USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1314 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 LYS NZ :NH3+ 147:sc= 0.257 (180deg=0) USER MOD Set 1.2: A 100 TYR OH : rot 165:sc= 0.259 USER MOD Set 1.3: A 110 GLN : amide:sc= -0.0166 X(o=0.5,f=0.25) USER MOD Set 2.1: A 22 THR OG1 : rot -160:sc= 0 USER MOD Set 2.2: A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 SER OG : rot 180:sc= -1.54! USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 29:sc= 0.519 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 79:sc= 0.911 USER MOD Single : A 29 GLN : amide:sc= -0.695 K(o=-0.69,f=0) USER MOD Single : A 34 GLN : amide:sc= -0.181 K(o=-0.18,f=-2.1!) USER MOD Single : A 35 LYS NZ :NH3+ -136:sc=-0.00544 (180deg=-0.197) USER MOD Single : A 37 LYS NZ :NH3+ 172:sc= -0.846 (180deg=-0.978) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 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 45 SER OG : rot 180:sc= -3.13! USER MOD Single : A 46 ASN : amide:sc= -0.458 X(o=-0.46,f=-0.44) USER MOD Single : A 48 GLN : amide:sc= -0.326 X(o=-0.33,f=-0.67) USER MOD Single : A 53 MET CE :methyl -133:sc= -3.58 (180deg=-6.73!) USER MOD Single : A 54 GLN : amide:sc= -0.0538 K(o=-0.054,f=-0.7) USER MOD Single : A 56 HIS : no HE2:sc= -2.89! C(o=-2.9!,f=-6.8!) USER MOD Single : A 57 HIS : no HD1:sc= -4.7! C(o=-4.7!,f=-5.7!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 60 SER OG : rot -34:sc= 0.91 USER MOD Single : A 64 TYR OH : rot 130:sc= 0.416 USER MOD Single : A 65 THR OG1 : rot 88:sc= 0.952 USER MOD Single : A 67 TYR OH : rot 165:sc= -0.432 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.356) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 173:sc= 0.255 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.0431 X(o=-0.043,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0.0111 USER MOD Single : A 115 ASN : amide:sc= -0.194 K(o=-0.19,f=-0.83) USER MOD Single : A 116 ASN : amide:sc= -1.46 K(o=-1.5,f=-4.4!) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.0671 USER MOD Single : A 128 GLN : amide:sc= -0.108 X(o=-0.11,f=-0.47) USER MOD Single : A 135 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.11) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.098 USER MOD Single : A 139 GLN : amide:sc= -0.141 K(o=-0.14,f=-0.8) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 144 GLN : amide:sc= -2.75 K(o=-2.8,f=-3.5!) USER MOD Single : A 147 HIS : no HD1:sc= -0.857 X(o=-0.86,f=-0.42) USER MOD Single : A 155 SER OG : rot 180:sc= 0.304 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.0301 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -38.527 13.533 14.302 1.00 0.00 N ATOM 2 CA GLY A -1 -39.188 12.208 14.126 1.00 0.00 C ATOM 3 C GLY A -1 -38.125 11.100 14.121 1.00 0.00 C ATOM 4 O GLY A -1 -37.681 10.671 13.072 1.00 0.00 O ATOM 0 H1 GLY A -1 -39.248 14.283 14.305 1.00 0.00 H new ATOM 0 H2 GLY A -1 -38.010 13.546 15.204 1.00 0.00 H new ATOM 0 H3 GLY A -1 -37.862 13.696 13.519 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -39.903 12.037 14.931 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -39.750 12.191 13.192 1.00 0.00 H new ATOM 10 N GLY A 0 -37.708 10.632 15.280 1.00 0.00 N ATOM 11 CA GLY A 0 -36.676 9.556 15.326 1.00 0.00 C ATOM 12 C GLY A 0 -37.362 8.182 15.318 1.00 0.00 C ATOM 13 O GLY A 0 -38.288 7.947 16.073 1.00 0.00 O ATOM 0 H GLY A 0 -38.041 10.952 16.190 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -36.006 9.644 14.471 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -36.065 9.663 16.222 1.00 0.00 H new ATOM 17 N SER A 1 -36.921 7.271 14.474 1.00 0.00 N ATOM 18 CA SER A 1 -37.555 5.919 14.430 1.00 0.00 C ATOM 19 C SER A 1 -36.520 4.837 14.772 1.00 0.00 C ATOM 20 O SER A 1 -35.340 5.030 14.552 1.00 0.00 O ATOM 21 CB SER A 1 -38.042 5.758 12.990 1.00 0.00 C ATOM 22 OG SER A 1 -38.772 4.545 12.875 1.00 0.00 O ATOM 0 H SER A 1 -36.152 7.410 13.818 1.00 0.00 H new ATOM 0 HA SER A 1 -38.368 5.820 15.149 1.00 0.00 H new ATOM 0 HB2 SER A 1 -38.671 6.603 12.710 1.00 0.00 H new ATOM 0 HB3 SER A 1 -37.194 5.752 12.305 1.00 0.00 H new ATOM 0 HG SER A 1 -39.087 4.439 11.953 1.00 0.00 H new ATOM 28 N PRO A 2 -36.986 3.727 15.303 1.00 0.00 N ATOM 29 CA PRO A 2 -36.060 2.625 15.667 1.00 0.00 C ATOM 30 C PRO A 2 -35.532 1.928 14.403 1.00 0.00 C ATOM 31 O PRO A 2 -36.288 1.322 13.666 1.00 0.00 O ATOM 32 CB PRO A 2 -36.930 1.676 16.487 1.00 0.00 C ATOM 33 CG PRO A 2 -38.330 1.944 16.034 1.00 0.00 C ATOM 34 CD PRO A 2 -38.387 3.388 15.611 1.00 0.00 C ATOM 0 HA PRO A 2 -35.182 2.969 16.214 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -36.651 0.637 16.314 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -36.818 1.862 17.555 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -38.599 1.289 15.206 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -39.039 1.749 16.838 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -39.031 3.524 14.742 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -38.785 4.021 16.404 1.00 0.00 H new ATOM 42 N ARG A 3 -34.243 2.008 14.142 1.00 0.00 N ATOM 43 CA ARG A 3 -33.683 1.347 12.925 1.00 0.00 C ATOM 44 C ARG A 3 -32.536 0.400 13.315 1.00 0.00 C ATOM 45 O ARG A 3 -31.376 0.752 13.204 1.00 0.00 O ATOM 46 CB ARG A 3 -33.162 2.494 12.058 1.00 0.00 C ATOM 47 CG ARG A 3 -33.224 2.088 10.583 1.00 0.00 C ATOM 48 CD ARG A 3 -34.670 2.176 10.090 1.00 0.00 C ATOM 49 NE ARG A 3 -34.691 1.392 8.817 1.00 0.00 N ATOM 50 CZ ARG A 3 -34.179 1.882 7.699 1.00 0.00 C ATOM 51 NH1 ARG A 3 -33.633 3.077 7.661 1.00 0.00 N ATOM 52 NH2 ARG A 3 -34.214 1.167 6.605 1.00 0.00 N ATOM 0 H ARG A 3 -33.562 2.501 14.720 1.00 0.00 H new ATOM 0 HA ARG A 3 -34.426 0.745 12.402 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -33.759 3.390 12.225 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -32.137 2.738 12.336 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -32.585 2.741 9.988 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -32.847 1.073 10.458 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -35.363 1.760 10.822 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -34.968 3.211 9.922 1.00 0.00 H new ATOM 0 HE ARG A 3 -35.108 0.461 8.810 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -33.597 3.648 8.505 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -33.245 3.433 6.787 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -34.634 0.238 6.616 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -33.821 1.539 5.740 1.00 0.00 H new ATOM 66 N ILE A 4 -32.846 -0.798 13.769 1.00 0.00 N ATOM 67 CA ILE A 4 -31.764 -1.753 14.160 1.00 0.00 C ATOM 68 C ILE A 4 -32.014 -3.125 13.512 1.00 0.00 C ATOM 69 O ILE A 4 -33.102 -3.664 13.599 1.00 0.00 O ATOM 70 CB ILE A 4 -31.850 -1.852 15.687 1.00 0.00 C ATOM 71 CG1 ILE A 4 -31.631 -0.466 16.305 1.00 0.00 C ATOM 72 CG2 ILE A 4 -30.771 -2.808 16.203 1.00 0.00 C ATOM 73 CD1 ILE A 4 -32.011 -0.502 17.786 1.00 0.00 C ATOM 0 H ILE A 4 -33.797 -1.149 13.883 1.00 0.00 H new ATOM 0 HA ILE A 4 -30.779 -1.421 13.832 1.00 0.00 H new ATOM 0 HB ILE A 4 -32.835 -2.227 15.966 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -30.589 -0.167 16.193 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -32.234 0.276 15.782 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -30.835 -2.876 17.289 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -30.922 -3.796 15.768 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -29.787 -2.433 15.920 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -31.855 0.483 18.226 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -33.060 -0.782 17.886 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -31.389 -1.233 18.304 1.00 0.00 H new ATOM 85 N LYS A 5 -31.019 -3.697 12.863 1.00 0.00 N ATOM 86 CA LYS A 5 -31.211 -5.030 12.218 1.00 0.00 C ATOM 87 C LYS A 5 -30.074 -5.982 12.620 1.00 0.00 C ATOM 88 O LYS A 5 -28.914 -5.691 12.398 1.00 0.00 O ATOM 89 CB LYS A 5 -31.172 -4.751 10.715 1.00 0.00 C ATOM 90 CG LYS A 5 -32.177 -5.658 10.000 1.00 0.00 C ATOM 91 CD LYS A 5 -33.563 -5.013 10.037 1.00 0.00 C ATOM 92 CE LYS A 5 -34.536 -5.846 9.200 1.00 0.00 C ATOM 93 NZ LYS A 5 -35.869 -5.627 9.828 1.00 0.00 N ATOM 0 H LYS A 5 -30.088 -3.295 12.756 1.00 0.00 H new ATOM 0 HA LYS A 5 -32.144 -5.505 12.520 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -31.409 -3.705 10.522 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -30.168 -4.927 10.328 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -31.867 -5.819 8.968 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -32.206 -6.636 10.481 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -33.917 -4.946 11.066 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -33.513 -3.995 9.650 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -34.533 -5.527 8.158 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -34.263 -6.901 9.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -36.590 -6.167 9.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -35.843 -5.946 10.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -36.105 -4.615 9.797 1.00 0.00 H new ATOM 107 N THR A 6 -30.393 -7.117 13.211 1.00 0.00 N ATOM 108 CA THR A 6 -29.321 -8.074 13.620 1.00 0.00 C ATOM 109 C THR A 6 -29.597 -9.466 13.031 1.00 0.00 C ATOM 110 O THR A 6 -30.628 -10.057 13.292 1.00 0.00 O ATOM 111 CB THR A 6 -29.390 -8.114 15.148 1.00 0.00 C ATOM 112 OG1 THR A 6 -30.718 -8.414 15.553 1.00 0.00 O ATOM 113 CG2 THR A 6 -28.976 -6.755 15.715 1.00 0.00 C ATOM 0 H THR A 6 -31.345 -7.415 13.424 1.00 0.00 H new ATOM 0 HA THR A 6 -28.337 -7.769 13.263 1.00 0.00 H new ATOM 0 HB THR A 6 -28.714 -8.882 15.523 1.00 0.00 H new ATOM 0 HG1 THR A 6 -31.156 -8.954 14.863 1.00 0.00 H new ATOM 0 HG21 THR A 6 -29.026 -6.785 16.803 1.00 0.00 H new ATOM 0 HG22 THR A 6 -27.957 -6.526 15.404 1.00 0.00 H new ATOM 0 HG23 THR A 6 -29.651 -5.984 15.342 1.00 0.00 H new ATOM 121 N ARG A 7 -28.686 -9.997 12.239 1.00 0.00 N ATOM 122 CA ARG A 7 -28.908 -11.349 11.644 1.00 0.00 C ATOM 123 C ARG A 7 -27.639 -12.205 11.784 1.00 0.00 C ATOM 124 O ARG A 7 -27.634 -13.197 12.489 1.00 0.00 O ATOM 125 CB ARG A 7 -29.220 -11.087 10.171 1.00 0.00 C ATOM 126 CG ARG A 7 -30.676 -10.636 10.029 1.00 0.00 C ATOM 127 CD ARG A 7 -30.818 -9.745 8.784 1.00 0.00 C ATOM 128 NE ARG A 7 -32.292 -9.468 8.624 1.00 0.00 N ATOM 129 CZ ARG A 7 -32.807 -9.158 7.442 1.00 0.00 C ATOM 130 NH1 ARG A 7 -32.054 -9.043 6.372 1.00 0.00 N ATOM 131 NH2 ARG A 7 -34.093 -8.944 7.335 1.00 0.00 N ATOM 0 H ARG A 7 -27.805 -9.550 11.984 1.00 0.00 H new ATOM 0 HA ARG A 7 -29.713 -11.892 12.140 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -28.551 -10.322 9.777 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -29.050 -11.991 9.586 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -31.330 -11.504 9.945 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -30.987 -10.088 10.919 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -30.259 -8.817 8.905 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -30.419 -10.245 7.901 1.00 0.00 H new ATOM 0 HE ARG A 7 -32.903 -9.520 9.439 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -31.047 -9.193 6.438 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -32.476 -8.803 5.475 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -34.692 -9.016 8.157 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -34.497 -8.705 6.429 1.00 0.00 H new ATOM 145 N ARG A 8 -26.561 -11.834 11.121 1.00 0.00 N ATOM 146 CA ARG A 8 -25.304 -12.637 11.228 1.00 0.00 C ATOM 147 C ARG A 8 -24.072 -11.721 11.114 1.00 0.00 C ATOM 148 O ARG A 8 -23.572 -11.486 10.031 1.00 0.00 O ATOM 149 CB ARG A 8 -25.357 -13.611 10.050 1.00 0.00 C ATOM 150 CG ARG A 8 -24.821 -14.976 10.489 1.00 0.00 C ATOM 151 CD ARG A 8 -25.000 -15.985 9.352 1.00 0.00 C ATOM 152 NE ARG A 8 -24.679 -17.313 9.960 1.00 0.00 N ATOM 153 CZ ARG A 8 -25.541 -17.934 10.750 1.00 0.00 C ATOM 154 NH1 ARG A 8 -26.713 -17.410 11.032 1.00 0.00 N ATOM 155 NH2 ARG A 8 -25.226 -19.095 11.264 1.00 0.00 N ATOM 0 H ARG A 8 -26.503 -11.015 10.516 1.00 0.00 H new ATOM 0 HA ARG A 8 -25.226 -13.154 12.184 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -26.382 -13.709 9.692 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -24.765 -13.226 9.220 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -23.767 -14.896 10.756 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -25.350 -15.317 11.379 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -26.018 -15.965 8.963 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -24.335 -15.762 8.518 1.00 0.00 H new ATOM 0 HE ARG A 8 -23.778 -17.749 9.762 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -26.975 -16.506 10.639 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -27.360 -17.908 11.643 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -24.321 -19.516 11.055 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -25.886 -19.579 11.873 1.00 0.00 H new ATOM 169 N SER A 9 -23.578 -11.204 12.222 1.00 0.00 N ATOM 170 CA SER A 9 -22.383 -10.309 12.162 1.00 0.00 C ATOM 171 C SER A 9 -21.337 -10.748 13.200 1.00 0.00 C ATOM 172 O SER A 9 -21.664 -11.410 14.167 1.00 0.00 O ATOM 173 CB SER A 9 -22.915 -8.916 12.494 1.00 0.00 C ATOM 174 OG SER A 9 -24.203 -8.755 11.914 1.00 0.00 O ATOM 0 H SER A 9 -23.953 -11.366 13.157 1.00 0.00 H new ATOM 0 HA SER A 9 -21.894 -10.338 11.188 1.00 0.00 H new ATOM 0 HB2 SER A 9 -22.971 -8.783 13.574 1.00 0.00 H new ATOM 0 HB3 SER A 9 -22.234 -8.154 12.114 1.00 0.00 H new ATOM 0 HG SER A 9 -24.548 -7.863 12.126 1.00 0.00 H new ATOM 180 N LYS A 10 -20.082 -10.389 13.009 1.00 0.00 N ATOM 181 CA LYS A 10 -19.032 -10.794 13.991 1.00 0.00 C ATOM 182 C LYS A 10 -18.287 -9.555 14.516 1.00 0.00 C ATOM 183 O LYS A 10 -17.362 -9.086 13.883 1.00 0.00 O ATOM 184 CB LYS A 10 -18.082 -11.698 13.205 1.00 0.00 C ATOM 185 CG LYS A 10 -17.296 -12.580 14.177 1.00 0.00 C ATOM 186 CD LYS A 10 -16.615 -13.712 13.406 1.00 0.00 C ATOM 187 CE LYS A 10 -16.304 -14.868 14.360 1.00 0.00 C ATOM 188 NZ LYS A 10 -14.969 -15.370 13.933 1.00 0.00 N ATOM 0 H LYS A 10 -19.748 -9.837 12.219 1.00 0.00 H new ATOM 0 HA LYS A 10 -19.453 -11.301 14.859 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -18.646 -12.319 12.509 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -17.397 -11.094 12.610 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -16.550 -11.984 14.703 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -17.965 -12.992 14.933 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -17.262 -14.057 12.599 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -15.696 -13.350 12.945 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -16.286 -14.531 15.396 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.060 -15.650 14.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -14.686 -16.165 14.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -15.018 -15.690 12.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -14.268 -14.606 14.015 1.00 0.00 H new ATOM 202 N PRO A 11 -18.708 -9.060 15.661 1.00 0.00 N ATOM 203 CA PRO A 11 -18.051 -7.865 16.250 1.00 0.00 C ATOM 204 C PRO A 11 -16.667 -8.228 16.805 1.00 0.00 C ATOM 205 O PRO A 11 -16.379 -9.384 17.057 1.00 0.00 O ATOM 206 CB PRO A 11 -18.995 -7.452 17.377 1.00 0.00 C ATOM 207 CG PRO A 11 -19.728 -8.700 17.748 1.00 0.00 C ATOM 208 CD PRO A 11 -19.814 -9.547 16.505 1.00 0.00 C ATOM 0 HA PRO A 11 -17.887 -7.069 15.524 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -18.443 -7.052 18.227 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.683 -6.673 17.049 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -19.205 -9.233 18.542 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -20.724 -8.465 18.124 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -19.703 -10.606 16.736 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -20.777 -9.429 16.008 1.00 0.00 H new ATOM 216 N ALA A 12 -15.808 -7.249 17.002 1.00 0.00 N ATOM 217 CA ALA A 12 -14.437 -7.563 17.553 1.00 0.00 C ATOM 218 C ALA A 12 -14.589 -8.168 18.963 1.00 0.00 C ATOM 219 O ALA A 12 -15.368 -7.672 19.753 1.00 0.00 O ATOM 220 CB ALA A 12 -13.645 -6.241 17.605 1.00 0.00 C ATOM 0 H ALA A 12 -15.988 -6.264 16.810 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.909 -8.284 16.928 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.647 -6.430 17.999 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.566 -5.825 16.601 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.162 -5.532 18.252 1.00 0.00 H new ATOM 226 N PRO A 13 -13.873 -9.241 19.233 1.00 0.00 N ATOM 227 CA PRO A 13 -13.990 -9.910 20.550 1.00 0.00 C ATOM 228 C PRO A 13 -13.119 -9.243 21.626 1.00 0.00 C ATOM 229 O PRO A 13 -12.030 -9.700 21.917 1.00 0.00 O ATOM 230 CB PRO A 13 -13.503 -11.327 20.272 1.00 0.00 C ATOM 231 CG PRO A 13 -12.592 -11.218 19.085 1.00 0.00 C ATOM 232 CD PRO A 13 -12.906 -9.928 18.364 1.00 0.00 C ATOM 0 HA PRO A 13 -15.007 -9.863 20.941 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -12.976 -11.736 21.134 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -14.339 -11.995 20.064 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -11.550 -11.231 19.404 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -12.732 -12.069 18.419 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -12.008 -9.327 18.218 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -13.326 -10.118 17.377 1.00 0.00 H new ATOM 240 N ASP A 14 -13.603 -8.183 22.240 1.00 0.00 N ATOM 241 CA ASP A 14 -12.824 -7.501 23.324 1.00 0.00 C ATOM 242 C ASP A 14 -11.372 -7.233 22.897 1.00 0.00 C ATOM 243 O ASP A 14 -10.506 -8.070 23.081 1.00 0.00 O ATOM 244 CB ASP A 14 -12.859 -8.473 24.505 1.00 0.00 C ATOM 245 CG ASP A 14 -14.260 -8.481 25.120 1.00 0.00 C ATOM 246 OD1 ASP A 14 -15.204 -8.729 24.390 1.00 0.00 O ATOM 247 OD2 ASP A 14 -14.363 -8.237 26.310 1.00 0.00 O ATOM 0 H ASP A 14 -14.509 -7.761 22.034 1.00 0.00 H new ATOM 0 HA ASP A 14 -13.251 -6.528 23.567 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -12.591 -9.476 24.172 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -12.124 -8.178 25.254 1.00 0.00 H new ATOM 252 N GLY A 15 -11.097 -6.076 22.340 1.00 0.00 N ATOM 253 CA GLY A 15 -9.690 -5.771 21.918 1.00 0.00 C ATOM 254 C GLY A 15 -9.671 -4.639 20.881 1.00 0.00 C ATOM 255 O GLY A 15 -8.809 -3.780 20.921 1.00 0.00 O ATOM 0 H GLY A 15 -11.777 -5.337 22.161 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -9.098 -5.485 22.787 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -9.229 -6.665 21.498 1.00 0.00 H new ATOM 259 N PHE A 16 -10.609 -4.619 19.955 1.00 0.00 N ATOM 260 CA PHE A 16 -10.613 -3.516 18.930 1.00 0.00 C ATOM 261 C PHE A 16 -10.700 -2.140 19.618 1.00 0.00 C ATOM 262 O PHE A 16 -10.160 -1.169 19.121 1.00 0.00 O ATOM 263 CB PHE A 16 -11.833 -3.755 18.021 1.00 0.00 C ATOM 264 CG PHE A 16 -11.933 -2.666 16.975 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.791 -2.257 16.273 1.00 0.00 C ATOM 266 CD2 PHE A 16 -13.169 -2.066 16.710 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.887 -1.251 15.311 1.00 0.00 C ATOM 268 CE2 PHE A 16 -13.264 -1.057 15.742 1.00 0.00 C ATOM 269 CZ PHE A 16 -12.121 -0.649 15.044 1.00 0.00 C ATOM 0 H PHE A 16 -11.359 -5.305 19.865 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.693 -3.522 18.346 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.748 -4.727 17.536 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.743 -3.777 18.621 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.837 -2.720 16.477 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -14.049 -2.380 17.251 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.006 -0.936 14.771 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -14.218 -0.595 15.535 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.192 0.130 14.300 1.00 0.00 H new ATOM 279 N GLU A 17 -11.358 -2.042 20.760 1.00 0.00 N ATOM 280 CA GLU A 17 -11.442 -0.705 21.462 1.00 0.00 C ATOM 281 C GLU A 17 -10.033 -0.111 21.646 1.00 0.00 C ATOM 282 O GLU A 17 -9.853 1.091 21.590 1.00 0.00 O ATOM 283 CB GLU A 17 -12.088 -0.963 22.833 1.00 0.00 C ATOM 284 CG GLU A 17 -12.572 0.363 23.425 1.00 0.00 C ATOM 285 CD GLU A 17 -13.787 0.860 22.640 1.00 0.00 C ATOM 286 OE1 GLU A 17 -13.590 1.453 21.593 1.00 0.00 O ATOM 287 OE2 GLU A 17 -14.896 0.638 23.100 1.00 0.00 O ATOM 0 H GLU A 17 -11.832 -2.813 21.230 1.00 0.00 H new ATOM 0 HA GLU A 17 -12.028 0.005 20.879 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.924 -1.654 22.729 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.368 -1.432 23.504 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.834 0.231 24.475 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.773 1.104 23.386 1.00 0.00 H new ATOM 294 N LYS A 18 -9.028 -0.944 21.858 1.00 0.00 N ATOM 295 CA LYS A 18 -7.632 -0.398 22.032 1.00 0.00 C ATOM 296 C LYS A 18 -7.222 0.411 20.790 1.00 0.00 C ATOM 297 O LYS A 18 -6.574 1.434 20.904 1.00 0.00 O ATOM 298 CB LYS A 18 -6.700 -1.608 22.206 1.00 0.00 C ATOM 299 CG LYS A 18 -6.989 -2.289 23.545 1.00 0.00 C ATOM 300 CD LYS A 18 -6.354 -1.481 24.679 1.00 0.00 C ATOM 301 CE LYS A 18 -6.499 -2.246 25.997 1.00 0.00 C ATOM 302 NZ LYS A 18 -5.353 -1.794 26.832 1.00 0.00 N ATOM 0 H LYS A 18 -9.111 -1.959 21.917 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.576 0.266 22.895 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.847 -2.314 21.388 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.659 -1.287 22.167 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -8.065 -2.368 23.700 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.592 -3.304 23.541 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.300 -1.301 24.465 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -6.835 -0.506 24.758 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -7.451 -2.024 26.480 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -6.468 -3.323 25.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -5.384 -2.275 27.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -4.460 -2.024 26.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -5.413 -0.766 26.976 1.00 0.00 H new ATOM 316 N ILE A 19 -7.596 -0.032 19.607 1.00 0.00 N ATOM 317 CA ILE A 19 -7.223 0.729 18.372 1.00 0.00 C ATOM 318 C ILE A 19 -8.488 1.245 17.652 1.00 0.00 C ATOM 319 O ILE A 19 -8.549 1.252 16.437 1.00 0.00 O ATOM 320 CB ILE A 19 -6.447 -0.265 17.487 1.00 0.00 C ATOM 321 CG1 ILE A 19 -7.345 -1.436 17.050 1.00 0.00 C ATOM 322 CG2 ILE A 19 -5.245 -0.825 18.259 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.988 -1.852 15.617 1.00 0.00 C ATOM 0 H ILE A 19 -8.139 -0.881 19.447 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.619 1.606 18.603 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.108 0.272 16.601 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -7.215 -2.280 17.727 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.394 -1.143 17.104 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.701 -1.527 17.627 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.584 -0.007 18.545 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.595 -1.339 19.154 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.625 -2.681 15.310 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.141 -1.008 14.944 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.944 -2.163 15.578 1.00 0.00 H new ATOM 335 N LYS A 20 -9.502 1.656 18.389 1.00 0.00 N ATOM 336 CA LYS A 20 -10.765 2.145 17.726 1.00 0.00 C ATOM 337 C LYS A 20 -10.705 3.634 17.304 1.00 0.00 C ATOM 338 O LYS A 20 -11.180 3.964 16.234 1.00 0.00 O ATOM 339 CB LYS A 20 -11.892 1.938 18.751 1.00 0.00 C ATOM 340 CG LYS A 20 -13.250 2.157 18.074 1.00 0.00 C ATOM 341 CD LYS A 20 -13.741 3.579 18.353 1.00 0.00 C ATOM 342 CE LYS A 20 -14.818 3.956 17.333 1.00 0.00 C ATOM 343 NZ LYS A 20 -15.758 4.841 18.076 1.00 0.00 N ATOM 0 H LYS A 20 -9.511 1.674 19.409 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.924 1.588 16.802 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.839 0.931 19.166 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.773 2.632 19.583 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.162 1.997 16.999 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.974 1.432 18.446 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.143 3.644 19.364 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.909 4.281 18.295 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.386 4.471 16.475 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.327 3.071 16.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.526 5.142 17.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -16.159 4.322 18.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.247 5.678 18.422 1.00 0.00 H new ATOM 357 N PRO A 21 -10.172 4.505 18.144 1.00 0.00 N ATOM 358 CA PRO A 21 -10.139 5.948 17.791 1.00 0.00 C ATOM 359 C PRO A 21 -9.071 6.256 16.727 1.00 0.00 C ATOM 360 O PRO A 21 -9.287 7.090 15.867 1.00 0.00 O ATOM 361 CB PRO A 21 -9.817 6.641 19.111 1.00 0.00 C ATOM 362 CG PRO A 21 -9.111 5.615 19.935 1.00 0.00 C ATOM 363 CD PRO A 21 -9.558 4.255 19.459 1.00 0.00 C ATOM 0 HA PRO A 21 -11.079 6.285 17.353 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.189 7.517 18.952 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.725 6.985 19.606 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.031 5.720 19.833 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.345 5.746 20.991 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.717 3.567 19.379 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.271 3.808 20.151 1.00 0.00 H new ATOM 371 N THR A 22 -7.927 5.603 16.766 1.00 0.00 N ATOM 372 CA THR A 22 -6.876 5.902 15.725 1.00 0.00 C ATOM 373 C THR A 22 -7.412 5.556 14.333 1.00 0.00 C ATOM 374 O THR A 22 -7.312 6.350 13.415 1.00 0.00 O ATOM 375 CB THR A 22 -5.649 5.035 16.056 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.223 5.311 17.383 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.514 5.352 15.077 1.00 0.00 C ATOM 0 H THR A 22 -7.677 4.893 17.454 1.00 0.00 H new ATOM 0 HA THR A 22 -6.610 6.959 15.729 1.00 0.00 H new ATOM 0 HB THR A 22 -5.915 3.981 15.969 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.293 5.023 17.494 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.646 4.736 15.314 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.842 5.141 14.059 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.245 6.405 15.160 1.00 0.00 H new ATOM 385 N LEU A 23 -7.993 4.389 14.165 1.00 0.00 N ATOM 386 CA LEU A 23 -8.548 4.024 12.812 1.00 0.00 C ATOM 387 C LEU A 23 -9.628 5.039 12.400 1.00 0.00 C ATOM 388 O LEU A 23 -9.748 5.375 11.236 1.00 0.00 O ATOM 389 CB LEU A 23 -9.152 2.619 12.938 1.00 0.00 C ATOM 390 CG LEU A 23 -8.079 1.579 12.614 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.415 0.265 13.317 1.00 0.00 C ATOM 392 CD2 LEU A 23 -8.034 1.349 11.102 1.00 0.00 C ATOM 0 H LEU A 23 -8.108 3.682 14.891 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.769 4.039 12.050 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.533 2.463 13.947 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.997 2.511 12.258 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.109 1.938 12.958 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.650 -0.477 13.086 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.450 0.427 14.394 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.385 -0.094 12.973 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.269 0.608 10.869 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.004 0.989 10.760 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.796 2.286 10.598 1.00 0.00 H new ATOM 404 N THR A 24 -10.411 5.544 13.340 1.00 0.00 N ATOM 405 CA THR A 24 -11.470 6.554 12.968 1.00 0.00 C ATOM 406 C THR A 24 -10.830 7.746 12.235 1.00 0.00 C ATOM 407 O THR A 24 -11.408 8.286 11.312 1.00 0.00 O ATOM 408 CB THR A 24 -12.117 7.026 14.280 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.514 5.896 15.044 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.341 7.887 13.965 1.00 0.00 C ATOM 0 H THR A 24 -10.364 5.305 14.331 1.00 0.00 H new ATOM 0 HA THR A 24 -12.213 6.114 12.303 1.00 0.00 H new ATOM 0 HB THR A 24 -11.398 7.615 14.849 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.732 5.515 15.495 1.00 0.00 H new ATOM 0 HG21 THR A 24 -13.800 8.222 14.895 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.035 8.754 13.379 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.062 7.300 13.396 1.00 0.00 H new ATOM 418 N ASP A 25 -9.638 8.157 12.630 1.00 0.00 N ATOM 419 CA ASP A 25 -8.979 9.318 11.924 1.00 0.00 C ATOM 420 C ASP A 25 -8.838 9.008 10.422 1.00 0.00 C ATOM 421 O ASP A 25 -9.020 9.878 9.590 1.00 0.00 O ATOM 422 CB ASP A 25 -7.590 9.496 12.559 1.00 0.00 C ATOM 423 CG ASP A 25 -7.685 10.483 13.725 1.00 0.00 C ATOM 424 OD1 ASP A 25 -8.364 11.485 13.574 1.00 0.00 O ATOM 425 OD2 ASP A 25 -7.077 10.219 14.749 1.00 0.00 O ATOM 0 H ASP A 25 -9.102 7.748 13.395 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.573 10.226 12.025 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.214 8.536 12.911 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -6.882 9.862 11.815 1.00 0.00 H new ATOM 430 N PHE A 26 -8.525 7.777 10.065 1.00 0.00 N ATOM 431 CA PHE A 26 -8.387 7.435 8.601 1.00 0.00 C ATOM 432 C PHE A 26 -9.709 7.719 7.871 1.00 0.00 C ATOM 433 O PHE A 26 -9.712 8.222 6.764 1.00 0.00 O ATOM 434 CB PHE A 26 -8.068 5.933 8.524 1.00 0.00 C ATOM 435 CG PHE A 26 -6.581 5.725 8.654 1.00 0.00 C ATOM 436 CD1 PHE A 26 -5.981 5.735 9.919 1.00 0.00 C ATOM 437 CD2 PHE A 26 -5.803 5.518 7.510 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.601 5.539 10.040 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.422 5.323 7.631 1.00 0.00 C ATOM 440 CZ PHE A 26 -3.822 5.334 8.895 1.00 0.00 C ATOM 0 H PHE A 26 -8.361 7.005 10.711 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.603 8.031 8.133 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.591 5.399 9.317 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.421 5.524 7.577 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.583 5.894 10.801 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.267 5.509 6.535 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.137 5.546 11.015 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.820 5.164 6.749 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.756 5.184 8.987 1.00 0.00 H new ATOM 450 N GLU A 27 -10.833 7.397 8.480 1.00 0.00 N ATOM 451 CA GLU A 27 -12.151 7.656 7.798 1.00 0.00 C ATOM 452 C GLU A 27 -12.324 9.148 7.463 1.00 0.00 C ATOM 453 O GLU A 27 -13.048 9.483 6.547 1.00 0.00 O ATOM 454 CB GLU A 27 -13.253 7.206 8.773 1.00 0.00 C ATOM 455 CG GLU A 27 -13.168 5.691 8.976 1.00 0.00 C ATOM 456 CD GLU A 27 -14.099 4.990 7.986 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.281 4.900 8.277 1.00 0.00 O ATOM 458 OE2 GLU A 27 -13.617 4.556 6.954 1.00 0.00 O ATOM 0 H GLU A 27 -10.896 6.973 9.405 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.201 7.109 6.857 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.140 7.718 9.728 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.233 7.477 8.381 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.143 5.351 8.830 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.447 5.434 9.998 1.00 0.00 H new ATOM 465 N ILE A 28 -11.675 10.049 8.179 1.00 0.00 N ATOM 466 CA ILE A 28 -11.838 11.511 7.848 1.00 0.00 C ATOM 467 C ILE A 28 -10.965 11.872 6.629 1.00 0.00 C ATOM 468 O ILE A 28 -11.358 12.685 5.812 1.00 0.00 O ATOM 469 CB ILE A 28 -11.429 12.299 9.119 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.553 12.200 10.156 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.195 13.782 8.795 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.475 10.857 10.884 1.00 0.00 C ATOM 0 H ILE A 28 -11.053 9.842 8.961 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.864 11.760 7.576 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.505 11.870 9.506 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.471 13.017 10.873 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.521 12.302 9.666 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -10.909 14.312 9.703 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.398 13.872 8.057 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.111 14.216 8.395 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.277 10.795 11.619 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.579 10.046 10.163 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.513 10.772 11.389 1.00 0.00 H new ATOM 484 N GLN A 29 -9.805 11.267 6.480 1.00 0.00 N ATOM 485 CA GLN A 29 -8.962 11.588 5.278 1.00 0.00 C ATOM 486 C GLN A 29 -9.467 10.774 4.078 1.00 0.00 C ATOM 487 O GLN A 29 -9.486 11.264 2.964 1.00 0.00 O ATOM 488 CB GLN A 29 -7.517 11.203 5.633 1.00 0.00 C ATOM 489 CG GLN A 29 -6.551 11.891 4.665 1.00 0.00 C ATOM 490 CD GLN A 29 -5.274 12.295 5.413 1.00 0.00 C ATOM 491 OE1 GLN A 29 -4.819 13.415 5.290 1.00 0.00 O ATOM 492 NE2 GLN A 29 -4.668 11.430 6.190 1.00 0.00 N ATOM 0 H GLN A 29 -9.412 10.580 7.123 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.015 12.644 5.013 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.293 11.498 6.658 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.394 10.121 5.578 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.306 11.220 3.842 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.023 12.771 4.229 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.046 10.489 6.297 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -3.819 11.699 6.688 1.00 0.00 H new ATOM 501 N LEU A 30 -9.898 9.544 4.291 1.00 0.00 N ATOM 502 CA LEU A 30 -10.423 8.735 3.137 1.00 0.00 C ATOM 503 C LEU A 30 -11.813 9.246 2.722 1.00 0.00 C ATOM 504 O LEU A 30 -12.158 9.195 1.556 1.00 0.00 O ATOM 505 CB LEU A 30 -10.505 7.274 3.614 1.00 0.00 C ATOM 506 CG LEU A 30 -10.047 6.345 2.488 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.281 5.159 3.078 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.269 5.837 1.718 1.00 0.00 C ATOM 0 H LEU A 30 -9.909 9.075 5.197 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.769 8.820 2.269 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.879 7.132 4.495 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.527 7.032 3.907 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.393 6.893 1.810 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -8.956 4.499 2.274 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.410 5.523 3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -9.931 4.609 3.759 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.944 5.175 0.915 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -11.925 5.291 2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -11.809 6.683 1.294 1.00 0.00 H new ATOM 520 N ARG A 31 -12.619 9.752 3.648 1.00 0.00 N ATOM 521 CA ARG A 31 -13.973 10.264 3.232 1.00 0.00 C ATOM 522 C ARG A 31 -13.810 11.548 2.397 1.00 0.00 C ATOM 523 O ARG A 31 -14.546 11.764 1.452 1.00 0.00 O ATOM 524 CB ARG A 31 -14.790 10.527 4.518 1.00 0.00 C ATOM 525 CG ARG A 31 -14.220 11.719 5.298 1.00 0.00 C ATOM 526 CD ARG A 31 -15.098 11.993 6.530 1.00 0.00 C ATOM 527 NE ARG A 31 -16.345 12.678 6.027 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.081 13.433 6.828 1.00 0.00 C ATOM 529 NH1 ARG A 31 -16.775 13.596 8.096 1.00 0.00 N ATOM 530 NH2 ARG A 31 -18.150 14.024 6.357 1.00 0.00 N ATOM 0 H ARG A 31 -12.402 9.829 4.642 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.495 9.536 2.611 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -15.831 10.722 4.258 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.780 9.637 5.148 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.196 11.509 5.607 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.185 12.602 4.660 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.346 11.064 7.043 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -14.573 12.623 7.248 1.00 0.00 H new ATOM 0 HE ARG A 31 -16.626 12.557 5.054 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -15.953 13.135 8.486 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.360 14.183 8.690 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.411 13.901 5.379 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -18.722 14.607 6.968 1.00 0.00 H new ATOM 544 N ASP A 32 -12.848 12.397 2.724 1.00 0.00 N ATOM 545 CA ASP A 32 -12.668 13.650 1.905 1.00 0.00 C ATOM 546 C ASP A 32 -12.306 13.262 0.466 1.00 0.00 C ATOM 547 O ASP A 32 -12.824 13.829 -0.479 1.00 0.00 O ATOM 548 CB ASP A 32 -11.522 14.448 2.549 1.00 0.00 C ATOM 549 CG ASP A 32 -12.086 15.363 3.638 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.436 14.852 4.690 1.00 0.00 O ATOM 551 OD2 ASP A 32 -12.160 16.557 3.402 1.00 0.00 O ATOM 0 H ASP A 32 -12.198 12.280 3.501 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.579 14.248 1.880 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.786 13.767 2.977 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.007 15.040 1.792 1.00 0.00 H new ATOM 556 N ALA A 33 -11.439 12.284 0.286 1.00 0.00 N ATOM 557 CA ALA A 33 -11.084 11.861 -1.113 1.00 0.00 C ATOM 558 C ALA A 33 -12.297 11.166 -1.743 1.00 0.00 C ATOM 559 O ALA A 33 -12.623 11.401 -2.892 1.00 0.00 O ATOM 560 CB ALA A 33 -9.912 10.873 -0.999 1.00 0.00 C ATOM 0 H ALA A 33 -10.971 11.770 1.032 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.807 12.713 -1.734 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.620 10.538 -1.994 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.066 11.366 -0.519 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.217 10.013 -0.402 1.00 0.00 H new ATOM 566 N GLN A 34 -12.979 10.316 -0.996 1.00 0.00 N ATOM 567 CA GLN A 34 -14.185 9.620 -1.569 1.00 0.00 C ATOM 568 C GLN A 34 -15.230 10.657 -2.023 1.00 0.00 C ATOM 569 O GLN A 34 -15.913 10.453 -3.010 1.00 0.00 O ATOM 570 CB GLN A 34 -14.767 8.743 -0.449 1.00 0.00 C ATOM 571 CG GLN A 34 -13.875 7.518 -0.240 1.00 0.00 C ATOM 572 CD GLN A 34 -14.320 6.393 -1.184 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.486 6.287 -1.505 1.00 0.00 O ATOM 574 NE2 GLN A 34 -13.438 5.540 -1.646 1.00 0.00 N ATOM 0 H GLN A 34 -12.756 10.078 -0.030 1.00 0.00 H new ATOM 0 HA GLN A 34 -13.912 9.019 -2.436 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.838 9.316 0.476 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.778 8.429 -0.708 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.833 7.777 -0.431 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.936 7.183 0.796 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -12.457 5.625 -1.379 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -13.733 4.791 -2.273 1.00 0.00 H new ATOM 583 N LYS A 35 -15.363 11.771 -1.321 1.00 0.00 N ATOM 584 CA LYS A 35 -16.370 12.803 -1.747 1.00 0.00 C ATOM 585 C LYS A 35 -15.724 13.803 -2.717 1.00 0.00 C ATOM 586 O LYS A 35 -16.340 14.216 -3.682 1.00 0.00 O ATOM 587 CB LYS A 35 -16.828 13.515 -0.466 1.00 0.00 C ATOM 588 CG LYS A 35 -17.462 12.498 0.486 1.00 0.00 C ATOM 589 CD LYS A 35 -18.941 12.324 0.137 1.00 0.00 C ATOM 590 CE LYS A 35 -19.651 11.583 1.273 1.00 0.00 C ATOM 591 NZ LYS A 35 -19.928 12.628 2.297 1.00 0.00 N ATOM 0 H LYS A 35 -14.825 12.004 -0.486 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.214 12.347 -2.265 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -15.979 14.000 0.016 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.546 14.298 -0.710 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -16.945 11.542 0.410 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.358 12.836 1.517 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.405 13.297 -0.022 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.043 11.767 -0.794 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -20.573 11.116 0.925 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -19.025 10.788 1.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -19.695 12.259 3.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -19.348 13.469 2.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -20.935 12.887 2.266 1.00 0.00 H new ATOM 605 N ASP A 36 -14.489 14.193 -2.478 1.00 0.00 N ATOM 606 CA ASP A 36 -13.816 15.169 -3.413 1.00 0.00 C ATOM 607 C ASP A 36 -13.798 14.609 -4.848 1.00 0.00 C ATOM 608 O ASP A 36 -13.926 15.353 -5.804 1.00 0.00 O ATOM 609 CB ASP A 36 -12.378 15.353 -2.903 1.00 0.00 C ATOM 610 CG ASP A 36 -11.668 16.411 -3.748 1.00 0.00 C ATOM 611 OD1 ASP A 36 -11.342 16.112 -4.886 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.460 17.503 -3.244 1.00 0.00 O ATOM 0 H ASP A 36 -13.922 13.885 -1.688 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.351 16.118 -3.434 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.388 15.656 -1.856 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.838 14.408 -2.956 1.00 0.00 H new ATOM 617 N LYS A 37 -13.647 13.307 -5.014 1.00 0.00 N ATOM 618 CA LYS A 37 -13.631 12.728 -6.402 1.00 0.00 C ATOM 619 C LYS A 37 -15.072 12.471 -6.877 1.00 0.00 C ATOM 620 O LYS A 37 -15.436 12.835 -7.979 1.00 0.00 O ATOM 621 CB LYS A 37 -12.850 11.407 -6.310 1.00 0.00 C ATOM 622 CG LYS A 37 -12.754 10.764 -7.694 1.00 0.00 C ATOM 623 CD LYS A 37 -12.352 9.295 -7.546 1.00 0.00 C ATOM 624 CE LYS A 37 -13.600 8.447 -7.287 1.00 0.00 C ATOM 625 NZ LYS A 37 -13.969 7.893 -8.619 1.00 0.00 N ATOM 0 H LYS A 37 -13.536 12.631 -4.258 1.00 0.00 H new ATOM 0 HA LYS A 37 -13.166 13.407 -7.116 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.851 11.591 -5.915 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -13.347 10.728 -5.617 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -13.711 10.840 -8.210 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.021 11.293 -8.303 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.848 8.952 -8.450 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -11.645 9.181 -6.724 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.395 7.651 -6.571 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.408 9.049 -6.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.731 7.195 -8.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -14.295 8.663 -9.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.139 7.434 -9.046 1.00 0.00 H new ATOM 639 N SER A 38 -15.899 11.851 -6.054 1.00 0.00 N ATOM 640 CA SER A 38 -17.318 11.578 -6.461 1.00 0.00 C ATOM 641 C SER A 38 -17.374 10.868 -7.826 1.00 0.00 C ATOM 642 O SER A 38 -17.805 11.441 -8.810 1.00 0.00 O ATOM 643 CB SER A 38 -17.986 12.954 -6.540 1.00 0.00 C ATOM 644 OG SER A 38 -19.393 12.800 -6.420 1.00 0.00 O ATOM 0 H SER A 38 -15.649 11.525 -5.121 1.00 0.00 H new ATOM 0 HA SER A 38 -17.820 10.920 -5.752 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.610 13.600 -5.746 1.00 0.00 H new ATOM 0 HB3 SER A 38 -17.741 13.436 -7.486 1.00 0.00 H new ATOM 0 HG SER A 38 -19.824 13.679 -6.469 1.00 0.00 H new ATOM 650 N SER A 39 -16.946 9.618 -7.900 1.00 0.00 N ATOM 651 CA SER A 39 -16.982 8.875 -9.204 1.00 0.00 C ATOM 652 C SER A 39 -16.303 9.697 -10.318 1.00 0.00 C ATOM 653 O SER A 39 -15.585 10.639 -10.039 1.00 0.00 O ATOM 654 CB SER A 39 -18.470 8.676 -9.508 1.00 0.00 C ATOM 655 OG SER A 39 -18.675 7.363 -10.012 1.00 0.00 O ATOM 0 H SER A 39 -16.575 9.086 -7.112 1.00 0.00 H new ATOM 0 HA SER A 39 -16.447 7.927 -9.149 1.00 0.00 H new ATOM 0 HB2 SER A 39 -19.061 8.828 -8.605 1.00 0.00 H new ATOM 0 HB3 SER A 39 -18.806 9.414 -10.236 1.00 0.00 H new ATOM 0 HG SER A 39 -19.627 7.232 -10.206 1.00 0.00 H new ATOM 661 N LYS A 40 -16.524 9.356 -11.574 1.00 0.00 N ATOM 662 CA LYS A 40 -15.880 10.145 -12.681 1.00 0.00 C ATOM 663 C LYS A 40 -16.728 11.388 -12.996 1.00 0.00 C ATOM 664 O LYS A 40 -17.516 11.383 -13.922 1.00 0.00 O ATOM 665 CB LYS A 40 -15.818 9.215 -13.902 1.00 0.00 C ATOM 666 CG LYS A 40 -15.014 7.962 -13.549 1.00 0.00 C ATOM 667 CD LYS A 40 -14.363 7.400 -14.814 1.00 0.00 C ATOM 668 CE LYS A 40 -12.997 8.058 -15.022 1.00 0.00 C ATOM 669 NZ LYS A 40 -12.595 7.680 -16.405 1.00 0.00 N ATOM 0 H LYS A 40 -17.112 8.579 -11.875 1.00 0.00 H new ATOM 0 HA LYS A 40 -14.883 10.486 -12.401 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -16.825 8.938 -14.213 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -15.356 9.732 -14.743 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -14.250 8.204 -12.810 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -15.666 7.213 -13.099 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -14.248 6.320 -14.727 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -15.002 7.584 -15.677 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.059 9.141 -14.911 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -12.272 7.703 -14.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.666 8.095 -16.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -12.538 6.644 -16.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -13.300 8.037 -17.081 1.00 0.00 H new ATOM 683 N LEU A 41 -16.577 12.450 -12.230 1.00 0.00 N ATOM 684 CA LEU A 41 -17.382 13.682 -12.492 1.00 0.00 C ATOM 685 C LEU A 41 -16.471 14.833 -12.952 1.00 0.00 C ATOM 686 O LEU A 41 -16.698 15.425 -13.991 1.00 0.00 O ATOM 687 CB LEU A 41 -18.041 14.023 -11.152 1.00 0.00 C ATOM 688 CG LEU A 41 -19.431 14.609 -11.401 1.00 0.00 C ATOM 689 CD1 LEU A 41 -20.172 14.748 -10.070 1.00 0.00 C ATOM 690 CD2 LEU A 41 -19.293 15.987 -12.052 1.00 0.00 C ATOM 0 H LEU A 41 -15.934 12.512 -11.441 1.00 0.00 H new ATOM 0 HA LEU A 41 -18.118 13.528 -13.281 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -18.117 13.128 -10.534 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -17.427 14.737 -10.604 1.00 0.00 H new ATOM 0 HG LEU A 41 -19.991 13.948 -12.062 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -21.163 15.166 -10.247 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -20.270 13.768 -9.604 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -19.612 15.410 -9.409 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -20.283 16.406 -12.230 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -18.733 16.648 -11.390 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -18.764 15.890 -13.000 1.00 0.00 H new ATOM 702 N ALA A 42 -15.444 15.158 -12.193 1.00 0.00 N ATOM 703 CA ALA A 42 -14.532 16.272 -12.604 1.00 0.00 C ATOM 704 C ALA A 42 -13.153 15.711 -12.993 1.00 0.00 C ATOM 705 O ALA A 42 -13.011 14.524 -13.222 1.00 0.00 O ATOM 706 CB ALA A 42 -14.422 17.175 -11.371 1.00 0.00 C ATOM 0 H ALA A 42 -15.203 14.701 -11.314 1.00 0.00 H new ATOM 0 HA ALA A 42 -14.908 16.816 -13.470 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.767 18.017 -11.594 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -15.411 17.545 -11.102 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -14.009 16.605 -10.539 1.00 0.00 H new ATOM 712 N ALA A 43 -12.135 16.547 -13.071 1.00 0.00 N ATOM 713 CA ALA A 43 -10.775 16.034 -13.444 1.00 0.00 C ATOM 714 C ALA A 43 -9.911 15.865 -12.187 1.00 0.00 C ATOM 715 O ALA A 43 -10.395 15.996 -11.078 1.00 0.00 O ATOM 716 CB ALA A 43 -10.169 17.089 -14.377 1.00 0.00 C ATOM 0 H ALA A 43 -12.189 17.550 -12.894 1.00 0.00 H new ATOM 0 HA ALA A 43 -10.830 15.060 -13.930 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -9.173 16.773 -14.686 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -10.802 17.203 -15.257 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -10.101 18.042 -13.853 1.00 0.00 H new ATOM 722 N LYS A 44 -8.631 15.569 -12.341 1.00 0.00 N ATOM 723 CA LYS A 44 -7.741 15.387 -11.146 1.00 0.00 C ATOM 724 C LYS A 44 -8.352 14.361 -10.172 1.00 0.00 C ATOM 725 O LYS A 44 -8.488 14.627 -8.993 1.00 0.00 O ATOM 726 CB LYS A 44 -7.651 16.769 -10.488 1.00 0.00 C ATOM 727 CG LYS A 44 -6.216 17.020 -10.017 1.00 0.00 C ATOM 728 CD LYS A 44 -6.209 18.132 -8.965 1.00 0.00 C ATOM 729 CE LYS A 44 -4.764 18.515 -8.636 1.00 0.00 C ATOM 730 NZ LYS A 44 -4.775 18.843 -7.185 1.00 0.00 N ATOM 0 H LYS A 44 -8.170 15.447 -13.243 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.757 15.010 -11.426 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.952 17.541 -11.196 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -8.337 16.826 -9.643 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.795 16.106 -9.598 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.589 17.301 -10.863 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -6.751 19.002 -9.336 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -6.722 17.797 -8.063 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -4.079 17.694 -8.850 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.436 19.367 -9.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -3.818 19.116 -6.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -5.430 19.632 -7.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -5.085 18.011 -6.643 1.00 0.00 H new ATOM 744 N SER A 45 -8.722 13.192 -10.657 1.00 0.00 N ATOM 745 CA SER A 45 -9.324 12.161 -9.745 1.00 0.00 C ATOM 746 C SER A 45 -8.256 11.159 -9.276 1.00 0.00 C ATOM 747 O SER A 45 -8.271 10.731 -8.136 1.00 0.00 O ATOM 748 CB SER A 45 -10.401 11.448 -10.571 1.00 0.00 C ATOM 749 OG SER A 45 -10.890 10.329 -9.842 1.00 0.00 O ATOM 0 H SER A 45 -8.634 12.911 -11.634 1.00 0.00 H new ATOM 0 HA SER A 45 -9.742 12.620 -8.849 1.00 0.00 H new ATOM 0 HB2 SER A 45 -11.217 12.135 -10.796 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.987 11.122 -11.525 1.00 0.00 H new ATOM 0 HG SER A 45 -11.580 9.872 -10.367 1.00 0.00 H new ATOM 755 N ASN A 46 -7.330 10.779 -10.133 1.00 0.00 N ATOM 756 CA ASN A 46 -6.268 9.798 -9.700 1.00 0.00 C ATOM 757 C ASN A 46 -5.506 10.352 -8.485 1.00 0.00 C ATOM 758 O ASN A 46 -5.199 9.624 -7.561 1.00 0.00 O ATOM 759 CB ASN A 46 -5.309 9.626 -10.890 1.00 0.00 C ATOM 760 CG ASN A 46 -5.795 8.472 -11.776 1.00 0.00 C ATOM 761 OD1 ASN A 46 -5.547 7.322 -11.475 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.480 8.727 -12.865 1.00 0.00 N ATOM 0 H ASN A 46 -7.261 11.098 -11.099 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.709 8.844 -9.413 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.262 10.548 -11.469 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.300 9.423 -10.531 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -6.802 7.961 -13.456 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.690 9.692 -13.121 1.00 0.00 H new ATOM 769 N GLU A 47 -5.203 11.636 -8.474 1.00 0.00 N ATOM 770 CA GLU A 47 -4.463 12.214 -7.295 1.00 0.00 C ATOM 771 C GLU A 47 -5.300 12.043 -6.018 1.00 0.00 C ATOM 772 O GLU A 47 -4.770 11.728 -4.968 1.00 0.00 O ATOM 773 CB GLU A 47 -4.246 13.706 -7.591 1.00 0.00 C ATOM 774 CG GLU A 47 -3.356 13.857 -8.825 1.00 0.00 C ATOM 775 CD GLU A 47 -2.696 15.238 -8.814 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.117 15.588 -7.800 1.00 0.00 O ATOM 777 OE2 GLU A 47 -2.782 15.922 -9.821 1.00 0.00 O ATOM 0 H GLU A 47 -5.431 12.298 -9.216 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.510 11.707 -7.142 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.204 14.198 -7.758 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.783 14.194 -6.734 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.594 13.078 -8.834 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.949 13.733 -9.731 1.00 0.00 H new ATOM 784 N GLN A 48 -6.603 12.237 -6.093 1.00 0.00 N ATOM 785 CA GLN A 48 -7.451 12.067 -4.859 1.00 0.00 C ATOM 786 C GLN A 48 -7.481 10.587 -4.446 1.00 0.00 C ATOM 787 O GLN A 48 -7.442 10.271 -3.271 1.00 0.00 O ATOM 788 CB GLN A 48 -8.867 12.542 -5.220 1.00 0.00 C ATOM 789 CG GLN A 48 -9.541 13.124 -3.977 1.00 0.00 C ATOM 790 CD GLN A 48 -8.804 14.394 -3.538 1.00 0.00 C ATOM 791 OE1 GLN A 48 -8.728 15.350 -4.284 1.00 0.00 O ATOM 792 NE2 GLN A 48 -8.251 14.452 -2.351 1.00 0.00 N ATOM 0 H GLN A 48 -7.108 12.501 -6.939 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.049 12.642 -4.025 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.820 13.294 -6.007 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.453 11.710 -5.609 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.585 13.353 -4.191 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.534 12.391 -3.171 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.312 13.652 -1.721 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.760 15.297 -2.058 1.00 0.00 H new ATOM 801 N LEU A 49 -7.548 9.675 -5.397 1.00 0.00 N ATOM 802 CA LEU A 49 -7.577 8.215 -5.026 1.00 0.00 C ATOM 803 C LEU A 49 -6.211 7.769 -4.476 1.00 0.00 C ATOM 804 O LEU A 49 -6.148 6.921 -3.606 1.00 0.00 O ATOM 805 CB LEU A 49 -7.917 7.436 -6.306 1.00 0.00 C ATOM 806 CG LEU A 49 -9.398 7.629 -6.645 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.711 6.941 -7.975 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.260 7.013 -5.539 1.00 0.00 C ATOM 0 H LEU A 49 -7.583 9.873 -6.397 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.317 8.029 -4.247 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.296 7.784 -7.132 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.700 6.377 -6.168 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.615 8.694 -6.726 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.765 7.078 -8.216 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.098 7.378 -8.764 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.493 5.876 -7.894 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.314 7.150 -5.780 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.042 5.948 -5.458 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.038 7.502 -4.590 1.00 0.00 H new ATOM 820 N TRP A 50 -5.112 8.325 -4.964 1.00 0.00 N ATOM 821 CA TRP A 50 -3.766 7.899 -4.430 1.00 0.00 C ATOM 822 C TRP A 50 -3.713 8.122 -2.916 1.00 0.00 C ATOM 823 O TRP A 50 -3.219 7.284 -2.186 1.00 0.00 O ATOM 824 CB TRP A 50 -2.702 8.752 -5.151 1.00 0.00 C ATOM 825 CG TRP A 50 -2.736 8.505 -6.641 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.448 7.534 -7.278 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.026 9.230 -7.689 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.226 7.635 -8.639 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.359 8.661 -8.939 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.135 10.321 -7.677 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -1.833 9.151 -10.128 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.599 10.814 -8.880 1.00 0.00 C ATOM 833 CH2 TRP A 50 -0.952 10.227 -10.104 1.00 0.00 C ATOM 0 H TRP A 50 -5.089 9.039 -5.692 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.585 6.839 -4.611 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.878 9.808 -4.949 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.713 8.514 -4.761 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.083 6.804 -6.798 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.653 7.024 -9.335 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.862 10.781 -6.739 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.108 8.697 -11.069 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.087 11.648 -8.861 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.540 10.610 -11.026 1.00 0.00 H new ATOM 844 N GLU A 51 -4.245 9.224 -2.430 1.00 0.00 N ATOM 845 CA GLU A 51 -4.237 9.448 -0.943 1.00 0.00 C ATOM 846 C GLU A 51 -5.075 8.356 -0.255 1.00 0.00 C ATOM 847 O GLU A 51 -4.755 7.931 0.839 1.00 0.00 O ATOM 848 CB GLU A 51 -4.852 10.834 -0.693 1.00 0.00 C ATOM 849 CG GLU A 51 -3.934 11.914 -1.268 1.00 0.00 C ATOM 850 CD GLU A 51 -4.646 13.268 -1.220 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.260 13.557 -0.206 1.00 0.00 O ATOM 852 OE2 GLU A 51 -4.565 13.992 -2.198 1.00 0.00 O ATOM 0 H GLU A 51 -4.676 9.964 -2.985 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.226 9.402 -0.539 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.837 10.895 -1.156 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.992 10.993 0.376 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.006 11.959 -0.698 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.665 11.669 -2.295 1.00 0.00 H new ATOM 859 N ILE A 52 -6.139 7.884 -0.887 1.00 0.00 N ATOM 860 CA ILE A 52 -6.964 6.806 -0.241 1.00 0.00 C ATOM 861 C ILE A 52 -6.175 5.488 -0.256 1.00 0.00 C ATOM 862 O ILE A 52 -5.944 4.903 0.787 1.00 0.00 O ATOM 863 CB ILE A 52 -8.268 6.693 -1.055 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.027 8.023 -0.948 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.136 5.563 -0.490 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.307 7.977 -1.789 1.00 0.00 C ATOM 0 H ILE A 52 -6.463 8.194 -1.803 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.197 7.036 0.799 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.036 6.475 -2.097 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.276 8.224 0.094 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.391 8.840 -1.287 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.057 5.487 -1.069 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.591 4.621 -0.550 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.379 5.776 0.551 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.834 8.927 -1.702 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.050 7.798 -2.833 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -10.949 7.172 -1.431 1.00 0.00 H new ATOM 878 N MET A 53 -5.737 5.018 -1.412 1.00 0.00 N ATOM 879 CA MET A 53 -4.941 3.739 -1.414 1.00 0.00 C ATOM 880 C MET A 53 -3.631 3.936 -0.628 1.00 0.00 C ATOM 881 O MET A 53 -3.142 3.007 -0.013 1.00 0.00 O ATOM 882 CB MET A 53 -4.665 3.331 -2.877 1.00 0.00 C ATOM 883 CG MET A 53 -3.898 4.425 -3.631 1.00 0.00 C ATOM 884 SD MET A 53 -4.521 4.520 -5.334 1.00 0.00 S ATOM 885 CE MET A 53 -3.938 2.900 -5.882 1.00 0.00 C ATOM 0 H MET A 53 -5.890 5.449 -2.324 1.00 0.00 H new ATOM 0 HA MET A 53 -5.501 2.942 -0.926 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.091 2.404 -2.895 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.609 3.131 -3.384 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.023 5.385 -3.131 1.00 0.00 H new ATOM 0 HG3 MET A 53 -2.831 4.203 -3.633 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.443 2.999 -6.848 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.234 2.501 -5.152 1.00 0.00 H new ATOM 0 HE3 MET A 53 -4.786 2.221 -5.977 1.00 0.00 H new ATOM 895 N GLN A 54 -3.070 5.138 -0.603 1.00 0.00 N ATOM 896 CA GLN A 54 -1.810 5.341 0.199 1.00 0.00 C ATOM 897 C GLN A 54 -2.137 5.172 1.692 1.00 0.00 C ATOM 898 O GLN A 54 -1.368 4.590 2.432 1.00 0.00 O ATOM 899 CB GLN A 54 -1.318 6.771 -0.080 1.00 0.00 C ATOM 900 CG GLN A 54 -0.446 6.776 -1.338 1.00 0.00 C ATOM 901 CD GLN A 54 0.313 8.104 -1.430 1.00 0.00 C ATOM 902 OE1 GLN A 54 0.859 8.569 -0.449 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.374 8.746 -2.572 1.00 0.00 N ATOM 0 H GLN A 54 -3.421 5.963 -1.090 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.041 4.618 -0.073 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.168 7.440 -0.212 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.748 7.143 0.771 1.00 0.00 H new ATOM 0 HG2 GLN A 54 0.258 5.944 -1.309 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.066 6.638 -2.224 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.082 8.361 -3.399 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.878 9.631 -2.633 1.00 0.00 H new ATOM 912 N LEU A 55 -3.285 5.657 2.142 1.00 0.00 N ATOM 913 CA LEU A 55 -3.653 5.489 3.599 1.00 0.00 C ATOM 914 C LEU A 55 -3.569 4.003 3.999 1.00 0.00 C ATOM 915 O LEU A 55 -3.225 3.682 5.121 1.00 0.00 O ATOM 916 CB LEU A 55 -5.101 5.988 3.754 1.00 0.00 C ATOM 917 CG LEU A 55 -5.100 7.483 4.082 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.519 8.043 3.930 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.624 7.685 5.524 1.00 0.00 C ATOM 0 H LEU A 55 -3.971 6.153 1.574 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.972 6.050 4.239 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.658 5.808 2.835 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.604 5.433 4.545 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.430 8.005 3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.517 9.108 4.164 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.860 7.897 2.905 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.191 7.523 4.613 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.622 8.749 5.761 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.296 7.163 6.205 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.615 7.287 5.633 1.00 0.00 H new ATOM 931 N HIS A 56 -3.873 3.089 3.090 1.00 0.00 N ATOM 932 CA HIS A 56 -3.795 1.623 3.443 1.00 0.00 C ATOM 933 C HIS A 56 -2.395 1.287 3.987 1.00 0.00 C ATOM 934 O HIS A 56 -2.263 0.502 4.909 1.00 0.00 O ATOM 935 CB HIS A 56 -4.060 0.841 2.144 1.00 0.00 C ATOM 936 CG HIS A 56 -4.064 -0.634 2.436 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.197 -1.296 2.886 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.081 -1.587 2.353 1.00 0.00 C ATOM 939 CE1 HIS A 56 -4.869 -2.590 3.055 1.00 0.00 C ATOM 940 NE2 HIS A 56 -3.590 -2.821 2.745 1.00 0.00 N ATOM 0 H HIS A 56 -4.167 3.292 2.135 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.523 1.363 4.212 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.017 1.140 1.716 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.294 1.074 1.405 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.112 -0.878 3.057 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.066 -1.407 2.032 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.556 -3.349 3.399 1.00 0.00 H new ATOM 948 N HIS A 57 -1.350 1.877 3.436 1.00 0.00 N ATOM 949 CA HIS A 57 0.032 1.574 3.960 1.00 0.00 C ATOM 950 C HIS A 57 0.115 1.985 5.434 1.00 0.00 C ATOM 951 O HIS A 57 0.535 1.210 6.273 1.00 0.00 O ATOM 952 CB HIS A 57 1.023 2.400 3.123 1.00 0.00 C ATOM 953 CG HIS A 57 1.460 1.599 1.929 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.624 1.886 1.233 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.901 0.516 1.298 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.727 0.992 0.232 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.703 0.134 0.228 1.00 0.00 N ATOM 0 H HIS A 57 -1.391 2.541 2.663 1.00 0.00 H new ATOM 0 HA HIS A 57 0.262 0.511 3.886 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.555 3.330 2.799 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.888 2.672 3.728 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.021 0.034 1.588 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.538 0.971 -0.481 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.544 -0.637 -0.421 1.00 0.00 H new ATOM 965 N GLN A 58 -0.305 3.190 5.761 1.00 0.00 N ATOM 966 CA GLN A 58 -0.266 3.620 7.204 1.00 0.00 C ATOM 967 C GLN A 58 -1.151 2.678 8.042 1.00 0.00 C ATOM 968 O GLN A 58 -0.819 2.356 9.167 1.00 0.00 O ATOM 969 CB GLN A 58 -0.811 5.056 7.255 1.00 0.00 C ATOM 970 CG GLN A 58 -0.364 5.726 8.556 1.00 0.00 C ATOM 971 CD GLN A 58 0.964 6.457 8.326 1.00 0.00 C ATOM 972 OE1 GLN A 58 2.018 5.865 8.443 1.00 0.00 O ATOM 973 NE2 GLN A 58 0.965 7.727 8.003 1.00 0.00 N ATOM 0 H GLN A 58 -0.667 3.883 5.106 1.00 0.00 H new ATOM 0 HA GLN A 58 0.746 3.580 7.607 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.449 5.624 6.398 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -1.899 5.046 7.194 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.124 6.430 8.895 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.249 4.979 9.341 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.082 8.229 7.904 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.848 8.214 7.851 1.00 0.00 H new ATOM 982 N ARG A 59 -2.269 2.219 7.500 1.00 0.00 N ATOM 983 CA ARG A 59 -3.146 1.283 8.287 1.00 0.00 C ATOM 984 C ARG A 59 -2.371 -0.007 8.586 1.00 0.00 C ATOM 985 O ARG A 59 -2.314 -0.446 9.720 1.00 0.00 O ATOM 986 CB ARG A 59 -4.373 0.974 7.412 1.00 0.00 C ATOM 987 CG ARG A 59 -5.442 2.055 7.620 1.00 0.00 C ATOM 988 CD ARG A 59 -6.061 2.434 6.272 1.00 0.00 C ATOM 989 NE ARG A 59 -7.487 2.762 6.579 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.380 1.811 6.808 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.048 0.540 6.781 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.620 2.137 7.067 1.00 0.00 N ATOM 0 H ARG A 59 -2.603 2.449 6.564 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.453 1.726 9.234 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.082 0.934 6.362 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.777 -0.005 7.669 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.215 1.690 8.296 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.998 2.934 8.087 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.547 3.286 5.827 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.990 1.612 5.560 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.778 3.739 6.613 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.085 0.268 6.581 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.753 -0.175 6.960 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.895 3.119 7.092 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.312 1.409 7.244 1.00 0.00 H new ATOM 1006 N SER A 60 -1.757 -0.615 7.585 1.00 0.00 N ATOM 1007 CA SER A 60 -0.976 -1.870 7.857 1.00 0.00 C ATOM 1008 C SER A 60 0.206 -1.533 8.771 1.00 0.00 C ATOM 1009 O SER A 60 0.514 -2.277 9.678 1.00 0.00 O ATOM 1010 CB SER A 60 -0.476 -2.395 6.502 1.00 0.00 C ATOM 1011 OG SER A 60 0.405 -1.440 5.925 1.00 0.00 O ATOM 0 H SER A 60 -1.764 -0.302 6.614 1.00 0.00 H new ATOM 0 HA SER A 60 -1.587 -2.625 8.350 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.038 -3.347 6.635 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.319 -2.578 5.836 1.00 0.00 H new ATOM 0 HG SER A 60 0.108 -0.536 6.160 1.00 0.00 H new ATOM 1017 N ARG A 61 0.862 -0.407 8.559 1.00 0.00 N ATOM 1018 CA ARG A 61 2.012 -0.043 9.460 1.00 0.00 C ATOM 1019 C ARG A 61 1.487 0.151 10.892 1.00 0.00 C ATOM 1020 O ARG A 61 2.114 -0.271 11.844 1.00 0.00 O ATOM 1021 CB ARG A 61 2.601 1.272 8.925 1.00 0.00 C ATOM 1022 CG ARG A 61 4.043 1.423 9.418 1.00 0.00 C ATOM 1023 CD ARG A 61 4.870 2.169 8.369 1.00 0.00 C ATOM 1024 NE ARG A 61 4.933 3.581 8.859 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.641 3.906 9.929 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.313 3.002 10.607 1.00 0.00 N ATOM 1027 NH2 ARG A 61 5.675 5.151 10.329 1.00 0.00 N ATOM 0 H ARG A 61 0.656 0.262 7.817 1.00 0.00 H new ATOM 0 HA ARG A 61 2.773 -0.823 9.476 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.575 1.278 7.835 1.00 0.00 H new ATOM 0 HB3 ARG A 61 2.000 2.116 9.262 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.060 1.967 10.363 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.478 0.442 9.607 1.00 0.00 H new ATOM 0 HD2 ARG A 61 5.867 1.739 8.274 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.403 2.113 7.385 1.00 0.00 H new ATOM 0 HE ARG A 61 4.420 4.307 8.359 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.296 2.026 10.311 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.852 3.277 11.429 1.00 0.00 H new ATOM 0 HH21 ARG A 61 5.158 5.865 9.817 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.219 5.407 11.153 1.00 0.00 H new ATOM 1041 N TYR A 62 0.330 0.771 11.054 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.220 0.963 12.442 1.00 0.00 C ATOM 1043 C TYR A 62 -0.525 -0.413 13.060 1.00 0.00 C ATOM 1044 O TYR A 62 -0.048 -0.729 14.137 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.511 1.799 12.292 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.215 1.917 13.627 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.112 0.921 14.028 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.965 3.013 14.461 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.760 1.020 15.261 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.616 3.113 15.696 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.514 2.116 16.097 1.00 0.00 C ATOM 1052 OH TYR A 62 -4.155 2.213 17.315 1.00 0.00 O ATOM 0 H TYR A 62 -0.245 1.145 10.299 1.00 0.00 H new ATOM 0 HA TYR A 62 0.488 1.472 13.096 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.268 2.791 11.912 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.173 1.331 11.563 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.303 0.075 13.384 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.271 3.780 14.152 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.452 0.250 15.570 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.426 3.959 16.340 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.871 3.033 17.770 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.300 -1.240 12.384 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.601 -2.599 12.959 1.00 0.00 C ATOM 1064 C ILE A 63 -0.305 -3.433 13.005 1.00 0.00 C ATOM 1065 O ILE A 63 -0.100 -4.207 13.920 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.656 -3.254 12.046 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.955 -2.436 12.106 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.937 -4.680 12.527 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.994 -3.026 11.145 1.00 0.00 C ATOM 0 H ILE A 63 -1.728 -1.039 11.480 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.985 -2.531 13.977 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.283 -3.282 11.022 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.347 -2.436 13.123 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.753 -1.398 11.843 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.683 -5.142 11.880 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.017 -5.263 12.493 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.311 -4.652 13.550 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.911 -2.439 11.195 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.603 -3.002 10.128 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.207 -4.057 11.428 1.00 0.00 H new ATOM 1081 N TYR A 64 0.580 -3.271 12.042 1.00 0.00 N ATOM 1082 CA TYR A 64 1.863 -4.052 12.079 1.00 0.00 C ATOM 1083 C TYR A 64 2.720 -3.540 13.244 1.00 0.00 C ATOM 1084 O TYR A 64 3.316 -4.314 13.965 1.00 0.00 O ATOM 1085 CB TYR A 64 2.583 -3.788 10.743 1.00 0.00 C ATOM 1086 CG TYR A 64 3.801 -4.676 10.630 1.00 0.00 C ATOM 1087 CD1 TYR A 64 4.928 -4.439 11.427 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.798 -5.740 9.725 1.00 0.00 C ATOM 1089 CE1 TYR A 64 6.050 -5.269 11.315 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.916 -6.568 9.612 1.00 0.00 C ATOM 1091 CZ TYR A 64 6.043 -6.335 10.408 1.00 0.00 C ATOM 1092 OH TYR A 64 7.148 -7.154 10.297 1.00 0.00 O ATOM 0 H TYR A 64 0.472 -2.643 11.246 1.00 0.00 H new ATOM 0 HA TYR A 64 1.684 -5.118 12.217 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.905 -3.978 9.911 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.879 -2.741 10.680 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.932 -3.617 12.127 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.928 -5.922 9.111 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.920 -5.087 11.928 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.911 -7.389 8.910 1.00 0.00 H new ATOM 0 HH TYR A 64 6.868 -8.091 10.356 1.00 0.00 H new ATOM 1102 N THR A 65 2.790 -2.237 13.434 1.00 0.00 N ATOM 1103 CA THR A 65 3.627 -1.697 14.560 1.00 0.00 C ATOM 1104 C THR A 65 3.135 -2.241 15.908 1.00 0.00 C ATOM 1105 O THR A 65 3.933 -2.540 16.775 1.00 0.00 O ATOM 1106 CB THR A 65 3.492 -0.162 14.523 1.00 0.00 C ATOM 1107 OG1 THR A 65 3.924 0.316 13.258 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.358 0.465 15.621 1.00 0.00 C ATOM 0 H THR A 65 2.312 -1.536 12.868 1.00 0.00 H new ATOM 0 HA THR A 65 4.667 -2.001 14.446 1.00 0.00 H new ATOM 0 HB THR A 65 2.449 0.110 14.687 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.170 0.313 12.632 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.257 1.550 15.589 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.032 0.099 16.595 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.401 0.192 15.462 1.00 0.00 H new ATOM 1116 N LEU A 66 1.838 -2.360 16.113 1.00 0.00 N ATOM 1117 CA LEU A 66 1.364 -2.874 17.444 1.00 0.00 C ATOM 1118 C LEU A 66 1.389 -4.419 17.514 1.00 0.00 C ATOM 1119 O LEU A 66 1.644 -4.978 18.564 1.00 0.00 O ATOM 1120 CB LEU A 66 -0.056 -2.304 17.676 1.00 0.00 C ATOM 1121 CG LEU A 66 -1.088 -2.967 16.752 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.584 -4.278 17.377 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.276 -2.013 16.557 1.00 0.00 C ATOM 0 H LEU A 66 1.108 -2.131 15.439 1.00 0.00 H new ATOM 0 HA LEU A 66 2.036 -2.543 18.236 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.345 -2.458 18.716 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.050 -1.228 17.503 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.625 -3.184 15.789 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.316 -4.742 16.716 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.742 -4.955 17.519 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.047 -4.069 18.341 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.012 -2.478 15.902 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.733 -1.799 17.523 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.926 -1.084 16.108 1.00 0.00 H new ATOM 1135 N TYR A 67 1.118 -5.118 16.426 1.00 0.00 N ATOM 1136 CA TYR A 67 1.127 -6.628 16.490 1.00 0.00 C ATOM 1137 C TYR A 67 2.539 -7.207 16.257 1.00 0.00 C ATOM 1138 O TYR A 67 2.863 -8.253 16.790 1.00 0.00 O ATOM 1139 CB TYR A 67 0.154 -7.122 15.401 1.00 0.00 C ATOM 1140 CG TYR A 67 0.098 -8.640 15.409 1.00 0.00 C ATOM 1141 CD1 TYR A 67 1.093 -9.377 14.754 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.942 -9.310 16.074 1.00 0.00 C ATOM 1143 CE1 TYR A 67 1.052 -10.777 14.763 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -0.983 -10.711 16.082 1.00 0.00 C ATOM 1145 CZ TYR A 67 0.015 -11.443 15.426 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.025 -12.823 15.434 1.00 0.00 O ATOM 0 H TYR A 67 0.895 -4.719 15.514 1.00 0.00 H new ATOM 0 HA TYR A 67 0.821 -6.963 17.481 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.841 -6.712 15.576 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.478 -6.766 14.423 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.893 -8.865 14.241 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.711 -8.745 16.580 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.821 -11.343 14.258 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.783 -11.226 16.593 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.652 -13.128 16.122 1.00 0.00 H new ATOM 1156 N TYR A 68 3.372 -6.572 15.455 1.00 0.00 N ATOM 1157 CA TYR A 68 4.738 -7.154 15.200 1.00 0.00 C ATOM 1158 C TYR A 68 5.839 -6.510 16.071 1.00 0.00 C ATOM 1159 O TYR A 68 6.904 -7.083 16.215 1.00 0.00 O ATOM 1160 CB TYR A 68 5.023 -6.927 13.705 1.00 0.00 C ATOM 1161 CG TYR A 68 4.516 -8.108 12.909 1.00 0.00 C ATOM 1162 CD1 TYR A 68 5.056 -9.380 13.132 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.506 -7.935 11.947 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.592 -10.479 12.398 1.00 0.00 C ATOM 1165 CE2 TYR A 68 3.043 -9.035 11.215 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.586 -10.307 11.441 1.00 0.00 C ATOM 1167 OH TYR A 68 3.128 -11.389 10.718 1.00 0.00 O ATOM 0 H TYR A 68 3.171 -5.695 14.975 1.00 0.00 H new ATOM 0 HA TYR A 68 4.748 -8.211 15.465 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.538 -6.012 13.366 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.093 -6.799 13.543 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.832 -9.514 13.871 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.088 -6.955 11.773 1.00 0.00 H new ATOM 0 HE1 TYR A 68 5.011 -11.459 12.571 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.267 -8.903 10.476 1.00 0.00 H new ATOM 0 HH TYR A 68 2.429 -11.095 10.097 1.00 0.00 H new ATOM 1177 N LYS A 69 5.622 -5.344 16.654 1.00 0.00 N ATOM 1178 CA LYS A 69 6.703 -4.729 17.498 1.00 0.00 C ATOM 1179 C LYS A 69 6.235 -4.567 18.954 1.00 0.00 C ATOM 1180 O LYS A 69 6.863 -5.072 19.865 1.00 0.00 O ATOM 1181 CB LYS A 69 6.987 -3.351 16.893 1.00 0.00 C ATOM 1182 CG LYS A 69 7.349 -3.476 15.410 1.00 0.00 C ATOM 1183 CD LYS A 69 7.109 -2.131 14.722 1.00 0.00 C ATOM 1184 CE LYS A 69 8.422 -1.348 14.653 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.220 -0.353 13.565 1.00 0.00 N ATOM 0 H LYS A 69 4.760 -4.804 16.582 1.00 0.00 H new ATOM 0 HA LYS A 69 7.591 -5.361 17.508 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.112 -2.711 17.006 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.804 -2.872 17.433 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.392 -3.773 15.301 1.00 0.00 H new ATOM 0 HG3 LYS A 69 6.745 -4.252 14.940 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.715 -2.290 13.718 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.361 -1.559 15.271 1.00 0.00 H new ATOM 0 HE2 LYS A 69 8.639 -0.857 15.602 1.00 0.00 H new ATOM 0 HE3 LYS A 69 9.263 -2.006 14.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 9.079 0.223 13.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.022 -0.849 12.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.417 0.264 13.803 1.00 0.00 H new ATOM 1199 N ARG A 70 5.144 -3.862 19.185 1.00 0.00 N ATOM 1200 CA ARG A 70 4.666 -3.678 20.605 1.00 0.00 C ATOM 1201 C ARG A 70 4.152 -5.005 21.189 1.00 0.00 C ATOM 1202 O ARG A 70 4.217 -5.215 22.386 1.00 0.00 O ATOM 1203 CB ARG A 70 3.525 -2.649 20.562 1.00 0.00 C ATOM 1204 CG ARG A 70 4.030 -1.347 19.936 1.00 0.00 C ATOM 1205 CD ARG A 70 3.161 -0.175 20.419 1.00 0.00 C ATOM 1206 NE ARG A 70 3.366 -0.078 21.909 1.00 0.00 N ATOM 1207 CZ ARG A 70 2.444 0.465 22.694 1.00 0.00 C ATOM 1208 NH1 ARG A 70 1.337 0.976 22.205 1.00 0.00 N ATOM 1209 NH2 ARG A 70 2.645 0.512 23.986 1.00 0.00 N ATOM 0 H ARG A 70 4.573 -3.414 18.469 1.00 0.00 H new ATOM 0 HA ARG A 70 5.485 -3.339 21.240 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.689 -3.042 19.983 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.154 -2.460 21.569 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.071 -1.179 20.211 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.994 -1.416 18.849 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.452 0.753 19.926 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.111 -0.347 20.182 1.00 0.00 H new ATOM 0 HE ARG A 70 4.228 -0.436 22.321 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.170 0.962 21.199 1.00 0.00 H new ATOM 0 HH12 ARG A 70 0.645 1.387 22.831 1.00 0.00 H new ATOM 0 HH21 ARG A 70 3.505 0.133 24.382 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.942 0.928 24.597 1.00 0.00 H new ATOM 1223 N LYS A 71 3.632 -5.904 20.369 1.00 0.00 N ATOM 1224 CA LYS A 71 3.108 -7.205 20.901 1.00 0.00 C ATOM 1225 C LYS A 71 2.008 -6.940 21.939 1.00 0.00 C ATOM 1226 O LYS A 71 1.946 -7.592 22.964 1.00 0.00 O ATOM 1227 CB LYS A 71 4.310 -7.915 21.545 1.00 0.00 C ATOM 1228 CG LYS A 71 4.325 -9.396 21.135 1.00 0.00 C ATOM 1229 CD LYS A 71 3.939 -10.271 22.333 1.00 0.00 C ATOM 1230 CE LYS A 71 2.446 -10.602 22.267 1.00 0.00 C ATOM 1231 NZ LYS A 71 2.353 -12.033 22.671 1.00 0.00 N ATOM 0 H LYS A 71 3.551 -5.788 19.359 1.00 0.00 H new ATOM 0 HA LYS A 71 2.668 -7.819 20.115 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.237 -7.433 21.234 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.255 -7.830 22.630 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.629 -9.562 20.313 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.316 -9.673 20.775 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.526 -11.189 22.329 1.00 0.00 H new ATOM 0 HD3 LYS A 71 4.166 -9.751 23.264 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.870 -9.964 22.937 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.051 -10.448 21.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.358 -12.335 22.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.906 -12.617 22.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.730 -12.147 23.634 1.00 0.00 H new ATOM 1245 N ALA A 72 1.130 -5.996 21.671 1.00 0.00 N ATOM 1246 CA ALA A 72 0.026 -5.702 22.635 1.00 0.00 C ATOM 1247 C ALA A 72 -1.329 -6.092 22.016 1.00 0.00 C ATOM 1248 O ALA A 72 -2.329 -5.438 22.247 1.00 0.00 O ATOM 1249 CB ALA A 72 0.093 -4.192 22.874 1.00 0.00 C ATOM 0 H ALA A 72 1.134 -5.421 20.828 1.00 0.00 H new ATOM 0 HA ALA A 72 0.128 -6.262 23.564 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.690 -3.899 23.574 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.067 -3.932 23.289 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.050 -3.667 21.929 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.372 -7.153 21.233 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.664 -7.578 20.606 1.00 0.00 C ATOM 1257 C ILE A 73 -2.640 -9.095 20.340 1.00 0.00 C ATOM 1258 O ILE A 73 -1.584 -9.700 20.324 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.752 -6.785 19.291 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -4.036 -7.170 18.542 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.539 -7.092 18.407 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.200 -6.280 17.305 1.00 0.00 C ATOM 0 H ILE A 73 -0.568 -7.738 21.005 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.525 -7.383 21.245 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.766 -5.720 19.522 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.995 -8.218 18.245 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.899 -7.059 19.199 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.612 -6.525 17.479 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.626 -6.812 18.932 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.515 -8.158 18.180 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.112 -6.556 16.776 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.261 -5.236 17.613 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.343 -6.414 16.645 1.00 0.00 H new ATOM 1274 N SER A 74 -3.782 -9.714 20.134 1.00 0.00 N ATOM 1275 CA SER A 74 -3.790 -11.187 19.875 1.00 0.00 C ATOM 1276 C SER A 74 -4.130 -11.465 18.403 1.00 0.00 C ATOM 1277 O SER A 74 -4.849 -10.709 17.780 1.00 0.00 O ATOM 1278 CB SER A 74 -4.871 -11.758 20.794 1.00 0.00 C ATOM 1279 OG SER A 74 -4.418 -12.990 21.343 1.00 0.00 O ATOM 0 H SER A 74 -4.698 -9.266 20.134 1.00 0.00 H new ATOM 0 HA SER A 74 -2.818 -11.641 20.069 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.096 -11.051 21.593 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.794 -11.913 20.236 1.00 0.00 H new ATOM 0 HG SER A 74 -5.108 -13.358 21.934 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.616 -12.547 17.839 1.00 0.00 N ATOM 1286 CA LYS A 75 -3.916 -12.873 16.391 1.00 0.00 C ATOM 1287 C LYS A 75 -5.422 -12.741 16.084 1.00 0.00 C ATOM 1288 O LYS A 75 -5.794 -12.380 14.986 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.466 -14.327 16.168 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.193 -14.559 14.677 1.00 0.00 C ATOM 1291 CD LYS A 75 -1.910 -15.378 14.507 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.112 -16.776 15.095 1.00 0.00 C ATOM 1293 NZ LYS A 75 -0.919 -17.553 14.656 1.00 0.00 N ATOM 0 H LYS A 75 -3.007 -13.213 18.314 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.393 -12.180 15.732 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.567 -14.533 16.749 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.236 -15.014 16.518 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.033 -15.083 14.221 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.096 -13.603 14.162 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.650 -15.451 13.451 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -1.079 -14.879 15.006 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.182 -16.741 16.182 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.034 -17.228 14.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.984 -18.525 15.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -0.882 -17.575 13.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.057 -17.102 15.024 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.294 -13.020 17.037 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.768 -12.880 16.752 1.00 0.00 C ATOM 1309 C ASP A 76 -8.093 -11.406 16.469 1.00 0.00 C ATOM 1310 O ASP A 76 -8.750 -11.093 15.494 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.517 -13.365 18.004 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.602 -14.892 17.989 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -8.894 -15.439 16.938 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -8.375 -15.489 19.028 1.00 0.00 O ATOM 0 H ASP A 76 -6.056 -13.332 17.979 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.064 -13.466 15.882 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.001 -13.028 18.903 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.518 -12.935 18.031 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.624 -10.493 17.299 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.905 -9.034 17.033 1.00 0.00 C ATOM 1321 C LEU A 77 -7.159 -8.612 15.759 1.00 0.00 C ATOM 1322 O LEU A 77 -7.697 -7.898 14.934 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.378 -8.251 18.256 1.00 0.00 C ATOM 1324 CG LEU A 77 -8.204 -6.973 18.492 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -8.047 -6.015 17.301 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -9.691 -7.326 18.693 1.00 0.00 C ATOM 0 H LEU A 77 -7.070 -10.688 18.133 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.968 -8.840 16.888 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.419 -8.884 19.143 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.332 -7.988 18.101 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.836 -6.482 19.393 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -8.635 -5.115 17.478 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -6.997 -5.746 17.187 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -8.397 -6.504 16.392 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -10.263 -6.413 18.859 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -10.068 -7.834 17.805 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -9.796 -7.981 19.558 1.00 0.00 H new ATOM 1338 N TYR A 78 -5.932 -9.063 15.581 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.177 -8.689 14.334 1.00 0.00 C ATOM 1340 C TYR A 78 -5.865 -9.327 13.113 1.00 0.00 C ATOM 1341 O TYR A 78 -6.022 -8.692 12.083 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.741 -9.232 14.507 1.00 0.00 C ATOM 1343 CG TYR A 78 -2.909 -8.954 13.269 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.013 -7.724 12.606 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.026 -9.929 12.792 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.239 -7.471 11.469 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.249 -9.675 11.655 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.356 -8.446 10.994 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.590 -8.197 9.873 1.00 0.00 O ATOM 0 H TYR A 78 -5.429 -9.664 16.234 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.157 -7.611 14.177 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.274 -8.769 15.376 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.773 -10.305 14.696 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.693 -6.969 12.974 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -1.944 -10.878 13.301 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.323 -6.523 10.958 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.567 -10.428 11.288 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.030 -8.978 9.679 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.304 -10.568 13.224 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.006 -11.215 12.061 1.00 0.00 C ATOM 1361 C ASP A 79 -8.403 -10.598 11.922 1.00 0.00 C ATOM 1362 O ASP A 79 -8.847 -10.302 10.829 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.109 -12.715 12.377 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.639 -13.460 11.151 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -8.849 -13.530 11.000 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -6.827 -13.949 10.381 1.00 0.00 O ATOM 0 H ASP A 79 -6.208 -11.150 14.056 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.467 -11.063 11.126 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.131 -13.106 12.659 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -7.773 -12.874 13.227 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.098 -10.377 13.026 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.467 -9.746 12.938 1.00 0.00 C ATOM 1373 C TRP A 80 -10.362 -8.403 12.189 1.00 0.00 C ATOM 1374 O TRP A 80 -11.232 -8.057 11.411 1.00 0.00 O ATOM 1375 CB TRP A 80 -10.943 -9.522 14.387 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.288 -8.862 14.392 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.471 -9.500 14.242 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.602 -7.448 14.549 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.491 -8.566 14.297 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.004 -7.287 14.484 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.812 -6.302 14.739 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.600 -6.032 14.605 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.409 -5.038 14.859 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.800 -4.903 14.791 1.00 0.00 C ATOM 0 H TRP A 80 -8.782 -10.602 13.969 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.171 -10.379 12.397 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -10.996 -10.476 14.912 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.224 -8.903 14.923 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.599 -10.563 14.102 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.481 -8.794 14.210 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.737 -6.395 14.793 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.674 -5.934 14.555 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.791 -4.164 15.005 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.254 -3.927 14.882 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.293 -7.652 12.398 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.153 -6.351 11.662 1.00 0.00 C ATOM 1397 C LEU A 81 -8.947 -6.650 10.176 1.00 0.00 C ATOM 1398 O LEU A 81 -9.738 -6.247 9.349 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.912 -5.645 12.234 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.173 -5.236 13.683 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.844 -5.133 14.433 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.870 -3.877 13.706 1.00 0.00 C ATOM 0 H LEU A 81 -8.529 -7.882 13.034 1.00 0.00 H new ATOM 0 HA LEU A 81 -10.037 -5.723 11.776 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.049 -6.309 12.183 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.674 -4.766 11.635 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.805 -5.983 14.163 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -7.031 -4.841 15.466 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.340 -6.099 14.414 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.213 -4.385 13.953 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -9.058 -3.582 14.738 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.234 -3.134 13.226 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.817 -3.944 13.170 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.901 -7.372 9.819 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.691 -7.690 8.358 1.00 0.00 C ATOM 1416 C ILE A 82 -8.934 -8.422 7.790 1.00 0.00 C ATOM 1417 O ILE A 82 -9.217 -8.319 6.610 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.391 -8.537 8.275 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.189 -7.579 8.308 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.338 -9.359 6.975 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.072 -8.165 9.170 1.00 0.00 C ATOM 0 H ILE A 82 -7.199 -7.747 10.457 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.575 -6.793 7.749 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.369 -9.230 9.116 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -4.824 -7.406 7.295 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.496 -6.612 8.706 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.416 -9.940 6.949 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.193 -10.034 6.936 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.367 -8.686 6.118 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.226 -7.478 9.186 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.437 -8.315 10.186 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.755 -9.121 8.754 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.690 -9.131 8.609 1.00 0.00 N ATOM 1434 CA LYS A 83 -10.918 -9.819 8.074 1.00 0.00 C ATOM 1435 C LYS A 83 -12.096 -8.824 7.941 1.00 0.00 C ATOM 1436 O LYS A 83 -13.043 -9.093 7.226 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.270 -10.929 9.077 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.297 -11.874 8.451 1.00 0.00 C ATOM 1439 CD LYS A 83 -11.598 -12.807 7.461 1.00 0.00 C ATOM 1440 CE LYS A 83 -12.606 -13.292 6.416 1.00 0.00 C ATOM 1441 NZ LYS A 83 -13.618 -14.065 7.187 1.00 0.00 N ATOM 0 H LYS A 83 -9.514 -9.261 9.605 1.00 0.00 H new ATOM 0 HA LYS A 83 -10.730 -10.226 7.080 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.372 -11.482 9.354 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -11.671 -10.493 9.992 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -12.792 -12.456 9.228 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -13.071 -11.300 7.941 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -10.775 -12.285 6.973 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -11.168 -13.658 7.989 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -13.065 -12.454 5.892 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.124 -13.915 5.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.157 -14.674 6.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -13.138 -14.654 7.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -14.267 -13.408 7.665 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.059 -7.681 8.613 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.196 -6.705 8.493 1.00 0.00 C ATOM 1457 C GLU A 84 -12.792 -5.438 7.697 1.00 0.00 C ATOM 1458 O GLU A 84 -13.398 -4.397 7.857 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.541 -6.323 9.925 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.059 -7.542 10.686 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.374 -8.017 10.064 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -15.316 -8.776 9.110 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -16.417 -7.614 10.553 1.00 0.00 O ATOM 0 H GLU A 84 -11.299 -7.391 9.229 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.034 -7.149 7.955 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.659 -5.921 10.424 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.295 -5.536 9.928 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.320 -8.343 10.655 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.212 -7.290 11.735 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.781 -5.521 6.840 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.320 -4.346 6.003 1.00 0.00 C ATOM 1472 C LYS A 85 -10.486 -3.347 6.818 1.00 0.00 C ATOM 1473 O LYS A 85 -10.902 -2.230 7.061 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.571 -3.668 5.416 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.239 -3.082 4.043 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.536 -2.757 3.300 1.00 0.00 C ATOM 1477 CE LYS A 85 -13.280 -2.781 1.792 1.00 0.00 C ATOM 1478 NZ LYS A 85 -12.802 -1.409 1.462 1.00 0.00 N ATOM 0 H LYS A 85 -11.246 -6.375 6.684 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.668 -4.704 5.206 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.382 -4.391 5.328 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.918 -2.880 6.085 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.637 -2.181 4.156 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.645 -3.792 3.467 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.308 -3.481 3.560 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.904 -1.776 3.602 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -12.535 -3.532 1.530 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -14.188 -3.026 1.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -12.605 -1.346 0.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -13.534 -0.716 1.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -11.933 -1.206 1.996 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.296 -3.742 7.229 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.416 -2.825 8.011 1.00 0.00 C ATOM 1494 C TYR A 86 -7.013 -2.817 7.386 1.00 0.00 C ATOM 1495 O TYR A 86 -6.540 -1.802 6.914 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.357 -3.425 9.416 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.645 -3.162 10.158 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.843 -3.774 9.755 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.635 -2.311 11.268 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -12.023 -3.525 10.469 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.815 -2.065 11.976 1.00 0.00 C ATOM 1502 CZ TYR A 86 -12.008 -2.673 11.577 1.00 0.00 C ATOM 1503 OH TYR A 86 -13.173 -2.430 12.276 1.00 0.00 O ATOM 0 H TYR A 86 -8.902 -4.666 7.051 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.787 -1.800 8.023 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.180 -4.499 9.352 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.519 -2.996 9.966 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.855 -4.433 8.899 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.713 -1.843 11.579 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.947 -3.993 10.162 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.804 -1.405 12.831 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.969 -1.909 13.081 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.349 -3.954 7.375 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.983 -4.033 6.778 1.00 0.00 C ATOM 1515 C ALA A 87 -4.926 -5.194 5.773 1.00 0.00 C ATOM 1516 O ALA A 87 -5.867 -5.958 5.657 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.047 -4.301 7.957 1.00 0.00 C ATOM 0 H ALA A 87 -6.701 -4.832 7.757 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.708 -3.124 6.243 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.020 -4.372 7.598 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.124 -3.485 8.676 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.328 -5.237 8.440 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.838 -5.340 5.043 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.747 -6.457 4.057 1.00 0.00 C ATOM 1525 C ASP A 88 -2.558 -7.373 4.391 1.00 0.00 C ATOM 1526 O ASP A 88 -1.414 -6.998 4.209 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.534 -5.775 2.706 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.708 -6.799 1.584 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.094 -7.850 1.666 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.453 -6.515 0.660 1.00 0.00 O ATOM 0 H ASP A 88 -3.018 -4.735 5.092 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.639 -7.084 4.064 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.247 -4.960 2.582 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.537 -5.337 2.661 1.00 0.00 H new ATOM 1535 N LYS A 89 -2.815 -8.574 4.874 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.675 -9.503 5.211 1.00 0.00 C ATOM 1537 C LYS A 89 -0.818 -9.763 3.961 1.00 0.00 C ATOM 1538 O LYS A 89 0.394 -9.833 4.043 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.302 -10.822 5.695 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.667 -10.703 7.176 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.427 -12.045 7.871 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.424 -13.080 7.344 1.00 0.00 C ATOM 1543 NZ LYS A 89 -2.924 -14.388 7.851 1.00 0.00 N ATOM 0 H LYS A 89 -3.748 -8.947 5.047 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.033 -9.068 5.976 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.192 -11.051 5.108 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.602 -11.645 5.547 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.067 -9.925 7.648 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.711 -10.408 7.281 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -1.407 -12.383 7.690 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -2.539 -11.933 8.949 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -4.432 -12.876 7.704 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -3.466 -13.069 6.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -3.556 -15.149 7.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -1.965 -14.558 7.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -2.901 -14.372 8.891 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.433 -9.911 2.802 1.00 0.00 N ATOM 1558 CA LEU A 90 -0.623 -10.171 1.557 1.00 0.00 C ATOM 1559 C LEU A 90 0.360 -9.016 1.311 1.00 0.00 C ATOM 1560 O LEU A 90 1.485 -9.242 0.905 1.00 0.00 O ATOM 1561 CB LEU A 90 -1.619 -10.280 0.391 1.00 0.00 C ATOM 1562 CG LEU A 90 -0.887 -10.763 -0.862 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -0.624 -12.266 -0.753 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -1.750 -10.485 -2.095 1.00 0.00 C ATOM 0 H LEU A 90 -2.443 -9.864 2.665 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.038 -11.086 1.657 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.420 -10.973 0.647 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.083 -9.312 0.203 1.00 0.00 H new ATOM 0 HG LEU A 90 0.062 -10.234 -0.955 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.102 -12.610 -1.646 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.010 -12.465 0.125 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -1.572 -12.796 -0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.229 -10.829 -2.989 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -2.699 -11.014 -2.002 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -1.938 -9.414 -2.174 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.041 -7.782 1.558 1.00 0.00 N ATOM 1577 CA LEU A 91 0.915 -6.640 1.333 1.00 0.00 C ATOM 1578 C LEU A 91 2.046 -6.719 2.365 1.00 0.00 C ATOM 1579 O LEU A 91 3.209 -6.655 2.013 1.00 0.00 O ATOM 1580 CB LEU A 91 0.112 -5.335 1.494 1.00 0.00 C ATOM 1581 CG LEU A 91 1.036 -4.117 1.320 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.736 -4.164 -0.051 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.202 -2.838 1.426 1.00 0.00 C ATOM 0 H LEU A 91 -0.967 -7.521 1.898 1.00 0.00 H new ATOM 0 HA LEU A 91 1.363 -6.680 0.340 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.690 -5.300 0.757 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.357 -5.307 2.478 1.00 0.00 H new ATOM 0 HG LEU A 91 1.797 -4.132 2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.386 -3.295 -0.158 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.332 -5.074 -0.124 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.987 -4.156 -0.843 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.850 -1.970 1.304 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.560 -2.835 0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.279 -2.797 2.403 1.00 0.00 H new ATOM 1595 N ILE A 92 1.725 -6.883 3.637 1.00 0.00 N ATOM 1596 CA ILE A 92 2.823 -6.994 4.666 1.00 0.00 C ATOM 1597 C ILE A 92 3.712 -8.205 4.317 1.00 0.00 C ATOM 1598 O ILE A 92 4.920 -8.145 4.451 1.00 0.00 O ATOM 1599 CB ILE A 92 2.136 -7.167 6.041 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.409 -5.863 6.401 1.00 0.00 C ATOM 1601 CG2 ILE A 92 3.184 -7.477 7.118 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.660 -6.018 7.731 1.00 0.00 C ATOM 0 H ILE A 92 0.774 -6.944 4.000 1.00 0.00 H new ATOM 0 HA ILE A 92 3.462 -6.111 4.687 1.00 0.00 H new ATOM 0 HB ILE A 92 1.425 -7.992 5.990 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.128 -5.047 6.474 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.707 -5.600 5.610 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.690 -7.597 8.082 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.708 -8.398 6.862 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.899 -6.657 7.176 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.150 -5.085 7.972 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.073 -6.820 7.645 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.370 -6.259 8.522 1.00 0.00 H new ATOM 1614 N ALA A 93 3.130 -9.294 3.842 1.00 0.00 N ATOM 1615 CA ALA A 93 3.978 -10.478 3.460 1.00 0.00 C ATOM 1616 C ALA A 93 4.845 -10.104 2.246 1.00 0.00 C ATOM 1617 O ALA A 93 6.000 -10.480 2.171 1.00 0.00 O ATOM 1618 CB ALA A 93 3.016 -11.621 3.097 1.00 0.00 C ATOM 0 H ALA A 93 2.126 -9.411 3.706 1.00 0.00 H new ATOM 0 HA ALA A 93 4.637 -10.780 4.274 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.590 -12.503 2.813 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.390 -11.857 3.958 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.385 -11.314 2.263 1.00 0.00 H new ATOM 1624 N LYS A 94 4.306 -9.355 1.296 1.00 0.00 N ATOM 1625 CA LYS A 94 5.131 -8.955 0.096 1.00 0.00 C ATOM 1626 C LYS A 94 6.390 -8.208 0.565 1.00 0.00 C ATOM 1627 O LYS A 94 7.477 -8.445 0.070 1.00 0.00 O ATOM 1628 CB LYS A 94 4.258 -8.014 -0.753 1.00 0.00 C ATOM 1629 CG LYS A 94 3.451 -8.824 -1.770 1.00 0.00 C ATOM 1630 CD LYS A 94 4.400 -9.506 -2.758 1.00 0.00 C ATOM 1631 CE LYS A 94 3.650 -9.811 -4.058 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.334 -11.265 -3.988 1.00 0.00 N ATOM 0 H LYS A 94 3.346 -9.009 1.300 1.00 0.00 H new ATOM 0 HA LYS A 94 5.440 -9.828 -0.479 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.584 -7.450 -0.108 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.887 -7.289 -1.270 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.847 -9.572 -1.256 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.762 -8.170 -2.305 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.255 -8.861 -2.962 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.791 -10.427 -2.326 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.742 -9.213 -4.140 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.262 -9.582 -4.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.427 -11.446 -4.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.086 -11.807 -4.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.268 -11.558 -2.992 1.00 0.00 H new ATOM 1646 N TRP A 95 6.253 -7.312 1.524 1.00 0.00 N ATOM 1647 CA TRP A 95 7.463 -6.563 2.021 1.00 0.00 C ATOM 1648 C TRP A 95 8.467 -7.537 2.667 1.00 0.00 C ATOM 1649 O TRP A 95 9.665 -7.337 2.579 1.00 0.00 O ATOM 1650 CB TRP A 95 6.964 -5.541 3.062 1.00 0.00 C ATOM 1651 CG TRP A 95 6.613 -4.248 2.386 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.351 -3.644 1.425 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.454 -3.391 2.607 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.722 -2.473 1.046 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.549 -2.273 1.743 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.340 -3.471 3.463 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.578 -1.273 1.730 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.360 -2.465 3.451 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.479 -1.369 2.585 1.00 0.00 C ATOM 0 H TRP A 95 5.372 -7.070 1.977 1.00 0.00 H new ATOM 0 HA TRP A 95 7.974 -6.062 1.199 1.00 0.00 H new ATOM 0 HB2 TRP A 95 6.092 -5.937 3.583 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.734 -5.370 3.814 1.00 0.00 H new ATOM 0 HD1 TRP A 95 8.280 -4.017 1.020 1.00 0.00 H new ATOM 0 HE1 TRP A 95 7.082 -1.834 0.337 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.238 -4.311 4.134 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.675 -0.429 1.063 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.510 -2.536 4.113 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.721 -0.600 2.579 1.00 0.00 H new ATOM 1670 N ARG A 96 7.999 -8.591 3.307 1.00 0.00 N ATOM 1671 CA ARG A 96 8.956 -9.567 3.942 1.00 0.00 C ATOM 1672 C ARG A 96 9.458 -10.588 2.905 1.00 0.00 C ATOM 1673 O ARG A 96 10.586 -11.038 2.978 1.00 0.00 O ATOM 1674 CB ARG A 96 8.180 -10.281 5.060 1.00 0.00 C ATOM 1675 CG ARG A 96 8.279 -9.466 6.351 1.00 0.00 C ATOM 1676 CD ARG A 96 7.197 -8.384 6.357 1.00 0.00 C ATOM 1677 NE ARG A 96 7.665 -7.377 7.359 1.00 0.00 N ATOM 1678 CZ ARG A 96 8.642 -6.529 7.078 1.00 0.00 C ATOM 1679 NH1 ARG A 96 9.241 -6.538 5.908 1.00 0.00 N ATOM 1680 NH2 ARG A 96 9.026 -5.663 7.980 1.00 0.00 N ATOM 0 H ARG A 96 7.010 -8.816 3.417 1.00 0.00 H new ATOM 0 HA ARG A 96 9.831 -9.051 4.337 1.00 0.00 H new ATOM 0 HB2 ARG A 96 7.135 -10.401 4.773 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.585 -11.281 5.217 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.160 -10.119 7.216 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.265 -9.009 6.430 1.00 0.00 H new ATOM 0 HD2 ARG A 96 7.082 -7.935 5.370 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.227 -8.797 6.635 1.00 0.00 H new ATOM 0 HE ARG A 96 7.222 -7.343 8.277 1.00 0.00 H new ATOM 0 HH11 ARG A 96 8.955 -7.208 5.194 1.00 0.00 H new ATOM 0 HH12 ARG A 96 9.991 -5.875 5.714 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.573 -5.644 8.894 1.00 0.00 H new ATOM 0 HH22 ARG A 96 9.778 -5.007 7.770 1.00 0.00 H new ATOM 1694 N LYS A 97 8.639 -10.964 1.937 1.00 0.00 N ATOM 1695 CA LYS A 97 9.101 -11.965 0.899 1.00 0.00 C ATOM 1696 C LYS A 97 10.445 -11.535 0.284 1.00 0.00 C ATOM 1697 O LYS A 97 10.960 -10.476 0.590 1.00 0.00 O ATOM 1698 CB LYS A 97 8.027 -11.987 -0.201 1.00 0.00 C ATOM 1699 CG LYS A 97 6.966 -13.041 0.116 1.00 0.00 C ATOM 1700 CD LYS A 97 7.570 -14.441 -0.024 1.00 0.00 C ATOM 1701 CE LYS A 97 7.240 -15.007 -1.409 1.00 0.00 C ATOM 1702 NZ LYS A 97 8.187 -16.142 -1.595 1.00 0.00 N ATOM 0 H LYS A 97 7.683 -10.627 1.820 1.00 0.00 H new ATOM 0 HA LYS A 97 9.239 -12.946 1.354 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.561 -11.005 -0.284 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.488 -12.203 -1.165 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.588 -12.897 1.128 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.118 -12.931 -0.560 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.650 -14.397 0.114 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.176 -15.097 0.752 1.00 0.00 H new ATOM 0 HE2 LYS A 97 6.205 -15.344 -1.462 1.00 0.00 H new ATOM 0 HE3 LYS A 97 7.370 -14.253 -2.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 8.023 -16.582 -2.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 9.164 -15.790 -1.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 8.035 -16.847 -0.846 1.00 0.00 H new ATOM 1716 N THR A 98 11.009 -12.340 -0.595 1.00 0.00 N ATOM 1717 CA THR A 98 12.308 -11.956 -1.235 1.00 0.00 C ATOM 1718 C THR A 98 12.045 -11.472 -2.666 1.00 0.00 C ATOM 1719 O THR A 98 11.206 -12.017 -3.360 1.00 0.00 O ATOM 1720 CB THR A 98 13.165 -13.226 -1.240 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.802 -14.044 -0.136 1.00 0.00 O ATOM 1722 CG2 THR A 98 14.643 -12.848 -1.134 1.00 0.00 C ATOM 0 H THR A 98 10.627 -13.238 -0.892 1.00 0.00 H new ATOM 0 HA THR A 98 12.810 -11.149 -0.701 1.00 0.00 H new ATOM 0 HB THR A 98 12.999 -13.773 -2.168 1.00 0.00 H new ATOM 0 HG1 THR A 98 13.348 -14.858 -0.138 1.00 0.00 H new ATOM 0 HG21 THR A 98 15.251 -13.753 -1.138 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.920 -12.221 -1.982 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.813 -12.300 -0.207 1.00 0.00 H new ATOM 1730 N GLY A 99 12.738 -10.444 -3.114 1.00 0.00 N ATOM 1731 CA GLY A 99 12.495 -9.932 -4.495 1.00 0.00 C ATOM 1732 C GLY A 99 11.642 -8.648 -4.442 1.00 0.00 C ATOM 1733 O GLY A 99 11.729 -7.818 -5.329 1.00 0.00 O ATOM 0 H GLY A 99 13.453 -9.946 -2.584 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.445 -9.726 -4.987 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.986 -10.692 -5.089 1.00 0.00 H new ATOM 1737 N TYR A 100 10.820 -8.465 -3.419 1.00 0.00 N ATOM 1738 CA TYR A 100 9.984 -7.216 -3.350 1.00 0.00 C ATOM 1739 C TYR A 100 10.721 -6.129 -2.548 1.00 0.00 C ATOM 1740 O TYR A 100 10.210 -5.628 -1.561 1.00 0.00 O ATOM 1741 CB TYR A 100 8.684 -7.605 -2.632 1.00 0.00 C ATOM 1742 CG TYR A 100 7.949 -8.662 -3.418 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.412 -8.358 -4.674 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.791 -9.944 -2.880 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.720 -9.337 -5.394 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.098 -10.926 -3.597 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.562 -10.623 -4.856 1.00 0.00 C ATOM 1748 OH TYR A 100 5.877 -11.589 -5.565 1.00 0.00 O ATOM 0 H TYR A 100 10.696 -9.117 -2.644 1.00 0.00 H new ATOM 0 HA TYR A 100 9.786 -6.818 -4.345 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.910 -7.976 -1.632 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.051 -6.726 -2.510 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.532 -7.367 -5.087 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.205 -10.176 -1.910 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.307 -9.103 -6.364 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.977 -11.915 -3.181 1.00 0.00 H new ATOM 0 HH TYR A 100 6.058 -12.470 -5.176 1.00 0.00 H new ATOM 1758 N GLU A 101 11.912 -5.748 -2.961 1.00 0.00 N ATOM 1759 CA GLU A 101 12.653 -4.679 -2.199 1.00 0.00 C ATOM 1760 C GLU A 101 11.942 -3.326 -2.365 1.00 0.00 C ATOM 1761 O GLU A 101 11.888 -2.537 -1.440 1.00 0.00 O ATOM 1762 CB GLU A 101 14.072 -4.609 -2.789 1.00 0.00 C ATOM 1763 CG GLU A 101 15.074 -4.313 -1.671 1.00 0.00 C ATOM 1764 CD GLU A 101 16.422 -3.927 -2.284 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.419 -3.192 -3.257 1.00 0.00 O ATOM 1766 OE2 GLU A 101 17.433 -4.373 -1.768 1.00 0.00 O ATOM 0 H GLU A 101 12.397 -6.122 -3.777 1.00 0.00 H new ATOM 0 HA GLU A 101 12.687 -4.910 -1.134 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.322 -5.552 -3.276 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.122 -3.833 -3.552 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.704 -3.504 -1.041 1.00 0.00 H new ATOM 0 HG3 GLU A 101 15.190 -5.188 -1.031 1.00 0.00 H new ATOM 1773 N LYS A 102 11.396 -3.044 -3.534 1.00 0.00 N ATOM 1774 CA LYS A 102 10.698 -1.739 -3.738 1.00 0.00 C ATOM 1775 C LYS A 102 9.264 -1.969 -4.242 1.00 0.00 C ATOM 1776 O LYS A 102 9.003 -1.878 -5.428 1.00 0.00 O ATOM 1777 CB LYS A 102 11.527 -1.017 -4.803 1.00 0.00 C ATOM 1778 CG LYS A 102 12.851 -0.527 -4.195 1.00 0.00 C ATOM 1779 CD LYS A 102 12.887 1.007 -4.180 1.00 0.00 C ATOM 1780 CE LYS A 102 13.771 1.517 -5.321 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.472 2.707 -4.763 1.00 0.00 N ATOM 0 H LYS A 102 11.407 -3.662 -4.346 1.00 0.00 H new ATOM 0 HA LYS A 102 10.619 -1.165 -2.815 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.727 -1.689 -5.637 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.966 -0.172 -5.202 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.959 -0.911 -3.181 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.691 -0.913 -4.773 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.877 1.404 -4.285 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.272 1.361 -3.224 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.481 0.755 -5.641 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.175 1.783 -6.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.098 3.113 -5.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.771 3.419 -4.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.037 2.422 -3.938 1.00 0.00 H new ATOM 1795 N LEU A 103 8.328 -2.259 -3.359 1.00 0.00 N ATOM 1796 CA LEU A 103 6.922 -2.482 -3.815 1.00 0.00 C ATOM 1797 C LEU A 103 5.992 -1.403 -3.216 1.00 0.00 C ATOM 1798 O LEU A 103 6.142 -1.025 -2.069 1.00 0.00 O ATOM 1799 CB LEU A 103 6.555 -3.903 -3.331 1.00 0.00 C ATOM 1800 CG LEU A 103 6.196 -3.909 -1.838 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.698 -3.625 -1.676 1.00 0.00 C ATOM 1802 CD2 LEU A 103 6.525 -5.277 -1.236 1.00 0.00 C ATOM 0 H LEU A 103 8.480 -2.349 -2.354 1.00 0.00 H new ATOM 0 HA LEU A 103 6.813 -2.404 -4.897 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.713 -4.281 -3.911 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.393 -4.578 -3.508 1.00 0.00 H new ATOM 0 HG LEU A 103 6.772 -3.141 -1.322 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.439 -3.629 -0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.464 -2.650 -2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.124 -4.394 -2.192 1.00 0.00 H new ATOM 0 HD21 LEU A 103 6.270 -5.279 -0.176 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.951 -6.048 -1.749 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.590 -5.479 -1.353 1.00 0.00 H new ATOM 1814 N CYS A 104 5.044 -0.905 -3.980 1.00 0.00 N ATOM 1815 CA CYS A 104 4.127 0.150 -3.430 1.00 0.00 C ATOM 1816 C CYS A 104 2.705 -0.385 -3.156 1.00 0.00 C ATOM 1817 O CYS A 104 2.047 0.094 -2.255 1.00 0.00 O ATOM 1818 CB CYS A 104 4.121 1.303 -4.450 1.00 0.00 C ATOM 1819 SG CYS A 104 3.506 0.776 -6.076 1.00 0.00 S ATOM 0 H CYS A 104 4.867 -1.178 -4.947 1.00 0.00 H new ATOM 0 HA CYS A 104 4.486 0.492 -2.459 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.499 2.115 -4.074 1.00 0.00 H new ATOM 0 HB3 CYS A 104 5.132 1.698 -4.556 1.00 0.00 H new ATOM 1824 N CYS A 105 2.214 -1.365 -3.892 1.00 0.00 N ATOM 1825 CA CYS A 105 0.831 -1.892 -3.605 1.00 0.00 C ATOM 1826 C CYS A 105 0.771 -3.402 -3.901 1.00 0.00 C ATOM 1827 O CYS A 105 1.781 -4.028 -4.157 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.146 -1.185 -4.559 1.00 0.00 C ATOM 1829 SG CYS A 105 0.137 0.606 -4.667 1.00 0.00 S ATOM 0 H CYS A 105 2.702 -1.816 -4.666 1.00 0.00 H new ATOM 0 HA CYS A 105 0.578 -1.714 -2.560 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.054 -1.622 -5.553 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.167 -1.366 -4.224 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.415 -3.985 -3.891 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.536 -5.450 -4.202 1.00 0.00 C ATOM 1836 C LEU A 106 -0.982 -5.656 -5.669 1.00 0.00 C ATOM 1837 O LEU A 106 -0.539 -6.583 -6.321 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.587 -5.996 -3.230 1.00 0.00 C ATOM 1839 CG LEU A 106 -0.918 -6.348 -1.901 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -1.992 -6.707 -0.873 1.00 0.00 C ATOM 1841 CD2 LEU A 106 0.033 -7.539 -2.096 1.00 0.00 C ATOM 0 H LEU A 106 -1.294 -3.512 -3.683 1.00 0.00 H new ATOM 0 HA LEU A 106 0.417 -5.967 -4.088 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.370 -5.255 -3.070 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.066 -6.879 -3.654 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.346 -5.491 -1.545 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.518 -6.959 0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.659 -5.856 -0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.566 -7.562 -1.230 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.507 -7.786 -1.146 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.531 -8.400 -2.454 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.799 -7.277 -2.826 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.824 -4.787 -6.210 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.248 -4.936 -7.647 1.00 0.00 C ATOM 1855 C ARG A 107 -1.511 -3.882 -8.507 1.00 0.00 C ATOM 1856 O ARG A 107 -2.061 -3.335 -9.443 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.760 -4.686 -7.664 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.323 -5.030 -9.047 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.409 -4.011 -9.431 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.659 -4.421 -8.694 1.00 0.00 N ATOM 1861 CZ ARG A 107 -7.860 -4.083 -9.143 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -8.011 -3.349 -10.222 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -8.925 -4.471 -8.490 1.00 0.00 N ATOM 0 H ARG A 107 -2.230 -3.990 -5.720 1.00 0.00 H new ATOM 0 HA ARG A 107 -2.010 -5.920 -8.051 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.248 -5.293 -6.901 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.969 -3.643 -7.424 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.524 -5.021 -9.788 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -4.741 -6.037 -9.040 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.109 -3.001 -9.154 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.576 -4.009 -10.508 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.579 -4.967 -7.836 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -7.192 -3.024 -10.737 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -8.947 -3.104 -10.545 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -8.828 -5.029 -7.642 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -9.852 -4.215 -8.829 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.272 -3.592 -8.177 1.00 0.00 N ATOM 1878 CA CYS A 108 0.529 -2.578 -8.933 1.00 0.00 C ATOM 1879 C CYS A 108 1.854 -3.283 -9.315 1.00 0.00 C ATOM 1880 O CYS A 108 2.154 -3.464 -10.477 1.00 0.00 O ATOM 1881 CB CYS A 108 0.720 -1.473 -7.878 1.00 0.00 C ATOM 1882 SG CYS A 108 0.828 0.212 -8.545 1.00 0.00 S ATOM 0 H CYS A 108 0.225 -4.026 -7.399 1.00 0.00 H new ATOM 0 HA CYS A 108 0.097 -2.175 -9.849 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.111 -1.516 -7.173 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.628 -1.683 -7.313 1.00 0.00 H new ATOM 1887 N ILE A 109 2.617 -3.746 -8.334 1.00 0.00 N ATOM 1888 CA ILE A 109 3.889 -4.501 -8.652 1.00 0.00 C ATOM 1889 C ILE A 109 3.576 -5.863 -9.311 1.00 0.00 C ATOM 1890 O ILE A 109 4.414 -6.417 -9.997 1.00 0.00 O ATOM 1891 CB ILE A 109 4.629 -4.736 -7.311 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.741 -5.548 -6.346 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.968 -3.393 -6.666 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.610 -6.330 -5.360 1.00 0.00 C ATOM 0 H ILE A 109 2.416 -3.635 -7.340 1.00 0.00 H new ATOM 0 HA ILE A 109 4.498 -3.926 -9.350 1.00 0.00 H new ATOM 0 HB ILE A 109 5.545 -5.292 -7.512 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.075 -4.878 -5.803 1.00 0.00 H new ATOM 0 HG13 ILE A 109 3.111 -6.235 -6.911 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.488 -3.563 -5.723 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.609 -2.819 -7.336 1.00 0.00 H new ATOM 0 HG23 ILE A 109 4.049 -2.837 -6.478 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.972 -6.899 -4.684 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.258 -7.014 -5.909 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.221 -5.636 -4.783 1.00 0.00 H new ATOM 1906 N GLN A 110 2.396 -6.421 -9.100 1.00 0.00 N ATOM 1907 CA GLN A 110 2.069 -7.743 -9.710 1.00 0.00 C ATOM 1908 C GLN A 110 0.815 -7.621 -10.589 1.00 0.00 C ATOM 1909 O GLN A 110 0.076 -6.661 -10.483 1.00 0.00 O ATOM 1910 CB GLN A 110 1.803 -8.667 -8.520 1.00 0.00 C ATOM 1911 CG GLN A 110 1.625 -10.105 -9.013 1.00 0.00 C ATOM 1912 CD GLN A 110 2.008 -11.082 -7.894 1.00 0.00 C ATOM 1913 OE1 GLN A 110 3.097 -11.007 -7.360 1.00 0.00 O ATOM 1914 NE2 GLN A 110 1.159 -12.005 -7.512 1.00 0.00 N ATOM 0 H GLN A 110 1.654 -6.012 -8.532 1.00 0.00 H new ATOM 0 HA GLN A 110 2.869 -8.118 -10.348 1.00 0.00 H new ATOM 0 HB2 GLN A 110 2.632 -8.614 -7.814 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.909 -8.342 -7.987 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.591 -10.271 -9.317 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.247 -10.279 -9.891 1.00 0.00 H new ATOM 0 HE21 GLN A 110 0.244 -12.072 -7.957 1.00 0.00 H new ATOM 0 HE22 GLN A 110 1.414 -12.656 -6.769 1.00 0.00 H new ATOM 1923 N LYS A 111 0.565 -8.583 -11.455 1.00 0.00 N ATOM 1924 CA LYS A 111 -0.647 -8.501 -12.329 1.00 0.00 C ATOM 1925 C LYS A 111 -1.701 -9.531 -11.882 1.00 0.00 C ATOM 1926 O LYS A 111 -1.376 -10.517 -11.246 1.00 0.00 O ATOM 1927 CB LYS A 111 -0.148 -8.786 -13.757 1.00 0.00 C ATOM 1928 CG LYS A 111 0.324 -10.246 -13.894 1.00 0.00 C ATOM 1929 CD LYS A 111 1.756 -10.288 -14.444 1.00 0.00 C ATOM 1930 CE LYS A 111 2.740 -10.580 -13.307 1.00 0.00 C ATOM 1931 NZ LYS A 111 3.946 -11.139 -13.977 1.00 0.00 N ATOM 0 H LYS A 111 1.144 -9.412 -11.590 1.00 0.00 H new ATOM 0 HA LYS A 111 -1.130 -7.525 -12.272 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -0.947 -8.590 -14.472 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.672 -8.110 -14.002 1.00 0.00 H new ATOM 0 HG2 LYS A 111 0.284 -10.742 -12.924 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -0.345 -10.792 -14.559 1.00 0.00 H new ATOM 0 HD2 LYS A 111 1.837 -11.055 -15.214 1.00 0.00 H new ATOM 0 HD3 LYS A 111 2.002 -9.337 -14.915 1.00 0.00 H new ATOM 0 HE2 LYS A 111 2.981 -9.674 -12.751 1.00 0.00 H new ATOM 0 HE3 LYS A 111 2.320 -11.289 -12.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 4.667 -11.365 -13.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 3.687 -12.004 -14.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 4.328 -10.439 -14.645 1.00 0.00 H new ATOM 1945 N ASN A 112 -2.961 -9.311 -12.202 1.00 0.00 N ATOM 1946 CA ASN A 112 -4.022 -10.279 -11.785 1.00 0.00 C ATOM 1947 C ASN A 112 -4.881 -10.728 -12.983 1.00 0.00 C ATOM 1948 O ASN A 112 -6.025 -11.108 -12.811 1.00 0.00 O ATOM 1949 CB ASN A 112 -4.881 -9.495 -10.808 1.00 0.00 C ATOM 1950 CG ASN A 112 -4.127 -9.318 -9.484 1.00 0.00 C ATOM 1951 OD1 ASN A 112 -4.320 -10.083 -8.560 1.00 0.00 O ATOM 1952 ND2 ASN A 112 -3.270 -8.336 -9.346 1.00 0.00 N ATOM 0 H ASN A 112 -3.294 -8.505 -12.732 1.00 0.00 H new ATOM 0 HA ASN A 112 -3.593 -11.184 -11.356 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -5.130 -8.521 -11.229 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -5.822 -10.018 -10.635 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -2.769 -8.217 -8.466 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -3.104 -7.691 -10.119 1.00 0.00 H new ATOM 1959 N GLU A 113 -4.355 -10.696 -14.190 1.00 0.00 N ATOM 1960 CA GLU A 113 -5.169 -11.130 -15.372 1.00 0.00 C ATOM 1961 C GLU A 113 -4.684 -12.499 -15.872 1.00 0.00 C ATOM 1962 O GLU A 113 -3.616 -12.953 -15.501 1.00 0.00 O ATOM 1963 CB GLU A 113 -4.945 -10.056 -16.443 1.00 0.00 C ATOM 1964 CG GLU A 113 -6.262 -9.776 -17.170 1.00 0.00 C ATOM 1965 CD GLU A 113 -7.079 -8.758 -16.371 1.00 0.00 C ATOM 1966 OE1 GLU A 113 -7.454 -9.074 -15.255 1.00 0.00 O ATOM 1967 OE2 GLU A 113 -7.315 -7.679 -16.890 1.00 0.00 O ATOM 0 H GLU A 113 -3.406 -10.391 -14.404 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.225 -11.234 -15.124 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -4.570 -9.142 -15.983 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -4.189 -10.389 -17.154 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -6.063 -9.393 -18.171 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -6.828 -10.700 -17.289 1.00 0.00 H new ATOM 1974 N THR A 114 -5.456 -13.165 -16.707 1.00 0.00 N ATOM 1975 CA THR A 114 -5.026 -14.502 -17.219 1.00 0.00 C ATOM 1976 C THR A 114 -4.799 -14.443 -18.739 1.00 0.00 C ATOM 1977 O THR A 114 -5.495 -15.091 -19.499 1.00 0.00 O ATOM 1978 CB THR A 114 -6.183 -15.447 -16.881 1.00 0.00 C ATOM 1979 OG1 THR A 114 -7.415 -14.829 -17.226 1.00 0.00 O ATOM 1980 CG2 THR A 114 -6.168 -15.759 -15.383 1.00 0.00 C ATOM 0 H THR A 114 -6.359 -12.838 -17.051 1.00 0.00 H new ATOM 0 HA THR A 114 -4.088 -14.833 -16.774 1.00 0.00 H new ATOM 0 HB THR A 114 -6.072 -16.374 -17.444 1.00 0.00 H new ATOM 0 HG1 THR A 114 -8.156 -15.434 -17.012 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.992 -16.431 -15.143 1.00 0.00 H new ATOM 0 HG22 THR A 114 -5.223 -16.234 -15.120 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.279 -14.834 -14.818 1.00 0.00 H new ATOM 1988 N ASN A 115 -3.829 -13.674 -19.191 1.00 0.00 N ATOM 1989 CA ASN A 115 -3.567 -13.584 -20.659 1.00 0.00 C ATOM 1990 C ASN A 115 -2.055 -13.490 -20.922 1.00 0.00 C ATOM 1991 O ASN A 115 -1.489 -14.334 -21.591 1.00 0.00 O ATOM 1992 CB ASN A 115 -4.273 -12.305 -21.111 1.00 0.00 C ATOM 1993 CG ASN A 115 -4.938 -12.538 -22.473 1.00 0.00 C ATOM 1994 OD1 ASN A 115 -5.478 -13.599 -22.720 1.00 0.00 O ATOM 1995 ND2 ASN A 115 -4.922 -11.591 -23.379 1.00 0.00 N ATOM 0 H ASN A 115 -3.213 -13.110 -18.605 1.00 0.00 H new ATOM 0 HA ASN A 115 -3.929 -14.459 -21.198 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -5.022 -12.011 -20.375 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.556 -11.487 -21.180 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -5.361 -11.746 -24.286 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -4.470 -10.699 -23.177 1.00 0.00 H new ATOM 2002 N ASN A 116 -1.395 -12.473 -20.404 1.00 0.00 N ATOM 2003 CA ASN A 116 0.077 -12.340 -20.634 1.00 0.00 C ATOM 2004 C ASN A 116 0.745 -11.623 -19.448 1.00 0.00 C ATOM 2005 O ASN A 116 0.069 -11.109 -18.575 1.00 0.00 O ATOM 2006 CB ASN A 116 0.202 -11.499 -21.905 1.00 0.00 C ATOM 2007 CG ASN A 116 0.043 -12.401 -23.135 1.00 0.00 C ATOM 2008 OD1 ASN A 116 0.356 -13.574 -23.082 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -0.434 -11.906 -24.252 1.00 0.00 N ATOM 0 H ASN A 116 -1.814 -11.736 -19.836 1.00 0.00 H new ATOM 0 HA ASN A 116 0.566 -13.309 -20.732 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -0.559 -10.718 -21.913 1.00 0.00 H new ATOM 0 HB3 ASN A 116 1.171 -11.000 -21.930 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -0.541 -12.505 -25.071 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -0.698 -10.922 -24.302 1.00 0.00 H new ATOM 2016 N GLY A 117 2.061 -11.581 -19.407 1.00 0.00 N ATOM 2017 CA GLY A 117 2.753 -10.895 -18.276 1.00 0.00 C ATOM 2018 C GLY A 117 2.507 -9.383 -18.370 1.00 0.00 C ATOM 2019 O GLY A 117 3.279 -8.665 -18.979 1.00 0.00 O ATOM 0 H GLY A 117 2.678 -11.992 -20.108 1.00 0.00 H new ATOM 0 HA2 GLY A 117 2.383 -11.276 -17.324 1.00 0.00 H new ATOM 0 HA3 GLY A 117 3.822 -11.103 -18.309 1.00 0.00 H new ATOM 2023 N SER A 118 1.440 -8.888 -17.775 1.00 0.00 N ATOM 2024 CA SER A 118 1.157 -7.423 -17.842 1.00 0.00 C ATOM 2025 C SER A 118 1.049 -6.834 -16.426 1.00 0.00 C ATOM 2026 O SER A 118 0.022 -6.947 -15.784 1.00 0.00 O ATOM 2027 CB SER A 118 -0.181 -7.312 -18.571 1.00 0.00 C ATOM 2028 OG SER A 118 0.054 -7.207 -19.970 1.00 0.00 O ATOM 0 H SER A 118 0.760 -9.437 -17.250 1.00 0.00 H new ATOM 0 HA SER A 118 1.948 -6.874 -18.353 1.00 0.00 H new ATOM 0 HB2 SER A 118 -0.798 -8.185 -18.359 1.00 0.00 H new ATOM 0 HB3 SER A 118 -0.730 -6.440 -18.216 1.00 0.00 H new ATOM 0 HG SER A 118 -0.802 -7.137 -20.441 1.00 0.00 H new ATOM 2034 N THR A 119 2.096 -6.201 -15.934 1.00 0.00 N ATOM 2035 CA THR A 119 2.034 -5.607 -14.562 1.00 0.00 C ATOM 2036 C THR A 119 2.096 -4.077 -14.649 1.00 0.00 C ATOM 2037 O THR A 119 2.330 -3.525 -15.708 1.00 0.00 O ATOM 2038 CB THR A 119 3.267 -6.148 -13.831 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.517 -7.482 -14.252 1.00 0.00 O ATOM 2040 CG2 THR A 119 3.024 -6.127 -12.319 1.00 0.00 C ATOM 0 H THR A 119 2.982 -6.073 -16.423 1.00 0.00 H new ATOM 0 HA THR A 119 1.110 -5.865 -14.045 1.00 0.00 H new ATOM 0 HB THR A 119 4.128 -5.522 -14.065 1.00 0.00 H new ATOM 0 HG1 THR A 119 4.306 -7.829 -13.787 1.00 0.00 H new ATOM 0 HG21 THR A 119 3.904 -6.513 -11.804 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.833 -5.104 -11.995 1.00 0.00 H new ATOM 0 HG23 THR A 119 2.162 -6.750 -12.080 1.00 0.00 H new ATOM 2048 N CYS A 120 1.893 -3.380 -13.546 1.00 0.00 N ATOM 2049 CA CYS A 120 1.951 -1.874 -13.596 1.00 0.00 C ATOM 2050 C CYS A 120 3.326 -1.418 -14.120 1.00 0.00 C ATOM 2051 O CYS A 120 4.302 -2.137 -14.005 1.00 0.00 O ATOM 2052 CB CYS A 120 1.733 -1.372 -12.164 1.00 0.00 C ATOM 2053 SG CYS A 120 1.491 0.410 -12.201 1.00 0.00 S ATOM 0 H CYS A 120 1.693 -3.780 -12.629 1.00 0.00 H new ATOM 0 HA CYS A 120 1.190 -1.473 -14.266 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.865 -1.861 -11.721 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.592 -1.623 -11.542 1.00 0.00 H new ATOM 2058 N ILE A 121 3.412 -0.241 -14.706 1.00 0.00 N ATOM 2059 CA ILE A 121 4.739 0.231 -15.246 1.00 0.00 C ATOM 2060 C ILE A 121 5.676 0.681 -14.109 1.00 0.00 C ATOM 2061 O ILE A 121 6.878 0.513 -14.204 1.00 0.00 O ATOM 2062 CB ILE A 121 4.421 1.399 -16.215 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.669 1.741 -17.062 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.932 2.640 -15.445 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.774 2.412 -16.223 1.00 0.00 C ATOM 0 H ILE A 121 2.634 0.406 -14.834 1.00 0.00 H new ATOM 0 HA ILE A 121 5.262 -0.573 -15.763 1.00 0.00 H new ATOM 0 HB ILE A 121 3.619 1.083 -16.882 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.061 0.830 -17.514 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.382 2.404 -17.879 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.716 3.444 -16.149 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.027 2.391 -14.890 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.706 2.965 -14.750 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.630 2.634 -16.860 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.392 3.338 -15.793 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.082 1.740 -15.422 1.00 0.00 H new ATOM 2077 N CYS A 122 5.159 1.272 -13.049 1.00 0.00 N ATOM 2078 CA CYS A 122 6.078 1.746 -11.947 1.00 0.00 C ATOM 2079 C CYS A 122 6.979 0.600 -11.438 1.00 0.00 C ATOM 2080 O CYS A 122 8.122 0.831 -11.085 1.00 0.00 O ATOM 2081 CB CYS A 122 5.184 2.354 -10.835 1.00 0.00 C ATOM 2082 SG CYS A 122 4.393 1.073 -9.808 1.00 0.00 S ATOM 0 H CYS A 122 4.165 1.445 -12.898 1.00 0.00 H new ATOM 0 HA CYS A 122 6.768 2.508 -12.311 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.787 3.004 -10.201 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.415 2.978 -11.290 1.00 0.00 H new ATOM 2087 N ARG A 123 6.500 -0.629 -11.422 1.00 0.00 N ATOM 2088 CA ARG A 123 7.388 -1.760 -10.958 1.00 0.00 C ATOM 2089 C ARG A 123 8.636 -1.839 -11.856 1.00 0.00 C ATOM 2090 O ARG A 123 9.715 -2.156 -11.391 1.00 0.00 O ATOM 2091 CB ARG A 123 6.571 -3.055 -11.093 1.00 0.00 C ATOM 2092 CG ARG A 123 7.144 -4.130 -10.157 1.00 0.00 C ATOM 2093 CD ARG A 123 7.936 -5.165 -10.968 1.00 0.00 C ATOM 2094 NE ARG A 123 9.363 -4.963 -10.573 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.815 -5.367 -9.396 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.025 -5.949 -8.522 1.00 0.00 N ATOM 2097 NH2 ARG A 123 11.074 -5.185 -9.091 1.00 0.00 N ATOM 0 H ARG A 123 5.556 -0.896 -11.702 1.00 0.00 H new ATOM 0 HA ARG A 123 7.713 -1.607 -9.929 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.526 -2.864 -10.847 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.596 -3.406 -12.124 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.791 -3.667 -9.412 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.335 -4.621 -9.616 1.00 0.00 H new ATOM 0 HD2 ARG A 123 7.605 -6.179 -10.743 1.00 0.00 H new ATOM 0 HD3 ARG A 123 7.799 -5.015 -12.039 1.00 0.00 H new ATOM 0 HE ARG A 123 10.002 -4.505 -11.223 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.041 -6.098 -8.744 1.00 0.00 H new ATOM 0 HH12 ARG A 123 9.396 -6.252 -7.621 1.00 0.00 H new ATOM 0 HH21 ARG A 123 11.700 -4.734 -9.758 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.429 -5.494 -8.186 1.00 0.00 H new ATOM 2111 N VAL A 124 8.503 -1.550 -13.139 1.00 0.00 N ATOM 2112 CA VAL A 124 9.702 -1.612 -14.045 1.00 0.00 C ATOM 2113 C VAL A 124 10.546 -0.334 -13.885 1.00 0.00 C ATOM 2114 O VAL A 124 10.035 0.756 -14.050 1.00 0.00 O ATOM 2115 CB VAL A 124 9.158 -1.704 -15.483 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.326 -1.846 -16.462 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.237 -2.924 -15.607 1.00 0.00 C ATOM 0 H VAL A 124 7.629 -1.278 -13.589 1.00 0.00 H new ATOM 0 HA VAL A 124 10.336 -2.466 -13.806 1.00 0.00 H new ATOM 0 HB VAL A 124 8.595 -0.800 -15.716 1.00 0.00 H new ATOM 0 HG11 VAL A 124 9.942 -1.911 -17.480 1.00 0.00 H new ATOM 0 HG12 VAL A 124 10.980 -0.979 -16.376 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.889 -2.750 -16.228 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.853 -2.988 -16.625 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.798 -3.829 -15.374 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.404 -2.824 -14.911 1.00 0.00 H new ATOM 2127 N PRO A 125 11.818 -0.494 -13.577 1.00 0.00 N ATOM 2128 CA PRO A 125 12.710 0.687 -13.414 1.00 0.00 C ATOM 2129 C PRO A 125 12.874 1.439 -14.745 1.00 0.00 C ATOM 2130 O PRO A 125 12.363 1.015 -15.765 1.00 0.00 O ATOM 2131 CB PRO A 125 14.038 0.077 -12.959 1.00 0.00 C ATOM 2132 CG PRO A 125 13.991 -1.333 -13.446 1.00 0.00 C ATOM 2133 CD PRO A 125 12.549 -1.753 -13.357 1.00 0.00 C ATOM 0 HA PRO A 125 12.319 1.419 -12.708 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.887 0.614 -13.382 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.143 0.119 -11.875 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.356 -1.405 -14.471 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.624 -1.978 -12.836 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.300 -2.500 -14.110 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.316 -2.190 -12.386 1.00 0.00 H new ATOM 2141 N ARG A 126 13.579 2.554 -14.744 1.00 0.00 N ATOM 2142 CA ARG A 126 13.760 3.323 -16.029 1.00 0.00 C ATOM 2143 C ARG A 126 14.774 2.615 -16.941 1.00 0.00 C ATOM 2144 O ARG A 126 14.610 2.596 -18.147 1.00 0.00 O ATOM 2145 CB ARG A 126 14.279 4.718 -15.644 1.00 0.00 C ATOM 2146 CG ARG A 126 13.092 5.651 -15.391 1.00 0.00 C ATOM 2147 CD ARG A 126 12.630 6.261 -16.716 1.00 0.00 C ATOM 2148 NE ARG A 126 12.208 7.654 -16.374 1.00 0.00 N ATOM 2149 CZ ARG A 126 13.093 8.579 -16.037 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.378 8.311 -15.989 1.00 0.00 N ATOM 2151 NH2 ARG A 126 12.686 9.788 -15.746 1.00 0.00 N ATOM 0 H ARG A 126 14.030 2.960 -13.924 1.00 0.00 H new ATOM 0 HA ARG A 126 12.819 3.391 -16.575 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.901 4.653 -14.751 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.906 5.117 -16.441 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.274 5.099 -14.928 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.378 6.440 -14.695 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.434 6.262 -17.452 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.805 5.693 -17.146 1.00 0.00 H new ATOM 0 HE ARG A 126 11.218 7.897 -16.401 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.712 7.374 -16.214 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.042 9.040 -15.727 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.692 10.013 -15.780 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.363 10.505 -15.486 1.00 0.00 H new ATOM 2165 N ALA A 127 15.822 2.029 -16.388 1.00 0.00 N ATOM 2166 CA ALA A 127 16.831 1.326 -17.265 1.00 0.00 C ATOM 2167 C ALA A 127 16.134 0.242 -18.099 1.00 0.00 C ATOM 2168 O ALA A 127 16.419 0.084 -19.272 1.00 0.00 O ATOM 2169 CB ALA A 127 17.870 0.688 -16.328 1.00 0.00 C ATOM 0 H ALA A 127 16.020 2.006 -15.388 1.00 0.00 H new ATOM 0 HA ALA A 127 17.306 2.024 -17.954 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.622 0.167 -16.920 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.350 1.466 -15.734 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.375 -0.021 -15.665 1.00 0.00 H new ATOM 2175 N GLN A 128 15.208 -0.492 -17.515 1.00 0.00 N ATOM 2176 CA GLN A 128 14.490 -1.547 -18.313 1.00 0.00 C ATOM 2177 C GLN A 128 13.565 -0.862 -19.329 1.00 0.00 C ATOM 2178 O GLN A 128 13.486 -1.273 -20.472 1.00 0.00 O ATOM 2179 CB GLN A 128 13.670 -2.382 -17.315 1.00 0.00 C ATOM 2180 CG GLN A 128 13.382 -3.759 -17.917 1.00 0.00 C ATOM 2181 CD GLN A 128 14.490 -4.739 -17.509 1.00 0.00 C ATOM 2182 OE1 GLN A 128 14.831 -4.829 -16.346 1.00 0.00 O ATOM 2183 NE2 GLN A 128 15.071 -5.484 -18.417 1.00 0.00 N ATOM 0 H GLN A 128 14.922 -0.409 -16.539 1.00 0.00 H new ATOM 0 HA GLN A 128 15.185 -2.185 -18.859 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.218 -2.490 -16.379 1.00 0.00 H new ATOM 0 HB3 GLN A 128 12.735 -1.873 -17.081 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.415 -4.123 -17.572 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.327 -3.688 -19.003 1.00 0.00 H new ATOM 0 HE21 GLN A 128 14.787 -5.411 -19.394 1.00 0.00 H new ATOM 0 HE22 GLN A 128 15.807 -6.137 -18.147 1.00 0.00 H new ATOM 2192 N LEU A 129 12.877 0.191 -18.930 1.00 0.00 N ATOM 2193 CA LEU A 129 11.975 0.902 -19.904 1.00 0.00 C ATOM 2194 C LEU A 129 12.824 1.530 -21.021 1.00 0.00 C ATOM 2195 O LEU A 129 12.441 1.511 -22.175 1.00 0.00 O ATOM 2196 CB LEU A 129 11.240 1.996 -19.115 1.00 0.00 C ATOM 2197 CG LEU A 129 10.024 1.390 -18.407 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.850 2.046 -17.036 1.00 0.00 C ATOM 2199 CD2 LEU A 129 8.769 1.631 -19.249 1.00 0.00 C ATOM 0 H LEU A 129 12.900 0.583 -17.989 1.00 0.00 H new ATOM 0 HA LEU A 129 11.263 0.216 -20.363 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.912 2.445 -18.384 1.00 0.00 H new ATOM 0 HB3 LEU A 129 10.922 2.792 -19.788 1.00 0.00 H new ATOM 0 HG LEU A 129 10.177 0.318 -18.280 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.985 1.614 -16.533 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.743 1.874 -16.434 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.699 3.118 -17.162 1.00 0.00 H new ATOM 0 HD21 LEU A 129 7.904 1.200 -18.745 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.617 2.703 -19.377 1.00 0.00 H new ATOM 0 HD23 LEU A 129 8.891 1.162 -20.226 1.00 0.00 H new ATOM 2211 N GLU A 130 13.979 2.084 -20.693 1.00 0.00 N ATOM 2212 CA GLU A 130 14.838 2.701 -21.768 1.00 0.00 C ATOM 2213 C GLU A 130 15.221 1.636 -22.807 1.00 0.00 C ATOM 2214 O GLU A 130 15.239 1.906 -23.993 1.00 0.00 O ATOM 2215 CB GLU A 130 16.101 3.241 -21.075 1.00 0.00 C ATOM 2216 CG GLU A 130 15.805 4.614 -20.470 1.00 0.00 C ATOM 2217 CD GLU A 130 17.049 5.134 -19.749 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.469 4.495 -18.799 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.560 6.164 -20.158 1.00 0.00 O ATOM 0 H GLU A 130 14.357 2.135 -19.747 1.00 0.00 H new ATOM 0 HA GLU A 130 14.306 3.499 -22.285 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.424 2.551 -20.296 1.00 0.00 H new ATOM 0 HB3 GLU A 130 16.918 3.317 -21.793 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.508 5.311 -21.253 1.00 0.00 H new ATOM 0 HG3 GLU A 130 14.971 4.543 -19.772 1.00 0.00 H new ATOM 2226 N GLU A 131 15.521 0.423 -22.377 1.00 0.00 N ATOM 2227 CA GLU A 131 15.896 -0.647 -23.374 1.00 0.00 C ATOM 2228 C GLU A 131 14.753 -0.862 -24.381 1.00 0.00 C ATOM 2229 O GLU A 131 14.994 -1.093 -25.551 1.00 0.00 O ATOM 2230 CB GLU A 131 16.141 -1.936 -22.572 1.00 0.00 C ATOM 2231 CG GLU A 131 17.043 -2.874 -23.376 1.00 0.00 C ATOM 2232 CD GLU A 131 17.673 -3.906 -22.438 1.00 0.00 C ATOM 2233 OE1 GLU A 131 18.379 -3.498 -21.529 1.00 0.00 O ATOM 2234 OE2 GLU A 131 17.438 -5.085 -22.643 1.00 0.00 O ATOM 0 H GLU A 131 15.523 0.131 -21.400 1.00 0.00 H new ATOM 0 HA GLU A 131 16.784 -0.360 -23.937 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.606 -1.699 -21.615 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.192 -2.426 -22.352 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.464 -3.377 -24.151 1.00 0.00 H new ATOM 0 HG3 GLU A 131 17.822 -2.302 -23.881 1.00 0.00 H new ATOM 2241 N GLU A 132 13.512 -0.787 -23.942 1.00 0.00 N ATOM 2242 CA GLU A 132 12.367 -0.991 -24.903 1.00 0.00 C ATOM 2243 C GLU A 132 12.427 0.061 -26.021 1.00 0.00 C ATOM 2244 O GLU A 132 12.239 -0.257 -27.181 1.00 0.00 O ATOM 2245 CB GLU A 132 11.070 -0.826 -24.093 1.00 0.00 C ATOM 2246 CG GLU A 132 10.669 -2.174 -23.491 1.00 0.00 C ATOM 2247 CD GLU A 132 9.831 -2.957 -24.504 1.00 0.00 C ATOM 2248 OE1 GLU A 132 10.418 -3.618 -25.344 1.00 0.00 O ATOM 2249 OE2 GLU A 132 8.616 -2.881 -24.421 1.00 0.00 O ATOM 0 H GLU A 132 13.244 -0.597 -22.977 1.00 0.00 H new ATOM 0 HA GLU A 132 12.415 -1.976 -25.366 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.214 -0.091 -23.301 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.273 -0.451 -24.735 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.559 -2.743 -23.222 1.00 0.00 H new ATOM 0 HG3 GLU A 132 10.100 -2.020 -22.574 1.00 0.00 H new ATOM 2256 N ALA A 133 12.690 1.311 -25.688 1.00 0.00 N ATOM 2257 CA ALA A 133 12.758 2.366 -26.766 1.00 0.00 C ATOM 2258 C ALA A 133 13.862 2.013 -27.779 1.00 0.00 C ATOM 2259 O ALA A 133 13.693 2.203 -28.969 1.00 0.00 O ATOM 2260 CB ALA A 133 13.083 3.701 -26.071 1.00 0.00 C ATOM 0 H ALA A 133 12.857 1.643 -24.738 1.00 0.00 H new ATOM 0 HA ALA A 133 11.814 2.431 -27.308 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.142 4.494 -26.816 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.299 3.937 -25.351 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.038 3.618 -25.553 1.00 0.00 H new ATOM 2266 N ARG A 134 14.989 1.497 -27.323 1.00 0.00 N ATOM 2267 CA ARG A 134 16.087 1.137 -28.292 1.00 0.00 C ATOM 2268 C ARG A 134 15.636 -0.036 -29.179 1.00 0.00 C ATOM 2269 O ARG A 134 15.901 -0.051 -30.367 1.00 0.00 O ATOM 2270 CB ARG A 134 17.305 0.724 -27.450 1.00 0.00 C ATOM 2271 CG ARG A 134 18.057 1.976 -26.990 1.00 0.00 C ATOM 2272 CD ARG A 134 19.443 1.579 -26.479 1.00 0.00 C ATOM 2273 NE ARG A 134 19.718 2.514 -25.345 1.00 0.00 N ATOM 2274 CZ ARG A 134 19.998 3.791 -25.558 1.00 0.00 C ATOM 2275 NH1 ARG A 134 20.046 4.288 -26.773 1.00 0.00 N ATOM 2276 NH2 ARG A 134 20.234 4.579 -24.541 1.00 0.00 N ATOM 0 H ARG A 134 15.194 1.312 -26.341 1.00 0.00 H new ATOM 0 HA ARG A 134 16.330 1.977 -28.943 1.00 0.00 H new ATOM 0 HB2 ARG A 134 16.983 0.143 -26.586 1.00 0.00 H new ATOM 0 HB3 ARG A 134 17.966 0.085 -28.036 1.00 0.00 H new ATOM 0 HG2 ARG A 134 18.150 2.681 -27.816 1.00 0.00 H new ATOM 0 HG3 ARG A 134 17.498 2.480 -26.202 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.459 0.541 -26.148 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.195 1.676 -27.262 1.00 0.00 H new ATOM 0 HE ARG A 134 19.689 2.161 -24.388 1.00 0.00 H new ATOM 0 HH11 ARG A 134 19.866 3.687 -27.577 1.00 0.00 H new ATOM 0 HH12 ARG A 134 20.264 5.275 -26.912 1.00 0.00 H new ATOM 0 HH21 ARG A 134 20.202 4.209 -23.591 1.00 0.00 H new ATOM 0 HH22 ARG A 134 20.450 5.563 -24.698 1.00 0.00 H new ATOM 2290 N LYS A 135 14.954 -1.017 -28.618 1.00 0.00 N ATOM 2291 CA LYS A 135 14.491 -2.179 -29.460 1.00 0.00 C ATOM 2292 C LYS A 135 13.394 -1.726 -30.440 1.00 0.00 C ATOM 2293 O LYS A 135 13.333 -2.197 -31.560 1.00 0.00 O ATOM 2294 CB LYS A 135 13.932 -3.233 -28.491 1.00 0.00 C ATOM 2295 CG LYS A 135 15.080 -3.849 -27.687 1.00 0.00 C ATOM 2296 CD LYS A 135 15.860 -4.821 -28.574 1.00 0.00 C ATOM 2297 CE LYS A 135 17.030 -5.408 -27.782 1.00 0.00 C ATOM 2298 NZ LYS A 135 16.429 -6.491 -26.954 1.00 0.00 N ATOM 0 H LYS A 135 14.701 -1.064 -27.631 1.00 0.00 H new ATOM 0 HA LYS A 135 15.313 -2.584 -30.050 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.207 -2.775 -27.818 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.405 -4.009 -29.046 1.00 0.00 H new ATOM 0 HG2 LYS A 135 15.742 -3.065 -27.319 1.00 0.00 H new ATOM 0 HG3 LYS A 135 14.688 -4.371 -26.814 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.204 -5.620 -28.920 1.00 0.00 H new ATOM 0 HD3 LYS A 135 16.229 -4.305 -29.460 1.00 0.00 H new ATOM 0 HE2 LYS A 135 17.800 -5.800 -28.447 1.00 0.00 H new ATOM 0 HE3 LYS A 135 17.504 -4.650 -27.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 16.769 -6.409 -25.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 15.393 -6.405 -26.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 16.705 -7.417 -27.340 1.00 0.00 H new ATOM 2312 N LYS A 136 12.529 -0.814 -30.037 1.00 0.00 N ATOM 2313 CA LYS A 136 11.446 -0.345 -30.973 1.00 0.00 C ATOM 2314 C LYS A 136 11.944 0.794 -31.886 1.00 0.00 C ATOM 2315 O LYS A 136 11.374 1.030 -32.935 1.00 0.00 O ATOM 2316 CB LYS A 136 10.295 0.150 -30.085 1.00 0.00 C ATOM 2317 CG LYS A 136 8.959 -0.106 -30.789 1.00 0.00 C ATOM 2318 CD LYS A 136 8.365 -1.427 -30.293 1.00 0.00 C ATOM 2319 CE LYS A 136 7.863 -1.255 -28.858 1.00 0.00 C ATOM 2320 NZ LYS A 136 7.093 -2.496 -28.568 1.00 0.00 N ATOM 0 H LYS A 136 12.526 -0.380 -29.114 1.00 0.00 H new ATOM 0 HA LYS A 136 11.130 -1.155 -31.630 1.00 0.00 H new ATOM 0 HB2 LYS A 136 10.316 -0.364 -29.124 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.412 1.214 -29.880 1.00 0.00 H new ATOM 0 HG2 LYS A 136 8.268 0.713 -30.590 1.00 0.00 H new ATOM 0 HG3 LYS A 136 9.106 -0.144 -31.868 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.545 -1.735 -30.942 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.118 -2.214 -30.334 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.693 -1.133 -28.162 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.235 -0.369 -28.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 6.716 -2.452 -27.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 6.306 -2.582 -29.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.718 -3.322 -28.659 1.00 0.00 H new ATOM 2334 N GLY A 137 12.989 1.507 -31.510 1.00 0.00 N ATOM 2335 CA GLY A 137 13.487 2.619 -32.373 1.00 0.00 C ATOM 2336 C GLY A 137 12.816 3.944 -31.967 1.00 0.00 C ATOM 2337 O GLY A 137 12.608 4.809 -32.796 1.00 0.00 O ATOM 0 H GLY A 137 13.511 1.362 -30.646 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.569 2.706 -32.279 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.275 2.401 -33.420 1.00 0.00 H new ATOM 2341 N THR A 138 12.479 4.120 -30.702 1.00 0.00 N ATOM 2342 CA THR A 138 11.832 5.396 -30.268 1.00 0.00 C ATOM 2343 C THR A 138 12.384 5.821 -28.895 1.00 0.00 C ATOM 2344 O THR A 138 13.432 5.359 -28.484 1.00 0.00 O ATOM 2345 CB THR A 138 10.333 5.074 -30.187 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.627 6.237 -29.777 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.082 3.944 -29.182 1.00 0.00 C ATOM 0 H THR A 138 12.626 3.435 -29.961 1.00 0.00 H new ATOM 0 HA THR A 138 12.026 6.221 -30.954 1.00 0.00 H new ATOM 0 HB THR A 138 9.985 4.753 -31.169 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.669 6.037 -29.725 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.015 3.728 -29.137 1.00 0.00 H new ATOM 0 HG22 THR A 138 10.620 3.050 -29.498 1.00 0.00 H new ATOM 0 HG23 THR A 138 10.433 4.249 -28.196 1.00 0.00 H new ATOM 2355 N GLN A 139 11.698 6.693 -28.183 1.00 0.00 N ATOM 2356 CA GLN A 139 12.203 7.128 -26.847 1.00 0.00 C ATOM 2357 C GLN A 139 11.149 6.850 -25.763 1.00 0.00 C ATOM 2358 O GLN A 139 10.026 6.489 -26.067 1.00 0.00 O ATOM 2359 CB GLN A 139 12.447 8.631 -26.985 1.00 0.00 C ATOM 2360 CG GLN A 139 13.883 8.874 -27.457 1.00 0.00 C ATOM 2361 CD GLN A 139 14.416 10.167 -26.830 1.00 0.00 C ATOM 2362 OE1 GLN A 139 14.201 10.417 -25.660 1.00 0.00 O ATOM 2363 NE2 GLN A 139 15.109 11.011 -27.558 1.00 0.00 N ATOM 0 H GLN A 139 10.816 7.116 -28.473 1.00 0.00 H new ATOM 0 HA GLN A 139 13.107 6.594 -26.554 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.742 9.061 -27.696 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.278 9.127 -26.029 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.517 8.033 -27.176 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.912 8.946 -28.544 1.00 0.00 H new ATOM 0 HE21 GLN A 139 15.292 10.806 -28.540 1.00 0.00 H new ATOM 0 HE22 GLN A 139 15.464 11.872 -27.141 1.00 0.00 H new ATOM 2372 N VAL A 140 11.495 7.016 -24.502 1.00 0.00 N ATOM 2373 CA VAL A 140 10.499 6.761 -23.413 1.00 0.00 C ATOM 2374 C VAL A 140 10.857 7.564 -22.149 1.00 0.00 C ATOM 2375 O VAL A 140 11.984 7.995 -21.987 1.00 0.00 O ATOM 2376 CB VAL A 140 10.574 5.252 -23.139 1.00 0.00 C ATOM 2377 CG1 VAL A 140 11.985 4.867 -22.674 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.560 4.887 -22.050 1.00 0.00 C ATOM 0 H VAL A 140 12.418 7.315 -24.186 1.00 0.00 H new ATOM 0 HA VAL A 140 9.494 7.070 -23.702 1.00 0.00 H new ATOM 0 HB VAL A 140 10.345 4.710 -24.056 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.025 3.795 -22.483 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.707 5.125 -23.449 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.227 5.408 -21.759 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.609 3.816 -21.851 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.792 5.436 -21.138 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.556 5.148 -22.385 1.00 0.00 H new ATOM 2388 N SER A 141 9.910 7.770 -21.255 1.00 0.00 N ATOM 2389 CA SER A 141 10.216 8.548 -20.011 1.00 0.00 C ATOM 2390 C SER A 141 9.072 8.428 -18.987 1.00 0.00 C ATOM 2391 O SER A 141 8.159 9.234 -18.977 1.00 0.00 O ATOM 2392 CB SER A 141 10.360 9.989 -20.488 1.00 0.00 C ATOM 2393 OG SER A 141 10.618 10.832 -19.372 1.00 0.00 O ATOM 0 H SER A 141 8.950 7.436 -21.335 1.00 0.00 H new ATOM 0 HA SER A 141 11.112 8.182 -19.509 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.172 10.065 -21.211 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.450 10.308 -20.996 1.00 0.00 H new ATOM 0 HG SER A 141 10.712 11.759 -19.677 1.00 0.00 H new ATOM 2399 N PHE A 142 9.115 7.434 -18.124 1.00 0.00 N ATOM 2400 CA PHE A 142 8.025 7.278 -17.106 1.00 0.00 C ATOM 2401 C PHE A 142 8.444 7.936 -15.774 1.00 0.00 C ATOM 2402 O PHE A 142 9.616 8.129 -15.508 1.00 0.00 O ATOM 2403 CB PHE A 142 7.836 5.754 -16.945 1.00 0.00 C ATOM 2404 CG PHE A 142 7.000 5.440 -15.716 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.613 5.645 -15.718 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.628 4.955 -14.566 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.863 5.358 -14.567 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.884 4.676 -13.428 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.504 4.872 -13.419 1.00 0.00 C ATOM 0 H PHE A 142 9.852 6.731 -18.082 1.00 0.00 H new ATOM 0 HA PHE A 142 7.097 7.762 -17.411 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.352 5.347 -17.833 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.809 5.269 -16.862 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.123 6.023 -16.603 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.696 4.797 -14.563 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.794 5.511 -14.566 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.378 4.304 -12.543 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.931 4.650 -12.531 1.00 0.00 H new ATOM 2419 N HIS A 143 7.486 8.264 -14.934 1.00 0.00 N ATOM 2420 CA HIS A 143 7.806 8.888 -13.616 1.00 0.00 C ATOM 2421 C HIS A 143 6.942 8.234 -12.528 1.00 0.00 C ATOM 2422 O HIS A 143 7.449 7.616 -11.611 1.00 0.00 O ATOM 2423 CB HIS A 143 7.448 10.366 -13.775 1.00 0.00 C ATOM 2424 CG HIS A 143 8.646 11.121 -14.284 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.737 11.565 -15.594 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.808 11.519 -13.672 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.916 12.199 -15.725 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.608 12.200 -14.584 1.00 0.00 N ATOM 0 H HIS A 143 6.491 8.123 -15.111 1.00 0.00 H new ATOM 0 HA HIS A 143 8.850 8.761 -13.329 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.614 10.477 -14.468 1.00 0.00 H new ATOM 0 HB3 HIS A 143 7.125 10.778 -12.819 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.063 11.332 -12.639 1.00 0.00 H new ATOM 0 HE1 HIS A 143 10.261 12.652 -16.643 1.00 0.00 H new ATOM 0 HE2 HIS A 143 11.526 12.612 -14.417 1.00 0.00 H new ATOM 2436 N GLN A 144 5.637 8.350 -12.640 1.00 0.00 N ATOM 2437 CA GLN A 144 4.730 7.721 -11.635 1.00 0.00 C ATOM 2438 C GLN A 144 3.574 7.029 -12.370 1.00 0.00 C ATOM 2439 O GLN A 144 3.199 7.440 -13.452 1.00 0.00 O ATOM 2440 CB GLN A 144 4.217 8.879 -10.764 1.00 0.00 C ATOM 2441 CG GLN A 144 3.485 9.913 -11.629 1.00 0.00 C ATOM 2442 CD GLN A 144 2.884 10.999 -10.728 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.765 10.870 -10.273 1.00 0.00 O ATOM 2444 NE2 GLN A 144 3.581 12.074 -10.446 1.00 0.00 N ATOM 0 H GLN A 144 5.164 8.856 -13.389 1.00 0.00 H new ATOM 0 HA GLN A 144 5.229 6.968 -11.026 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.545 8.495 -9.997 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.052 9.353 -10.248 1.00 0.00 H new ATOM 0 HG2 GLN A 144 4.176 10.360 -12.344 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.698 9.428 -12.207 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.521 12.187 -10.826 1.00 0.00 H new ATOM 0 HE22 GLN A 144 3.183 12.797 -9.847 1.00 0.00 H new ATOM 2453 N CYS A 145 3.008 5.981 -11.807 1.00 0.00 N ATOM 2454 CA CYS A 145 1.878 5.287 -12.519 1.00 0.00 C ATOM 2455 C CYS A 145 0.524 5.891 -12.122 1.00 0.00 C ATOM 2456 O CYS A 145 0.373 6.438 -11.046 1.00 0.00 O ATOM 2457 CB CYS A 145 1.953 3.790 -12.164 1.00 0.00 C ATOM 2458 SG CYS A 145 1.642 3.497 -10.394 1.00 0.00 S ATOM 0 H CYS A 145 3.272 5.583 -10.906 1.00 0.00 H new ATOM 0 HA CYS A 145 1.971 5.418 -13.597 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.223 3.239 -12.757 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.937 3.403 -12.429 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.462 5.805 -12.995 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.809 6.393 -12.661 1.00 0.00 C ATOM 2465 C VAL A 146 -2.532 5.569 -11.578 1.00 0.00 C ATOM 2466 O VAL A 146 -3.351 6.104 -10.853 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.631 6.413 -13.968 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -1.876 7.216 -15.028 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -2.860 4.985 -14.485 1.00 0.00 C ATOM 0 H VAL A 146 -0.395 5.360 -13.910 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.690 7.399 -12.258 1.00 0.00 H new ATOM 0 HB VAL A 146 -3.598 6.873 -13.766 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -2.454 7.232 -15.952 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.728 8.236 -14.675 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -0.907 6.753 -15.214 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -3.441 5.020 -15.407 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -1.898 4.510 -14.680 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.403 4.409 -13.736 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.254 4.280 -11.453 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.960 3.459 -10.395 1.00 0.00 C ATOM 2481 C HIS A 147 -2.843 4.145 -9.020 1.00 0.00 C ATOM 2482 O HIS A 147 -3.839 4.503 -8.419 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.264 2.082 -10.354 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.412 1.357 -11.678 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.306 1.755 -12.671 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.776 0.244 -12.180 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.176 0.896 -13.699 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.260 -0.041 -13.453 1.00 0.00 N ATOM 0 H HIS A 147 -1.582 3.769 -12.026 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.020 3.357 -10.630 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.207 2.212 -10.123 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.693 1.478 -9.555 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.016 -0.323 -11.663 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.746 0.958 -14.614 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.975 -0.804 -14.067 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.639 4.338 -8.522 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.473 5.001 -7.195 1.00 0.00 C ATOM 2498 C CYS A 148 -0.533 6.221 -7.304 1.00 0.00 C ATOM 2499 O CYS A 148 -0.151 6.616 -8.389 1.00 0.00 O ATOM 2500 CB CYS A 148 -0.871 3.912 -6.291 1.00 0.00 C ATOM 2501 SG CYS A 148 0.824 3.494 -6.815 1.00 0.00 S ATOM 0 H CYS A 148 -0.770 4.064 -8.980 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.414 5.384 -6.801 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -0.862 4.257 -5.257 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.496 3.020 -6.324 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.143 6.800 -6.187 1.00 0.00 N ATOM 2507 CA GLY A 149 0.788 7.966 -6.232 1.00 0.00 C ATOM 2508 C GLY A 149 2.220 7.448 -6.028 1.00 0.00 C ATOM 2509 O GLY A 149 2.895 7.829 -5.091 1.00 0.00 O ATOM 0 H GLY A 149 -0.432 6.512 -5.252 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.704 8.483 -7.188 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.531 8.687 -5.456 1.00 0.00 H new ATOM 2513 N CYS A 150 2.683 6.569 -6.895 1.00 0.00 N ATOM 2514 CA CYS A 150 4.068 6.015 -6.742 1.00 0.00 C ATOM 2515 C CYS A 150 5.024 6.726 -7.711 1.00 0.00 C ATOM 2516 O CYS A 150 4.672 6.989 -8.843 1.00 0.00 O ATOM 2517 CB CYS A 150 3.921 4.518 -7.083 1.00 0.00 C ATOM 2518 SG CYS A 150 5.531 3.693 -7.210 1.00 0.00 S ATOM 0 H CYS A 150 2.162 6.215 -7.697 1.00 0.00 H new ATOM 0 HA CYS A 150 4.483 6.159 -5.744 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.321 4.028 -6.316 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.383 4.411 -8.025 1.00 0.00 H new ATOM 2523 N ARG A 151 6.235 7.022 -7.285 1.00 0.00 N ATOM 2524 CA ARG A 151 7.203 7.702 -8.207 1.00 0.00 C ATOM 2525 C ARG A 151 8.105 6.651 -8.872 1.00 0.00 C ATOM 2526 O ARG A 151 9.318 6.748 -8.825 1.00 0.00 O ATOM 2527 CB ARG A 151 8.033 8.651 -7.331 1.00 0.00 C ATOM 2528 CG ARG A 151 8.453 9.870 -8.155 1.00 0.00 C ATOM 2529 CD ARG A 151 9.738 9.551 -8.921 1.00 0.00 C ATOM 2530 NE ARG A 151 10.484 10.846 -8.980 1.00 0.00 N ATOM 2531 CZ ARG A 151 11.052 11.363 -7.902 1.00 0.00 C ATOM 2532 NH1 ARG A 151 10.987 10.758 -6.737 1.00 0.00 N ATOM 2533 NH2 ARG A 151 11.695 12.499 -7.991 1.00 0.00 N ATOM 0 H ARG A 151 6.590 6.824 -6.349 1.00 0.00 H new ATOM 0 HA ARG A 151 6.694 8.250 -9.000 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.451 8.967 -6.466 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.914 8.135 -6.951 1.00 0.00 H new ATOM 0 HG2 ARG A 151 7.660 10.142 -8.852 1.00 0.00 H new ATOM 0 HG3 ARG A 151 8.611 10.728 -7.501 1.00 0.00 H new ATOM 0 HD2 ARG A 151 10.320 8.783 -8.412 1.00 0.00 H new ATOM 0 HD3 ARG A 151 9.519 9.176 -9.921 1.00 0.00 H new ATOM 0 HE ARG A 151 10.557 11.341 -9.869 1.00 0.00 H new ATOM 0 HH11 ARG A 151 10.491 9.871 -6.650 1.00 0.00 H new ATOM 0 HH12 ARG A 151 11.433 11.176 -5.920 1.00 0.00 H new ATOM 0 HH21 ARG A 151 11.757 12.981 -8.888 1.00 0.00 H new ATOM 0 HH22 ARG A 151 12.135 12.902 -7.164 1.00 0.00 H new ATOM 2547 N GLY A 152 7.524 5.643 -9.491 1.00 0.00 N ATOM 2548 CA GLY A 152 8.341 4.593 -10.153 1.00 0.00 C ATOM 2549 C GLY A 152 9.113 3.791 -9.096 1.00 0.00 C ATOM 2550 O GLY A 152 10.157 4.212 -8.635 1.00 0.00 O ATOM 0 H GLY A 152 6.515 5.511 -9.561 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.698 3.928 -10.729 1.00 0.00 H new ATOM 0 HA3 GLY A 152 9.037 5.050 -10.856 1.00 0.00 H new ATOM 2554 N CYS A 153 8.612 2.633 -8.712 1.00 0.00 N ATOM 2555 CA CYS A 153 9.331 1.810 -7.689 1.00 0.00 C ATOM 2556 C CYS A 153 9.952 0.560 -8.343 1.00 0.00 C ATOM 2557 O CYS A 153 9.282 -0.185 -9.033 1.00 0.00 O ATOM 2558 CB CYS A 153 8.277 1.441 -6.622 1.00 0.00 C ATOM 2559 SG CYS A 153 7.015 0.310 -7.283 1.00 0.00 S ATOM 0 H CYS A 153 7.743 2.229 -9.062 1.00 0.00 H new ATOM 0 HA CYS A 153 10.159 2.355 -7.235 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.771 0.976 -5.769 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.796 2.349 -6.257 1.00 0.00 H new ATOM 2564 N ALA A 154 11.233 0.331 -8.139 1.00 0.00 N ATOM 2565 CA ALA A 154 11.892 -0.861 -8.753 1.00 0.00 C ATOM 2566 C ALA A 154 12.932 -1.441 -7.784 1.00 0.00 C ATOM 2567 O ALA A 154 13.542 -0.713 -7.022 1.00 0.00 O ATOM 2568 CB ALA A 154 12.570 -0.332 -10.014 1.00 0.00 C ATOM 0 H ALA A 154 11.845 0.920 -7.574 1.00 0.00 H new ATOM 0 HA ALA A 154 11.184 -1.659 -8.978 1.00 0.00 H new ATOM 0 HB1 ALA A 154 13.078 -1.150 -10.524 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.820 0.099 -10.677 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.297 0.434 -9.742 1.00 0.00 H new ATOM 2574 N SER A 155 13.140 -2.741 -7.799 1.00 0.00 N ATOM 2575 CA SER A 155 14.142 -3.346 -6.864 1.00 0.00 C ATOM 2576 C SER A 155 15.414 -3.757 -7.625 1.00 0.00 C ATOM 2577 O SER A 155 16.513 -3.433 -7.214 1.00 0.00 O ATOM 2578 CB SER A 155 13.455 -4.573 -6.264 1.00 0.00 C ATOM 2579 OG SER A 155 12.053 -4.345 -6.206 1.00 0.00 O ATOM 0 H SER A 155 12.663 -3.401 -8.413 1.00 0.00 H new ATOM 0 HA SER A 155 14.451 -2.640 -6.093 1.00 0.00 H new ATOM 0 HB2 SER A 155 13.667 -5.455 -6.869 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.845 -4.770 -5.265 1.00 0.00 H new ATOM 0 HG SER A 155 11.609 -5.131 -5.823 1.00 0.00 H new ATOM 2585 N THR A 156 15.283 -4.471 -8.729 1.00 0.00 N ATOM 2586 CA THR A 156 16.515 -4.895 -9.497 1.00 0.00 C ATOM 2587 C THR A 156 17.386 -3.675 -9.840 1.00 0.00 C ATOM 2588 O THR A 156 18.601 -3.747 -9.794 1.00 0.00 O ATOM 2589 CB THR A 156 16.021 -5.567 -10.790 1.00 0.00 C ATOM 2590 OG1 THR A 156 14.943 -6.441 -10.485 1.00 0.00 O ATOM 2591 CG2 THR A 156 17.164 -6.365 -11.419 1.00 0.00 C ATOM 0 H THR A 156 14.394 -4.775 -9.127 1.00 0.00 H new ATOM 0 HA THR A 156 17.124 -5.576 -8.903 1.00 0.00 H new ATOM 0 HB THR A 156 15.683 -4.804 -11.491 1.00 0.00 H new ATOM 0 HG1 THR A 156 14.626 -6.869 -11.308 1.00 0.00 H new ATOM 0 HG21 THR A 156 16.814 -6.841 -12.335 1.00 0.00 H new ATOM 0 HG22 THR A 156 17.991 -5.694 -11.652 1.00 0.00 H new ATOM 0 HG23 THR A 156 17.502 -7.129 -10.719 1.00 0.00 H new ATOM 2599 N ASP A 157 16.782 -2.556 -10.180 1.00 0.00 N ATOM 2600 CA ASP A 157 17.585 -1.343 -10.520 1.00 0.00 C ATOM 2601 C ASP A 157 17.212 -0.185 -9.590 1.00 0.00 C ATOM 2602 O ASP A 157 16.034 0.115 -9.493 1.00 0.00 O ATOM 2603 CB ASP A 157 17.212 -1.012 -11.965 1.00 0.00 C ATOM 2604 CG ASP A 157 17.743 -2.105 -12.894 1.00 0.00 C ATOM 2605 OD1 ASP A 157 17.207 -3.200 -12.855 1.00 0.00 O ATOM 2606 OD2 ASP A 157 18.678 -1.829 -13.628 1.00 0.00 O ATOM 2607 OXT ASP A 157 18.112 0.381 -8.992 1.00 0.00 O ATOM 0 H ASP A 157 15.771 -2.435 -10.235 1.00 0.00 H new ATOM 0 HA ASP A 157 18.656 -1.511 -10.405 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.129 -0.932 -12.063 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.630 -0.046 -12.247 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 1.306 1.265 -6.548 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 5.061 1.475 -7.629 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 2.118 1.246 -10.162 1.00 0.00 ZN