.832 0.576 7.507 1.00 0.00 N ATOM 333 CA THR A 25 -13.006 0.816 8.337 1.00 0.00 C ATOM 334 C THR A 25 -14.112 1.498 7.540 1.00 0.00 C ATOM 335 O THR A 25 -13.952 1.780 6.352 1.00 0.00 O ATOM 336 CB THR A 25 -12.660 1.685 9.561 1.00 0.00 C ATOM 337 OG1 THR A 25 -12.208 2.975 9.134 1.00 0.00 O ATOM 338 CG2 THR A 25 -11.587 1.021 10.410 1.00 0.00 C ATOM 0 H THR A 25 -11.581 1.354 6.897 1.00 0.00 H new ATOM 0 HA THR A 25 -13.356 -0.158 8.679 1.00 0.00 H new ATOM 0 HB THR A 25 -13.560 1.798 10.165 1.00 0.00 H new ATOM 0 HG1 THR A 25 -11.624 2.875 8.354 1.00 0.00 H new ATOM 0 HG21 THR A 25 -11.359 1.653 11.268 1.00 0.00 H new ATOM 0 HG22 THR A 25 -11.946 0.052 10.758 1.00 0.00 H new ATOM 0 HG23 THR A 25 -10.686 0.881 9.813 1.00 0.00 H new ATOM 346 N LEU A 26 -15.234 1.761 8.201 1.00 0.00 N ATOM 347 CA LEU A 26 -16.368 2.411 7.553 1.00 0.00 C ATOM 348 C LEU A 26 -16.180 3.924 7.515 1.00 0.00 C ATOM 349 O LEU A 26 -17.147 4.678 7.412 1.00 0.00 O ATOM 350 CB LEU A 26 -17.666 2.066 8.287 1.00 0.00 C ATOM 351 CG LEU A 26 -18.305 0.725 7.925 1.00 0.00 C ATOM 352 CD1 LEU A 26 -19.589 0.516 8.712 1.00 0.00 C ATOM 353 CD2 LEU A 26 -18.577 0.651 6.429 1.00 0.00 C ATOM 0 H LEU A 26 -15.383 1.534 9.184 1.00 0.00 H new ATOM 0 HA LEU A 26 -16.428 2.045 6.528 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -17.467 2.074 9.359 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -18.391 2.856 8.092 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.608 -0.071 8.188 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -20.030 -0.443 8.441 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -19.367 0.525 9.779 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -20.292 1.316 8.481 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -19.032 -0.310 6.189 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -19.255 1.455 6.142 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -17.639 0.755 5.883 1.00 0.00 H new ATOM 365 N ALA A 27 -14.927 4.362 7.597 1.00 0.00 N ATOM 366 CA ALA A 27 -14.611 5.784 7.567 1.00 0.00 C ATOM 367 C ALA A 27 -13.437 6.066 6.635 1.00 0.00 C ATOM 368 O ALA A 27 -13.469 7.016 5.854 1.00 0.00 O ATOM 369 CB ALA A 27 -14.306 6.286 8.971 1.00 0.00 C ATOM 0 H ALA A 27 -14.115 3.751 7.685 1.00 0.00 H new ATOM 0 HA ALA A 27 -15.481 6.317 7.183 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -14.072 7.350 8.934 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -15.174 6.128 9.611 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -13.453 5.740 9.375 1.00 0.00 H new ATOM 375 N GLU A 28 -12.403 5.236 6.725 1.00 0.00 N ATOM 376 CA GLU A 28 -11.219 5.398 5.890 1.00 0.00 C ATOM 377 C GLU A 28 -10.313 4.174 5.986 1.00 0.00 C ATOM 378 O GLU A 28 -10.558 3.267 6.783 1.00 0.00 O ATOM 379 CB GLU A 28 -10.445 6.652 6.303 1.00 0.00 C ATOM 380 CG GLU A 28 -9.976 6.630 7.748 1.00 0.00 C ATOM 381 CD GLU A 28 -8.826 5.668 7.973 1.00 0.00 C ATOM 382 OE1 GLU A 28 -7.827 5.752 7.230 1.00 0.00 O ATOM 383 OE2 GLU A 28 -8.926 4.830 8.895 1.00 0.00 O ATOM 0 H GLU A 28 -12.361 4.445 7.367 1.00 0.00 H new ATOM 0 HA GLU A 28 -11.547 5.505 4.856 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.579 6.765 5.651 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -11.077 7.526 6.148 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -9.668 7.634 8.041 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.810 6.351 8.393 1.00 0.00 H new ATOM 390 N LEU A 29 -9.267 4.154 5.167 1.00 0.00 N ATOM 391 CA LEU A 29 -8.324 3.041 5.158 1.00 0.00 C ATOM 392 C LEU A 29 -6.936 3.500 5.591 1.00 0.00 C ATOM 393 O LEU A 29 -6.473 4.569 5.193 1.00 0.00 O ATOM 394 CB LEU A 29 -8.256 2.416 3.763 1.00 0.00 C ATOM 395 CG LEU A 29 -7.956 0.918 3.713 1.00 0.00 C ATOM 396 CD1 LEU A 29 -8.581 0.289 2.477 1.00 0.00 C ATOM 397 CD2 LEU A 29 -6.454 0.673 3.736 1.00 0.00 C ATOM 0 H LEU A 29 -9.051 4.896 4.501 1.00 0.00 H new ATOM 0 HA LEU A 29 -8.676 2.292 5.868 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -9.207 2.593 3.261 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -7.491 2.939 3.189 1.00 0.00 H new ATOM 0 HG LEU A 29 -8.394 0.450 4.595 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -8.357 -0.778 2.459 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.661 0.432 2.503 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -8.173 0.761 1.583 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.260 -0.399 3.700 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -5.994 1.155 2.873 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -6.032 1.088 4.651 1.00 0.00 H new ATOM 409 N ASP A 30 -6.276 2.685 6.405 1.00 0.00 N ATOM 410 CA ASP A 30 -4.938 3.005 6.890 1.00 0.00 C ATOM 411 C ASP A 30 -3.908 2.031 6.326 1.00 0.00 C ATOM 412 O ASP A 30 -4.200 0.853 6.118 1.00 0.00 O ATOM 413 CB ASP A 30 -4.905 2.973 8.418 1.00 0.00 C ATOM 414 CG ASP A 30 -3.809 3.851 8.992 1.00 0.00 C ATOM 415 OD1 ASP A 30 -4.040 5.069 9.136 1.00 0.00 O ATOM 416 OD2 ASP A 30 -2.721 3.318 9.296 1.00 0.00 O ATOM 0 H ASP A 30 -6.646 1.797 6.744 1.00 0.00 H new ATOM 0 HA ASP A 30 -4.686 4.009 6.550 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.869 3.300 8.806 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -4.758 1.947 8.754 1.00 0.00 H new ATOM 421 N LEU A 31 -2.702 2.531 6.079 1.00 0.00 N ATOM 422 CA LEU A 31 -1.628 1.706 5.537 1.00 0.00 C ATOM 423 C LEU A 31 -0.286 2.084 6.156 1.00 0.00 C ATOM 424 O LEU A 31 0.018 3.264 6.330 1.00 0.00 O ATOM 425 CB LEU A 31 -1.561 1.855 4.016 1.00 0.00 C ATOM 426 CG LEU A 31 -0.212 1.539 3.370 1.00 0.00 C ATOM 427 CD1 LEU A 31 0.035 0.039 3.356 1.00 0.00 C ATOM 428 CD2 LEU A 31 -0.151 2.105 1.959 1.00 0.00 C ATOM 0 H LEU A 31 -2.444 3.504 6.245 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.842 0.666 5.785 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.315 1.204 3.574 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.834 2.879 3.759 1.00 0.00 H new ATOM 0 HG LEU A 31 0.572 2.010 3.963 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.000 -0.167 2.892 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.036 -0.339 4.378 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -0.753 -0.454 2.787 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.816 1.871 1.514 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -0.944 1.664 1.355 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.281 3.187 1.995 1.00 0.00 H new ATOM 440 N ALA A 32 0.513 1.075 6.485 1.00 0.00 N ATOM 441 CA ALA A 32 1.825 1.301 7.080 1.00 0.00 C ATOM 442 C ALA A 32 2.869 0.366 6.480 1.00 0.00 C ATOM 443 O ALA A 32 2.819 -0.848 6.682 1.00 0.00 O ATOM 444 CB ALA A 32 1.757 1.121 8.589 1.00 0.00 C ATOM 0 H ALA A 32 0.275 0.092 6.350 1.00 0.00 H new ATOM 0 HA ALA A 32 2.125 2.326 6.860 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.743 1.293 9.021 1.00 0.00 H new ATOM 0 HB2 ALA A 32 1.048 1.834 9.009 1.00 0.00 H new ATOM 0 HB3 ALA A 32 1.431 0.107 8.820 1.00 0.00 H new ATOM 450 N VAL A 33 3.814 0.938 5.741 1.00 0.00 N ATOM 451 CA VAL A 33 4.871 0.155 5.111 1.00 0.00 C ATOM 452 C VAL A 33 6.199 0.341 5.837 1.00 0.00 C ATOM 453 O VAL A 33 6.855 1.377 5.727 1.00 0.00 O ATOM 454 CB VAL A 33 5.049 0.540 3.631 1.00 0.00 C ATOM 455 CG1 VAL A 33 6.220 -0.214 3.020 1.00 0.00 C ATOM 456 CG2 VAL A 33 3.768 0.275 2.854 1.00 0.00 C ATOM 0 H VAL A 33 3.869 1.941 5.564 1.00 0.00 H new ATOM 0 HA VAL A 33 4.570 -0.891 5.172 1.00 0.00 H new ATOM 0 HB VAL A 33 5.266 1.607 3.574 1.00 0.00 H new ATOM 0 HG11 VAL A 33 6.330 0.071 1.974 1.00 0.00 H new ATOM 0 HG12 VAL A 33 7.133 0.032 3.561 1.00 0.00 H new ATOM 0 HG13 VAL A 33 6.037 -1.286 3.086 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.912 0.553 1.810 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.517 -0.784 2.917 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.956 0.866 3.278 1.00 0.00 H new ATOM 466 N PRO A 34 6.606 -0.686 6.597 1.00 0.00 N ATOM 467 CA PRO A 34 7.861 -0.661 7.355 1.00 0.00 C ATOM 468 C PRO A 34 9.087 -0.716 6.450 1.00 0.00 C ATOM 469 O PRO A 34 9.245 -1.646 5.659 1.00 0.00 O ATOM 470 CB PRO A 34 7.778 -1.921 8.221 1.00 0.00 C ATOM 471 CG PRO A 34 6.872 -2.836 7.472 1.00 0.00 C ATOM 472 CD PRO A 34 5.875 -1.952 6.774 1.00 0.00 C ATOM 0 HA PRO A 34 7.972 0.260 7.928 1.00 0.00 H new ATOM 0 HB2 PRO A 34 8.762 -2.368 8.365 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.382 -1.695 9.211 1.00 0.00 H new ATOM 0 HG2 PRO A 34 7.431 -3.437 6.754 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.372 -3.530 8.148 1.00 0.00 H new ATOM 0 HD2 PRO A 34 5.564 -2.374 5.818 1.00 0.00 H new ATOM 0 HD3 PRO A 34 4.973 -1.815 7.370 1.00 0.00 H new ATOM 480 N PHE A 35 9.952 0.285 6.572 1.00 0.00 N ATOM 481 CA PHE A 35 11.164 0.350 5.764 1.00 0.00 C ATOM 482 C PHE A 35 12.402 0.089 6.618 1.00 0.00 C ATOM 483 O PHE A 35 12.737 0.879 7.501 1.00 0.00 O ATOM 484 CB PHE A 35 11.278 1.716 5.085 1.00 0.00 C ATOM 485 CG PHE A 35 10.446 1.837 3.840 1.00 0.00 C ATOM 486 CD1 PHE A 35 10.710 1.044 2.735 1.00 0.00 C ATOM 487 CD2 PHE A 35 9.401 2.744 3.774 1.00 0.00 C ATOM 488 CE1 PHE A 35 9.947 1.154 1.588 1.00 0.00 C ATOM 489 CE2 PHE A 35 8.634 2.859 2.630 1.00 0.00 C ATOM 490 CZ PHE A 35 8.907 2.062 1.536 1.00 0.00 C ATOM 0 H PHE A 35 9.836 1.062 7.222 1.00 0.00 H new ATOM 0 HA PHE A 35 11.102 -0.424 4.999 1.00 0.00 H new ATOM 0 HB2 PHE A 35 10.977 2.490 5.791 1.00 0.00 H new ATOM 0 HB3 PHE A 35 12.322 1.902 4.834 1.00 0.00 H new ATOM 0 HD1 PHE A 35 11.521 0.332 2.770 1.00 0.00 H new ATOM 0 HD2 PHE A 35 9.183 3.369 4.627 1.00 0.00 H new ATOM 0 HE1 PHE A 35 10.164 0.531 0.733 1.00 0.00 H new ATOM 0 HE2 PHE A 35 7.823 3.571 2.592 1.00 0.00 H new ATOM 0 HZ PHE A 35 8.309 2.148 0.641 1.00 0.00 H new ATOM 500 N ARG A 36 13.076 -1.023 6.348 1.00 0.00 N ATOM 501 CA ARG A 36 14.275 -1.390 7.092 1.00 0.00 C ATOM 502 C ARG A 36 15.370 -0.342 6.909 1.00 0.00 C ATOM 503 O ARG A 36 16.273 -0.509 6.090 1.00 0.00 O ATOM 504 CB ARG A 36 14.785 -2.759 6.639 1.00 0.00 C ATOM 505 CG ARG A 36 15.682 -3.443 7.658 1.00 0.00 C ATOM 506 CD ARG A 36 16.635 -4.423 6.991 1.00 0.00 C ATOM 507 NE ARG A 36 15.970 -5.671 6.626 1.00 0.00 N ATOM 508 CZ ARG A 36 16.607 -6.826 6.474 1.00 0.00 C ATOM 509 NH1 ARG A 36 17.919 -6.892 6.655 1.00 0.00 N ATOM 510 NH2 ARG A 36 15.932 -7.919 6.140 1.00 0.00 N ATOM 0 H ARG A 36 12.812 -1.686 5.619 1.00 0.00 H new ATOM 0 HA ARG A 36 14.014 -1.439 8.149 1.00 0.00 H new ATOM 0 HB2 ARG A 36 13.932 -3.404 6.428 1.00 0.00 H new ATOM 0 HB3 ARG A 36 15.334 -2.642 5.705 1.00 0.00 H new ATOM 0 HG2 ARG A 36 16.253 -2.692 8.204 1.00 0.00 H new ATOM 0 HG3 ARG A 36 15.069 -3.970 8.389 1.00 0.00 H new ATOM 0 HD2 ARG A 36 17.060 -3.964 6.098 1.00 0.00 H new ATOM 0 HD3 ARG A 36 17.464 -4.638 7.665 1.00 0.00 H new ATOM 0 HE ARG A 36 14.961 -5.654 6.480 1.00 0.00 H new ATOM 0 HH11 ARG A 36 18.441 -6.054 6.912 1.00 0.00 H new ATOM 0 HH12 ARG A 36 18.406 -7.781 6.538 1.00 0.00 H new ATOM 0 HH21 ARG A 36 14.923 -7.872 6.000 1.00 0.00 H new ATOM 0 HH22 ARG A 36 16.423 -8.806 6.024 1.00 0.00 H new ATOM 524 N VAL A 37 15.281 0.739 7.678 1.00 0.00 N ATOM 525 CA VAL A 37 16.264 1.814 7.602 1.00 0.00 C ATOM 526 C VAL A 37 16.788 2.179 8.986 1.00 0.00 C ATOM 527 O VAL A 37 16.058 2.110 9.975 1.00 0.00 O ATOM 528 CB VAL A 37 15.669 3.072 6.942 1.00 0.00 C ATOM 529 CG1 VAL A 37 15.285 2.787 5.498 1.00 0.00 C ATOM 530 CG2 VAL A 37 14.469 3.571 7.733 1.00 0.00 C ATOM 0 H VAL A 37 14.539 0.894 8.360 1.00 0.00 H new ATOM 0 HA VAL A 37 17.088 1.447 6.990 1.00 0.00 H new ATOM 0 HB VAL A 37 16.427 3.855 6.943 1.00 0.00 H new ATOM 0 HG11 VAL A 37 14.866 3.687 5.048 1.00 0.00 H new ATOM 0 HG12 VAL A 37 16.170 2.480 4.940 1.00 0.00 H new ATOM 0 HG13 VAL A 37 14.543 1.989 5.470 1.00 0.00 H new ATOM 0 HG21 VAL A 37 14.061 4.460 7.253 1.00 0.00 H new ATOM 0 HG22 VAL A 37 13.706 2.794 7.765 1.00 0.00 H new ATOM 0 HG23 VAL A 37 14.779 3.817 8.748 1.00 0.00 H new ATOM 540 N SER A 38 18.057 2.568 9.048 1.00 0.00 N ATOM 541 CA SER A 38 18.681 2.941 10.313 1.00 0.00 C ATOM 542 C SER A 38 18.851 4.454 10.409 1.00 0.00 C ATOM 543 O SER A 38 19.741 4.948 11.101 1.00 0.00 O ATOM 544 CB SER A 38 20.040 2.254 10.457 1.00 0.00 C ATOM 545 OG SER A 38 19.905 0.978 11.060 1.00 0.00 O ATOM 0 H SER A 38 18.673 2.633 8.238 1.00 0.00 H new ATOM 0 HA SER A 38 18.029 2.614 11.123 1.00 0.00 H new ATOM 0 HB2 SER A 38 20.504 2.149 9.476 1.00 0.00 H new ATOM 0 HB3 SER A 38 20.703 2.876 11.058 1.00 0.00 H new ATOM 0 HG SER A 38 20.787 0.559 11.139 1.00 0.00 H new ATOM 551 N PHE A 39 17.990 5.185 9.708 1.00 0.00 N ATOM 552 CA PHE A 39 18.044 6.643 9.713 1.00 0.00 C ATOM 553 C PHE A 39 16.652 7.239 9.526 1.00 0.00 C ATOM 554 O PHE A 39 15.663 6.513 9.423 1.00 0.00 O ATOM 555 CB PHE A 39 18.978 7.143 8.609 1.00 0.00 C ATOM 556 CG PHE A 39 18.604 6.653 7.240 1.00 0.00 C ATOM 557 CD1 PHE A 39 19.079 5.439 6.770 1.00 0.00 C ATOM 558 CD2 PHE A 39 17.777 7.406 6.422 1.00 0.00 C ATOM 559 CE1 PHE A 39 18.737 4.986 5.510 1.00 0.00 C ATOM 560 CE2 PHE A 39 17.431 6.958 5.161 1.00 0.00 C ATOM 561 CZ PHE A 39 17.911 5.746 4.705 1.00 0.00 C ATOM 0 H PHE A 39 17.247 4.792 9.130 1.00 0.00 H new ATOM 0 HA PHE A 39 18.431 6.965 10.680 1.00 0.00 H new ATOM 0 HB2 PHE A 39 18.977 8.233 8.609 1.00 0.00 H new ATOM 0 HB3 PHE A 39 19.996 6.826 8.834 1.00 0.00 H new ATOM 0 HD1 PHE A 39 19.724 4.840 7.396 1.00 0.00 H new ATOM 0 HD2 PHE A 39 17.398 8.354 6.774 1.00 0.00 H new ATOM 0 HE1 PHE A 39 19.115 4.039 5.155 1.00 0.00 H new ATOM 0 HE2 PHE A 39 16.786 7.555 4.533 1.00 0.00 H new ATOM 0 HZ PHE A 39 17.641 5.393 3.721 1.00 0.00 H new ATOM 571 N ARG A 40 16.584 8.566 9.484 1.00 0.00 N ATOM 572 CA ARG A 40 15.314 9.260 9.311 1.00 0.00 C ATOM 573 C ARG A 40 15.008 9.473 7.831 1.00 0.00 C ATOM 574 O ARG A 40 15.820 10.030 7.091 1.00 0.00 O ATOM 575 CB ARG A 40 15.343 10.608 10.035 1.00 0.00 C ATOM 576 CG ARG A 40 13.967 11.112 10.437 1.00 0.00 C ATOM 577 CD ARG A 40 13.531 10.537 11.776 1.00 0.00 C ATOM 578 NE ARG A 40 13.945 11.379 12.894 1.00 0.00 N ATOM 579 CZ ARG A 40 13.411 11.303 14.108 1.00 0.00 C ATOM 580 NH1 ARG A 40 12.448 10.427 14.359 1.00 0.00 N ATOM 581 NH2 ARG A 40 13.841 12.104 15.075 1.00 0.00 N ATOM 0 H ARG A 40 17.393 9.181 9.567 1.00 0.00 H new ATOM 0 HA ARG A 40 14.528 8.640 9.742 1.00 0.00 H new ATOM 0 HB2 ARG A 40 15.963 10.519 10.927 1.00 0.00 H new ATOM 0 HB3 ARG A 40 15.817 11.347 9.390 1.00 0.00 H new ATOM 0 HG2 ARG A 40 13.980 12.200 10.494 1.00 0.00 H new ATOM 0 HG3 ARG A 40 13.241 10.842 9.670 1.00 0.00 H new ATOM 0 HD2 ARG A 40 12.447 10.427 11.787 1.00 0.00 H new ATOM 0 HD3 ARG A 40 13.954 9.540 11.897 1.00 0.00 H new ATOM 0 HE ARG A 40 14.685 12.063 12.734 1.00 0.00 H new ATOM 0 HH11 ARG A 40 12.115 9.809 13.619 1.00 0.00 H new ATOM 0 HH12 ARG A 40 12.040 10.371 15.292 1.00 0.00 H new ATOM 0 HH21 ARG A 40 14.582 12.779 14.886 1.00 0.00 H new ATOM 0 HH22 ARG A 40 13.430 12.045 16.007 1.00 0.00 H new ATOM 595 N LEU A 41 13.831 9.025 7.406 1.00 0.00 N ATOM 596 CA LEU A 41 13.417 9.165 6.015 1.00 0.00 C ATOM 597 C LEU A 41 12.752 10.518 5.778 1.00 0.00 C ATOM 598 O LEU A 41 11.901 10.948 6.557 1.00 0.00 O ATOM 599 CB LEU A 41 12.456 8.038 5.632 1.00 0.00 C ATOM 600 CG LEU A 41 13.041 6.625 5.643 1.00 0.00 C ATOM 601 CD1 LEU A 41 11.938 5.590 5.484 1.00 0.00 C ATOM 602 CD2 LEU A 41 14.083 6.471 4.545 1.00 0.00 C ATOM 0 H LEU A 41 13.147 8.562 8.005 1.00 0.00 H new ATOM 0 HA LEU A 41 14.307 9.104 5.389 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.607 8.064 6.315 1.00 0.00 H new ATOM 0 HB3 LEU A 41 12.068 8.242 4.634 1.00 0.00 H new ATOM 0 HG LEU A 41 13.529 6.461 6.604 1.00 0.00 H new ATOM 0 HD11 LEU A 41 12.373 4.591 5.494 1.00 0.00 H new ATOM 0 HD12 LEU A 41 11.228 5.685 6.306 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.421 5.751 4.538 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.489 5.460 4.568 1.00 0.00 H new ATOM 0 HD22 LEU A 41 13.620 6.655 3.576 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.888 7.188 4.704 1.00 0.00 H new ATOM 614 N LYS A 42 13.144 11.183 4.697 1.00 0.00 N ATOM 615 CA LYS A 42 12.584 12.485 4.354 1.00 0.00 C ATOM 616 C LYS A 42 11.536 12.354 3.254 1.00 0.00 C ATOM 617 O LYS A 42 11.669 11.529 2.351 1.00 0.00 O ATOM 618 CB LYS A 42 13.694 13.438 3.905 1.00 0.00 C ATOM 619 CG LYS A 42 14.821 13.577 4.914 1.00 0.00 C ATOM 620 CD LYS A 42 14.348 14.258 6.187 1.00 0.00 C ATOM 621 CE LYS A 42 13.997 15.718 5.942 1.00 0.00 C ATOM 622 NZ LYS A 42 13.814 16.466 7.216 1.00 0.00 N ATOM 0 H LYS A 42 13.848 10.842 4.043 1.00 0.00 H new ATOM 0 HA LYS A 42 12.102 12.891 5.243 1.00 0.00 H new ATOM 0 HB2 LYS A 42 14.105 13.084 2.960 1.00 0.00 H new ATOM 0 HB3 LYS A 42 13.263 14.421 3.716 1.00 0.00 H new ATOM 0 HG2 LYS A 42 15.219 12.591 5.154 1.00 0.00 H new ATOM 0 HG3 LYS A 42 15.636 14.152 4.474 1.00 0.00 H new ATOM 0 HD2 LYS A 42 13.476 13.734 6.579 1.00 0.00 H new ATOM 0 HD3 LYS A 42 15.127 14.193 6.947 1.00 0.00 H new ATOM 0 HE2 LYS A 42 14.787 16.188 5.355 1.00 0.00 H new ATOM 0 HE3 LYS A 42 13.083 15.777 5.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 13.576 17.456 7.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 13.044 16.034 7.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 14.694 16.431 7.769 1.00 0.00 H new ATOM 636 N GLY A 43 10.493 13.175 3.335 1.00 0.00 N ATOM 637 CA GLY A 43 9.438 13.135 2.339 1.00 0.00 C ATOM 638 C GLY A 43 9.975 12.965 0.932 1.00 0.00 C ATOM 639 O GLY A 43 9.354 12.308 0.097 1.00 0.00 O ATOM 0 H GLY A 43 10.360 13.867 4.073 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.758 12.314 2.567 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.856 14.055 2.394 1.00 0.00 H new ATOM 643 N LYS A 44 11.134 13.560 0.667 1.00 0.00 N ATOM 644 CA LYS A 44 11.756 13.472 -0.649 1.00 0.00 C ATOM 645 C LYS A 44 12.369 12.093 -0.870 1.00 0.00 C ATOM 646 O LYS A 44 12.292 11.537 -1.966 1.00 0.00 O ATOM 647 CB LYS A 44 12.831 14.551 -0.800 1.00 0.00 C ATOM 648 CG LYS A 44 14.034 14.341 0.103 1.00 0.00 C ATOM 649 CD LYS A 44 14.767 15.646 0.367 1.00 0.00 C ATOM 650 CE LYS A 44 16.239 15.408 0.665 1.00 0.00 C ATOM 651 NZ LYS A 44 17.075 16.587 0.310 1.00 0.00 N ATOM 0 H LYS A 44 11.661 14.108 1.347 1.00 0.00 H new ATOM 0 HA LYS A 44 10.983 13.630 -1.401 1.00 0.00 H new ATOM 0 HB2 LYS A 44 13.166 14.576 -1.837 1.00 0.00 H new ATOM 0 HB3 LYS A 44 12.390 15.524 -0.584 1.00 0.00 H new ATOM 0 HG2 LYS A 44 13.709 13.907 1.049 1.00 0.00 H new ATOM 0 HG3 LYS A 44 14.716 13.626 -0.358 1.00 0.00 H new ATOM 0 HD2 LYS A 44 14.671 16.300 -0.500 1.00 0.00 H new ATOM 0 HD3 LYS A 44 14.303 16.161 1.208 1.00 0.00 H new ATOM 0 HE2 LYS A 44 16.363 15.181 1.724 1.00 0.00 H new ATOM 0 HE3 LYS A 44 16.586 14.537 0.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 18.071 16.384 0.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 16.977 16.789 -0.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 16.761 17.413 0.859 1.00 0.00 H new ATOM 665 N ASP A 45 12.976 11.546 0.177 1.00 0.00 N ATOM 666 CA ASP A 45 13.601 10.231 0.098 1.00 0.00 C ATOM 667 C ASP A 45 12.590 9.175 -0.337 1.00 0.00 C ATOM 668 O ASP A 45 12.901 8.296 -1.141 1.00 0.00 O ATOM 669 CB ASP A 45 14.207 9.848 1.449 1.00 0.00 C ATOM 670 CG ASP A 45 15.407 10.702 1.808 1.00 0.00 C ATOM 671 OD1 ASP A 45 15.354 11.928 1.575 1.00 0.00 O ATOM 672 OD2 ASP A 45 16.399 10.145 2.322 1.00 0.00 O ATOM 0 H ASP A 45 13.049 11.993 1.091 1.00 0.00 H new ATOM 0 HA ASP A 45 14.395 10.278 -0.647 1.00 0.00 H new ATOM 0 HB2 ASP A 45 13.449 9.948 2.225 1.00 0.00 H new ATOM 0 HB3 ASP A 45 14.504 8.800 1.426 1.00 0.00 H new ATOM 677 N VAL A 46 11.378 9.266 0.201 1.00 0.00 N ATOM 678 CA VAL A 46 10.320 8.318 -0.131 1.00 0.00 C ATOM 679 C VAL A 46 9.451 8.842 -1.269 1.00 0.00 C ATOM 680 O VAL A 46 9.393 10.047 -1.517 1.00 0.00 O ATOM 681 CB VAL A 46 9.427 8.023 1.088 1.00 0.00 C ATOM 682 CG1 VAL A 46 10.244 7.399 2.209 1.00 0.00 C ATOM 683 CG2 VAL A 46 8.738 9.293 1.563 1.00 0.00 C ATOM 0 H VAL A 46 11.104 9.987 0.869 1.00 0.00 H new ATOM 0 HA VAL A 46 10.809 7.396 -0.445 1.00 0.00 H new ATOM 0 HB VAL A 46 8.658 7.310 0.790 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.596 7.197 3.062 1.00 0.00 H new ATOM 0 HG12 VAL A 46 10.686 6.466 1.861 1.00 0.00 H new ATOM 0 HG13 VAL A 46 11.035 8.086 2.508 1.00 0.00 H new ATOM 0 HG21 VAL A 46 8.111 9.066 2.425 1.00 0.00 H new ATOM 0 HG22 VAL A 46 9.489 10.031 1.845 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.119 9.694 0.760 1.00 0.00 H new ATOM 693 N VAL A 47 8.775 7.929 -1.959 1.00 0.00 N ATOM 694 CA VAL A 47 7.906 8.298 -3.070 1.00 0.00 C ATOM 695 C VAL A 47 6.511 7.709 -2.896 1.00 0.00 C ATOM 696 O VAL A 47 6.317 6.499 -3.018 1.00 0.00 O ATOM 697 CB VAL A 47 8.487 7.827 -4.417 1.00 0.00 C ATOM 698 CG1 VAL A 47 7.536 8.164 -5.555 1.00 0.00 C ATOM 699 CG2 VAL A 47 9.855 8.447 -4.653 1.00 0.00 C ATOM 0 H VAL A 47 8.813 6.928 -1.768 1.00 0.00 H new ATOM 0 HA VAL A 47 7.839 9.386 -3.072 1.00 0.00 H new ATOM 0 HB VAL A 47 8.606 6.744 -4.383 1.00 0.00 H new ATOM 0 HG11 VAL A 47 7.963 7.824 -6.499 1.00 0.00 H new ATOM 0 HG12 VAL A 47 6.580 7.667 -5.389 1.00 0.00 H new ATOM 0 HG13 VAL A 47 7.383 9.242 -5.594 1.00 0.00 H new ATOM 0 HG21 VAL A 47 10.250 8.103 -5.609 1.00 0.00 H new ATOM 0 HG22 VAL A 47 9.765 9.533 -4.667 1.00 0.00 H new ATOM 0 HG23 VAL A 47 10.532 8.150 -3.852 1.00 0.00 H new ATOM 709 N VAL A 48 5.541 8.572 -2.611 1.00 0.00 N ATOM 710 CA VAL A 48 4.162 8.137 -2.422 1.00 0.00 C ATOM 711 C VAL A 48 3.218 8.885 -3.355 1.00 0.00 C ATOM 712 O VAL A 48 2.974 10.080 -3.182 1.00 0.00 O ATOM 713 CB VAL A 48 3.702 8.347 -0.967 1.00 0.00 C ATOM 714 CG1 VAL A 48 2.236 7.974 -0.812 1.00 0.00 C ATOM 715 CG2 VAL A 48 4.570 7.541 -0.013 1.00 0.00 C ATOM 0 H VAL A 48 5.685 9.576 -2.506 1.00 0.00 H new ATOM 0 HA VAL A 48 4.131 7.073 -2.655 1.00 0.00 H new ATOM 0 HB VAL A 48 3.812 9.402 -0.718 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.929 8.129 0.222 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.630 8.599 -1.468 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.097 6.926 -1.079 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.231 7.701 1.011 1.00 0.00 H new ATOM 0 HG22 VAL A 48 4.494 6.482 -0.259 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.608 7.862 -0.106 1.00 0.00 H new ATOM 725 N ASP A 49 2.687 8.175 -4.345 1.00 0.00 N ATOM 726 CA ASP A 49 1.767 8.771 -5.306 1.00 0.00 C ATOM 727 C ASP A 49 0.326 8.380 -4.993 1.00 0.00 C ATOM 728 O ASP A 49 -0.049 7.212 -5.106 1.00 0.00 O ATOM 729 CB ASP A 49 2.129 8.338 -6.728 1.00 0.00 C ATOM 730 CG ASP A 49 1.725 9.366 -7.766 1.00 0.00 C ATOM 731 OD1 ASP A 49 2.494 10.327 -7.980 1.00 0.00 O ATOM 732 OD2 ASP A 49 0.640 9.210 -8.365 1.00 0.00 O ATOM 0 H ASP A 49 2.878 7.186 -4.503 1.00 0.00 H new ATOM 0 HA ASP A 49 1.855 9.855 -5.232 1.00 0.00 H new ATOM 0 HB2 ASP A 49 3.204 8.166 -6.790 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.641 7.389 -6.951 1.00 0.00 H new ATOM 737 N ILE A 50 -0.477 9.363 -4.600 1.00 0.00 N ATOM 738 CA ILE A 50 -1.876 9.121 -4.271 1.00 0.00 C ATOM 739 C ILE A 50 -2.796 9.618 -5.382 1.00 0.00 C ATOM 740 O ILE A 50 -2.760 10.791 -5.751 1.00 0.00 O ATOM 741 CB ILE A 50 -2.270 9.805 -2.949 1.00 0.00 C ATOM 742 CG1 ILE A 50 -1.400 9.287 -1.802 1.00 0.00 C ATOM 743 CG2 ILE A 50 -3.744 9.571 -2.650 1.00 0.00 C ATOM 744 CD1 ILE A 50 -1.529 10.099 -0.532 1.00 0.00 C ATOM 0 H ILE A 50 -0.183 10.335 -4.502 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.992 8.043 -4.161 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.105 10.878 -3.049 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.669 8.252 -1.591 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.357 9.287 -2.119 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.007 10.061 -1.712 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.349 9.984 -3.457 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.933 8.501 -2.566 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.885 9.675 0.238 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.231 11.129 -0.727 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.564 10.079 -0.191 1.00 0.00 H new ATOM 756 N GLN A 51 -3.619 8.717 -5.908 1.00 0.00 N ATOM 757 CA GLN A 51 -4.549 9.065 -6.976 1.00 0.00 C ATOM 758 C GLN A 51 -5.981 8.714 -6.586 1.00 0.00 C ATOM 759 O GLN A 51 -6.219 8.100 -5.546 1.00 0.00 O ATOM 760 CB GLN A 51 -4.168 8.341 -8.269 1.00 0.00 C ATOM 761 CG GLN A 51 -2.875 8.845 -8.889 1.00 0.00 C ATOM 762 CD GLN A 51 -2.514 8.108 -10.164 1.00 0.00 C ATOM 763 OE1 GLN A 51 -3.190 7.158 -10.558 1.00 0.00 O ATOM 764 NE2 GLN A 51 -1.443 8.544 -10.817 1.00 0.00 N ATOM 0 H GLN A 51 -3.661 7.742 -5.613 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.489 10.141 -7.139 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -4.072 7.275 -8.064 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -4.976 8.455 -8.991 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -2.970 9.909 -9.103 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -2.064 8.736 -8.169 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -0.912 9.335 -10.454 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.152 8.088 -11.681 1.00 0.00 H new ATOM 773 N ARG A 52 -6.932 9.108 -7.427 1.00 0.00 N ATOM 774 CA ARG A 52 -8.341 8.837 -7.169 1.00 0.00 C ATOM 775 C ARG A 52 -8.585 7.340 -7.004 1.00 0.00 C ATOM 776 O ARG A 52 -9.112 6.895 -5.984 1.00 0.00 O ATOM 777 CB ARG A 52 -9.204 9.382 -8.308 1.00 0.00 C ATOM 778 CG ARG A 52 -10.680 9.483 -7.959 1.00 0.00 C ATOM 779 CD ARG A 52 -10.939 10.588 -6.947 1.00 0.00 C ATOM 780 NE ARG A 52 -10.693 11.913 -7.508 1.00 0.00 N ATOM 781 CZ ARG A 52 -10.828 13.040 -6.818 1.00 0.00 C ATOM 782 NH1 ARG A 52 -11.204 13.002 -5.547 1.00 0.00 N ATOM 783 NH2 ARG A 52 -10.586 14.208 -7.399 1.00 0.00 N ATOM 0 H ARG A 52 -6.752 9.616 -8.293 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.617 9.338 -6.241 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.838 10.369 -8.590 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.089 8.738 -9.180 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -11.257 9.675 -8.864 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -11.026 8.531 -7.556 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.971 10.527 -6.600 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -10.301 10.439 -6.076 1.00 0.00 H new ATOM 0 HE ARG A 52 -10.401 11.977 -8.483 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -11.390 12.106 -5.097 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -11.307 13.869 -5.019 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.296 14.241 -8.376 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -10.690 15.073 -6.868 1.00 0.00 H new ATOM 797 N ARG A 53 -8.197 6.567 -8.013 1.00 0.00 N ATOM 798 CA ARG A 53 -8.375 5.121 -7.981 1.00 0.00 C ATOM 799 C ARG A 53 -7.038 4.404 -8.146 1.00 0.00 C ATOM 800 O ARG A 53 -6.954 3.367 -8.804 1.00 0.00 O ATOM 801 CB ARG A 53 -9.342 4.679 -9.082 1.00 0.00 C ATOM 802 CG ARG A 53 -10.131 3.428 -8.733 1.00 0.00 C ATOM 803 CD ARG A 53 -11.309 3.233 -9.674 1.00 0.00 C ATOM 804 NE ARG A 53 -12.125 4.439 -9.787 1.00 0.00 N ATOM 805 CZ ARG A 53 -12.890 4.713 -10.838 1.00 0.00 C ATOM 806 NH1 ARG A 53 -12.942 3.872 -11.862 1.00 0.00 N ATOM 807 NH2 ARG A 53 -13.604 5.831 -10.867 1.00 0.00 N ATOM 0 H ARG A 53 -7.757 6.919 -8.863 1.00 0.00 H new ATOM 0 HA ARG A 53 -8.794 4.854 -7.011 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -10.038 5.491 -9.290 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.779 4.500 -9.998 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -9.476 2.558 -8.782 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -10.491 3.498 -7.707 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -10.942 2.950 -10.661 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -11.927 2.410 -9.316 1.00 0.00 H new ATOM 0 HE ARG A 53 -12.107 5.107 -9.017 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -12.394 3.012 -11.844 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -13.530 4.085 -12.668 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -13.566 6.481 -10.082 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -14.191 6.040 -11.674 1.00 0.00 H new ATOM 821 N HIS A 54 -5.994 4.965 -7.544 1.00 0.00 N ATOM 822 CA HIS A 54 -4.660 4.380 -7.624 1.00 0.00 C ATOM 823 C HIS A 54 -3.748 4.957 -6.545 1.00 0.00 C ATOM 824 O HIS A 54 -3.845 6.135 -6.200 1.00 0.00 O ATOM 825 CB HIS A 54 -4.054 4.627 -9.006 1.00 0.00 C ATOM 826 CG HIS A 54 -3.148 3.528 -9.468 1.00 0.00 C ATOM 827 ND1 HIS A 54 -3.486 2.647 -10.473 1.00 0.00 N ATOM 828 CD2 HIS A 54 -1.909 3.170 -9.057 1.00 0.00 C ATOM 829 CE1 HIS A 54 -2.495 1.793 -10.659 1.00 0.00 C ATOM 830 NE2 HIS A 54 -1.526 2.090 -9.813 1.00 0.00 N ATOM 0 H HIS A 54 -6.046 5.824 -6.996 1.00 0.00 H new ATOM 0 HA HIS A 54 -4.751 3.306 -7.462 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -4.859 4.751 -9.730 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -3.496 5.563 -8.987 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -1.330 3.645 -8.279 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -2.480 0.989 -11.380 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -0.637 1.597 -9.734 1.00 0.00 H new ATOM 839 N LEU A 55 -2.864 4.119 -6.015 1.00 0.00 N ATOM 840 CA LEU A 55 -1.935 4.545 -4.974 1.00 0.00 C ATOM 841 C LEU A 55 -0.565 3.905 -5.172 1.00 0.00 C ATOM 842 O LEU A 55 -0.459 2.775 -5.649 1.00 0.00 O ATOM 843 CB LEU A 55 -2.484 4.182 -3.593 1.00 0.00 C ATOM 844 CG LEU A 55 -1.481 4.222 -2.440 1.00 0.00 C ATOM 845 CD1 LEU A 55 -1.090 5.657 -2.122 1.00 0.00 C ATOM 846 CD2 LEU A 55 -2.056 3.538 -1.208 1.00 0.00 C ATOM 0 H LEU A 55 -2.771 3.141 -6.289 1.00 0.00 H new ATOM 0 HA LEU A 55 -1.824 5.627 -5.042 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -3.303 4.862 -3.359 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -2.908 3.179 -3.645 1.00 0.00 H new ATOM 0 HG LEU A 55 -0.585 3.682 -2.745 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -0.376 5.666 -1.299 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.636 6.114 -3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -1.978 6.222 -1.838 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -1.328 3.576 -0.398 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -2.968 4.049 -0.901 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.284 2.498 -1.442 1.00 0.00 H new ATOM 858 N ARG A 56 0.482 4.636 -4.802 1.00 0.00 N ATOM 859 CA ARG A 56 1.846 4.139 -4.939 1.00 0.00 C ATOM 860 C ARG A 56 2.690 4.527 -3.728 1.00 0.00 C ATOM 861 O ARG A 56 2.556 5.626 -3.191 1.00 0.00 O ATOM 862 CB ARG A 56 2.486 4.689 -6.216 1.00 0.00 C ATOM 863 CG ARG A 56 3.557 3.782 -6.799 1.00 0.00 C ATOM 864 CD ARG A 56 4.209 4.406 -8.023 1.00 0.00 C ATOM 865 NE ARG A 56 4.933 3.419 -8.820 1.00 0.00 N ATOM 866 CZ ARG A 56 5.549 3.706 -9.962 1.00 0.00 C ATOM 867 NH1 ARG A 56 5.530 4.944 -10.437 1.00 0.00 N ATOM 868 NH2 ARG A 56 6.187 2.754 -10.631 1.00 0.00 N ATOM 0 H ARG A 56 0.412 5.573 -4.406 1.00 0.00 H new ATOM 0 HA ARG A 56 1.805 3.051 -5.000 1.00 0.00 H new ATOM 0 HB2 ARG A 56 1.708 4.846 -6.964 1.00 0.00 H new ATOM 0 HB3 ARG A 56 2.924 5.664 -6.002 1.00 0.00 H new ATOM 0 HG2 ARG A 56 4.316 3.581 -6.043 1.00 0.00 H new ATOM 0 HG3 ARG A 56 3.115 2.823 -7.070 1.00 0.00 H new ATOM 0 HD2 ARG A 56 3.445 4.880 -8.639 1.00 0.00 H new ATOM 0 HD3 ARG A 56 4.896 5.191 -7.707 1.00 0.00 H new ATOM 0 HE ARG A 56 4.968 2.457 -8.482 1.00 0.00 H new ATOM 0 HH11 ARG A 56 5.042 5.679 -9.926 1.00 0.00 H new ATOM 0 HH12 ARG A 56 6.004 5.161 -11.314 1.00 0.00 H new ATOM 0 HH21 ARG A 56 6.205 1.801 -10.269 1.00 0.00 H new ATOM 0 HH22 ARG A 56 6.659 2.976 -11.507 1.00 0.00 H new ATOM 882 N VAL A 57 3.558 3.615 -3.302 1.00 0.00 N ATOM 883 CA VAL A 57 4.423 3.860 -2.155 1.00 0.00 C ATOM 884 C VAL A 57 5.778 3.183 -2.333 1.00 0.00 C ATOM 885 O VAL A 57 5.863 2.064 -2.836 1.00 0.00 O ATOM 886 CB VAL A 57 3.779 3.359 -0.848 1.00 0.00 C ATOM 887 CG1 VAL A 57 4.740 3.525 0.319 1.00 0.00 C ATOM 888 CG2 VAL A 57 2.474 4.093 -0.583 1.00 0.00 C ATOM 0 H VAL A 57 3.681 2.699 -3.735 1.00 0.00 H new ATOM 0 HA VAL A 57 4.565 4.939 -2.091 1.00 0.00 H new ATOM 0 HB VAL A 57 3.557 2.297 -0.956 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.268 3.166 1.233 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.646 2.950 0.129 1.00 0.00 H new ATOM 0 HG13 VAL A 57 4.996 4.578 0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.032 3.727 0.344 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.669 5.162 -0.495 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.784 3.917 -1.408 1.00 0.00 H new ATOM 898 N GLY A 58 6.837 3.871 -1.915 1.00 0.00 N ATOM 899 CA GLY A 58 8.174 3.320 -2.037 1.00 0.00 C ATOM 900 C GLY A 58 9.252 4.357 -1.794 1.00 0.00 C ATOM 901 O GLY A 58 9.044 5.318 -1.052 1.00 0.00 O ATOM 0 H GLY A 58 6.792 4.799 -1.495 1.00 0.00 H new ATOM 0 HA2 GLY A 58 8.293 2.503 -1.326 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.300 2.896 -3.033 1.00 0.00 H new ATOM 905 N LEU A 59 10.409 4.163 -2.419 1.00 0.00 N ATOM 906 CA LEU A 59 11.526 5.089 -2.266 1.00 0.00 C ATOM 907 C LEU A 59 12.132 5.440 -3.621 1.00 0.00 C ATOM 908 O LEU A 59 12.228 4.592 -4.508 1.00 0.00 O ATOM 909 CB LEU A 59 12.596 4.482 -1.357 1.00 0.00 C ATOM 910 CG LEU A 59 12.101 3.900 -0.032 1.00 0.00 C ATOM 911 CD1 LEU A 59 13.034 2.801 0.450 1.00 0.00 C ATOM 912 CD2 LEU A 59 11.976 4.995 1.017 1.00 0.00 C ATOM 0 H LEU A 59 10.598 3.373 -3.036 1.00 0.00 H new ATOM 0 HA LEU A 59 11.148 6.004 -1.810 1.00 0.00 H new ATOM 0 HB2 LEU A 59 13.108 3.693 -1.908 1.00 0.00 H new ATOM 0 HB3 LEU A 59 13.337 5.251 -1.139 1.00 0.00 H new ATOM 0 HG LEU A 59 11.115 3.465 -0.194 1.00 0.00 H new ATOM 0 HD11 LEU A 59 12.666 2.399 1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 59 13.073 2.005 -0.293 1.00 0.00 H new ATOM 0 HD13 LEU A 59 14.034 3.210 0.595 1.00 0.00 H new ATOM 0 HD21 LEU A 59 11.623 4.563 1.953 1.00 0.00 H new ATOM 0 HD22 LEU A 59 12.949 5.459 1.176 1.00 0.00 H new ATOM 0 HD23 LEU A 59 11.266 5.748 0.674 1.00 0.00 H new ATOM 924 N LYS A 60 12.542 6.694 -3.772 1.00 0.00 N ATOM 925 CA LYS A 60 13.143 7.158 -5.017 1.00 0.00 C ATOM 926 C LYS A 60 14.224 6.193 -5.492 1.00 0.00 C ATOM 927 O LYS A 60 14.979 5.647 -4.689 1.00 0.00 O ATOM 928 CB LYS A 60 13.738 8.556 -4.831 1.00 0.00 C ATOM 929 CG LYS A 60 13.914 9.320 -6.131 1.00 0.00 C ATOM 930 CD LYS A 60 12.585 9.836 -6.659 1.00 0.00 C ATOM 931 CE LYS A 60 12.682 10.230 -8.124 1.00 0.00 C ATOM 932 NZ LYS A 60 11.405 10.804 -8.630 1.00 0.00 N ATOM 0 H LYS A 60 12.469 7.408 -3.047 1.00 0.00 H new ATOM 0 HA LYS A 60 12.361 7.201 -5.775 1.00 0.00 H new ATOM 0 HB2 LYS A 60 13.093 9.131 -4.166 1.00 0.00 H new ATOM 0 HB3 LYS A 60 14.706 8.467 -4.338 1.00 0.00 H new ATOM 0 HG2 LYS A 60 14.594 10.157 -5.973 1.00 0.00 H new ATOM 0 HG3 LYS A 60 14.375 8.671 -6.876 1.00 0.00 H new ATOM 0 HD2 LYS A 60 11.821 9.068 -6.538 1.00 0.00 H new ATOM 0 HD3 LYS A 60 12.268 10.697 -6.070 1.00 0.00 H new ATOM 0 HE2 LYS A 60 13.483 10.958 -8.252 1.00 0.00 H new ATOM 0 HE3 LYS A 60 12.948 9.356 -8.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 11.512 11.060 -9.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.645 10.101 -8.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 11.164 11.653 -8.080 1.00 0.00 H new ATOM 946 N GLY A 61 14.294 5.988 -6.804 1.00 0.00 N ATOM 947 CA GLY A 61 15.287 5.089 -7.363 1.00 0.00 C ATOM 948 C GLY A 61 14.936 3.631 -7.146 1.00 0.00 C ATOM 949 O GLY A 61 14.934 2.840 -8.089 1.00 0.00 O ATOM 0 H GLY A 61 13.681 6.429 -7.490 1.00 0.00 H new ATOM 0 HA2 GLY A 61 15.386 5.281 -8.431 1.00 0.00 H new ATOM 0 HA3 GLY A 61 16.257 5.297 -6.911 1.00 0.00 H new ATOM 953 N GLN A 62 14.640 3.274 -5.901 1.00 0.00 N ATOM 954 CA GLN A 62 14.289 1.899 -5.563 1.00 0.00 C ATOM 955 C GLN A 62 12.880 1.565 -6.040 1.00 0.00 C ATOM 956 O GLN A 62 12.068 2.447 -6.323 1.00 0.00 O ATOM 957 CB GLN A 62 14.395 1.679 -4.053 1.00 0.00 C ATOM 958 CG GLN A 62 15.763 1.190 -3.604 1.00 0.00 C ATOM 959 CD GLN A 62 16.010 1.423 -2.127 1.00 0.00 C ATOM 960 OE1 GLN A 62 16.274 0.485 -1.374 1.00 0.00 O ATOM 961 NE2 GLN A 62 15.925 2.679 -1.703 1.00 0.00 N ATOM 0 H GLN A 62 14.636 3.917 -5.109 1.00 0.00 H new ATOM 0 HA GLN A 62 14.991 1.236 -6.069 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.166 2.614 -3.541 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.641 0.955 -3.746 1.00 0.00 H new ATOM 0 HG2 GLN A 62 15.853 0.125 -3.820 1.00 0.00 H new ATOM 0 HG3 GLN A 62 16.534 1.699 -4.182 1.00 0.00 H new ATOM 0 HE21 GLN A 62 15.704 3.426 -2.362 1.00 0.00 H new ATOM 0 HE22 GLN A 62 16.081 2.897 -0.719 1.00 0.00 H new ATOM 970 N PRO A 63 12.579 0.261 -6.132 1.00 0.00 N ATOM 971 CA PRO A 63 11.267 -0.220 -6.574 1.00 0.00 C ATOM 972 C PRO A 63 10.172 0.061 -5.551 1.00 0.00 C ATOM 973 O PRO A 63 10.366 -0.079 -4.343 1.00 0.00 O ATOM 974 CB PRO A 63 11.477 -1.728 -6.733 1.00 0.00 C ATOM 975 CG PRO A 63 12.602 -2.053 -5.813 1.00 0.00 C ATOM 976 CD PRO A 63 13.497 -0.845 -5.811 1.00 0.00 C ATOM 0 HA PRO A 63 10.937 0.276 -7.487 1.00 0.00 H new ATOM 0 HB2 PRO A 63 10.577 -2.283 -6.469 1.00 0.00 H new ATOM 0 HB3 PRO A 63 11.721 -1.987 -7.763 1.00 0.00 H new ATOM 0 HG2 PRO A 63 12.236 -2.269 -4.809 1.00 0.00 H new ATOM 0 HG3 PRO A 63 13.141 -2.937 -6.153 1.00 0.00 H new ATOM 0 HD2 PRO A 63 13.976 -0.701 -4.842 1.00 0.00 H new ATOM 0 HD3 PRO A 63 14.293 -0.934 -6.550 1.00 0.00 H new ATOM 984 N PRO A 64 8.991 0.466 -6.042 1.00 0.00 N ATOM 985 CA PRO A 64 7.841 0.773 -5.187 1.00 0.00 C ATOM 986 C PRO A 64 7.253 -0.474 -4.536 1.00 0.00 C ATOM 987 O PRO A 64 6.802 -1.391 -5.223 1.00 0.00 O ATOM 988 CB PRO A 64 6.834 1.396 -6.157 1.00 0.00 C ATOM 989 CG PRO A 64 7.196 0.836 -7.490 1.00 0.00 C ATOM 990 CD PRO A 64 8.688 0.654 -7.471 1.00 0.00 C ATOM 0 HA PRO A 64 8.113 1.425 -4.357 1.00 0.00 H new ATOM 0 HB2 PRO A 64 5.810 1.139 -5.884 1.00 0.00 H new ATOM 0 HB3 PRO A 64 6.901 2.484 -6.153 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.689 -0.113 -7.665 1.00 0.00 H new ATOM 0 HG3 PRO A 64 6.895 1.511 -8.292 1.00 0.00 H new ATOM 0 HD2 PRO A 64 8.995 -0.208 -8.064 1.00 0.00 H new ATOM 0 HD3 PRO A 64 9.204 1.523 -7.880 1.00 0.00 H new ATOM 998 N VAL A 65 7.261 -0.502 -3.207 1.00 0.00 N ATOM 999 CA VAL A 65 6.726 -1.636 -2.463 1.00 0.00 C ATOM 1000 C VAL A 65 5.254 -1.861 -2.787 1.00 0.00 C ATOM 1001 O VAL A 65 4.821 -2.992 -3.008 1.00 0.00 O ATOM 1002 CB VAL A 65 6.881 -1.434 -0.944 1.00 0.00 C ATOM 1003 CG1 VAL A 65 6.369 -2.651 -0.188 1.00 0.00 C ATOM 1004 CG2 VAL A 65 8.333 -1.149 -0.590 1.00 0.00 C ATOM 0 H VAL A 65 7.632 0.248 -2.624 1.00 0.00 H new ATOM 0 HA VAL A 65 7.299 -2.512 -2.766 1.00 0.00 H new ATOM 0 HB VAL A 65 6.282 -0.573 -0.647 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.487 -2.490 0.884 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.315 -2.805 -0.418 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.938 -3.531 -0.487 1.00 0.00 H new ATOM 0 HG21 VAL A 65 8.424 -1.009 0.487 1.00 0.00 H new ATOM 0 HG22 VAL A 65 8.955 -1.989 -0.901 1.00 0.00 H new ATOM 0 HG23 VAL A 65 8.662 -0.245 -1.103 1.00 0.00 H new ATOM 1014 N VAL A 66 4.487 -0.776 -2.814 1.00 0.00 N ATOM 1015 CA VAL A 66 3.062 -0.854 -3.113 1.00 0.00 C ATOM 1016 C VAL A 66 2.737 -0.156 -4.429 1.00 0.00 C ATOM 1017 O VAL A 66 3.023 1.029 -4.602 1.00 0.00 O ATOM 1018 CB VAL A 66 2.217 -0.225 -1.989 1.00 0.00 C ATOM 1019 CG1 VAL A 66 0.737 -0.295 -2.330 1.00 0.00 C ATOM 1020 CG2 VAL A 66 2.500 -0.913 -0.662 1.00 0.00 C ATOM 0 H VAL A 66 4.829 0.168 -2.632 1.00 0.00 H new ATOM 0 HA VAL A 66 2.814 -1.912 -3.195 1.00 0.00 H new ATOM 0 HB VAL A 66 2.494 0.825 -1.894 1.00 0.00 H new ATOM 0 HG11 VAL A 66 0.156 0.154 -1.524 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.551 0.247 -3.257 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.441 -1.337 -2.453 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.895 -0.456 0.121 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.252 -1.972 -0.741 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.556 -0.805 -0.414 1.00 0.00 H new ATOM 1030 N ASP A 67 2.137 -0.898 -5.353 1.00 0.00 N ATOM 1031 CA ASP A 67 1.772 -0.350 -6.654 1.00 0.00 C ATOM 1032 C ASP A 67 0.657 -1.170 -7.296 1.00 0.00 C ATOM 1033 O ASP A 67 0.856 -2.328 -7.662 1.00 0.00 O ATOM 1034 CB ASP A 67 2.991 -0.313 -7.577 1.00 0.00 C ATOM 1035 CG ASP A 67 2.610 -0.391 -9.043 1.00 0.00 C ATOM 1036 OD1 ASP A 67 1.512 0.087 -9.396 1.00 0.00 O ATOM 1037 OD2 ASP A 67 3.410 -0.930 -9.836 1.00 0.00 O ATOM 0 H ASP A 67 1.893 -1.880 -5.225 1.00 0.00 H new ATOM 0 HA ASP A 67 1.410 0.667 -6.503 1.00 0.00 H new ATOM 0 HB2 ASP A 67 3.551 0.605 -7.398 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.654 -1.143 -7.332 1.00 0.00 H new ATOM 1042 N GLY A 68 -0.518 -0.562 -7.427 1.00 0.00 N ATOM 1043 CA GLY A 68 -1.647 -1.252 -8.023 1.00 0.00 C ATOM 1044 C GLY A 68 -2.927 -0.444 -7.946 1.00 0.00 C ATOM 1045 O GLY A 68 -3.104 0.363 -7.033 1.00 0.00 O ATOM 0 H GLY A 68 -0.708 0.395 -7.131 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.423 -1.474 -9.066 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.793 -2.207 -7.518 1.00 0.00 H new ATOM 1049 N GLU A 69 -3.820 -0.658 -8.906 1.00 0.00 N ATOM 1050 CA GLU A 69 -5.089 0.059 -8.943 1.00 0.00 C ATOM 1051 C GLU A 69 -5.867 -0.144 -7.646 1.00 0.00 C ATOM 1052 O GLU A 69 -6.039 -1.272 -7.183 1.00 0.00 O ATOM 1053 CB GLU A 69 -5.930 -0.407 -10.134 1.00 0.00 C ATOM 1054 CG GLU A 69 -7.315 0.216 -10.182 1.00 0.00 C ATOM 1055 CD GLU A 69 -8.115 -0.233 -11.389 1.00 0.00 C ATOM 1056 OE1 GLU A 69 -7.632 -0.039 -12.525 1.00 0.00 O ATOM 1057 OE2 GLU A 69 -9.223 -0.777 -11.199 1.00 0.00 O ATOM 0 H GLU A 69 -3.688 -1.322 -9.669 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.873 1.122 -9.054 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -5.401 -0.168 -11.057 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.030 -1.492 -10.095 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.858 -0.044 -9.274 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.221 1.302 -10.197 1.00 0.00 H new ATOM 1064 N LEU A 70 -6.336 0.955 -7.066 1.00 0.00 N ATOM 1065 CA LEU A 70 -7.095 0.899 -5.822 1.00 0.00 C ATOM 1066 C LEU A 70 -8.434 0.199 -6.032 1.00 0.00 C ATOM 1067 O LEU A 70 -9.112 0.422 -7.035 1.00 0.00 O ATOM 1068 CB LEU A 70 -7.325 2.310 -5.277 1.00 0.00 C ATOM 1069 CG LEU A 70 -6.145 2.946 -4.543 1.00 0.00 C ATOM 1070 CD1 LEU A 70 -6.364 4.442 -4.375 1.00 0.00 C ATOM 1071 CD2 LEU A 70 -5.937 2.281 -3.190 1.00 0.00 C ATOM 0 H LEU A 70 -6.204 1.896 -7.437 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.516 0.326 -5.098 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.602 2.958 -6.108 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.177 2.281 -4.598 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.247 2.796 -5.142 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.514 4.878 -3.850 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.463 4.908 -5.356 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.273 4.614 -3.799 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.093 2.747 -2.682 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -6.835 2.399 -2.584 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.734 1.220 -3.334 1.00 0.00 H new ATOM 1083 N TYR A 71 -8.809 -0.648 -5.080 1.00 0.00 N ATOM 1084 CA TYR A 71 -10.067 -1.381 -5.161 1.00 0.00 C ATOM 1085 C TYR A 71 -11.230 -0.438 -5.455 1.00 0.00 C ATOM 1086 O TYR A 71 -12.104 -0.745 -6.264 1.00 0.00 O ATOM 1087 CB TYR A 71 -10.326 -2.137 -3.857 1.00 0.00 C ATOM 1088 CG TYR A 71 -11.742 -2.650 -3.725 1.00 0.00 C ATOM 1089 CD1 TYR A 71 -12.146 -3.808 -4.379 1.00 0.00 C ATOM 1090 CD2 TYR A 71 -12.676 -1.978 -2.947 1.00 0.00 C ATOM 1091 CE1 TYR A 71 -13.439 -4.280 -4.262 1.00 0.00 C ATOM 1092 CE2 TYR A 71 -13.971 -2.444 -2.823 1.00 0.00 C ATOM 1093 CZ TYR A 71 -14.347 -3.595 -3.483 1.00 0.00 C ATOM 1094 OH TYR A 71 -15.636 -4.063 -3.363 1.00 0.00 O ATOM 0 H TYR A 71 -8.260 -0.844 -4.243 1.00 0.00 H new ATOM 0 HA TYR A 71 -9.988 -2.097 -5.979 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -9.636 -2.978 -3.792 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -10.107 -1.479 -3.016 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -11.437 -4.348 -4.989 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -12.385 -1.076 -2.430 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -13.737 -5.181 -4.778 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -14.684 -1.910 -2.213 1.00 0.00 H new ATOM 0 HH TYR A 71 -16.148 -3.466 -2.778 1.00 0.00 H new ATOM 1104 N ASN A 72 -11.231 0.714 -4.791 1.00 0.00 N ATOM 1105 CA ASN A 72 -12.285 1.703 -4.980 1.00 0.00 C ATOM 1106 C ASN A 72 -11.719 3.119 -4.923 1.00 0.00 C ATOM 1107 O ASN A 72 -10.584 3.327 -4.496 1.00 0.00 O ATOM 1108 CB ASN A 72 -13.371 1.533 -3.915 1.00 0.00 C ATOM 1109 CG ASN A 72 -14.356 2.685 -3.904 1.00 0.00 C ATOM 1110 OD1 ASN A 72 -14.272 3.580 -3.063 1.00 0.00 O ATOM 1111 ND2 ASN A 72 -15.297 2.668 -4.841 1.00 0.00 N ATOM 0 H ASN A 72 -10.514 0.985 -4.118 1.00 0.00 H new ATOM 0 HA ASN A 72 -12.724 1.545 -5.965 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -13.908 0.601 -4.093 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -12.904 1.449 -2.934 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -15.988 3.417 -4.884 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -15.329 1.906 -5.518 1.00 0.00 H new ATOM 1118 N GLU A 73 -12.519 4.089 -5.355 1.00 0.00 N ATOM 1119 CA GLU A 73 -12.097 5.484 -5.352 1.00 0.00 C ATOM 1120 C GLU A 73 -11.780 5.955 -3.936 1.00 0.00 C ATOM 1121 O GLU A 73 -12.340 5.450 -2.962 1.00 0.00 O ATOM 1122 CB GLU A 73 -13.185 6.370 -5.964 1.00 0.00 C ATOM 1123 CG GLU A 73 -13.071 6.520 -7.472 1.00 0.00 C ATOM 1124 CD GLU A 73 -13.624 7.842 -7.970 1.00 0.00 C ATOM 1125 OE1 GLU A 73 -14.518 8.400 -7.300 1.00 0.00 O ATOM 1126 OE2 GLU A 73 -13.162 8.317 -9.028 1.00 0.00 O ATOM 0 H GLU A 73 -13.462 3.934 -5.711 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.191 5.564 -5.953 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -14.162 5.951 -5.722 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -13.139 7.357 -5.505 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -12.024 6.435 -7.764 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -13.604 5.702 -7.956 1.00 0.00 H new ATOM 1133 N VAL A 74 -10.877 6.924 -3.829 1.00 0.00 N ATOM 1134 CA VAL A 74 -10.485 7.464 -2.532 1.00 0.00 C ATOM 1135 C VAL A 74 -10.171 8.953 -2.629 1.00 0.00 C ATOM 1136 O VAL A 74 -9.312 9.369 -3.407 1.00 0.00 O ATOM 1137 CB VAL A 74 -9.256 6.727 -1.966 1.00 0.00 C ATOM 1138 CG1 VAL A 74 -9.536 5.237 -1.844 1.00 0.00 C ATOM 1139 CG2 VAL A 74 -8.036 6.978 -2.839 1.00 0.00 C ATOM 0 H VAL A 74 -10.403 7.351 -4.625 1.00 0.00 H new ATOM 0 HA VAL A 74 -11.330 7.317 -1.859 1.00 0.00 H new ATOM 0 HB VAL A 74 -9.048 7.116 -0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -8.657 4.733 -1.443 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -10.382 5.079 -1.175 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -9.771 4.829 -2.827 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -7.177 6.450 -2.425 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -8.231 6.617 -3.849 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -7.824 8.047 -2.870 1.00 0.00 H new ATOM 1149 N LYS A 75 -10.873 9.752 -1.833 1.00 0.00 N ATOM 1150 CA LYS A 75 -10.669 11.196 -1.826 1.00 0.00 C ATOM 1151 C LYS A 75 -9.182 11.536 -1.821 1.00 0.00 C ATOM 1152 O LYS A 75 -8.549 11.581 -0.766 1.00 0.00 O ATOM 1153 CB LYS A 75 -11.351 11.822 -0.607 1.00 0.00 C ATOM 1154 CG LYS A 75 -11.866 13.229 -0.854 1.00 0.00 C ATOM 1155 CD LYS A 75 -13.061 13.549 0.028 1.00 0.00 C ATOM 1156 CE LYS A 75 -13.790 14.795 -0.450 1.00 0.00 C ATOM 1157 NZ LYS A 75 -14.863 14.468 -1.430 1.00 0.00 N ATOM 0 H LYS A 75 -11.588 9.424 -1.184 1.00 0.00 H new ATOM 0 HA LYS A 75 -11.113 11.605 -2.733 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -12.183 11.188 -0.301 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -10.645 11.843 0.223 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.069 13.948 -0.663 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -12.147 13.336 -1.902 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.748 12.703 0.032 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.728 13.693 1.056 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -14.225 15.312 0.405 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -13.076 15.480 -0.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -15.336 15.344 -1.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -14.445 13.997 -2.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -15.558 13.835 -0.986 1.00 0.00 H new ATOM 1171 N VAL A 76 -8.630 11.775 -3.006 1.00 0.00 N ATOM 1172 CA VAL A 76 -7.218 12.114 -3.137 1.00 0.00 C ATOM 1173 C VAL A 76 -6.949 13.540 -2.671 1.00 0.00 C ATOM 1174 O VAL A 76 -5.903 13.825 -2.088 1.00 0.00 O ATOM 1175 CB VAL A 76 -6.737 11.962 -4.593 1.00 0.00 C ATOM 1176 CG1 VAL A 76 -7.544 12.861 -5.518 1.00 0.00 C ATOM 1177 CG2 VAL A 76 -5.251 12.271 -4.698 1.00 0.00 C ATOM 0 H VAL A 76 -9.139 11.740 -3.889 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.666 11.418 -2.505 1.00 0.00 H new ATOM 0 HB VAL A 76 -6.892 10.929 -4.903 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.190 12.741 -6.542 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -8.598 12.587 -5.463 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.423 13.900 -5.212 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.928 12.159 -5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -5.068 13.294 -4.370 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -4.691 11.582 -4.066 1.00 0.00 H new ATOM 1187 N GLU A 77 -7.900 14.431 -2.931 1.00 0.00 N ATOM 1188 CA GLU A 77 -7.765 15.829 -2.538 1.00 0.00 C ATOM 1189 C GLU A 77 -7.619 15.956 -1.024 1.00 0.00 C ATOM 1190 O GLU A 77 -7.041 16.921 -0.525 1.00 0.00 O ATOM 1191 CB GLU A 77 -8.974 16.635 -3.015 1.00 0.00 C ATOM 1192 CG GLU A 77 -9.267 16.474 -4.497 1.00 0.00 C ATOM 1193 CD GLU A 77 -10.027 17.653 -5.073 1.00 0.00 C ATOM 1194 OE1 GLU A 77 -10.839 18.252 -4.339 1.00 0.00 O ATOM 1195 OE2 GLU A 77 -9.809 17.975 -6.260 1.00 0.00 O ATOM 0 H GLU A 77 -8.772 14.210 -3.412 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.865 16.227 -3.007 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -9.851 16.330 -2.445 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.805 17.690 -2.799 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.329 16.352 -5.038 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.845 15.563 -4.652 1.00 0.00 H new ATOM 1202 N GLU A 78 -8.150 14.975 -0.300 1.00 0.00 N ATOM 1203 CA GLU A 78 -8.081 14.979 1.157 1.00 0.00 C ATOM 1204 C GLU A 78 -7.025 13.995 1.653 1.00 0.00 C ATOM 1205 O GLU A 78 -6.303 14.274 2.610 1.00 0.00 O ATOM 1206 CB GLU A 78 -9.444 14.627 1.755 1.00 0.00 C ATOM 1207 CG GLU A 78 -10.338 15.834 1.984 1.00 0.00 C ATOM 1208 CD GLU A 78 -9.894 16.672 3.167 1.00 0.00 C ATOM 1209 OE1 GLU A 78 -8.713 17.076 3.199 1.00 0.00 O ATOM 1210 OE2 GLU A 78 -10.729 16.925 4.061 1.00 0.00 O ATOM 0 H GLU A 78 -8.632 14.169 -0.698 1.00 0.00 H new ATOM 0 HA GLU A 78 -7.799 15.981 1.480 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -9.953 13.929 1.091 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -9.293 14.112 2.704 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -10.344 16.453 1.087 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -11.362 15.498 2.146 1.00 0.00 H new ATOM 1217 N SER A 79 -6.944 12.842 0.997 1.00 0.00 N ATOM 1218 CA SER A 79 -5.981 11.814 1.373 1.00 0.00 C ATOM 1219 C SER A 79 -4.586 12.410 1.536 1.00 0.00 C ATOM 1220 O SER A 79 -4.260 13.430 0.930 1.00 0.00 O ATOM 1221 CB SER A 79 -5.953 10.702 0.323 1.00 0.00 C ATOM 1222 OG SER A 79 -7.035 9.804 0.503 1.00 0.00 O ATOM 0 H SER A 79 -7.534 12.596 0.202 1.00 0.00 H new ATOM 0 HA SER A 79 -6.292 11.393 2.329 1.00 0.00 H new ATOM 0 HB2 SER A 79 -6.000 11.138 -0.675 1.00 0.00 H new ATOM 0 HB3 SER A 79 -5.010 10.159 0.389 1.00 0.00 H new ATOM 0 HG SER A 79 -7.860 10.214 0.167 1.00 0.00 H new ATOM 1228 N SER A 80 -3.766 11.764 2.360 1.00 0.00 N ATOM 1229 CA SER A 80 -2.407 12.231 2.607 1.00 0.00 C ATOM 1230 C SER A 80 -1.580 11.153 3.300 1.00 0.00 C ATOM 1231 O SER A 80 -2.105 10.115 3.703 1.00 0.00 O ATOM 1232 CB SER A 80 -2.429 13.501 3.460 1.00 0.00 C ATOM 1233 OG SER A 80 -2.590 14.655 2.653 1.00 0.00 O ATOM 0 H SER A 80 -4.019 10.916 2.867 1.00 0.00 H new ATOM 0 HA SER A 80 -1.946 12.456 1.645 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.242 13.443 4.183 1.00 0.00 H new ATOM 0 HB3 SER A 80 -1.502 13.577 4.028 1.00 0.00 H new ATOM 0 HG SER A 80 -3.193 14.451 1.908 1.00 0.00 H new ATOM 1239 N TRP A 81 -0.283 11.407 3.435 1.00 0.00 N ATOM 1240 CA TRP A 81 0.618 10.458 4.079 1.00 0.00 C ATOM 1241 C TRP A 81 1.650 11.184 4.935 1.00 0.00 C ATOM 1242 O TRP A 81 1.748 12.411 4.900 1.00 0.00 O ATOM 1243 CB TRP A 81 1.323 9.598 3.028 1.00 0.00 C ATOM 1244 CG TRP A 81 2.153 10.395 2.068 1.00 0.00 C ATOM 1245 CD1 TRP A 81 1.705 11.096 0.984 1.00 0.00 C ATOM 1246 CD2 TRP A 81 3.573 10.571 2.104 1.00 0.00 C ATOM 1247 NE1 TRP A 81 2.763 11.697 0.344 1.00 0.00 N ATOM 1248 CE2 TRP A 81 3.919 11.391 1.012 1.00 0.00 C ATOM 1249 CE3 TRP A 81 4.586 10.118 2.953 1.00 0.00 C ATOM 1250 CZ2 TRP A 81 5.234 11.764 0.749 1.00 0.00 C ATOM 1251 CZ3 TRP A 81 5.891 10.489 2.690 1.00 0.00 C ATOM 1252 CH2 TRP A 81 6.206 11.306 1.596 1.00 0.00 C ATOM 0 H TRP A 81 0.168 12.261 3.107 1.00 0.00 H new ATOM 0 HA TRP A 81 0.024 9.813 4.727 1.00 0.00 H new ATOM 0 HB2 TRP A 81 1.960 8.871 3.532 1.00 0.00 H new ATOM 0 HB3 TRP A 81 0.576 9.034 2.470 1.00 0.00 H new ATOM 0 HD1 TRP A 81 0.672 11.167 0.676 1.00 0.00 H new ATOM 0 HE1 TRP A 81 2.698 12.277 -0.493 1.00 0.00 H new ATOM 0 HE3 TRP A 81 4.353 9.489 3.800 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 5.479 12.393 -0.094 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 6.682 10.143 3.339 1.00 0.00 H new ATOM 0 HH2 TRP A 81 7.236 11.579 1.418 1.00 0.00 H new ATOM 1263 N LEU A 82 2.418 10.419 5.703 1.00 0.00 N ATOM 1264 CA LEU A 82 3.444 10.990 6.569 1.00 0.00 C ATOM 1265 C LEU A 82 4.437 9.921 7.016 1.00 0.00 C ATOM 1266 O LEU A 82 4.071 8.759 7.198 1.00 0.00 O ATOM 1267 CB LEU A 82 2.801 11.647 7.791 1.00 0.00 C ATOM 1268 CG LEU A 82 2.511 10.723 8.975 1.00 0.00 C ATOM 1269 CD1 LEU A 82 3.755 10.547 9.832 1.00 0.00 C ATOM 1270 CD2 LEU A 82 1.360 11.269 9.808 1.00 0.00 C ATOM 0 H LEU A 82 2.350 9.402 5.744 1.00 0.00 H new ATOM 0 HA LEU A 82 3.984 11.746 6.000 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.455 12.449 8.133 1.00 0.00 H new ATOM 0 HB3 LEU A 82 1.865 12.110 7.479 1.00 0.00 H new ATOM 0 HG LEU A 82 2.221 9.747 8.587 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.530 9.887 10.669 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.553 10.111 9.230 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.076 11.517 10.211 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.167 10.599 10.646 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.621 12.257 10.186 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.466 11.342 9.189 1.00 0.00 H new ATOM 1282 N ILE A 83 5.691 10.322 7.191 1.00 0.00 N ATOM 1283 CA ILE A 83 6.735 9.399 7.620 1.00 0.00 C ATOM 1284 C ILE A 83 6.742 9.243 9.137 1.00 0.00 C ATOM 1285 O ILE A 83 6.833 10.226 9.871 1.00 0.00 O ATOM 1286 CB ILE A 83 8.126 9.868 7.157 1.00 0.00 C ATOM 1287 CG1 ILE A 83 8.193 9.910 5.629 1.00 0.00 C ATOM 1288 CG2 ILE A 83 9.207 8.953 7.714 1.00 0.00 C ATOM 1289 CD1 ILE A 83 9.256 10.844 5.095 1.00 0.00 C ATOM 0 H ILE A 83 6.009 11.280 7.043 1.00 0.00 H new ATOM 0 HA ILE A 83 6.513 8.436 7.159 1.00 0.00 H new ATOM 0 HB ILE A 83 8.297 10.875 7.537 1.00 0.00 H new ATOM 0 HG12 ILE A 83 8.383 8.904 5.254 1.00 0.00 H new ATOM 0 HG13 ILE A 83 7.222 10.217 5.239 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.185 9.298 7.378 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.172 8.969 8.803 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.040 7.935 7.361 1.00 0.00 H new ATOM 0 HD11 ILE A 83 9.245 10.822 4.005 1.00 0.00 H new ATOM 0 HD12 ILE A 83 9.055 11.858 5.440 1.00 0.00 H new ATOM 0 HD13 ILE A 83 10.234 10.525 5.455 1.00 0.00 H new ATOM 1301 N GLU A 84 6.646 8.000 9.599 1.00 0.00 N ATOM 1302 CA GLU A 84 6.642 7.715 11.029 1.00 0.00 C ATOM 1303 C GLU A 84 8.015 7.239 11.492 1.00 0.00 C ATOM 1304 O GLU A 84 8.596 6.324 10.908 1.00 0.00 O ATOM 1305 CB GLU A 84 5.585 6.659 11.359 1.00 0.00 C ATOM 1306 CG GLU A 84 4.224 7.244 11.695 1.00 0.00 C ATOM 1307 CD GLU A 84 4.295 8.303 12.779 1.00 0.00 C ATOM 1308 OE1 GLU A 84 4.708 7.968 13.909 1.00 0.00 O ATOM 1309 OE2 GLU A 84 3.939 9.466 12.496 1.00 0.00 O ATOM 0 H GLU A 84 6.570 7.175 9.004 1.00 0.00 H new ATOM 0 HA GLU A 84 6.399 8.637 11.557 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.481 5.984 10.510 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.932 6.061 12.202 1.00 0.00 H new ATOM 0 HG2 GLU A 84 3.788 7.679 10.796 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.558 6.443 12.017 1.00 0.00 H new ATOM 1316 N ASP A 85 8.528 7.865 12.545 1.00 0.00 N ATOM 1317 CA ASP A 85 9.833 7.506 13.089 1.00 0.00 C ATOM 1318 C ASP A 85 10.855 7.322 11.971 1.00 0.00 C ATOM 1319 O ASP A 85 11.719 6.449 12.044 1.00 0.00 O ATOM 1320 CB ASP A 85 9.728 6.224 13.917 1.00 0.00 C ATOM 1321 CG ASP A 85 9.072 6.457 15.264 1.00 0.00 C ATOM 1322 OD1 ASP A 85 8.020 7.128 15.302 1.00 0.00 O ATOM 1323 OD2 ASP A 85 9.611 5.970 16.279 1.00 0.00 O ATOM 0 H ASP A 85 8.060 8.624 13.040 1.00 0.00 H new ATOM 0 HA ASP A 85 10.168 8.319 13.733 1.00 0.00 H new ATOM 0 HB2 ASP A 85 9.156 5.482 13.361 1.00 0.00 H new ATOM 0 HB3 ASP A 85 10.725 5.810 14.068 1.00 0.00 H new ATOM 1328 N GLY A 86 10.748 8.150 10.936 1.00 0.00 N ATOM 1329 CA GLY A 86 11.669 8.061 9.818 1.00 0.00 C ATOM 1330 C GLY A 86 12.037 6.630 9.482 1.00 0.00 C ATOM 1331 O GLY A 86 13.151 6.356 9.033 1.00 0.00 O ATOM 0 H GLY A 86 10.041 8.880 10.852 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.220 8.532 8.943 1.00 0.00 H new ATOM 0 HA3 GLY A 86 12.575 8.620 10.052 1.00 0.00 H new ATOM 1335 N LYS A 87 11.102 5.713 9.702 1.00 0.00 N ATOM 1336 CA LYS A 87 11.333 4.301 9.421 1.00 0.00 C ATOM 1337 C LYS A 87 10.146 3.692 8.682 1.00 0.00 C ATOM 1338 O LYS A 87 10.310 2.792 7.858 1.00 0.00 O ATOM 1339 CB LYS A 87 11.584 3.535 10.722 1.00 0.00 C ATOM 1340 CG LYS A 87 10.536 3.791 11.791 1.00 0.00 C ATOM 1341 CD LYS A 87 11.057 3.449 13.177 1.00 0.00 C ATOM 1342 CE LYS A 87 11.144 1.945 13.384 1.00 0.00 C ATOM 1343 NZ LYS A 87 11.909 1.598 14.614 1.00 0.00 N ATOM 0 H LYS A 87 10.176 5.922 10.075 1.00 0.00 H new ATOM 0 HA LYS A 87 12.214 4.223 8.784 1.00 0.00 H new ATOM 0 HB2 LYS A 87 11.616 2.467 10.505 1.00 0.00 H new ATOM 0 HB3 LYS A 87 12.564 3.810 11.112 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.235 4.838 11.763 1.00 0.00 H new ATOM 0 HG3 LYS A 87 9.647 3.198 11.579 1.00 0.00 H new ATOM 0 HD2 LYS A 87 12.042 3.894 13.317 1.00 0.00 H new ATOM 0 HD3 LYS A 87 10.401 3.884 13.931 1.00 0.00 H new ATOM 0 HE2 LYS A 87 10.139 1.529 13.452 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.621 1.486 12.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 11.946 0.564 14.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 12.876 1.973 14.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 11.440 2.014 15.444 1.00 0.00 H new ATOM 1357 N VAL A 88 8.950 4.189 8.981 1.00 0.00 N ATOM 1358 CA VAL A 88 7.736 3.696 8.342 1.00 0.00 C ATOM 1359 C VAL A 88 7.033 4.804 7.567 1.00 0.00 C ATOM 1360 O VAL A 88 7.175 5.985 7.884 1.00 0.00 O ATOM 1361 CB VAL A 88 6.757 3.108 9.376 1.00 0.00 C ATOM 1362 CG1 VAL A 88 5.521 2.552 8.686 1.00 0.00 C ATOM 1363 CG2 VAL A 88 7.442 2.034 10.208 1.00 0.00 C ATOM 0 H VAL A 88 8.796 4.933 9.662 1.00 0.00 H new ATOM 0 HA VAL A 88 8.040 2.910 7.651 1.00 0.00 H new ATOM 0 HB VAL A 88 6.441 3.907 10.046 1.00 0.00 H new ATOM 0 HG11 VAL A 88 4.841 2.141 9.433 1.00 0.00 H new ATOM 0 HG12 VAL A 88 5.019 3.350 8.139 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.815 1.765 7.991 1.00 0.00 H new ATOM 0 HG21 VAL A 88 6.736 1.630 10.933 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.789 1.234 9.554 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.293 2.468 10.733 1.00 0.00 H new ATOM 1373 N VAL A 89 6.273 4.416 6.547 1.00 0.00 N ATOM 1374 CA VAL A 89 5.546 5.377 5.726 1.00 0.00 C ATOM 1375 C VAL A 89 4.045 5.115 5.773 1.00 0.00 C ATOM 1376 O VAL A 89 3.536 4.227 5.088 1.00 0.00 O ATOM 1377 CB VAL A 89 6.018 5.333 4.261 1.00 0.00 C ATOM 1378 CG1 VAL A 89 5.107 6.175 3.381 1.00 0.00 C ATOM 1379 CG2 VAL A 89 7.461 5.804 4.152 1.00 0.00 C ATOM 0 H VAL A 89 6.145 3.443 6.270 1.00 0.00 H new ATOM 0 HA VAL A 89 5.752 6.365 6.137 1.00 0.00 H new ATOM 0 HB VAL A 89 5.969 4.301 3.913 1.00 0.00 H new ATOM 0 HG11 VAL A 89 5.456 6.132 2.349 1.00 0.00 H new ATOM 0 HG12 VAL A 89 4.089 5.789 3.436 1.00 0.00 H new ATOM 0 HG13 VAL A 89 5.122 7.209 3.726 1.00 0.00 H new ATOM 0 HG21 VAL A 89 7.778 5.766 3.110 1.00 0.00 H new ATOM 0 HG22 VAL A 89 7.538 6.828 4.518 1.00 0.00 H new ATOM 0 HG23 VAL A 89 8.102 5.156 4.750 1.00 0.00 H new ATOM 1389 N THR A 90 3.339 5.895 6.586 1.00 0.00 N ATOM 1390 CA THR A 90 1.895 5.747 6.724 1.00 0.00 C ATOM 1391 C THR A 90 1.156 6.588 5.689 1.00 0.00 C ATOM 1392 O THR A 90 1.566 7.705 5.374 1.00 0.00 O ATOM 1393 CB THR A 90 1.421 6.152 8.132 1.00 0.00 C ATOM 1394 OG1 THR A 90 1.865 7.479 8.436 1.00 0.00 O ATOM 1395 CG2 THR A 90 1.947 5.182 9.180 1.00 0.00 C ATOM 0 H THR A 90 3.744 6.636 7.159 1.00 0.00 H new ATOM 0 HA THR A 90 1.668 4.693 6.562 1.00 0.00 H new ATOM 0 HB THR A 90 0.332 6.122 8.147 1.00 0.00 H new ATOM 0 HG1 THR A 90 2.535 7.758 7.778 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.599 5.488 10.167 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.582 4.178 8.962 1.00 0.00 H new ATOM 0 HG23 THR A 90 3.037 5.184 9.163 1.00 0.00 H new ATOM 1403 N VAL A 91 0.062 6.045 5.164 1.00 0.00 N ATOM 1404 CA VAL A 91 -0.736 6.747 4.166 1.00 0.00 C ATOM 1405 C VAL A 91 -2.224 6.643 4.480 1.00 0.00 C ATOM 1406 O VAL A 91 -2.802 5.555 4.451 1.00 0.00 O ATOM 1407 CB VAL A 91 -0.481 6.192 2.752 1.00 0.00 C ATOM 1408 CG1 VAL A 91 -1.284 6.970 1.720 1.00 0.00 C ATOM 1409 CG2 VAL A 91 1.004 6.231 2.425 1.00 0.00 C ATOM 0 H VAL A 91 -0.292 5.121 5.413 1.00 0.00 H new ATOM 0 HA VAL A 91 -0.433 7.794 4.198 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.809 5.153 2.723 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.091 6.564 0.727 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.347 6.885 1.947 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -0.990 8.019 1.746 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.166 5.835 1.422 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.360 7.260 2.471 1.00 0.00 H new ATOM 0 HG23 VAL A 91 1.552 5.625 3.147 1.00 0.00 H new ATOM 1419 N HIS A 92 -2.841 7.781 4.781 1.00 0.00 N ATOM 1420 CA HIS A 92 -4.264 7.818 5.100 1.00 0.00 C ATOM 1421 C HIS A 92 -5.102 7.945 3.831 1.00 0.00 C ATOM 1422 O HIS A 92 -4.973 8.915 3.083 1.00 0.00 O ATOM 1423 CB HIS A 92 -4.567 8.983 6.043 1.00 0.00 C ATOM 1424 CG HIS A 92 -6.027 9.295 6.161 1.00 0.00 C ATOM 1425 ND1 HIS A 92 -6.737 9.140 7.333 1.00 0.00 N ATOM 1426 CD2 HIS A 92 -6.910 9.757 5.246 1.00 0.00 C ATOM 1427 CE1 HIS A 92 -7.995 9.491 7.132 1.00 0.00 C ATOM 1428 NE2 HIS A 92 -8.126 9.870 5.874 1.00 0.00 N ATOM 0 H HIS A 92 -2.378 8.690 4.811 1.00 0.00 H new ATOM 0 HA HIS A 92 -4.524 6.882 5.595 1.00 0.00 H new ATOM 0 HB2 HIS A 92 -4.173 8.751 7.032 1.00 0.00 H new ATOM 0 HB3 HIS A 92 -4.042 9.871 5.691 1.00 0.00 H new ATOM 0 HD2 HIS A 92 -6.698 9.993 4.214 1.00 0.00 H new ATOM 0 HE1 HIS A 92 -8.782 9.471 7.871 1.00 0.00 H new ATOM 0 HE2 HIS A 92 -8.990 10.194 5.439 1.00 0.00 H new ATOM 1437 N LEU A 93 -5.961 6.959 3.595 1.00 0.00 N ATOM 1438 CA LEU A 93 -6.820 6.959 2.416 1.00 0.00 C ATOM 1439 C LEU A 93 -8.280 7.162 2.806 1.00 0.00 C ATOM 1440 O LEU A 93 -8.852 6.359 3.544 1.00 0.00 O ATOM 1441 CB LEU A 93 -6.663 5.647 1.646 1.00 0.00 C ATOM 1442 CG LEU A 93 -5.348 5.467 0.887 1.00 0.00 C ATOM 1443 CD1 LEU A 93 -5.142 4.007 0.515 1.00 0.00 C ATOM 1444 CD2 LEU A 93 -5.325 6.345 -0.356 1.00 0.00 C ATOM 0 H LEU A 93 -6.081 6.150 4.204 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.516 7.787 1.776 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -6.769 4.821 2.350 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -7.484 5.567 0.934 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.530 5.773 1.539 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.201 3.898 -0.025 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -5.113 3.401 1.421 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -5.964 3.673 -0.118 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -4.382 6.204 -0.884 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -6.152 6.070 -1.011 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -5.425 7.391 -0.065 1.00 0.00 H new ATOM 1456 N GLU A 94 -8.878 8.238 2.305 1.00 0.00 N ATOM 1457 CA GLU A 94 -10.273 8.544 2.601 1.00 0.00 C ATOM 1458 C GLU A 94 -11.206 7.824 1.632 1.00 0.00 C ATOM 1459 O GLU A 94 -11.084 7.964 0.415 1.00 0.00 O ATOM 1460 CB GLU A 94 -10.513 10.053 2.531 1.00 0.00 C ATOM 1461 CG GLU A 94 -11.908 10.469 2.967 1.00 0.00 C ATOM 1462 CD GLU A 94 -12.341 9.797 4.256 1.00 0.00 C ATOM 1463 OE1 GLU A 94 -11.546 9.792 5.219 1.00 0.00 O ATOM 1464 OE2 GLU A 94 -13.476 9.277 4.301 1.00 0.00 O ATOM 0 H GLU A 94 -8.419 8.912 1.693 1.00 0.00 H new ATOM 0 HA GLU A 94 -10.488 8.196 3.611 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.779 10.558 3.159 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.345 10.392 1.509 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -11.936 11.551 3.098 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -12.619 10.225 2.178 1.00 0.00 H new ATOM 1471 N LYS A 95 -12.138 7.052 2.180 1.00 0.00 N ATOM 1472 CA LYS A 95 -13.093 6.309 1.366 1.00 0.00 C ATOM 1473 C LYS A 95 -14.243 7.207 0.922 1.00 0.00 C ATOM 1474 O LYS A 95 -15.083 7.602 1.731 1.00 0.00 O ATOM 1475 CB LYS A 95 -13.639 5.112 2.148 1.00 0.00 C ATOM 1476 CG LYS A 95 -12.686 3.930 2.194 1.00 0.00 C ATOM 1477 CD LYS A 95 -13.365 2.689 2.747 1.00 0.00 C ATOM 1478 CE LYS A 95 -12.351 1.700 3.303 1.00 0.00 C ATOM 1479 NZ LYS A 95 -13.011 0.522 3.931 1.00 0.00 N ATOM 0 H LYS A 95 -12.253 6.924 3.185 1.00 0.00 H new ATOM 0 HA LYS A 95 -12.573 5.948 0.479 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -13.864 5.426 3.167 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.579 4.793 1.698 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -12.311 3.725 1.191 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -11.824 4.180 2.812 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -14.064 2.975 3.533 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -13.948 2.211 1.960 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -11.695 1.363 2.501 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -11.723 2.200 4.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -12.923 0.585 4.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -14.017 0.507 3.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -12.554 -0.351 3.598 1.00 0.00 H new ATOM 1493 N ILE A 96 -14.275 7.525 -0.368 1.00 0.00 N ATOM 1494 CA ILE A 96 -15.324 8.374 -0.919 1.00 0.00 C ATOM 1495 C ILE A 96 -16.658 8.120 -0.225 1.00 0.00 C ATOM 1496 O ILE A 96 -17.363 9.057 0.150 1.00 0.00 O ATOM 1497 CB ILE A 96 -15.495 8.148 -2.433 1.00 0.00 C ATOM 1498 CG1 ILE A 96 -14.217 8.542 -3.176 1.00 0.00 C ATOM 1499 CG2 ILE A 96 -16.684 8.939 -2.956 1.00 0.00 C ATOM 1500 CD1 ILE A 96 -13.918 10.024 -3.120 1.00 0.00 C ATOM 0 H ILE A 96 -13.587 7.208 -1.051 1.00 0.00 H new ATOM 0 HA ILE A 96 -15.017 9.406 -0.746 1.00 0.00 H new ATOM 0 HB ILE A 96 -15.684 7.089 -2.609 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -13.376 7.994 -2.752 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -14.304 8.236 -4.219 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -16.791 8.769 -4.027 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -17.590 8.615 -2.444 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -16.524 10.001 -2.772 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -12.998 10.231 -3.667 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -14.741 10.579 -3.571 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -13.799 10.332 -2.081 1.00 0.00 H new ATOM 1512 N ASN A 97 -16.998 6.846 -0.055 1.00 0.00 N ATOM 1513 CA ASN A 97 -18.247 6.468 0.595 1.00 0.00 C ATOM 1514 C ASN A 97 -17.978 5.741 1.909 1.00 0.00 C ATOM 1515 O ASN A 97 -17.928 4.512 1.953 1.00 0.00 O ATOM 1516 CB ASN A 97 -19.080 5.580 -0.331 1.00 0.00 C ATOM 1517 CG ASN A 97 -20.565 5.664 -0.031 1.00 0.00 C ATOM 1518 OD1 ASN A 97 -21.246 6.591 -0.470 1.00 0.00 O ATOM 1519 ND2 ASN A 97 -21.072 4.694 0.720 1.00 0.00 N ATOM 0 H ASN A 97 -16.426 6.058 -0.359 1.00 0.00 H new ATOM 0 HA ASN A 97 -18.805 7.379 0.812 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -18.904 5.873 -1.366 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -18.750 4.546 -0.232 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -22.064 4.697 0.955 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -20.469 3.946 1.062 1.00 0.00 H new ATOM 1526 N LYS A 98 -17.806 6.509 2.980 1.00 0.00 N ATOM 1527 CA LYS A 98 -17.544 5.940 4.296 1.00 0.00 C ATOM 1528 C LYS A 98 -18.489 4.779 4.585 1.00 0.00 C ATOM 1529 O LYS A 98 -18.187 3.908 5.401 1.00 0.00 O ATOM 1530 CB LYS A 98 -17.692 7.013 5.377 1.00 0.00 C ATOM 1531 CG LYS A 98 -16.733 8.179 5.213 1.00 0.00 C ATOM 1532 CD LYS A 98 -16.785 9.117 6.407 1.00 0.00 C ATOM 1533 CE LYS A 98 -15.645 10.124 6.375 1.00 0.00 C ATOM 1534 NZ LYS A 98 -16.020 11.408 7.030 1.00 0.00 N ATOM 0 H LYS A 98 -17.844 7.528 2.962 1.00 0.00 H new ATOM 0 HA LYS A 98 -16.521 5.563 4.304 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -18.715 7.390 5.365 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -17.532 6.557 6.354 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -15.718 7.802 5.090 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -16.981 8.730 4.306 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -17.738 9.645 6.415 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -16.734 8.537 7.329 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -14.774 9.702 6.876 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -15.358 10.314 5.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -15.217 12.067 6.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -16.836 11.824 6.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -16.270 11.231 8.024 1.00 0.00 H new ATOM 1548 N MET A 99 -19.634 4.771 3.910 1.00 0.00 N ATOM 1549 CA MET A 99 -20.622 3.715 4.093 1.00 0.00 C ATOM 1550 C MET A 99 -20.336 2.537 3.166 1.00 0.00 C ATOM 1551 O MET A 99 -21.253 1.837 2.737 1.00 0.00 O ATOM 1552 CB MET A 99 -22.030 4.253 3.833 1.00 0.00 C ATOM 1553 CG MET A 99 -22.535 5.185 4.923 1.00 0.00 C ATOM 1554 SD MET A 99 -22.915 4.317 6.458 1.00 0.00 S ATOM 1555 CE MET A 99 -21.427 4.634 7.403 1.00 0.00 C ATOM 0 H MET A 99 -19.900 5.484 3.231 1.00 0.00 H new ATOM 0 HA MET A 99 -20.559 3.368 5.124 1.00 0.00 H new ATOM 0 HB2 MET A 99 -22.037 4.783 2.881 1.00 0.00 H new ATOM 0 HB3 MET A 99 -22.719 3.414 3.736 1.00 0.00 H new ATOM 0 HG2 MET A 99 -21.783 5.950 5.119 1.00 0.00 H new ATOM 0 HG3 MET A 99 -23.429 5.700 4.570 1.00 0.00 H new ATOM 0 HE1 MET A 99 -21.087 3.709 7.868 1.00 0.00 H new ATOM 0 HE2 MET A 99 -20.649 5.014 6.741 1.00 0.00 H new ATOM 0 HE3 MET A 99 -21.638 5.373 8.176 1.00 0.00 H new ATOM 1565 N GLU A 100 -19.060 2.325 2.861 1.00 0.00 N ATOM 1566 CA GLU A 100 -18.656 1.233 1.984 1.00 0.00 C ATOM 1567 C GLU A 100 -17.433 0.510 2.543 1.00 0.00 C ATOM 1568 O GLU A 100 -16.561 1.127 3.155 1.00 0.00 O ATOM 1569 CB GLU A 100 -18.352 1.762 0.581 1.00 0.00 C ATOM 1570 CG GLU A 100 -17.788 0.708 -0.358 1.00 0.00 C ATOM 1571 CD GLU A 100 -18.872 -0.065 -1.085 1.00 0.00 C ATOM 1572 OE1 GLU A 100 -19.444 -0.995 -0.480 1.00 0.00 O ATOM 1573 OE2 GLU A 100 -19.147 0.261 -2.258 1.00 0.00 O ATOM 0 H GLU A 100 -18.289 2.895 3.208 1.00 0.00 H new ATOM 0 HA GLU A 100 -19.481 0.523 1.926 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -19.266 2.169 0.149 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -17.642 2.585 0.658 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -17.137 1.188 -1.089 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -17.170 0.013 0.211 1.00 0.00 H new ATOM 1580 N TRP A 101 -17.378 -0.799 2.328 1.00 0.00 N ATOM 1581 CA TRP A 101 -16.263 -1.606 2.811 1.00 0.00 C ATOM 1582 C TRP A 101 -15.287 -1.916 1.681 1.00 0.00 C ATOM 1583 O TRP A 101 -15.618 -1.770 0.505 1.00 0.00 O ATOM 1584 CB TRP A 101 -16.778 -2.907 3.428 1.00 0.00 C ATOM 1585 CG TRP A 101 -17.233 -2.752 4.848 1.00 0.00 C ATOM 1586 CD1 TRP A 101 -18.519 -2.781 5.304 1.00 0.00 C ATOM 1587 CD2 TRP A 101 -16.402 -2.543 5.995 1.00 0.00 C ATOM 1588 NE1 TRP A 101 -18.539 -2.601 6.666 1.00 0.00 N ATOM 1589 CE2 TRP A 101 -17.253 -2.454 7.114 1.00 0.00 C ATOM 1590 CE3 TRP A 101 -15.023 -2.424 6.186 1.00 0.00 C ATOM 1591 CZ2 TRP A 101 -16.768 -2.250 8.403 1.00 0.00 C ATOM 1592 CZ3 TRP A 101 -14.543 -2.221 7.466 1.00 0.00 C ATOM 1593 CH2 TRP A 101 -15.413 -2.137 8.561 1.00 0.00 C ATOM 0 H TRP A 101 -18.092 -1.324 1.823 1.00 0.00 H new ATOM 0 HA TRP A 101 -15.736 -1.034 3.575 1.00 0.00 H new ATOM 0 HB2 TRP A 101 -17.607 -3.282 2.827 1.00 0.00 H new ATOM 0 HB3 TRP A 101 -15.989 -3.658 3.387 1.00 0.00 H new ATOM 0 HD1 TRP A 101 -19.393 -2.924 4.685 1.00 0.00 H new ATOM 0 HE1 TRP A 101 -19.376 -2.580 7.249 1.00 0.00 H new ATOM 0 HE3 TRP A 101 -14.344 -2.489 5.348 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 -17.437 -2.183 9.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 -13.479 -2.125 7.625 1.00 0.00 H new ATOM 0 HH2 TRP A 101 -15.007 -1.980 9.549 1.00 0.00 H new ATOM 1604 N TRP A 102 -14.084 -2.345 2.046 1.00 0.00 N ATOM 1605 CA TRP A 102 -13.060 -2.676 1.062 1.00 0.00 C ATOM 1606 C TRP A 102 -12.654 -4.142 1.170 1.00 0.00 C ATOM 1607 O TRP A 102 -12.539 -4.683 2.269 1.00 0.00 O ATOM 1608 CB TRP A 102 -11.834 -1.780 1.250 1.00 0.00 C ATOM 1609 CG TRP A 102 -11.963 -0.448 0.573 1.00 0.00 C ATOM 1610 CD1 TRP A 102 -13.059 0.367 0.571 1.00 0.00 C ATOM 1611 CD2 TRP A 102 -10.962 0.220 -0.201 1.00 0.00 C ATOM 1612 NE1 TRP A 102 -12.799 1.502 -0.158 1.00 0.00 N ATOM 1613 CE2 TRP A 102 -11.519 1.437 -0.641 1.00 0.00 C ATOM 1614 CE3 TRP A 102 -9.648 -0.089 -0.563 1.00 0.00 C ATOM 1615 CZ2 TRP A 102 -10.806 2.341 -1.425 1.00 0.00 C ATOM 1616 CZ3 TRP A 102 -8.943 0.808 -1.342 1.00 0.00 C ATOM 1617 CH2 TRP A 102 -9.522 2.012 -1.765 1.00 0.00 C ATOM 0 H TRP A 102 -13.794 -2.472 3.016 1.00 0.00 H new ATOM 0 HA TRP A 102 -13.477 -2.506 0.070 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -11.667 -1.623 2.316 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -10.954 -2.293 0.862 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -13.993 0.151 1.069 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -13.453 2.269 -0.314 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -9.192 -1.013 -0.239 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -11.251 3.269 -1.753 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -7.928 0.577 -1.630 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -8.944 2.693 -2.371 1.00 0.00 H new ATOM 1628 N ASN A 103 -12.438 -4.778 0.024 1.00 0.00 N ATOM 1629 CA ASN A 103 -12.045 -6.182 -0.009 1.00 0.00 C ATOM 1630 C ASN A 103 -10.529 -6.325 0.077 1.00 0.00 C ATOM 1631 O ASN A 103 -10.014 -7.385 0.435 1.00 0.00 O ATOM 1632 CB ASN A 103 -12.560 -6.847 -1.287 1.00 0.00 C ATOM 1633 CG ASN A 103 -12.606 -8.359 -1.174 1.00 0.00 C ATOM 1634 OD1 ASN A 103 -11.673 -8.984 -0.669 1.00 0.00 O ATOM 1635 ND2 ASN A 103 -13.696 -8.954 -1.645 1.00 0.00 N ATOM 0 H ASN A 103 -12.528 -4.344 -0.894 1.00 0.00 H new ATOM 0 HA ASN A 103 -12.488 -6.678 0.855 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -13.558 -6.472 -1.512 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -11.919 -6.567 -2.123 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -13.784 -9.969 -1.596 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -14.445 -8.396 -2.055 1.00 0.00 H new ATOM 1642 N ARG A 104 -9.819 -5.251 -0.253 1.00 0.00 N ATOM 1643 CA ARG A 104 -8.362 -5.256 -0.214 1.00 0.00 C ATOM 1644 C ARG A 104 -7.805 -3.868 -0.515 1.00 0.00 C ATOM 1645 O ARG A 104 -8.524 -2.989 -0.992 1.00 0.00 O ATOM 1646 CB ARG A 104 -7.807 -6.269 -1.218 1.00 0.00 C ATOM 1647 CG ARG A 104 -7.996 -5.855 -2.668 1.00 0.00 C ATOM 1648 CD ARG A 104 -7.521 -6.938 -3.623 1.00 0.00 C ATOM 1649 NE ARG A 104 -8.176 -6.846 -4.925 1.00 0.00 N ATOM 1650 CZ ARG A 104 -8.062 -7.770 -5.872 1.00 0.00 C ATOM 1651 NH1 ARG A 104 -7.324 -8.852 -5.663 1.00 0.00 N ATOM 1652 NH2 ARG A 104 -8.689 -7.615 -7.032 1.00 0.00 N ATOM 0 H ARG A 104 -10.230 -4.366 -0.550 1.00 0.00 H new ATOM 0 HA ARG A 104 -8.052 -5.543 0.791 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -6.744 -6.413 -1.026 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -8.293 -7.231 -1.057 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -9.049 -5.642 -2.852 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -7.446 -4.933 -2.859 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -6.442 -6.858 -3.754 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -7.717 -7.917 -3.187 1.00 0.00 H new ATOM 0 HE ARG A 104 -8.753 -6.027 -5.118 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -6.842 -8.976 -4.773 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -7.239 -9.560 -6.392 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -9.259 -6.785 -7.197 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -8.601 -8.325 -7.758 1.00 0.00 H new ATOM 1666 N LEU A 105 -6.521 -3.678 -0.233 1.00 0.00 N ATOM 1667 CA LEU A 105 -5.866 -2.396 -0.472 1.00 0.00 C ATOM 1668 C LEU A 105 -5.757 -2.112 -1.967 1.00 0.00 C ATOM 1669 O LEU A 105 -6.334 -1.147 -2.470 1.00 0.00 O ATOM 1670 CB LEU A 105 -4.475 -2.385 0.163 1.00 0.00 C ATOM 1671 CG LEU A 105 -3.597 -1.177 -0.165 1.00 0.00 C ATOM 1672 CD1 LEU A 105 -4.253 0.108 0.317 1.00 0.00 C ATOM 1673 CD2 LEU A 105 -2.216 -1.337 0.454 1.00 0.00 C ATOM 0 H LEU A 105 -5.912 -4.395 0.161 1.00 0.00 H new ATOM 0 HA LEU A 105 -6.473 -1.615 -0.015 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -4.591 -2.441 1.245 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.948 -3.287 -0.148 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.484 -1.119 -1.248 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.613 0.956 0.074 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -5.219 0.230 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -4.398 0.060 1.396 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.605 -0.468 0.210 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.310 -1.422 1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -1.742 -2.236 0.059 1.00 0.00 H new ATOM 1685 N VAL A 106 -5.016 -2.959 -2.673 1.00 0.00 N ATOM 1686 CA VAL A 106 -4.834 -2.801 -4.111 1.00 0.00 C ATOM 1687 C VAL A 106 -5.043 -4.124 -4.840 1.00 0.00 C ATOM 1688 O VAL A 106 -4.708 -5.191 -4.324 1.00 0.00 O ATOM 1689 CB VAL A 106 -3.430 -2.262 -4.443 1.00 0.00 C ATOM 1690 CG1 VAL A 106 -3.298 -0.811 -4.006 1.00 0.00 C ATOM 1691 CG2 VAL A 106 -2.360 -3.123 -3.790 1.00 0.00 C ATOM 0 H VAL A 106 -4.532 -3.762 -2.273 1.00 0.00 H new ATOM 0 HA VAL A 106 -5.581 -2.082 -4.447 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.290 -2.306 -5.523 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -2.300 -0.447 -4.249 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -4.041 -0.206 -4.525 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -3.459 -0.739 -2.930 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -1.375 -2.727 -4.036 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -2.496 -3.114 -2.709 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.442 -4.146 -4.157 1.00 0.00 H new ATOM 1701 N THR A 107 -5.600 -4.047 -6.045 1.00 0.00 N ATOM 1702 CA THR A 107 -5.855 -5.238 -6.846 1.00 0.00 C ATOM 1703 C THR A 107 -4.751 -6.273 -6.660 1.00 0.00 C ATOM 1704 O THR A 107 -5.006 -7.477 -6.684 1.00 0.00 O ATOM 1705 CB THR A 107 -5.974 -4.893 -8.342 1.00 0.00 C ATOM 1706 OG1 THR A 107 -4.771 -4.265 -8.797 1.00 0.00 O ATOM 1707 CG2 THR A 107 -7.159 -3.973 -8.593 1.00 0.00 C ATOM 0 H THR A 107 -5.883 -3.173 -6.487 1.00 0.00 H new ATOM 0 HA THR A 107 -6.801 -5.655 -6.501 1.00 0.00 H new ATOM 0 HB THR A 107 -6.131 -5.820 -8.894 1.00 0.00 H new ATOM 0 HG1 THR A 107 -4.854 -4.050 -9.750 1.00 0.00 H new ATOM 0 HG21 THR A 107 -7.222 -3.743 -9.657 1.00 0.00 H new ATOM 0 HG22 THR A 107 -8.077 -4.466 -8.273 1.00 0.00 H new ATOM 0 HG23 THR A 107 -7.028 -3.049 -8.030 1.00 0.00 H new ATOM 1715 N SER A 108 -3.525 -5.796 -6.474 1.00 0.00 N ATOM 1716 CA SER A 108 -2.381 -6.680 -6.288 1.00 0.00 C ATOM 1717 C SER A 108 -2.551 -7.531 -5.033 1.00 0.00 C ATOM 1718 O SER A 108 -2.379 -8.750 -5.067 1.00 0.00 O ATOM 1719 CB SER A 108 -1.089 -5.866 -6.194 1.00 0.00 C ATOM 1720 OG SER A 108 0.041 -6.665 -6.496 1.00 0.00 O ATOM 0 H SER A 108 -3.298 -4.802 -6.448 1.00 0.00 H new ATOM 0 HA SER A 108 -2.322 -7.343 -7.151 1.00 0.00 H new ATOM 0 HB2 SER A 108 -1.136 -5.023 -6.883 1.00 0.00 H new ATOM 0 HB3 SER A 108 -0.988 -5.453 -5.190 1.00 0.00 H new ATOM 0 HG SER A 108 0.853 -6.121 -6.430 1.00 0.00 H new ATOM 1726 N ASP A 109 -2.890 -6.879 -3.926 1.00 0.00 N ATOM 1727 CA ASP A 109 -3.084 -7.575 -2.659 1.00 0.00 C ATOM 1728 C ASP A 109 -4.202 -8.607 -2.771 1.00 0.00 C ATOM 1729 O ASP A 109 -5.060 -8.535 -3.652 1.00 0.00 O ATOM 1730 CB ASP A 109 -3.407 -6.574 -1.548 1.00 0.00 C ATOM 1731 CG ASP A 109 -2.160 -5.978 -0.925 1.00 0.00 C ATOM 1732 OD1 ASP A 109 -1.136 -6.689 -0.852 1.00 0.00 O ATOM 1733 OD2 ASP A 109 -2.208 -4.802 -0.509 1.00 0.00 O ATOM 0 H ASP A 109 -3.036 -5.871 -3.880 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.158 -8.095 -2.412 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -4.026 -5.773 -1.953 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.994 -7.070 -0.775 1.00 0.00 H new ATOM 1738 N PRO A 110 -4.194 -9.590 -1.860 1.00 0.00 N ATOM 1739 CA PRO A 110 -5.200 -10.656 -1.836 1.00 0.00 C ATOM 1740 C PRO A 110 -6.575 -10.146 -1.417 1.00 0.00 C ATOM 1741 O PRO A 110 -6.710 -9.020 -0.940 1.00 0.00 O ATOM 1742 CB PRO A 110 -4.654 -11.637 -0.796 1.00 0.00 C ATOM 1743 CG PRO A 110 -3.796 -10.806 0.095 1.00 0.00 C ATOM 1744 CD PRO A 110 -3.202 -9.738 -0.781 1.00 0.00 C ATOM 0 HA PRO A 110 -5.349 -11.098 -2.821 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -5.461 -12.112 -0.238 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -4.080 -12.435 -1.267 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -4.382 -10.367 0.903 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -3.016 -11.409 0.559 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -3.059 -8.805 -0.236 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -2.227 -10.033 -1.169 1.00 0.00 H new ATOM 1752 N GLU A 111 -7.592 -10.983 -1.599 1.00 0.00 N ATOM 1753 CA GLU A 111 -8.957 -10.615 -1.239 1.00 0.00 C ATOM 1754 C GLU A 111 -9.363 -11.258 0.084 1.00 0.00 C ATOM 1755 O GLU A 111 -9.003 -12.401 0.366 1.00 0.00 O ATOM 1756 CB GLU A 111 -9.930 -11.036 -2.343 1.00 0.00 C ATOM 1757 CG GLU A 111 -9.796 -10.217 -3.616 1.00 0.00 C ATOM 1758 CD GLU A 111 -10.688 -10.725 -4.733 1.00 0.00 C ATOM 1759 OE1 GLU A 111 -11.752 -11.302 -4.427 1.00 0.00 O ATOM 1760 OE2 GLU A 111 -10.320 -10.546 -5.913 1.00 0.00 O ATOM 0 H GLU A 111 -7.497 -11.919 -1.993 1.00 0.00 H new ATOM 0 HA GLU A 111 -8.996 -9.532 -1.124 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -9.766 -12.088 -2.578 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.950 -10.948 -1.970 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.044 -9.177 -3.402 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.758 -10.236 -3.948 1.00 0.00 H new ATOM 1767 N ILE A 112 -10.113 -10.514 0.890 1.00 0.00 N ATOM 1768 CA ILE A 112 -10.568 -11.011 2.182 1.00 0.00 C ATOM 1769 C ILE A 112 -12.088 -10.945 2.292 1.00 0.00 C ATOM 1770 O ILE A 112 -12.705 -9.952 1.911 1.00 0.00 O ATOM 1771 CB ILE A 112 -9.946 -10.214 3.343 1.00 0.00 C ATOM 1772 CG1 ILE A 112 -10.121 -8.711 3.111 1.00 0.00 C ATOM 1773 CG2 ILE A 112 -8.473 -10.563 3.496 1.00 0.00 C ATOM 1774 CD1 ILE A 112 -9.928 -7.880 4.360 1.00 0.00 C ATOM 0 H ILE A 112 -10.418 -9.566 0.671 1.00 0.00 H new ATOM 0 HA ILE A 112 -10.245 -12.050 2.252 1.00 0.00 H new ATOM 0 HB ILE A 112 -10.461 -10.483 4.265 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -9.410 -8.383 2.353 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -11.119 -8.527 2.713 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -8.047 -9.991 4.321 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -8.371 -11.628 3.702 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -7.944 -10.319 2.575 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -10.067 -6.826 4.121 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -10.657 -8.180 5.113 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -8.921 -8.034 4.748 1.00 0.00 H new ATOM 1786 N ASN A 113 -12.684 -12.010 2.818 1.00 0.00 N ATOM 1787 CA ASN A 113 -14.132 -12.073 2.980 1.00 0.00 C ATOM 1788 C ASN A 113 -14.627 -10.952 3.889 1.00 0.00 C ATOM 1789 O ASN A 113 -14.314 -10.919 5.080 1.00 0.00 O ATOM 1790 CB ASN A 113 -14.544 -13.430 3.555 1.00 0.00 C ATOM 1791 CG ASN A 113 -15.961 -13.423 4.095 1.00 0.00 C ATOM 1792 OD1 ASN A 113 -16.279 -12.684 5.026 1.00 0.00 O ATOM 1793 ND2 ASN A 113 -16.820 -14.251 3.511 1.00 0.00 N ATOM 0 H ASN A 113 -12.187 -12.841 3.139 1.00 0.00 H new ATOM 0 HA ASN A 113 -14.588 -11.949 1.998 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -14.457 -14.191 2.780 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -13.855 -13.708 4.353 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -17.787 -14.292 3.832 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -16.512 -14.846 2.742 1.00 0.00 H new ATOM 1800 N THR A 114 -15.403 -10.034 3.320 1.00 0.00 N ATOM 1801 CA THR A 114 -15.941 -8.912 4.078 1.00 0.00 C ATOM 1802 C THR A 114 -17.286 -9.264 4.702 1.00 0.00 C ATOM 1803 O THR A 114 -18.166 -9.813 4.038 1.00 0.00 O ATOM 1804 CB THR A 114 -16.111 -7.665 3.190 1.00 0.00 C ATOM 1805 OG1 THR A 114 -17.027 -7.943 2.125 1.00 0.00 O ATOM 1806 CG2 THR A 114 -14.774 -7.224 2.613 1.00 0.00 C ATOM 0 H THR A 114 -15.673 -10.046 2.336 1.00 0.00 H new ATOM 0 HA THR A 114 -15.224 -8.692 4.869 1.00 0.00 H new ATOM 0 HB THR A 114 -16.506 -6.858 3.808 1.00 0.00 H new ATOM 0 HG1 THR A 114 -17.131 -7.145 1.566 1.00 0.00 H new ATOM 0 HG21 THR A 114 -14.920 -6.342 1.990 1.00 0.00 H new ATOM 0 HG22 THR A 114 -14.088 -6.985 3.426 1.00 0.00 H new ATOM 0 HG23 THR A 114 -14.355 -8.029 2.010 1.00 0.00 H new ATOM 1814 N LYS A 115 -17.440 -8.945 5.983 1.00 0.00 N ATOM 1815 CA LYS A 115 -18.679 -9.226 6.698 1.00 0.00 C ATOM 1816 C LYS A 115 -19.715 -8.137 6.440 1.00 0.00 C ATOM 1817 O LYS A 115 -20.399 -7.687 7.360 1.00 0.00 O ATOM 1818 CB LYS A 115 -18.410 -9.344 8.200 1.00 0.00 C ATOM 1819 CG LYS A 115 -19.438 -10.184 8.938 1.00 0.00 C ATOM 1820 CD LYS A 115 -18.918 -10.639 10.291 1.00 0.00 C ATOM 1821 CE LYS A 115 -19.562 -11.947 10.725 1.00 0.00 C ATOM 1822 NZ LYS A 115 -21.014 -11.782 11.011 1.00 0.00 N ATOM 0 H LYS A 115 -16.721 -8.491 6.547 1.00 0.00 H new ATOM 0 HA LYS A 115 -19.074 -10.173 6.331 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -17.422 -9.779 8.351 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -18.388 -8.345 8.636 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -20.352 -9.606 9.074 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -19.698 -11.054 8.336 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -17.836 -10.763 10.243 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -19.118 -9.869 11.036 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -19.429 -12.695 9.943 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -19.057 -12.323 11.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -21.416 -12.695 11.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -21.141 -11.087 11.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -21.501 -11.448 10.155 1.00 0.00 H new ATOM 1836 N SER A 116 -19.826 -7.718 5.184 1.00 0.00 N ATOM 1837 CA SER A 116 -20.778 -6.679 4.806 1.00 0.00 C ATOM 1838 C SER A 116 -22.049 -7.291 4.226 1.00 0.00 C ATOM 1839 O SER A 116 -22.059 -8.448 3.807 1.00 0.00 O ATOM 1840 CB SER A 116 -20.147 -5.726 3.788 1.00 0.00 C ATOM 1841 OG SER A 116 -20.939 -4.563 3.620 1.00 0.00 O ATOM 0 H SER A 116 -19.269 -8.081 4.411 1.00 0.00 H new ATOM 0 HA SER A 116 -21.042 -6.119 5.703 1.00 0.00 H new ATOM 0 HB2 SER A 116 -19.147 -5.445 4.119 1.00 0.00 H new ATOM 0 HB3 SER A 116 -20.034 -6.234 2.830 1.00 0.00 H new ATOM 0 HG SER A 116 -20.514 -3.969 2.966 1.00 0.00 H new ATOM 1847 N GLY A 117 -23.121 -6.505 4.205 1.00 0.00 N ATOM 1848 CA GLY A 117 -24.384 -6.987 3.675 1.00 0.00 C ATOM 1849 C GLY A 117 -25.578 -6.398 4.399 1.00 0.00 C ATOM 1850 O GLY A 117 -25.824 -5.192 4.357 1.00 0.00 O ATOM 0 H GLY A 117 -23.138 -5.544 4.545 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -24.448 -6.741 2.615 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -24.416 -8.074 3.752 1.00 0.00 H new ATOM 1854 N PRO A 118 -26.347 -7.261 5.080 1.00 0.00 N ATOM 1855 CA PRO A 118 -27.536 -6.842 5.828 1.00 0.00 C ATOM 1856 C PRO A 118 -27.184 -6.026 7.067 1.00 0.00 C ATOM 1857 O PRO A 118 -26.305 -6.404 7.841 1.00 0.00 O ATOM 1858 CB PRO A 118 -28.189 -8.167 6.228 1.00 0.00 C ATOM 1859 CG PRO A 118 -27.069 -9.150 6.248 1.00 0.00 C ATOM 1860 CD PRO A 118 -26.114 -8.712 5.173 1.00 0.00 C ATOM 0 HA PRO A 118 -28.182 -6.194 5.236 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -28.669 -8.093 7.204 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -28.960 -8.460 5.515 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -26.580 -9.165 7.222 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -27.433 -10.160 6.059 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -25.081 -8.937 5.437 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -26.317 -9.213 4.227 1.00 0.00 H new ATOM 1868 N SER A 119 -27.876 -4.906 7.248 1.00 0.00 N ATOM 1869 CA SER A 119 -27.633 -4.034 8.392 1.00 0.00 C ATOM 1870 C SER A 119 -28.834 -3.129 8.650 1.00 0.00 C ATOM 1871 O SER A 119 -29.802 -3.131 7.889 1.00 0.00 O ATOM 1872 CB SER A 119 -26.382 -3.186 8.158 1.00 0.00 C ATOM 1873 OG SER A 119 -25.221 -3.996 8.096 1.00 0.00 O ATOM 0 H SER A 119 -28.609 -4.581 6.618 1.00 0.00 H new ATOM 0 HA SER A 119 -27.478 -4.662 9.269 1.00 0.00 H new ATOM 0 HB2 SER A 119 -26.488 -2.625 7.230 1.00 0.00 H new ATOM 0 HB3 SER A 119 -26.278 -2.457 8.961 1.00 0.00 H new ATOM 0 HG SER A 119 -25.442 -4.907 8.381 1.00 0.00 H new ATOM 1879 N SER A 120 -28.764 -2.356 9.729 1.00 0.00 N ATOM 1880 CA SER A 120 -29.846 -1.448 10.090 1.00 0.00 C ATOM 1881 C SER A 120 -29.888 -0.250 9.147 1.00 0.00 C ATOM 1882 O SER A 120 -28.913 0.490 9.022 1.00 0.00 O ATOM 1883 CB SER A 120 -29.678 -0.969 11.534 1.00 0.00 C ATOM 1884 OG SER A 120 -30.864 -0.356 12.009 1.00 0.00 O ATOM 0 H SER A 120 -27.969 -2.340 10.368 1.00 0.00 H new ATOM 0 HA SER A 120 -30.787 -1.991 10.002 1.00 0.00 H new ATOM 0 HB2 SER A 120 -29.420 -1.814 12.173 1.00 0.00 H new ATOM 0 HB3 SER A 120 -28.851 -0.262 11.592 1.00 0.00 H new ATOM 0 HG SER A 120 -30.732 -0.060 12.934 1.00 0.00 H new ATOM 1890 N GLY A 121 -31.026 -0.065 8.484 1.00 0.00 N ATOM 1891 CA GLY A 121 -31.175 1.044 7.560 1.00 0.00 C ATOM 1892 C GLY A 121 -30.240 0.937 6.371 1.00 0.00 C ATOM 1893 O GLY A 121 -29.476 -0.021 6.258 1.00 0.00 O ATOM 0 H GLY A 121 -31.847 -0.664 8.571 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -32.205 1.082 7.206 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -30.984 1.979 8.086 1.00 0.00 H new TER 1897 GLY A 121