USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=34 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 115 ASN : amide:sc= 0.13 X(o=0.26,f=0) USER MOD Set 1.2: A 116 ASN : amide:sc= 0.127 X(o=0.26,f=0) USER MOD Set 2.1: A 56 HIS : no HE2:sc= -2.09! C(o=-2.1!,f=-3.6!) USER MOD Set 2.2: A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 62 TYR OH : rot 180:sc= -1.94! USER MOD Single : A 1 SER OG : rot 180:sc= -1.62! USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 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+ -162:sc= -1.13 (180deg=-1.21) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.0421) USER MOD Single : A 24 THR OG1 : rot 180:sc= -1.08 USER MOD Single : A 29 GLN : amide:sc=-0.00472 K(o=-0.0047,f=-1.9!) USER MOD Single : A 34 GLN : amide:sc= -0.0901 K(o=-0.09,f=-0.91) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0.0234 USER MOD Single : A 39 SER OG : rot 36:sc= 0.457 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= -0.0306 USER MOD Single : A 46 ASN : amide:sc= -0.0907 X(o=-0.091,f=-0.33) USER MOD Single : A 48 GLN : amide:sc= -2.24 K(o=-2.2,f=-4.6!) USER MOD Single : A 53 MET CE :methyl 171:sc= -3.45 (180deg=-3.54) USER MOD Single : A 54 GLN : amide:sc= -0.125 K(o=-0.12,f=-3!) USER MOD Single : A 57 HIS : no HD1:sc= -5.59! C(o=-5.6!,f=-8.1!) USER MOD Single : A 58 GLN : amide:sc= -1.45 K(o=-1.5,f=0.21) USER MOD Single : A 60 SER OG : rot -47:sc= 0.948 USER MOD Single : A 64 TYR OH : rot 180:sc= -0.268! USER MOD Single : A 65 THR OG1 : rot 95:sc= 0.53 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -133:sc= 1.23 (180deg=-0.755) 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+ 160:sc= 0 (180deg=-0.257) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 154:sc= 1.42 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.388) 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 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -0.835 X(o=-0.83,f=-0.78!) USER MOD Single : A 111 LYS NZ :NH3+ -142:sc=-0.00128 (180deg=-0.416) USER MOD Single : A 112 ASN : amide:sc= -0.0105 K(o=-0.011,f=-1.5!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= -0.263 USER MOD Single : A 119 THR OG1 : rot -38:sc= -1.62! USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0304 USER MOD Single : A 139 GLN : amide:sc= -0.273 K(o=-0.27,f=-1.9!) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.305 X(o=-0.31,f=-0.58) USER MOD Single : A 144 GLN : amide:sc= -0.0729 K(o=-0.073,f=-0.8) USER MOD Single : A 147 HIS : no HD1:sc= -1.05 K(o=-1,f=-0.47) USER MOD Single : A 155 SER OG : rot 180:sc= -0.178 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.0622 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -24.454 -6.411 -18.568 1.00 0.00 N ATOM 2 CA GLY A -1 -25.112 -6.406 -17.230 1.00 0.00 C ATOM 3 C GLY A -1 -24.544 -7.546 -16.373 1.00 0.00 C ATOM 4 O GLY A -1 -24.898 -8.695 -16.556 1.00 0.00 O ATOM 0 H1 GLY A -1 -24.840 -5.638 -19.147 1.00 0.00 H new ATOM 0 H2 GLY A -1 -23.429 -6.278 -18.451 1.00 0.00 H new ATOM 0 H3 GLY A -1 -24.634 -7.320 -19.040 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -24.947 -5.449 -16.736 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -26.190 -6.524 -17.343 1.00 0.00 H new ATOM 10 N GLY A 0 -23.666 -7.242 -15.437 1.00 0.00 N ATOM 11 CA GLY A 0 -23.086 -8.317 -14.578 1.00 0.00 C ATOM 12 C GLY A 0 -23.909 -8.445 -13.289 1.00 0.00 C ATOM 13 O GLY A 0 -24.978 -7.873 -13.175 1.00 0.00 O ATOM 0 H GLY A 0 -23.332 -6.299 -15.237 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -23.084 -9.265 -15.116 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -22.049 -8.085 -14.338 1.00 0.00 H new ATOM 17 N SER A 1 -23.425 -9.188 -12.314 1.00 0.00 N ATOM 18 CA SER A 1 -24.189 -9.344 -11.040 1.00 0.00 C ATOM 19 C SER A 1 -23.351 -8.838 -9.854 1.00 0.00 C ATOM 20 O SER A 1 -22.152 -8.684 -9.975 1.00 0.00 O ATOM 21 CB SER A 1 -24.445 -10.846 -10.913 1.00 0.00 C ATOM 22 OG SER A 1 -25.758 -11.057 -10.414 1.00 0.00 O ATOM 0 H SER A 1 -22.537 -9.689 -12.351 1.00 0.00 H new ATOM 0 HA SER A 1 -25.116 -8.771 -11.041 1.00 0.00 H new ATOM 0 HB2 SER A 1 -24.330 -11.330 -11.883 1.00 0.00 H new ATOM 0 HB3 SER A 1 -23.712 -11.296 -10.243 1.00 0.00 H new ATOM 0 HG SER A 1 -25.926 -12.019 -10.333 1.00 0.00 H new ATOM 28 N PRO A 2 -24.005 -8.591 -8.738 1.00 0.00 N ATOM 29 CA PRO A 2 -23.280 -8.099 -7.540 1.00 0.00 C ATOM 30 C PRO A 2 -22.445 -9.230 -6.918 1.00 0.00 C ATOM 31 O PRO A 2 -22.932 -10.327 -6.725 1.00 0.00 O ATOM 32 CB PRO A 2 -24.398 -7.667 -6.593 1.00 0.00 C ATOM 33 CG PRO A 2 -25.589 -8.468 -7.007 1.00 0.00 C ATOM 34 CD PRO A 2 -25.448 -8.741 -8.482 1.00 0.00 C ATOM 0 HA PRO A 2 -22.583 -7.292 -7.764 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -24.133 -7.863 -5.554 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -24.594 -6.598 -6.676 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -25.640 -9.401 -6.446 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -26.510 -7.922 -6.803 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -25.796 -9.742 -8.737 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -26.033 -8.039 -9.075 1.00 0.00 H new ATOM 42 N ARG A 3 -21.191 -8.975 -6.603 1.00 0.00 N ATOM 43 CA ARG A 3 -20.339 -10.041 -5.997 1.00 0.00 C ATOM 44 C ARG A 3 -19.903 -9.631 -4.580 1.00 0.00 C ATOM 45 O ARG A 3 -18.763 -9.266 -4.361 1.00 0.00 O ATOM 46 CB ARG A 3 -19.127 -10.153 -6.924 1.00 0.00 C ATOM 47 CG ARG A 3 -19.540 -10.846 -8.226 1.00 0.00 C ATOM 48 CD ARG A 3 -19.514 -12.369 -8.036 1.00 0.00 C ATOM 49 NE ARG A 3 -18.580 -12.878 -9.087 1.00 0.00 N ATOM 50 CZ ARG A 3 -18.920 -12.880 -10.367 1.00 0.00 C ATOM 51 NH1 ARG A 3 -20.090 -12.438 -10.767 1.00 0.00 N ATOM 52 NH2 ARG A 3 -18.075 -13.331 -11.259 1.00 0.00 N ATOM 0 H ARG A 3 -20.728 -8.077 -6.741 1.00 0.00 H new ATOM 0 HA ARG A 3 -20.867 -10.990 -5.902 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -18.727 -9.162 -7.138 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -18.333 -10.718 -6.435 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -20.539 -10.524 -8.519 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -18.864 -10.559 -9.031 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -19.167 -12.636 -7.038 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -20.509 -12.798 -8.152 1.00 0.00 H new ATOM 0 HE ARG A 3 -17.663 -13.231 -8.813 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -20.761 -12.082 -10.086 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -20.328 -12.450 -11.759 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -17.161 -13.678 -10.967 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -18.330 -13.336 -12.247 1.00 0.00 H new ATOM 66 N ILE A 4 -20.798 -9.691 -3.612 1.00 0.00 N ATOM 67 CA ILE A 4 -20.418 -9.307 -2.215 1.00 0.00 C ATOM 68 C ILE A 4 -21.222 -10.131 -1.193 1.00 0.00 C ATOM 69 O ILE A 4 -22.436 -10.182 -1.255 1.00 0.00 O ATOM 70 CB ILE A 4 -20.747 -7.810 -2.088 1.00 0.00 C ATOM 71 CG1 ILE A 4 -22.255 -7.574 -2.302 1.00 0.00 C ATOM 72 CG2 ILE A 4 -19.951 -7.020 -3.131 1.00 0.00 C ATOM 73 CD1 ILE A 4 -22.918 -7.229 -0.965 1.00 0.00 C ATOM 0 H ILE A 4 -21.766 -9.988 -3.732 1.00 0.00 H new ATOM 0 HA ILE A 4 -19.364 -9.501 -2.017 1.00 0.00 H new ATOM 0 HB ILE A 4 -20.476 -7.473 -1.088 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -22.409 -6.764 -3.015 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -22.716 -8.465 -2.728 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -20.185 -5.959 -3.040 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -18.884 -7.172 -2.966 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -20.217 -7.366 -4.130 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -23.984 -7.063 -1.120 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -22.777 -8.053 -0.266 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -22.465 -6.325 -0.557 1.00 0.00 H new ATOM 85 N LYS A 5 -20.557 -10.775 -0.256 1.00 0.00 N ATOM 86 CA LYS A 5 -21.293 -11.590 0.759 1.00 0.00 C ATOM 87 C LYS A 5 -20.734 -11.316 2.165 1.00 0.00 C ATOM 88 O LYS A 5 -19.679 -11.808 2.518 1.00 0.00 O ATOM 89 CB LYS A 5 -21.046 -13.044 0.354 1.00 0.00 C ATOM 90 CG LYS A 5 -22.332 -13.852 0.529 1.00 0.00 C ATOM 91 CD LYS A 5 -22.084 -15.304 0.116 1.00 0.00 C ATOM 92 CE LYS A 5 -23.377 -15.908 -0.436 1.00 0.00 C ATOM 93 NZ LYS A 5 -23.263 -15.777 -1.916 1.00 0.00 N ATOM 0 H LYS A 5 -19.542 -10.769 -0.154 1.00 0.00 H new ATOM 0 HA LYS A 5 -22.356 -11.352 0.790 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -20.713 -13.092 -0.683 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -20.250 -13.472 0.964 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -22.662 -13.810 1.567 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -23.129 -13.422 -0.077 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -21.299 -15.349 -0.638 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -21.737 -15.882 0.972 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -23.483 -16.951 -0.139 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -24.252 -15.379 -0.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -24.114 -16.170 -2.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -23.170 -14.773 -2.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -22.425 -16.297 -2.247 1.00 0.00 H new ATOM 107 N THR A 6 -21.428 -10.536 2.969 1.00 0.00 N ATOM 108 CA THR A 6 -20.924 -10.241 4.344 1.00 0.00 C ATOM 109 C THR A 6 -21.905 -10.780 5.397 1.00 0.00 C ATOM 110 O THR A 6 -22.989 -11.224 5.066 1.00 0.00 O ATOM 111 CB THR A 6 -20.844 -8.716 4.417 1.00 0.00 C ATOM 112 OG1 THR A 6 -22.128 -8.163 4.159 1.00 0.00 O ATOM 113 CG2 THR A 6 -19.847 -8.203 3.377 1.00 0.00 C ATOM 0 H THR A 6 -22.316 -10.096 2.729 1.00 0.00 H new ATOM 0 HA THR A 6 -19.960 -10.710 4.540 1.00 0.00 H new ATOM 0 HB THR A 6 -20.512 -8.417 5.411 1.00 0.00 H new ATOM 0 HG1 THR A 6 -22.079 -7.185 4.207 1.00 0.00 H new ATOM 0 HG21 THR A 6 -19.792 -7.116 3.431 1.00 0.00 H new ATOM 0 HG22 THR A 6 -18.863 -8.627 3.577 1.00 0.00 H new ATOM 0 HG23 THR A 6 -20.175 -8.501 2.381 1.00 0.00 H new ATOM 121 N ARG A 7 -21.538 -10.748 6.662 1.00 0.00 N ATOM 122 CA ARG A 7 -22.457 -11.260 7.722 1.00 0.00 C ATOM 123 C ARG A 7 -22.481 -10.294 8.917 1.00 0.00 C ATOM 124 O ARG A 7 -21.776 -9.302 8.928 1.00 0.00 O ATOM 125 CB ARG A 7 -21.870 -12.610 8.136 1.00 0.00 C ATOM 126 CG ARG A 7 -22.265 -13.676 7.112 1.00 0.00 C ATOM 127 CD ARG A 7 -23.593 -14.314 7.526 1.00 0.00 C ATOM 128 NE ARG A 7 -23.209 -15.561 8.256 1.00 0.00 N ATOM 129 CZ ARG A 7 -22.725 -16.614 7.613 1.00 0.00 C ATOM 130 NH1 ARG A 7 -22.565 -16.606 6.309 1.00 0.00 N ATOM 131 NH2 ARG A 7 -22.396 -17.686 8.285 1.00 0.00 N ATOM 0 H ARG A 7 -20.644 -10.390 6.999 1.00 0.00 H new ATOM 0 HA ARG A 7 -23.484 -11.353 7.369 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -20.784 -12.541 8.204 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -22.234 -12.888 9.125 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -22.357 -13.228 6.122 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -21.488 -14.438 7.046 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -24.171 -13.645 8.164 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -24.211 -14.539 6.657 1.00 0.00 H new ATOM 0 HE ARG A 7 -23.322 -15.602 9.269 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -22.815 -15.777 5.770 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -22.191 -17.429 5.836 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -22.512 -17.709 9.298 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -22.023 -18.500 7.796 1.00 0.00 H new ATOM 145 N ARG A 8 -23.284 -10.571 9.925 1.00 0.00 N ATOM 146 CA ARG A 8 -23.342 -9.662 11.109 1.00 0.00 C ATOM 147 C ARG A 8 -23.072 -10.452 12.400 1.00 0.00 C ATOM 148 O ARG A 8 -23.794 -10.320 13.370 1.00 0.00 O ATOM 149 CB ARG A 8 -24.765 -9.103 11.109 1.00 0.00 C ATOM 150 CG ARG A 8 -24.893 -8.029 10.029 1.00 0.00 C ATOM 151 CD ARG A 8 -26.292 -7.396 10.096 1.00 0.00 C ATOM 152 NE ARG A 8 -26.263 -6.199 9.179 1.00 0.00 N ATOM 153 CZ ARG A 8 -27.094 -5.180 9.355 1.00 0.00 C ATOM 154 NH1 ARG A 8 -27.999 -5.186 10.307 1.00 0.00 N ATOM 155 NH2 ARG A 8 -27.028 -4.148 8.555 1.00 0.00 N ATOM 0 H ARG A 8 -23.897 -11.385 9.973 1.00 0.00 H new ATOM 0 HA ARG A 8 -22.593 -8.871 11.060 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -25.481 -9.904 10.926 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -25.001 -8.681 12.086 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -24.129 -7.264 10.170 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -24.728 -8.467 9.045 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -27.056 -8.108 9.782 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -26.535 -7.098 11.116 1.00 0.00 H new ATOM 0 HE ARG A 8 -25.593 -6.172 8.410 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -28.075 -5.988 10.933 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -28.625 -4.389 10.420 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -26.341 -4.130 7.801 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -27.664 -3.361 8.684 1.00 0.00 H new ATOM 169 N SER A 9 -22.040 -11.271 12.423 1.00 0.00 N ATOM 170 CA SER A 9 -21.737 -12.061 13.654 1.00 0.00 C ATOM 171 C SER A 9 -20.221 -12.095 13.904 1.00 0.00 C ATOM 172 O SER A 9 -19.675 -13.119 14.271 1.00 0.00 O ATOM 173 CB SER A 9 -22.265 -13.465 13.364 1.00 0.00 C ATOM 174 OG SER A 9 -22.510 -14.137 14.593 1.00 0.00 O ATOM 0 H SER A 9 -21.400 -11.422 11.643 1.00 0.00 H new ATOM 0 HA SER A 9 -22.195 -11.630 14.544 1.00 0.00 H new ATOM 0 HB2 SER A 9 -23.183 -13.407 12.778 1.00 0.00 H new ATOM 0 HB3 SER A 9 -21.542 -14.023 12.769 1.00 0.00 H new ATOM 0 HG SER A 9 -22.850 -15.038 14.411 1.00 0.00 H new ATOM 180 N LYS A 10 -19.533 -10.987 13.712 1.00 0.00 N ATOM 181 CA LYS A 10 -18.058 -10.971 13.942 1.00 0.00 C ATOM 182 C LYS A 10 -17.675 -9.776 14.834 1.00 0.00 C ATOM 183 O LYS A 10 -17.096 -8.818 14.362 1.00 0.00 O ATOM 184 CB LYS A 10 -17.442 -10.828 12.548 1.00 0.00 C ATOM 185 CG LYS A 10 -17.639 -12.129 11.768 1.00 0.00 C ATOM 186 CD LYS A 10 -17.192 -11.929 10.318 1.00 0.00 C ATOM 187 CE LYS A 10 -17.301 -13.254 9.562 1.00 0.00 C ATOM 188 NZ LYS A 10 -18.676 -13.256 8.988 1.00 0.00 N ATOM 0 H LYS A 10 -19.933 -10.100 13.407 1.00 0.00 H new ATOM 0 HA LYS A 10 -17.706 -11.869 14.450 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -17.908 -9.998 12.016 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -16.380 -10.598 12.630 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -17.064 -12.932 12.229 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -18.687 -12.428 11.799 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -17.811 -11.172 9.837 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -16.165 -11.566 10.290 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -16.546 -13.325 8.779 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.150 -14.103 10.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -18.940 -14.226 8.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -19.348 -12.894 9.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -18.701 -12.648 8.144 1.00 0.00 H new ATOM 202 N PRO A 11 -18.011 -9.865 16.104 1.00 0.00 N ATOM 203 CA PRO A 11 -17.686 -8.763 17.045 1.00 0.00 C ATOM 204 C PRO A 11 -16.187 -8.756 17.378 1.00 0.00 C ATOM 205 O PRO A 11 -15.511 -9.757 17.238 1.00 0.00 O ATOM 206 CB PRO A 11 -18.512 -9.091 18.285 1.00 0.00 C ATOM 207 CG PRO A 11 -18.730 -10.569 18.232 1.00 0.00 C ATOM 208 CD PRO A 11 -18.714 -10.972 16.779 1.00 0.00 C ATOM 0 HA PRO A 11 -17.909 -7.778 16.635 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.987 -8.803 19.196 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.460 -8.553 18.280 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.950 -11.093 18.785 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.681 -10.834 18.694 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.196 -11.920 16.634 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -19.724 -11.098 16.390 1.00 0.00 H new ATOM 216 N ALA A 12 -15.667 -7.632 17.826 1.00 0.00 N ATOM 217 CA ALA A 12 -14.210 -7.565 18.178 1.00 0.00 C ATOM 218 C ALA A 12 -14.045 -7.598 19.708 1.00 0.00 C ATOM 219 O ALA A 12 -14.853 -7.037 20.420 1.00 0.00 O ATOM 220 CB ALA A 12 -13.711 -6.232 17.607 1.00 0.00 C ATOM 0 H ALA A 12 -16.186 -6.765 17.962 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.646 -8.405 17.773 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.650 -6.116 17.828 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.860 -6.220 16.527 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.268 -5.411 18.059 1.00 0.00 H new ATOM 226 N PRO A 13 -13.006 -8.258 20.175 1.00 0.00 N ATOM 227 CA PRO A 13 -12.767 -8.349 21.639 1.00 0.00 C ATOM 228 C PRO A 13 -12.383 -6.981 22.218 1.00 0.00 C ATOM 229 O PRO A 13 -12.036 -6.069 21.492 1.00 0.00 O ATOM 230 CB PRO A 13 -11.608 -9.338 21.756 1.00 0.00 C ATOM 231 CG PRO A 13 -10.907 -9.261 20.441 1.00 0.00 C ATOM 232 CD PRO A 13 -11.966 -8.970 19.412 1.00 0.00 C ATOM 0 HA PRO A 13 -13.650 -8.667 22.192 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.941 -9.071 22.576 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.968 -10.348 21.954 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.149 -8.478 20.450 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.396 -10.197 20.218 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.577 -8.358 18.598 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.353 -9.886 18.965 1.00 0.00 H new ATOM 240 N ASP A 14 -12.451 -6.832 23.526 1.00 0.00 N ATOM 241 CA ASP A 14 -12.092 -5.506 24.166 1.00 0.00 C ATOM 242 C ASP A 14 -10.753 -4.963 23.630 1.00 0.00 C ATOM 243 O ASP A 14 -10.565 -3.764 23.541 1.00 0.00 O ATOM 244 CB ASP A 14 -11.980 -5.767 25.676 1.00 0.00 C ATOM 245 CG ASP A 14 -13.346 -5.557 26.333 1.00 0.00 C ATOM 246 OD1 ASP A 14 -14.336 -5.929 25.727 1.00 0.00 O ATOM 247 OD2 ASP A 14 -13.376 -5.029 27.432 1.00 0.00 O ATOM 0 H ASP A 14 -12.737 -7.562 24.178 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.852 -4.759 23.937 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.631 -6.784 25.855 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -11.245 -5.095 26.118 1.00 0.00 H new ATOM 252 N GLY A 15 -9.820 -5.824 23.269 1.00 0.00 N ATOM 253 CA GLY A 15 -8.504 -5.342 22.740 1.00 0.00 C ATOM 254 C GLY A 15 -8.718 -4.335 21.594 1.00 0.00 C ATOM 255 O GLY A 15 -7.973 -3.381 21.464 1.00 0.00 O ATOM 0 H GLY A 15 -9.918 -6.838 23.320 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.933 -4.873 23.542 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.917 -6.188 22.383 1.00 0.00 H new ATOM 259 N PHE A 16 -9.728 -4.528 20.763 1.00 0.00 N ATOM 260 CA PHE A 16 -9.962 -3.552 19.635 1.00 0.00 C ATOM 261 C PHE A 16 -10.153 -2.129 20.185 1.00 0.00 C ATOM 262 O PHE A 16 -9.750 -1.166 19.561 1.00 0.00 O ATOM 263 CB PHE A 16 -11.233 -4.006 18.897 1.00 0.00 C ATOM 264 CG PHE A 16 -11.457 -3.130 17.683 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.410 -2.893 16.779 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.713 -2.551 17.463 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.621 -2.080 15.661 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.923 -1.738 16.342 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.877 -1.503 15.441 1.00 0.00 C ATOM 0 H PHE A 16 -10.389 -5.304 20.815 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.105 -3.535 18.962 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.136 -5.048 18.593 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.093 -3.947 19.564 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.441 -3.339 16.947 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.520 -2.731 18.158 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.814 -1.897 14.967 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.892 -1.292 16.172 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.040 -0.877 14.576 1.00 0.00 H new ATOM 279 N GLU A 17 -10.760 -1.978 21.350 1.00 0.00 N ATOM 280 CA GLU A 17 -10.958 -0.591 21.921 1.00 0.00 C ATOM 281 C GLU A 17 -9.619 0.165 21.957 1.00 0.00 C ATOM 282 O GLU A 17 -9.572 1.359 21.720 1.00 0.00 O ATOM 283 CB GLU A 17 -11.499 -0.772 23.348 1.00 0.00 C ATOM 284 CG GLU A 17 -12.060 0.558 23.853 1.00 0.00 C ATOM 285 CD GLU A 17 -10.931 1.392 24.459 1.00 0.00 C ATOM 286 OE1 GLU A 17 -10.500 1.065 25.553 1.00 0.00 O ATOM 287 OE2 GLU A 17 -10.516 2.346 23.821 1.00 0.00 O ATOM 0 H GLU A 17 -11.122 -2.741 21.923 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.650 -0.012 21.309 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.277 -1.535 23.359 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.704 -1.118 24.009 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.528 1.102 23.033 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.834 0.378 24.599 1.00 0.00 H new ATOM 294 N LYS A 18 -8.529 -0.518 22.242 1.00 0.00 N ATOM 295 CA LYS A 18 -7.195 0.184 22.277 1.00 0.00 C ATOM 296 C LYS A 18 -6.901 0.837 20.916 1.00 0.00 C ATOM 297 O LYS A 18 -6.323 1.907 20.855 1.00 0.00 O ATOM 298 CB LYS A 18 -6.135 -0.885 22.588 1.00 0.00 C ATOM 299 CG LYS A 18 -5.950 -0.996 24.103 1.00 0.00 C ATOM 300 CD LYS A 18 -4.492 -1.335 24.418 1.00 0.00 C ATOM 301 CE LYS A 18 -4.315 -2.855 24.446 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.065 -3.081 25.225 1.00 0.00 N ATOM 0 H LYS A 18 -8.502 -1.516 22.449 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.191 0.971 23.031 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.442 -1.847 22.177 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -5.189 -0.623 22.114 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.228 -0.058 24.583 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.608 -1.767 24.504 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -3.835 -0.896 23.667 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.208 -0.907 25.380 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.168 -3.343 24.917 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -4.231 -3.262 23.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.875 -4.102 25.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.269 -2.610 24.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.177 -2.689 26.182 1.00 0.00 H new ATOM 316 N ILE A 19 -7.292 0.211 19.824 1.00 0.00 N ATOM 317 CA ILE A 19 -7.027 0.815 18.480 1.00 0.00 C ATOM 318 C ILE A 19 -8.348 1.052 17.716 1.00 0.00 C ATOM 319 O ILE A 19 -8.398 0.902 16.511 1.00 0.00 O ATOM 320 CB ILE A 19 -6.136 -0.201 17.738 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.887 -1.533 17.538 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.861 -0.459 18.552 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.695 -2.033 16.101 1.00 0.00 C ATOM 0 H ILE A 19 -7.779 -0.685 19.809 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.541 1.787 18.564 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.877 0.211 16.763 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.518 -2.278 18.243 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.948 -1.396 17.745 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.233 -1.177 18.026 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.315 0.476 18.679 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.128 -0.859 19.530 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.229 -2.974 15.969 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.086 -1.293 15.403 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.633 -2.188 15.908 1.00 0.00 H new ATOM 335 N LYS A 20 -9.419 1.403 18.403 1.00 0.00 N ATOM 336 CA LYS A 20 -10.731 1.622 17.688 1.00 0.00 C ATOM 337 C LYS A 20 -10.867 3.037 17.078 1.00 0.00 C ATOM 338 O LYS A 20 -11.353 3.159 15.970 1.00 0.00 O ATOM 339 CB LYS A 20 -11.835 1.397 18.732 1.00 0.00 C ATOM 340 CG LYS A 20 -13.186 1.227 18.024 1.00 0.00 C ATOM 341 CD LYS A 20 -14.272 1.987 18.792 1.00 0.00 C ATOM 342 CE LYS A 20 -15.264 2.606 17.803 1.00 0.00 C ATOM 343 NZ LYS A 20 -16.094 1.464 17.327 1.00 0.00 N ATOM 0 H LYS A 20 -9.444 1.546 19.413 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.800 0.932 16.847 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.611 0.512 19.328 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.877 2.242 19.420 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.121 1.600 17.002 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.444 0.170 17.961 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.793 1.311 19.470 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.820 2.767 19.405 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -15.878 3.367 18.284 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.746 3.090 16.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.035 1.400 16.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.743 0.580 17.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -17.084 1.613 17.609 1.00 0.00 H new ATOM 357 N PRO A 21 -10.480 4.072 17.804 1.00 0.00 N ATOM 358 CA PRO A 21 -10.635 5.449 17.268 1.00 0.00 C ATOM 359 C PRO A 21 -9.579 5.770 16.197 1.00 0.00 C ATOM 360 O PRO A 21 -9.863 6.479 15.250 1.00 0.00 O ATOM 361 CB PRO A 21 -10.463 6.341 18.493 1.00 0.00 C ATOM 362 CG PRO A 21 -9.650 5.538 19.457 1.00 0.00 C ATOM 363 CD PRO A 21 -9.875 4.079 19.146 1.00 0.00 C ATOM 0 HA PRO A 21 -11.595 5.590 16.771 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.959 7.272 18.234 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -11.428 6.610 18.922 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.593 5.789 19.367 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.945 5.760 20.483 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.938 3.522 19.161 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.534 3.615 19.880 1.00 0.00 H new ATOM 371 N THR A 22 -8.365 5.269 16.330 1.00 0.00 N ATOM 372 CA THR A 22 -7.320 5.584 15.286 1.00 0.00 C ATOM 373 C THR A 22 -7.779 5.079 13.911 1.00 0.00 C ATOM 374 O THR A 22 -7.644 5.772 12.920 1.00 0.00 O ATOM 375 CB THR A 22 -6.026 4.873 15.714 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.657 5.310 17.015 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.906 5.206 14.724 1.00 0.00 C ATOM 0 H THR A 22 -8.056 4.670 17.096 1.00 0.00 H new ATOM 0 HA THR A 22 -7.160 6.659 15.207 1.00 0.00 H new ATOM 0 HB THR A 22 -6.189 3.795 15.724 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.833 4.857 17.291 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.989 4.701 15.029 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.190 4.871 13.727 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.740 6.283 14.711 1.00 0.00 H new ATOM 385 N LEU A 23 -8.328 3.887 13.841 1.00 0.00 N ATOM 386 CA LEU A 23 -8.800 3.365 12.508 1.00 0.00 C ATOM 387 C LEU A 23 -9.971 4.224 12.011 1.00 0.00 C ATOM 388 O LEU A 23 -10.044 4.556 10.843 1.00 0.00 O ATOM 389 CB LEU A 23 -9.254 1.914 12.731 1.00 0.00 C ATOM 390 CG LEU A 23 -8.027 1.026 12.952 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.362 -0.076 13.964 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.609 0.394 11.621 1.00 0.00 C ATOM 0 H LEU A 23 -8.470 3.260 14.633 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.009 3.406 11.759 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.918 1.857 13.594 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.821 1.562 11.869 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.207 1.631 13.340 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.486 -0.706 14.119 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.655 0.377 14.911 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.183 -0.683 13.582 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.735 -0.239 11.777 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.429 -0.209 11.231 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.365 1.180 10.906 1.00 0.00 H new ATOM 404 N THR A 24 -10.881 4.600 12.887 1.00 0.00 N ATOM 405 CA THR A 24 -12.038 5.459 12.438 1.00 0.00 C ATOM 406 C THR A 24 -11.516 6.777 11.838 1.00 0.00 C ATOM 407 O THR A 24 -12.097 7.303 10.906 1.00 0.00 O ATOM 408 CB THR A 24 -12.892 5.745 13.689 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.748 4.680 14.636 1.00 0.00 O ATOM 410 CG2 THR A 24 -14.364 5.897 13.285 1.00 0.00 C ATOM 0 H THR A 24 -10.876 4.356 13.877 1.00 0.00 H new ATOM 0 HA THR A 24 -12.626 4.955 11.671 1.00 0.00 H new ATOM 0 HB THR A 24 -12.551 6.672 14.151 1.00 0.00 H new ATOM 0 HG1 THR A 24 -13.292 4.871 15.428 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.966 6.099 14.171 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.465 6.724 12.582 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.709 4.976 12.815 1.00 0.00 H new ATOM 418 N ASP A 25 -10.428 7.316 12.356 1.00 0.00 N ATOM 419 CA ASP A 25 -9.892 8.606 11.786 1.00 0.00 C ATOM 420 C ASP A 25 -9.572 8.438 10.291 1.00 0.00 C ATOM 421 O ASP A 25 -9.781 9.348 9.510 1.00 0.00 O ATOM 422 CB ASP A 25 -8.611 8.940 12.566 1.00 0.00 C ATOM 423 CG ASP A 25 -8.971 9.356 13.995 1.00 0.00 C ATOM 424 OD1 ASP A 25 -9.959 8.853 14.509 1.00 0.00 O ATOM 425 OD2 ASP A 25 -8.254 10.169 14.552 1.00 0.00 O ATOM 0 H ASP A 25 -9.896 6.927 13.135 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.627 9.406 11.879 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.949 8.074 12.585 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.070 9.745 12.068 1.00 0.00 H new ATOM 430 N PHE A 26 -9.074 7.283 9.873 1.00 0.00 N ATOM 431 CA PHE A 26 -8.762 7.094 8.406 1.00 0.00 C ATOM 432 C PHE A 26 -10.014 7.373 7.567 1.00 0.00 C ATOM 433 O PHE A 26 -9.940 8.011 6.533 1.00 0.00 O ATOM 434 CB PHE A 26 -8.324 5.634 8.222 1.00 0.00 C ATOM 435 CG PHE A 26 -6.830 5.535 8.394 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.268 5.524 9.675 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.006 5.457 7.266 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.880 5.435 9.827 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.620 5.368 7.417 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.057 5.357 8.697 1.00 0.00 C ATOM 0 H PHE A 26 -8.874 6.481 10.470 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.977 7.779 8.084 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.828 4.997 8.949 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.612 5.278 7.233 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.905 5.584 10.545 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.442 5.466 6.278 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.444 5.426 10.815 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -3.984 5.308 6.546 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.986 5.288 8.814 1.00 0.00 H new ATOM 450 N GLU A 27 -11.169 6.916 8.010 1.00 0.00 N ATOM 451 CA GLU A 27 -12.422 7.191 7.221 1.00 0.00 C ATOM 452 C GLU A 27 -12.632 8.709 7.053 1.00 0.00 C ATOM 453 O GLU A 27 -13.252 9.139 6.099 1.00 0.00 O ATOM 454 CB GLU A 27 -13.591 6.580 8.012 1.00 0.00 C ATOM 455 CG GLU A 27 -13.398 5.066 8.127 1.00 0.00 C ATOM 456 CD GLU A 27 -14.762 4.374 8.108 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.386 4.310 9.155 1.00 0.00 O ATOM 458 OE2 GLU A 27 -15.159 3.921 7.047 1.00 0.00 O ATOM 0 H GLU A 27 -11.298 6.376 8.865 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.353 6.757 6.224 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.644 7.026 9.005 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.535 6.800 7.513 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.783 4.704 7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.869 4.825 9.049 1.00 0.00 H new ATOM 465 N ILE A 28 -12.115 9.530 7.955 1.00 0.00 N ATOM 466 CA ILE A 28 -12.305 11.015 7.793 1.00 0.00 C ATOM 467 C ILE A 28 -11.505 11.495 6.576 1.00 0.00 C ATOM 468 O ILE A 28 -12.044 12.141 5.697 1.00 0.00 O ATOM 469 CB ILE A 28 -11.781 11.711 9.074 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.361 11.085 10.365 1.00 0.00 C ATOM 471 CG2 ILE A 28 -12.177 13.188 9.030 1.00 0.00 C ATOM 472 CD1 ILE A 28 -13.875 10.877 10.248 1.00 0.00 C ATOM 0 H ILE A 28 -11.583 9.241 8.776 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.358 11.254 7.643 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.698 11.587 9.098 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -11.874 10.130 10.560 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -12.145 11.732 11.215 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.813 13.689 9.927 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.737 13.656 8.149 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -13.263 13.272 8.982 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -14.254 10.436 11.170 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -14.362 11.837 10.078 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.087 10.210 9.413 1.00 0.00 H new ATOM 484 N GLN A 29 -10.226 11.176 6.505 1.00 0.00 N ATOM 485 CA GLN A 29 -9.418 11.621 5.312 1.00 0.00 C ATOM 486 C GLN A 29 -9.928 10.892 4.063 1.00 0.00 C ATOM 487 O GLN A 29 -10.091 11.493 3.017 1.00 0.00 O ATOM 488 CB GLN A 29 -7.956 11.243 5.596 1.00 0.00 C ATOM 489 CG GLN A 29 -7.045 11.932 4.577 1.00 0.00 C ATOM 490 CD GLN A 29 -6.599 13.292 5.127 1.00 0.00 C ATOM 491 OE1 GLN A 29 -7.423 14.141 5.406 1.00 0.00 O ATOM 492 NE2 GLN A 29 -5.324 13.543 5.299 1.00 0.00 N ATOM 0 H GLN A 29 -9.715 10.638 7.205 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.506 12.694 5.142 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.681 11.543 6.607 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.831 10.162 5.539 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.175 11.308 4.371 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.573 12.065 3.633 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.629 12.834 5.066 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.027 14.447 5.665 1.00 0.00 H new ATOM 501 N LEU A 30 -10.207 9.607 4.165 1.00 0.00 N ATOM 502 CA LEU A 30 -10.737 8.867 2.965 1.00 0.00 C ATOM 503 C LEU A 30 -12.118 9.439 2.589 1.00 0.00 C ATOM 504 O LEU A 30 -12.453 9.529 1.423 1.00 0.00 O ATOM 505 CB LEU A 30 -10.861 7.381 3.360 1.00 0.00 C ATOM 506 CG LEU A 30 -10.317 6.499 2.229 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.525 5.329 2.822 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.483 5.957 1.397 1.00 0.00 C ATOM 0 H LEU A 30 -10.093 9.048 5.010 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.074 8.974 2.106 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.308 7.192 4.280 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.904 7.133 3.558 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.661 7.093 1.593 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.140 4.705 2.016 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.693 5.714 3.411 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.178 4.735 3.461 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.096 5.330 0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.140 5.365 2.034 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.043 6.789 0.971 1.00 0.00 H new ATOM 520 N ARG A 31 -12.922 9.838 3.565 1.00 0.00 N ATOM 521 CA ARG A 31 -14.276 10.411 3.228 1.00 0.00 C ATOM 522 C ARG A 31 -14.115 11.643 2.324 1.00 0.00 C ATOM 523 O ARG A 31 -14.876 11.830 1.392 1.00 0.00 O ATOM 524 CB ARG A 31 -14.929 10.828 4.558 1.00 0.00 C ATOM 525 CG ARG A 31 -15.757 9.668 5.116 1.00 0.00 C ATOM 526 CD ARG A 31 -15.856 9.793 6.642 1.00 0.00 C ATOM 527 NE ARG A 31 -17.314 9.666 6.950 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.946 8.509 6.825 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.321 7.426 6.420 1.00 0.00 N ATOM 530 NH2 ARG A 31 -19.220 8.434 7.110 1.00 0.00 N ATOM 0 H ARG A 31 -12.702 9.792 4.560 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.887 9.679 2.700 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.161 11.117 5.276 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.565 11.700 4.404 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.754 9.675 4.675 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.296 8.717 4.848 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.279 9.014 7.140 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.462 10.750 6.985 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.832 10.487 7.263 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.327 7.465 6.194 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.830 6.546 6.332 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.721 9.264 7.427 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.712 7.546 7.016 1.00 0.00 H new ATOM 544 N ASP A 32 -13.134 12.487 2.586 1.00 0.00 N ATOM 545 CA ASP A 32 -12.954 13.705 1.715 1.00 0.00 C ATOM 546 C ASP A 32 -12.637 13.272 0.280 1.00 0.00 C ATOM 547 O ASP A 32 -13.239 13.757 -0.659 1.00 0.00 O ATOM 548 CB ASP A 32 -11.781 14.509 2.300 1.00 0.00 C ATOM 549 CG ASP A 32 -12.309 15.501 3.338 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.935 16.469 2.938 1.00 0.00 O ATOM 551 OD2 ASP A 32 -12.079 15.276 4.515 1.00 0.00 O ATOM 0 H ASP A 32 -12.463 12.389 3.348 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.861 14.310 1.692 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.058 13.835 2.760 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.259 15.042 1.505 1.00 0.00 H new ATOM 556 N ALA A 33 -11.711 12.355 0.095 1.00 0.00 N ATOM 557 CA ALA A 33 -11.392 11.898 -1.304 1.00 0.00 C ATOM 558 C ALA A 33 -12.580 11.101 -1.860 1.00 0.00 C ATOM 559 O ALA A 33 -12.938 11.245 -3.015 1.00 0.00 O ATOM 560 CB ALA A 33 -10.150 11.002 -1.206 1.00 0.00 C ATOM 0 H ALA A 33 -11.170 11.909 0.836 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.206 12.741 -1.969 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.879 10.645 -2.200 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.321 11.573 -0.788 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.366 10.150 -0.561 1.00 0.00 H new ATOM 566 N GLN A 34 -13.204 10.269 -1.049 1.00 0.00 N ATOM 567 CA GLN A 34 -14.382 9.478 -1.554 1.00 0.00 C ATOM 568 C GLN A 34 -15.569 10.414 -1.853 1.00 0.00 C ATOM 569 O GLN A 34 -16.353 10.147 -2.745 1.00 0.00 O ATOM 570 CB GLN A 34 -14.759 8.483 -0.445 1.00 0.00 C ATOM 571 CG GLN A 34 -13.913 7.217 -0.586 1.00 0.00 C ATOM 572 CD GLN A 34 -14.468 6.353 -1.725 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.666 6.184 -1.840 1.00 0.00 O ATOM 574 NE2 GLN A 34 -13.647 5.791 -2.580 1.00 0.00 N ATOM 0 H GLN A 34 -12.953 10.105 -0.074 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.132 8.958 -2.479 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.597 8.934 0.534 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.818 8.234 -0.510 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.875 7.481 -0.789 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.922 6.655 0.348 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -12.641 5.930 -2.488 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.015 5.215 -3.337 1.00 0.00 H new ATOM 583 N LYS A 35 -15.718 11.508 -1.123 1.00 0.00 N ATOM 584 CA LYS A 35 -16.870 12.436 -1.399 1.00 0.00 C ATOM 585 C LYS A 35 -16.452 13.547 -2.376 1.00 0.00 C ATOM 586 O LYS A 35 -17.244 13.981 -3.191 1.00 0.00 O ATOM 587 CB LYS A 35 -17.271 13.036 -0.045 1.00 0.00 C ATOM 588 CG LYS A 35 -17.853 11.940 0.851 1.00 0.00 C ATOM 589 CD LYS A 35 -19.379 11.946 0.742 1.00 0.00 C ATOM 590 CE LYS A 35 -19.937 13.197 1.430 1.00 0.00 C ATOM 591 NZ LYS A 35 -21.160 12.731 2.141 1.00 0.00 N ATOM 0 H LYS A 35 -15.101 11.792 -0.362 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.702 11.903 -1.860 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.403 13.489 0.435 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -18.005 13.829 -0.190 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -17.461 10.967 0.555 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.551 12.103 1.886 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.679 11.930 -0.306 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.791 11.049 1.205 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.213 13.621 2.126 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.174 13.974 0.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -21.600 13.532 2.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -21.833 12.339 1.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -20.902 11.996 2.830 1.00 0.00 H new ATOM 605 N ASP A 36 -15.219 14.013 -2.311 1.00 0.00 N ATOM 606 CA ASP A 36 -14.784 15.102 -3.263 1.00 0.00 C ATOM 607 C ASP A 36 -14.976 14.641 -4.720 1.00 0.00 C ATOM 608 O ASP A 36 -15.327 15.431 -5.576 1.00 0.00 O ATOM 609 CB ASP A 36 -13.297 15.368 -2.984 1.00 0.00 C ATOM 610 CG ASP A 36 -13.163 16.271 -1.756 1.00 0.00 C ATOM 611 OD1 ASP A 36 -13.966 16.128 -0.849 1.00 0.00 O ATOM 612 OD2 ASP A 36 -12.259 17.091 -1.743 1.00 0.00 O ATOM 0 H ASP A 36 -14.506 13.695 -1.654 1.00 0.00 H new ATOM 0 HA ASP A 36 -15.376 16.006 -3.120 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.773 14.427 -2.816 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.832 15.841 -3.849 1.00 0.00 H new ATOM 617 N LYS A 37 -14.751 13.372 -5.014 1.00 0.00 N ATOM 618 CA LYS A 37 -14.933 12.887 -6.434 1.00 0.00 C ATOM 619 C LYS A 37 -16.343 13.237 -6.946 1.00 0.00 C ATOM 620 O LYS A 37 -16.512 13.580 -8.102 1.00 0.00 O ATOM 621 CB LYS A 37 -14.748 11.361 -6.410 1.00 0.00 C ATOM 622 CG LYS A 37 -13.257 11.024 -6.506 1.00 0.00 C ATOM 623 CD LYS A 37 -13.070 9.755 -7.340 1.00 0.00 C ATOM 624 CE LYS A 37 -13.683 8.562 -6.604 1.00 0.00 C ATOM 625 NZ LYS A 37 -14.127 7.636 -7.683 1.00 0.00 N ATOM 0 H LYS A 37 -14.454 12.661 -4.345 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.212 13.362 -7.099 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -15.166 10.948 -5.492 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -15.289 10.906 -7.240 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -12.715 11.853 -6.961 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.841 10.880 -5.509 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.542 9.876 -8.315 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.009 9.579 -7.519 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -12.955 8.085 -5.948 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.521 8.871 -5.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.559 6.791 -7.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -14.825 8.116 -8.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.307 7.354 -8.258 1.00 0.00 H new ATOM 639 N SER A 38 -17.355 13.161 -6.103 1.00 0.00 N ATOM 640 CA SER A 38 -18.739 13.502 -6.566 1.00 0.00 C ATOM 641 C SER A 38 -19.168 14.865 -5.998 1.00 0.00 C ATOM 642 O SER A 38 -20.308 15.047 -5.616 1.00 0.00 O ATOM 643 CB SER A 38 -19.639 12.388 -6.029 1.00 0.00 C ATOM 644 OG SER A 38 -19.381 12.203 -4.643 1.00 0.00 O ATOM 0 H SER A 38 -17.280 12.880 -5.125 1.00 0.00 H new ATOM 0 HA SER A 38 -18.798 13.575 -7.652 1.00 0.00 H new ATOM 0 HB2 SER A 38 -20.687 12.645 -6.185 1.00 0.00 H new ATOM 0 HB3 SER A 38 -19.454 11.461 -6.572 1.00 0.00 H new ATOM 0 HG SER A 38 -19.957 11.491 -4.295 1.00 0.00 H new ATOM 650 N SER A 39 -18.267 15.827 -5.940 1.00 0.00 N ATOM 651 CA SER A 39 -18.639 17.172 -5.394 1.00 0.00 C ATOM 652 C SER A 39 -17.714 18.261 -5.967 1.00 0.00 C ATOM 653 O SER A 39 -16.684 18.564 -5.396 1.00 0.00 O ATOM 654 CB SER A 39 -18.447 17.048 -3.883 1.00 0.00 C ATOM 655 OG SER A 39 -19.683 16.686 -3.281 1.00 0.00 O ATOM 0 H SER A 39 -17.298 15.736 -6.246 1.00 0.00 H new ATOM 0 HA SER A 39 -19.658 17.456 -5.658 1.00 0.00 H new ATOM 0 HB2 SER A 39 -17.688 16.298 -3.662 1.00 0.00 H new ATOM 0 HB3 SER A 39 -18.091 17.993 -3.471 1.00 0.00 H new ATOM 0 HG SER A 39 -20.166 16.071 -3.871 1.00 0.00 H new ATOM 661 N LYS A 40 -18.069 18.854 -7.093 1.00 0.00 N ATOM 662 CA LYS A 40 -17.204 19.921 -7.700 1.00 0.00 C ATOM 663 C LYS A 40 -15.762 19.414 -7.880 1.00 0.00 C ATOM 664 O LYS A 40 -14.924 19.605 -7.017 1.00 0.00 O ATOM 665 CB LYS A 40 -17.242 21.091 -6.712 1.00 0.00 C ATOM 666 CG LYS A 40 -16.495 22.286 -7.306 1.00 0.00 C ATOM 667 CD LYS A 40 -17.032 23.580 -6.693 1.00 0.00 C ATOM 668 CE LYS A 40 -18.160 24.130 -7.568 1.00 0.00 C ATOM 669 NZ LYS A 40 -18.799 25.196 -6.745 1.00 0.00 N ATOM 0 H LYS A 40 -18.920 18.643 -7.614 1.00 0.00 H new ATOM 0 HA LYS A 40 -17.560 20.214 -8.688 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -18.275 21.365 -6.496 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -16.786 20.797 -5.767 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -15.427 22.194 -7.110 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -16.620 22.305 -8.389 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -17.399 23.392 -5.684 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -16.231 24.315 -6.609 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -17.773 24.532 -8.504 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -18.875 23.349 -7.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -19.584 25.622 -7.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -19.163 24.782 -5.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -18.096 25.928 -6.519 1.00 0.00 H new ATOM 683 N LEU A 41 -15.464 18.769 -8.990 1.00 0.00 N ATOM 684 CA LEU A 41 -14.074 18.257 -9.209 1.00 0.00 C ATOM 685 C LEU A 41 -13.772 18.133 -10.713 1.00 0.00 C ATOM 686 O LEU A 41 -13.966 17.085 -11.301 1.00 0.00 O ATOM 687 CB LEU A 41 -14.047 16.879 -8.545 1.00 0.00 C ATOM 688 CG LEU A 41 -12.631 16.306 -8.617 1.00 0.00 C ATOM 689 CD1 LEU A 41 -11.875 16.647 -7.331 1.00 0.00 C ATOM 690 CD2 LEU A 41 -12.702 14.784 -8.776 1.00 0.00 C ATOM 0 H LEU A 41 -16.121 18.578 -9.746 1.00 0.00 H new ATOM 0 HA LEU A 41 -13.324 18.929 -8.792 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -14.366 16.958 -7.506 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -14.748 16.209 -9.044 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.110 16.738 -9.471 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -10.866 16.238 -7.383 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -11.823 17.730 -7.216 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -12.397 16.216 -6.477 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.693 14.376 -8.827 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.225 14.353 -7.922 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -13.239 14.539 -9.692 1.00 0.00 H new ATOM 702 N ALA A 42 -13.295 19.190 -11.340 1.00 0.00 N ATOM 703 CA ALA A 42 -12.983 19.108 -12.808 1.00 0.00 C ATOM 704 C ALA A 42 -11.496 18.783 -13.019 1.00 0.00 C ATOM 705 O ALA A 42 -11.148 18.024 -13.904 1.00 0.00 O ATOM 706 CB ALA A 42 -13.319 20.487 -13.390 1.00 0.00 C ATOM 0 H ALA A 42 -13.111 20.094 -10.905 1.00 0.00 H new ATOM 0 HA ALA A 42 -13.557 18.321 -13.296 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.112 20.490 -14.460 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.374 20.705 -13.224 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.710 21.247 -12.900 1.00 0.00 H new ATOM 712 N ALA A 43 -10.611 19.347 -12.220 1.00 0.00 N ATOM 713 CA ALA A 43 -9.155 19.057 -12.390 1.00 0.00 C ATOM 714 C ALA A 43 -8.610 18.329 -11.151 1.00 0.00 C ATOM 715 O ALA A 43 -9.283 18.225 -10.143 1.00 0.00 O ATOM 716 CB ALA A 43 -8.493 20.427 -12.543 1.00 0.00 C ATOM 0 H ALA A 43 -10.839 19.992 -11.463 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.960 18.413 -13.247 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.418 20.299 -12.673 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.906 20.935 -13.414 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.682 21.024 -11.651 1.00 0.00 H new ATOM 722 N LYS A 44 -7.391 17.820 -11.212 1.00 0.00 N ATOM 723 CA LYS A 44 -6.804 17.099 -10.034 1.00 0.00 C ATOM 724 C LYS A 44 -7.749 15.983 -9.551 1.00 0.00 C ATOM 725 O LYS A 44 -8.436 16.137 -8.558 1.00 0.00 O ATOM 726 CB LYS A 44 -6.630 18.165 -8.947 1.00 0.00 C ATOM 727 CG LYS A 44 -5.294 18.884 -9.148 1.00 0.00 C ATOM 728 CD LYS A 44 -4.901 19.601 -7.855 1.00 0.00 C ATOM 729 CE LYS A 44 -4.109 20.867 -8.191 1.00 0.00 C ATOM 730 NZ LYS A 44 -4.568 21.881 -7.201 1.00 0.00 N ATOM 0 H LYS A 44 -6.782 17.876 -12.028 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.858 16.620 -10.287 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.451 18.881 -8.990 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -6.662 17.703 -7.960 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.522 18.168 -9.428 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.374 19.602 -9.964 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.793 19.859 -7.284 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -4.302 18.940 -7.228 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.036 20.694 -8.111 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.304 21.195 -9.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -4.069 22.779 -7.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -5.592 22.029 -7.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.363 21.544 -6.239 1.00 0.00 H new ATOM 744 N SER A 45 -7.790 14.861 -10.242 1.00 0.00 N ATOM 745 CA SER A 45 -8.692 13.748 -9.811 1.00 0.00 C ATOM 746 C SER A 45 -7.870 12.520 -9.395 1.00 0.00 C ATOM 747 O SER A 45 -8.012 12.021 -8.293 1.00 0.00 O ATOM 748 CB SER A 45 -9.549 13.432 -11.035 1.00 0.00 C ATOM 749 OG SER A 45 -10.779 12.859 -10.613 1.00 0.00 O ATOM 0 H SER A 45 -7.239 14.673 -11.080 1.00 0.00 H new ATOM 0 HA SER A 45 -9.300 14.025 -8.949 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.736 14.341 -11.607 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.021 12.743 -11.695 1.00 0.00 H new ATOM 0 HG SER A 45 -11.332 12.657 -11.397 1.00 0.00 H new ATOM 755 N ASN A 46 -7.006 12.027 -10.259 1.00 0.00 N ATOM 756 CA ASN A 46 -6.173 10.822 -9.887 1.00 0.00 C ATOM 757 C ASN A 46 -5.404 11.095 -8.581 1.00 0.00 C ATOM 758 O ASN A 46 -5.263 10.218 -7.749 1.00 0.00 O ATOM 759 CB ASN A 46 -5.183 10.594 -11.040 1.00 0.00 C ATOM 760 CG ASN A 46 -5.853 9.751 -12.133 1.00 0.00 C ATOM 761 OD1 ASN A 46 -6.369 8.687 -11.857 1.00 0.00 O ATOM 762 ND2 ASN A 46 -5.871 10.181 -13.371 1.00 0.00 N ATOM 0 H ASN A 46 -6.840 12.399 -11.194 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.802 9.945 -9.730 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.861 11.551 -11.451 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.290 10.088 -10.672 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -6.317 9.622 -14.098 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.439 11.074 -13.607 1.00 0.00 H new ATOM 769 N GLU A 47 -4.911 12.304 -8.392 1.00 0.00 N ATOM 770 CA GLU A 47 -4.158 12.611 -7.123 1.00 0.00 C ATOM 771 C GLU A 47 -5.066 12.386 -5.900 1.00 0.00 C ATOM 772 O GLU A 47 -4.617 11.898 -4.879 1.00 0.00 O ATOM 773 CB GLU A 47 -3.737 14.088 -7.201 1.00 0.00 C ATOM 774 CG GLU A 47 -2.737 14.274 -8.344 1.00 0.00 C ATOM 775 CD GLU A 47 -1.747 15.381 -7.980 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.194 16.488 -7.729 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.560 15.103 -7.957 1.00 0.00 O ATOM 0 H GLU A 47 -4.995 13.080 -9.049 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.290 11.961 -7.018 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.611 14.718 -7.363 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.289 14.400 -6.257 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.204 13.342 -8.530 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.263 14.530 -9.264 1.00 0.00 H new ATOM 784 N GLN A 48 -6.338 12.733 -5.989 1.00 0.00 N ATOM 785 CA GLN A 48 -7.250 12.522 -4.805 1.00 0.00 C ATOM 786 C GLN A 48 -7.385 11.020 -4.509 1.00 0.00 C ATOM 787 O GLN A 48 -7.385 10.611 -3.363 1.00 0.00 O ATOM 788 CB GLN A 48 -8.621 13.108 -5.178 1.00 0.00 C ATOM 789 CG GLN A 48 -9.263 13.737 -3.941 1.00 0.00 C ATOM 790 CD GLN A 48 -10.481 14.565 -4.367 1.00 0.00 C ATOM 791 OE1 GLN A 48 -10.621 15.703 -3.963 1.00 0.00 O ATOM 792 NE2 GLN A 48 -11.377 14.046 -5.172 1.00 0.00 N ATOM 0 H GLN A 48 -6.777 13.145 -6.812 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.850 13.008 -3.915 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.507 13.857 -5.962 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.266 12.325 -5.577 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.565 12.960 -3.239 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.541 14.370 -3.425 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -11.264 13.092 -5.514 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.187 14.597 -5.456 1.00 0.00 H new ATOM 801 N LEU A 49 -7.498 10.193 -5.530 1.00 0.00 N ATOM 802 CA LEU A 49 -7.630 8.713 -5.278 1.00 0.00 C ATOM 803 C LEU A 49 -6.320 8.150 -4.697 1.00 0.00 C ATOM 804 O LEU A 49 -6.347 7.264 -3.863 1.00 0.00 O ATOM 805 CB LEU A 49 -7.935 8.056 -6.634 1.00 0.00 C ATOM 806 CG LEU A 49 -9.426 8.196 -6.946 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.702 7.671 -8.355 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.236 7.384 -5.932 1.00 0.00 C ATOM 0 H LEU A 49 -7.505 10.472 -6.511 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.423 8.510 -4.558 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.343 8.526 -7.419 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.655 7.003 -6.611 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.714 9.245 -6.886 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.764 7.770 -8.579 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.124 8.247 -9.078 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.415 6.621 -8.415 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.299 7.483 -6.153 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.948 6.334 -5.993 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.038 7.756 -4.927 1.00 0.00 H new ATOM 820 N TRP A 50 -5.173 8.650 -5.122 1.00 0.00 N ATOM 821 CA TRP A 50 -3.875 8.115 -4.564 1.00 0.00 C ATOM 822 C TRP A 50 -3.842 8.300 -3.042 1.00 0.00 C ATOM 823 O TRP A 50 -3.374 7.434 -2.326 1.00 0.00 O ATOM 824 CB TRP A 50 -2.731 8.893 -5.250 1.00 0.00 C ATOM 825 CG TRP A 50 -2.793 8.716 -6.750 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.576 7.823 -7.417 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.050 9.437 -7.777 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.365 7.964 -8.773 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.436 8.942 -9.046 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.091 10.466 -7.734 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -1.894 9.446 -10.223 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.541 10.974 -8.923 1.00 0.00 C ATOM 833 CH2 TRP A 50 -0.945 10.463 -10.166 1.00 0.00 C ATOM 0 H TRP A 50 -5.079 9.391 -5.817 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.769 7.048 -4.759 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.803 9.952 -5.000 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.769 8.541 -4.876 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.253 7.118 -6.958 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.840 7.411 -9.486 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.776 10.867 -6.782 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.208 9.050 -11.178 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.196 11.762 -8.880 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.520 10.858 -11.077 1.00 0.00 H new ATOM 844 N GLU A 51 -4.359 9.400 -2.531 1.00 0.00 N ATOM 845 CA GLU A 51 -4.366 9.579 -1.038 1.00 0.00 C ATOM 846 C GLU A 51 -5.231 8.481 -0.393 1.00 0.00 C ATOM 847 O GLU A 51 -4.946 8.039 0.706 1.00 0.00 O ATOM 848 CB GLU A 51 -4.961 10.967 -0.754 1.00 0.00 C ATOM 849 CG GLU A 51 -3.912 12.041 -1.049 1.00 0.00 C ATOM 850 CD GLU A 51 -4.458 13.412 -0.644 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.403 13.860 -1.272 1.00 0.00 O ATOM 852 OE2 GLU A 51 -3.922 13.991 0.286 1.00 0.00 O ATOM 0 H GLU A 51 -4.767 10.164 -3.069 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.361 9.503 -0.624 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.846 11.128 -1.370 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.281 11.032 0.286 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.994 11.827 -0.502 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.660 12.037 -2.109 1.00 0.00 H new ATOM 859 N ILE A 52 -6.277 8.019 -1.062 1.00 0.00 N ATOM 860 CA ILE A 52 -7.122 6.934 -0.454 1.00 0.00 C ATOM 861 C ILE A 52 -6.336 5.616 -0.478 1.00 0.00 C ATOM 862 O ILE A 52 -6.083 5.037 0.563 1.00 0.00 O ATOM 863 CB ILE A 52 -8.409 6.838 -1.295 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.162 8.171 -1.193 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.292 5.702 -0.759 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.448 8.131 -2.026 1.00 0.00 C ATOM 0 H ILE A 52 -6.573 8.342 -1.983 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.378 7.148 0.584 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.160 6.631 -2.336 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.404 8.379 -0.151 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.523 8.983 -1.540 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.202 5.636 -1.356 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.749 4.759 -0.820 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.553 5.903 0.280 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.967 9.086 -1.940 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.199 7.946 -3.071 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.094 7.333 -1.660 1.00 0.00 H new ATOM 878 N MET A 53 -5.927 5.139 -1.642 1.00 0.00 N ATOM 879 CA MET A 53 -5.132 3.854 -1.655 1.00 0.00 C ATOM 880 C MET A 53 -3.831 4.033 -0.847 1.00 0.00 C ATOM 881 O MET A 53 -3.342 3.085 -0.260 1.00 0.00 O ATOM 882 CB MET A 53 -4.830 3.466 -3.121 1.00 0.00 C ATOM 883 CG MET A 53 -4.155 4.615 -3.887 1.00 0.00 C ATOM 884 SD MET A 53 -5.018 4.875 -5.467 1.00 0.00 S ATOM 885 CE MET A 53 -4.649 3.262 -6.195 1.00 0.00 C ATOM 0 H MET A 53 -6.101 5.565 -2.552 1.00 0.00 H new ATOM 0 HA MET A 53 -5.706 3.053 -1.190 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.184 2.588 -3.139 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.758 3.190 -3.623 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.180 5.528 -3.292 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.106 4.380 -4.067 1.00 0.00 H new ATOM 0 HE1 MET A 53 -5.221 3.138 -7.115 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.584 3.199 -6.419 1.00 0.00 H new ATOM 0 HE3 MET A 53 -4.919 2.475 -5.491 1.00 0.00 H new ATOM 895 N GLN A 54 -3.278 5.236 -0.775 1.00 0.00 N ATOM 896 CA GLN A 54 -2.029 5.423 0.047 1.00 0.00 C ATOM 897 C GLN A 54 -2.376 5.258 1.536 1.00 0.00 C ATOM 898 O GLN A 54 -1.613 4.685 2.291 1.00 0.00 O ATOM 899 CB GLN A 54 -1.516 6.845 -0.232 1.00 0.00 C ATOM 900 CG GLN A 54 -0.790 6.871 -1.579 1.00 0.00 C ATOM 901 CD GLN A 54 0.684 6.499 -1.373 1.00 0.00 C ATOM 902 OE1 GLN A 54 0.985 5.530 -0.704 1.00 0.00 O ATOM 903 NE2 GLN A 54 1.626 7.228 -1.920 1.00 0.00 N ATOM 0 H GLN A 54 -3.630 6.074 -1.239 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.265 4.688 -0.209 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.349 7.548 -0.242 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.841 7.162 0.563 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.259 6.171 -2.271 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.867 7.862 -2.027 1.00 0.00 H new ATOM 0 HE21 GLN A 54 1.379 8.042 -2.482 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.606 6.981 -1.783 1.00 0.00 H new ATOM 912 N LEU A 55 -3.533 5.737 1.971 1.00 0.00 N ATOM 913 CA LEU A 55 -3.918 5.574 3.423 1.00 0.00 C ATOM 914 C LEU A 55 -3.834 4.093 3.837 1.00 0.00 C ATOM 915 O LEU A 55 -3.527 3.784 4.972 1.00 0.00 O ATOM 916 CB LEU A 55 -5.371 6.066 3.557 1.00 0.00 C ATOM 917 CG LEU A 55 -5.383 7.561 3.881 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.797 8.116 3.680 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.956 7.768 5.337 1.00 0.00 C ATOM 0 H LEU A 55 -4.216 6.226 1.392 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.245 6.141 4.066 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.914 5.881 2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.882 5.510 4.343 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.691 8.083 3.220 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.806 9.181 3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.103 7.966 2.645 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.490 7.596 4.342 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.964 8.833 5.571 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.649 7.247 5.997 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.951 7.372 5.481 1.00 0.00 H new ATOM 931 N HIS A 56 -4.104 3.169 2.928 1.00 0.00 N ATOM 932 CA HIS A 56 -4.029 1.711 3.300 1.00 0.00 C ATOM 933 C HIS A 56 -2.631 1.371 3.850 1.00 0.00 C ATOM 934 O HIS A 56 -2.504 0.585 4.770 1.00 0.00 O ATOM 935 CB HIS A 56 -4.300 0.918 2.013 1.00 0.00 C ATOM 936 CG HIS A 56 -4.886 -0.421 2.360 1.00 0.00 C ATOM 937 ND1 HIS A 56 -6.088 -0.547 3.036 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.450 -1.702 2.129 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.335 -1.861 3.187 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.367 -2.609 2.651 1.00 0.00 N ATOM 0 H HIS A 56 -4.368 3.360 1.962 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.755 1.465 4.075 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -4.986 1.471 1.371 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.374 0.787 1.453 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.679 0.218 3.361 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.535 -1.966 1.620 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.208 -2.261 3.681 1.00 0.00 H new ATOM 948 N HIS A 57 -1.581 1.961 3.305 1.00 0.00 N ATOM 949 CA HIS A 57 -0.202 1.654 3.836 1.00 0.00 C ATOM 950 C HIS A 57 -0.117 2.072 5.308 1.00 0.00 C ATOM 951 O HIS A 57 0.276 1.291 6.154 1.00 0.00 O ATOM 952 CB HIS A 57 0.797 2.467 2.999 1.00 0.00 C ATOM 953 CG HIS A 57 1.238 1.653 1.816 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.421 1.913 1.141 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.672 0.576 1.183 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.527 1.008 0.151 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.487 0.170 0.133 1.00 0.00 N ATOM 0 H HIS A 57 -1.616 2.627 2.533 1.00 0.00 H new ATOM 0 HA HIS A 57 0.018 0.589 3.768 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.336 3.396 2.663 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.659 2.741 3.607 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.264 0.114 1.459 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.352 0.964 -0.544 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.326 -0.603 -0.513 1.00 0.00 H new ATOM 965 N GLN A 58 -0.497 3.295 5.626 1.00 0.00 N ATOM 966 CA GLN A 58 -0.444 3.735 7.068 1.00 0.00 C ATOM 967 C GLN A 58 -1.307 2.795 7.930 1.00 0.00 C ATOM 968 O GLN A 58 -0.958 2.494 9.056 1.00 0.00 O ATOM 969 CB GLN A 58 -0.999 5.167 7.116 1.00 0.00 C ATOM 970 CG GLN A 58 -0.581 5.832 8.430 1.00 0.00 C ATOM 971 CD GLN A 58 -1.100 7.274 8.462 1.00 0.00 C ATOM 972 OE1 GLN A 58 -2.293 7.500 8.420 1.00 0.00 O ATOM 973 NE2 GLN A 58 -0.254 8.272 8.538 1.00 0.00 N ATOM 0 H GLN A 58 -0.835 3.995 4.965 1.00 0.00 H new ATOM 0 HA GLN A 58 0.574 3.703 7.456 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.624 5.742 6.269 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.086 5.150 7.034 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.980 5.272 9.276 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.505 5.823 8.525 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.749 8.089 8.574 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -0.598 9.232 8.562 1.00 0.00 H new ATOM 982 N ARG A 59 -2.426 2.316 7.410 1.00 0.00 N ATOM 983 CA ARG A 59 -3.282 1.381 8.224 1.00 0.00 C ATOM 984 C ARG A 59 -2.515 0.074 8.471 1.00 0.00 C ATOM 985 O ARG A 59 -2.408 -0.377 9.597 1.00 0.00 O ATOM 986 CB ARG A 59 -4.557 1.105 7.407 1.00 0.00 C ATOM 987 CG ARG A 59 -5.752 0.987 8.354 1.00 0.00 C ATOM 988 CD ARG A 59 -6.171 2.382 8.827 1.00 0.00 C ATOM 989 NE ARG A 59 -7.666 2.365 8.797 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.332 2.339 7.652 1.00 0.00 C ATOM 991 NH1 ARG A 59 -7.707 2.329 6.497 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.640 2.322 7.666 1.00 0.00 N ATOM 0 H ARG A 59 -2.776 2.528 6.476 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.536 1.816 9.190 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.725 1.910 6.691 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.442 0.186 6.833 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.584 0.499 7.847 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.491 0.365 9.210 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.798 2.588 9.830 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.771 3.157 8.173 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.184 2.374 9.676 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -6.687 2.341 6.469 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.241 2.309 5.628 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.141 2.329 8.555 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.159 2.302 6.788 1.00 0.00 H new ATOM 1006 N SER A 60 -1.964 -0.537 7.435 1.00 0.00 N ATOM 1007 CA SER A 60 -1.193 -1.809 7.652 1.00 0.00 C ATOM 1008 C SER A 60 0.011 -1.521 8.556 1.00 0.00 C ATOM 1009 O SER A 60 0.331 -2.309 9.416 1.00 0.00 O ATOM 1010 CB SER A 60 -0.721 -2.295 6.273 1.00 0.00 C ATOM 1011 OG SER A 60 0.322 -1.449 5.808 1.00 0.00 O ATOM 0 H SER A 60 -2.015 -0.214 6.469 1.00 0.00 H new ATOM 0 HA SER A 60 -1.808 -2.570 8.132 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.368 -3.324 6.339 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.552 -2.288 5.568 1.00 0.00 H new ATOM 0 HG SER A 60 0.061 -0.512 5.928 1.00 0.00 H new ATOM 1017 N ARG A 61 0.670 -0.392 8.385 1.00 0.00 N ATOM 1018 CA ARG A 61 1.843 -0.080 9.279 1.00 0.00 C ATOM 1019 C ARG A 61 1.355 0.064 10.732 1.00 0.00 C ATOM 1020 O ARG A 61 2.030 -0.353 11.654 1.00 0.00 O ATOM 1021 CB ARG A 61 2.442 1.247 8.786 1.00 0.00 C ATOM 1022 CG ARG A 61 3.819 1.457 9.421 1.00 0.00 C ATOM 1023 CD ARG A 61 4.015 2.947 9.746 1.00 0.00 C ATOM 1024 NE ARG A 61 5.496 3.149 9.949 1.00 0.00 N ATOM 1025 CZ ARG A 61 6.053 4.341 9.781 1.00 0.00 C ATOM 1026 NH1 ARG A 61 5.337 5.397 9.464 1.00 0.00 N ATOM 1027 NH2 ARG A 61 7.343 4.480 9.950 1.00 0.00 N ATOM 0 H ARG A 61 0.454 0.314 7.681 1.00 0.00 H new ATOM 0 HA ARG A 61 2.590 -0.874 9.247 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.529 1.237 7.700 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.781 2.074 9.045 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.906 0.862 10.330 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.600 1.117 8.741 1.00 0.00 H new ATOM 0 HD2 ARG A 61 3.646 3.573 8.934 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.459 3.225 10.641 1.00 0.00 H new ATOM 0 HE ARG A 61 6.078 2.356 10.220 1.00 0.00 H new ATOM 0 HH11 ARG A 61 4.328 5.311 9.341 1.00 0.00 H new ATOM 0 HH12 ARG A 61 5.790 6.302 9.341 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.913 3.675 10.209 1.00 0.00 H new ATOM 0 HH22 ARG A 61 7.779 5.393 9.823 1.00 0.00 H new ATOM 1041 N TYR A 62 0.186 0.641 10.947 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.327 0.788 12.357 1.00 0.00 C ATOM 1043 C TYR A 62 -0.494 -0.605 12.986 1.00 0.00 C ATOM 1044 O TYR A 62 0.000 -0.860 14.069 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.687 1.503 12.257 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.285 1.670 13.635 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.978 0.607 14.225 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.148 2.883 14.319 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.533 0.756 15.500 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.703 3.033 15.596 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.396 1.969 16.185 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.943 2.116 17.443 1.00 0.00 O ATOM 0 H TYR A 62 -0.426 1.011 10.219 1.00 0.00 H new ATOM 0 HA TYR A 62 0.361 1.358 12.981 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.561 2.478 11.786 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.364 0.928 11.625 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.084 -0.328 13.696 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.614 3.703 13.862 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.067 -0.065 15.956 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.596 3.968 16.126 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.756 3.018 17.778 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.169 -1.515 12.310 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.334 -2.895 12.892 1.00 0.00 C ATOM 1064 C ILE A 63 -0.001 -3.651 12.765 1.00 0.00 C ATOM 1065 O ILE A 63 0.423 -4.328 13.684 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.438 -3.592 12.076 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.747 -2.808 12.221 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.644 -5.016 12.595 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.801 -3.395 11.282 1.00 0.00 C ATOM 0 H ILE A 63 -1.604 -1.367 11.400 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.608 -2.865 13.947 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.142 -3.628 11.027 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.098 -2.853 13.252 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.581 -1.757 11.987 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.426 -5.505 12.015 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.715 -5.577 12.497 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -2.938 -4.982 13.644 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.732 -2.837 11.386 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.450 -3.327 10.252 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.974 -4.440 11.538 1.00 0.00 H new ATOM 1081 N TYR A 64 0.671 -3.528 11.639 1.00 0.00 N ATOM 1082 CA TYR A 64 1.993 -4.229 11.469 1.00 0.00 C ATOM 1083 C TYR A 64 2.981 -3.746 12.543 1.00 0.00 C ATOM 1084 O TYR A 64 3.780 -4.515 13.038 1.00 0.00 O ATOM 1085 CB TYR A 64 2.508 -3.847 10.070 1.00 0.00 C ATOM 1086 CG TYR A 64 3.724 -4.669 9.725 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.588 -6.032 9.452 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.986 -4.065 9.663 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.708 -6.795 9.117 1.00 0.00 C ATOM 1090 CE2 TYR A 64 6.110 -4.828 9.331 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.972 -6.195 9.057 1.00 0.00 C ATOM 1092 OH TYR A 64 7.080 -6.949 8.726 1.00 0.00 O ATOM 0 H TYR A 64 0.365 -2.978 10.836 1.00 0.00 H new ATOM 0 HA TYR A 64 1.888 -5.309 11.571 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.726 -4.011 9.329 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.756 -2.786 10.042 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.614 -6.497 9.500 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.091 -3.011 9.871 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.600 -7.848 8.904 1.00 0.00 H new ATOM 0 HE2 TYR A 64 7.084 -4.364 9.286 1.00 0.00 H new ATOM 0 HH TYR A 64 7.877 -6.378 8.729 1.00 0.00 H new ATOM 1102 N THR A 65 2.940 -2.479 12.912 1.00 0.00 N ATOM 1103 CA THR A 65 3.898 -1.987 13.961 1.00 0.00 C ATOM 1104 C THR A 65 3.462 -2.472 15.353 1.00 0.00 C ATOM 1105 O THR A 65 4.292 -2.813 16.173 1.00 0.00 O ATOM 1106 CB THR A 65 3.870 -0.449 13.899 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.204 -0.025 12.585 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.881 0.124 14.893 1.00 0.00 C ATOM 0 H THR A 65 2.298 -1.779 12.540 1.00 0.00 H new ATOM 0 HA THR A 65 4.903 -2.368 13.782 1.00 0.00 H new ATOM 0 HB THR A 65 2.872 -0.093 14.155 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.383 0.129 12.072 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.859 1.213 14.847 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.625 -0.202 15.901 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.880 -0.230 14.640 1.00 0.00 H new ATOM 1116 N LEU A 66 2.177 -2.494 15.643 1.00 0.00 N ATOM 1117 CA LEU A 66 1.742 -2.951 17.007 1.00 0.00 C ATOM 1118 C LEU A 66 1.650 -4.496 17.104 1.00 0.00 C ATOM 1119 O LEU A 66 1.872 -5.053 18.162 1.00 0.00 O ATOM 1120 CB LEU A 66 0.386 -2.266 17.295 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.736 -2.880 16.450 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.320 -4.093 17.182 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.839 -1.834 16.235 1.00 0.00 C ATOM 0 H LEU A 66 1.426 -2.222 15.009 1.00 0.00 H new ATOM 0 HA LEU A 66 2.479 -2.667 17.758 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.143 -2.364 18.353 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.462 -1.199 17.083 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.337 -3.195 15.486 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.118 -4.530 16.582 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.537 -4.834 17.340 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.721 -3.778 18.145 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.639 -2.267 15.634 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.238 -1.522 17.200 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.424 -0.969 15.718 1.00 0.00 H new ATOM 1135 N TYR A 67 1.320 -5.194 16.031 1.00 0.00 N ATOM 1136 CA TYR A 67 1.221 -6.701 16.129 1.00 0.00 C ATOM 1137 C TYR A 67 2.589 -7.384 15.902 1.00 0.00 C ATOM 1138 O TYR A 67 2.906 -8.350 16.570 1.00 0.00 O ATOM 1139 CB TYR A 67 0.207 -7.156 15.054 1.00 0.00 C ATOM 1140 CG TYR A 67 0.132 -8.677 15.028 1.00 0.00 C ATOM 1141 CD1 TYR A 67 1.062 -9.404 14.274 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.845 -9.354 15.770 1.00 0.00 C ATOM 1143 CE1 TYR A 67 1.015 -10.804 14.264 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -0.892 -10.755 15.758 1.00 0.00 C ATOM 1145 CZ TYR A 67 0.040 -11.480 15.006 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.005 -12.859 14.995 1.00 0.00 O ATOM 0 H TYR A 67 1.119 -4.799 15.112 1.00 0.00 H new ATOM 0 HA TYR A 67 0.896 -6.987 17.129 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.776 -6.738 15.268 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.507 -6.781 14.076 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.816 -8.885 13.700 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.563 -8.795 16.352 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.733 -11.363 13.682 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.647 -11.275 16.329 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.741 -13.167 15.564 1.00 0.00 H new ATOM 1156 N TYR A 68 3.379 -6.932 14.948 1.00 0.00 N ATOM 1157 CA TYR A 68 4.692 -7.627 14.688 1.00 0.00 C ATOM 1158 C TYR A 68 5.853 -7.039 15.513 1.00 0.00 C ATOM 1159 O TYR A 68 6.811 -7.737 15.792 1.00 0.00 O ATOM 1160 CB TYR A 68 4.967 -7.478 13.182 1.00 0.00 C ATOM 1161 CG TYR A 68 4.343 -8.638 12.437 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.826 -9.936 12.640 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.283 -8.417 11.544 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.253 -11.013 11.953 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.711 -9.496 10.859 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.195 -10.793 11.063 1.00 0.00 C ATOM 1167 OH TYR A 68 2.631 -11.855 10.386 1.00 0.00 O ATOM 0 H TYR A 68 3.179 -6.130 14.350 1.00 0.00 H new ATOM 0 HA TYR A 68 4.623 -8.672 14.990 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.557 -6.536 12.818 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.041 -7.450 12.999 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.641 -10.107 13.327 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.909 -7.416 11.385 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.627 -12.014 12.110 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.895 -9.327 10.172 1.00 0.00 H new ATOM 0 HH TYR A 68 1.908 -11.529 9.810 1.00 0.00 H new ATOM 1177 N LYS A 69 5.798 -5.784 15.909 1.00 0.00 N ATOM 1178 CA LYS A 69 6.932 -5.217 16.712 1.00 0.00 C ATOM 1179 C LYS A 69 6.502 -4.986 18.171 1.00 0.00 C ATOM 1180 O LYS A 69 7.098 -5.531 19.082 1.00 0.00 O ATOM 1181 CB LYS A 69 7.301 -3.893 16.039 1.00 0.00 C ATOM 1182 CG LYS A 69 7.908 -4.172 14.662 1.00 0.00 C ATOM 1183 CD LYS A 69 6.786 -4.393 13.638 1.00 0.00 C ATOM 1184 CE LYS A 69 7.093 -3.611 12.357 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.079 -4.451 11.621 1.00 0.00 N ATOM 0 H LYS A 69 5.032 -5.140 15.715 1.00 0.00 H new ATOM 0 HA LYS A 69 7.782 -5.899 16.740 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.416 -3.265 15.938 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.012 -3.344 16.657 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.535 -3.335 14.354 1.00 0.00 H new ATOM 0 HG3 LYS A 69 8.550 -5.052 14.708 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.690 -5.455 13.413 1.00 0.00 H new ATOM 0 HD3 LYS A 69 5.832 -4.068 14.054 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.191 -3.451 11.766 1.00 0.00 H new ATOM 0 HE3 LYS A 69 7.504 -2.627 12.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.866 -3.856 11.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.444 -5.192 12.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.615 -4.893 10.802 1.00 0.00 H new ATOM 1199 N ARG A 70 5.476 -4.192 18.409 1.00 0.00 N ATOM 1200 CA ARG A 70 5.035 -3.958 19.835 1.00 0.00 C ATOM 1201 C ARG A 70 4.669 -5.294 20.509 1.00 0.00 C ATOM 1202 O ARG A 70 4.875 -5.465 21.696 1.00 0.00 O ATOM 1203 CB ARG A 70 3.806 -3.037 19.780 1.00 0.00 C ATOM 1204 CG ARG A 70 3.559 -2.432 21.164 1.00 0.00 C ATOM 1205 CD ARG A 70 4.475 -1.223 21.366 1.00 0.00 C ATOM 1206 NE ARG A 70 3.959 -0.548 22.596 1.00 0.00 N ATOM 1207 CZ ARG A 70 2.837 0.156 22.575 1.00 0.00 C ATOM 1208 NH1 ARG A 70 2.135 0.295 21.474 1.00 0.00 N ATOM 1209 NH2 ARG A 70 2.415 0.730 23.672 1.00 0.00 N ATOM 0 H ARG A 70 4.934 -3.704 17.696 1.00 0.00 H new ATOM 0 HA ARG A 70 5.836 -3.504 20.418 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.964 -2.245 19.048 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.931 -3.600 19.456 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.516 -2.131 21.260 1.00 0.00 H new ATOM 0 HG3 ARG A 70 3.748 -3.177 21.937 1.00 0.00 H new ATOM 0 HD2 ARG A 70 5.513 -1.531 21.491 1.00 0.00 H new ATOM 0 HD3 ARG A 70 4.442 -0.555 20.506 1.00 0.00 H new ATOM 0 HE ARG A 70 4.481 -0.631 23.468 1.00 0.00 H new ATOM 0 HH11 ARG A 70 2.450 -0.144 20.609 1.00 0.00 H new ATOM 0 HH12 ARG A 70 1.274 0.842 21.484 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.949 0.634 24.536 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.552 1.274 23.664 1.00 0.00 H new ATOM 1223 N LYS A 71 4.127 -6.248 19.769 1.00 0.00 N ATOM 1224 CA LYS A 71 3.754 -7.568 20.375 1.00 0.00 C ATOM 1225 C LYS A 71 2.736 -7.368 21.506 1.00 0.00 C ATOM 1226 O LYS A 71 2.878 -7.930 22.576 1.00 0.00 O ATOM 1227 CB LYS A 71 5.056 -8.172 20.918 1.00 0.00 C ATOM 1228 CG LYS A 71 4.840 -9.655 21.229 1.00 0.00 C ATOM 1229 CD LYS A 71 5.684 -10.050 22.443 1.00 0.00 C ATOM 1230 CE LYS A 71 5.056 -11.266 23.126 1.00 0.00 C ATOM 1231 NZ LYS A 71 5.712 -12.443 22.491 1.00 0.00 N ATOM 0 H LYS A 71 3.930 -6.163 18.772 1.00 0.00 H new ATOM 0 HA LYS A 71 3.290 -8.227 19.641 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.856 -8.056 20.187 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.367 -7.642 21.818 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.785 -9.846 21.428 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.117 -10.262 20.367 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.703 -10.280 22.132 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.745 -9.217 23.144 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.231 -11.249 24.202 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.976 -11.288 22.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 5.334 -13.318 22.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.523 -12.436 21.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.738 -12.398 22.654 1.00 0.00 H new ATOM 1245 N ALA A 72 1.704 -6.585 21.275 1.00 0.00 N ATOM 1246 CA ALA A 72 0.676 -6.370 22.341 1.00 0.00 C ATOM 1247 C ALA A 72 -0.652 -7.003 21.907 1.00 0.00 C ATOM 1248 O ALA A 72 -1.185 -7.865 22.579 1.00 0.00 O ATOM 1249 CB ALA A 72 0.535 -4.852 22.465 1.00 0.00 C ATOM 0 H ALA A 72 1.533 -6.090 20.400 1.00 0.00 H new ATOM 0 HA ALA A 72 0.958 -6.823 23.291 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.204 -4.617 23.230 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.496 -4.419 22.743 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.213 -4.437 21.510 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.185 -6.587 20.780 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.487 -7.176 20.289 1.00 0.00 C ATOM 1257 C ILE A 73 -2.375 -8.712 20.193 1.00 0.00 C ATOM 1258 O ILE A 73 -1.284 -9.250 20.161 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.727 -6.569 18.890 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -4.046 -7.090 18.313 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.574 -6.950 17.952 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.344 -6.382 16.989 1.00 0.00 C ATOM 0 H ILE A 73 -0.781 -5.869 20.178 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.309 -6.952 20.968 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.777 -5.484 18.981 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.985 -8.167 18.155 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.857 -6.917 19.020 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.749 -6.519 16.966 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.636 -6.567 18.354 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.517 -8.035 17.868 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.283 -6.755 16.580 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.423 -5.308 17.160 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.538 -6.578 16.282 1.00 0.00 H new ATOM 1274 N SER A 74 -3.485 -9.417 20.128 1.00 0.00 N ATOM 1275 CA SER A 74 -3.414 -10.906 20.011 1.00 0.00 C ATOM 1276 C SER A 74 -3.885 -11.342 18.613 1.00 0.00 C ATOM 1277 O SER A 74 -4.736 -10.704 18.025 1.00 0.00 O ATOM 1278 CB SER A 74 -4.357 -11.443 21.090 1.00 0.00 C ATOM 1279 OG SER A 74 -4.186 -12.849 21.206 1.00 0.00 O ATOM 0 H SER A 74 -4.427 -9.026 20.151 1.00 0.00 H new ATOM 0 HA SER A 74 -2.400 -11.284 20.142 1.00 0.00 H new ATOM 0 HB2 SER A 74 -4.149 -10.960 22.045 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.391 -11.211 20.834 1.00 0.00 H new ATOM 0 HG SER A 74 -4.787 -13.196 21.898 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.329 -12.414 18.070 1.00 0.00 N ATOM 1286 CA LYS A 75 -3.743 -12.892 16.688 1.00 0.00 C ATOM 1287 C LYS A 75 -5.273 -12.848 16.496 1.00 0.00 C ATOM 1288 O LYS A 75 -5.747 -12.581 15.409 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.253 -14.344 16.563 1.00 0.00 C ATOM 1290 CG LYS A 75 -2.987 -14.669 15.091 1.00 0.00 C ATOM 1291 CD LYS A 75 -4.245 -15.269 14.462 1.00 0.00 C ATOM 1292 CE LYS A 75 -4.349 -14.825 13.001 1.00 0.00 C ATOM 1293 NZ LYS A 75 -3.211 -15.497 12.315 1.00 0.00 N ATOM 0 H LYS A 75 -2.609 -12.979 18.520 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.310 -12.242 15.928 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.343 -14.483 17.147 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.000 -15.027 16.968 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -2.696 -13.765 14.556 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.157 -15.370 15.007 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.210 -16.357 14.521 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.128 -14.948 15.014 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.303 -15.121 12.565 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.280 -13.741 12.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.393 -15.531 11.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.335 -14.965 12.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.108 -16.465 12.680 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.051 -13.096 17.534 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.548 -13.046 17.361 1.00 0.00 C ATOM 1309 C ASP A 76 -7.965 -11.637 16.914 1.00 0.00 C ATOM 1310 O ASP A 76 -8.705 -11.485 15.960 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.171 -13.382 18.725 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.104 -14.893 18.960 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -7.002 -15.407 19.068 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -9.154 -15.510 19.025 1.00 0.00 O ATOM 0 H ASP A 76 -5.724 -13.326 18.472 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.884 -13.754 16.604 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.640 -12.856 19.518 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.207 -13.044 18.757 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.479 -10.603 17.573 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.848 -9.213 17.134 1.00 0.00 C ATOM 1321 C LEU A 77 -7.155 -8.919 15.796 1.00 0.00 C ATOM 1322 O LEU A 77 -7.752 -8.363 14.894 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.353 -8.242 18.221 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.836 -6.824 17.898 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.340 -6.721 18.171 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.086 -5.811 18.774 1.00 0.00 C ATOM 0 H LEU A 77 -6.856 -10.659 18.379 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.924 -9.105 17.000 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.726 -8.551 19.197 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.265 -8.264 18.275 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.641 -6.607 16.848 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.683 -5.712 17.941 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.873 -7.437 17.546 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.535 -6.940 19.221 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.431 -4.804 18.542 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.277 -6.027 19.825 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.016 -5.882 18.578 1.00 0.00 H new ATOM 1338 N TYR A 78 -5.901 -9.310 15.650 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.193 -9.065 14.344 1.00 0.00 C ATOM 1340 C TYR A 78 -5.922 -9.817 13.216 1.00 0.00 C ATOM 1341 O TYR A 78 -6.029 -9.318 12.112 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.755 -9.593 14.514 1.00 0.00 C ATOM 1343 CG TYR A 78 -2.970 -9.393 13.236 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -2.950 -8.141 12.608 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.262 -10.464 12.680 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.222 -7.961 11.425 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.534 -10.286 11.496 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.514 -9.034 10.870 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.797 -8.858 9.704 1.00 0.00 O ATOM 0 H TYR A 78 -5.347 -9.780 16.366 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.181 -8.007 14.083 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.264 -9.073 15.336 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.777 -10.651 14.774 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.496 -7.314 13.036 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.277 -11.429 13.164 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.207 -6.995 10.941 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.989 -11.114 11.067 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.364 -9.701 9.456 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.445 -11.004 13.482 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.181 -11.747 12.399 1.00 0.00 C ATOM 1361 C ASP A 79 -8.523 -11.049 12.141 1.00 0.00 C ATOM 1362 O ASP A 79 -8.911 -10.841 11.007 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.411 -13.178 12.912 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.897 -14.061 11.762 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -8.878 -13.698 11.135 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -7.279 -15.088 11.528 1.00 0.00 O ATOM 0 H ASP A 79 -6.394 -11.479 14.383 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.617 -11.766 11.466 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.487 -13.580 13.327 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.146 -13.173 13.717 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.230 -10.664 13.188 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.545 -9.953 12.984 1.00 0.00 C ATOM 1373 C TRP A 80 -10.309 -8.659 12.179 1.00 0.00 C ATOM 1374 O TRP A 80 -11.108 -8.301 11.336 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.087 -9.622 14.390 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.390 -8.891 14.285 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.580 -9.459 13.985 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.651 -7.469 14.478 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.555 -8.477 13.981 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.031 -7.234 14.279 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.832 -6.374 14.801 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.580 -5.957 14.397 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.381 -5.087 14.920 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.752 -4.878 14.719 1.00 0.00 C ATOM 0 H TRP A 80 -8.959 -10.808 14.161 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.255 -10.567 12.431 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.222 -10.541 14.961 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.363 -9.014 14.932 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.743 -10.507 13.782 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.540 -8.650 13.782 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.774 -6.523 14.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.637 -5.803 14.241 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.742 -4.252 15.168 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.168 -3.886 14.813 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.216 -7.962 12.426 1.00 0.00 N ATOM 1396 CA LEU A 81 -8.950 -6.699 11.650 1.00 0.00 C ATOM 1397 C LEU A 81 -8.715 -7.044 10.171 1.00 0.00 C ATOM 1398 O LEU A 81 -9.317 -6.457 9.291 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.683 -6.065 12.249 1.00 0.00 C ATOM 1400 CG LEU A 81 -7.945 -5.662 13.701 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.617 -5.574 14.454 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.636 -4.300 13.731 1.00 0.00 C ATOM 0 H LEU A 81 -8.509 -8.208 13.119 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.794 -6.012 11.711 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.854 -6.771 12.201 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.391 -5.191 11.666 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.583 -6.407 14.176 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.804 -5.287 15.489 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.121 -6.544 14.431 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.979 -4.828 13.980 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.824 -4.010 14.765 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.996 -3.557 13.256 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.582 -4.360 13.193 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.850 -7.998 9.889 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.596 -8.372 8.449 1.00 0.00 C ATOM 1416 C ILE A 82 -8.906 -8.845 7.783 1.00 0.00 C ATOM 1417 O ILE A 82 -9.108 -8.629 6.602 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.547 -9.511 8.459 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.209 -8.998 9.028 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.317 -10.030 7.033 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.681 -7.827 8.189 1.00 0.00 C ATOM 0 H ILE A 82 -7.316 -8.527 10.579 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.231 -7.517 7.880 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.924 -10.319 9.086 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.345 -8.680 10.062 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.477 -9.806 9.037 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.578 -10.831 7.052 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.255 -10.412 6.629 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -5.955 -9.217 6.404 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.736 -7.478 8.605 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.525 -8.157 7.162 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.406 -7.013 8.203 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.796 -9.488 8.517 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.080 -9.963 7.887 1.00 0.00 C ATOM 1435 C LYS A 83 -12.199 -8.897 7.955 1.00 0.00 C ATOM 1436 O LYS A 83 -13.257 -9.096 7.385 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.500 -11.215 8.671 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.087 -12.251 7.709 1.00 0.00 C ATOM 1439 CD LYS A 83 -10.994 -13.237 7.290 1.00 0.00 C ATOM 1440 CE LYS A 83 -11.458 -14.034 6.068 1.00 0.00 C ATOM 1441 NZ LYS A 83 -10.761 -13.406 4.911 1.00 0.00 N ATOM 0 H LYS A 83 -9.691 -9.701 9.509 1.00 0.00 H new ATOM 0 HA LYS A 83 -10.922 -10.169 6.828 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.640 -11.635 9.193 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.236 -10.951 9.430 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -12.908 -12.784 8.189 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -12.500 -11.754 6.831 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -10.075 -12.699 7.058 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -10.767 -13.914 8.113 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -11.196 -15.088 6.162 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.541 -13.983 5.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -11.029 -13.899 4.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -11.034 -12.405 4.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -9.732 -13.475 5.046 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.000 -7.777 8.632 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.090 -6.746 8.696 1.00 0.00 C ATOM 1457 C GLU A 84 -12.688 -5.436 7.978 1.00 0.00 C ATOM 1458 O GLU A 84 -13.248 -4.391 8.248 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.287 -6.485 10.179 1.00 0.00 C ATOM 1460 CG GLU A 84 -13.755 -7.758 10.874 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.278 -7.869 10.770 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -15.801 -7.585 9.704 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.894 -8.235 11.757 1.00 0.00 O ATOM 0 H GLU A 84 -11.144 -7.540 9.133 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.995 -7.097 8.199 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.353 -6.140 10.623 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.020 -5.692 10.323 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.285 -8.628 10.416 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.452 -7.745 11.921 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.731 -5.481 7.063 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.283 -4.256 6.302 1.00 0.00 C ATOM 1472 C LYS A 85 -10.443 -3.327 7.182 1.00 0.00 C ATOM 1473 O LYS A 85 -10.916 -2.314 7.661 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.545 -3.541 5.787 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.301 -3.029 4.366 1.00 0.00 C ATOM 1476 CD LYS A 85 -11.717 -1.615 4.424 1.00 0.00 C ATOM 1477 CE LYS A 85 -10.188 -1.694 4.459 1.00 0.00 C ATOM 1478 NZ LYS A 85 -9.724 -0.520 3.670 1.00 0.00 N ATOM 0 H LYS A 85 -11.233 -6.334 6.809 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.646 -4.548 5.467 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.393 -4.226 5.797 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.799 -2.710 6.445 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.616 -3.695 3.841 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -13.235 -3.025 3.804 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -12.042 -1.040 3.557 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -12.085 -1.094 5.308 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.814 -1.655 5.482 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -9.831 -2.628 4.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -8.684 -0.505 3.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -10.090 -0.588 2.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.073 0.355 4.111 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.187 -3.668 7.394 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.300 -2.815 8.232 1.00 0.00 C ATOM 1494 C TYR A 86 -6.929 -2.689 7.558 1.00 0.00 C ATOM 1495 O TYR A 86 -6.521 -1.614 7.162 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.177 -3.564 9.558 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.410 -3.324 10.388 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.621 -3.960 10.069 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.339 -2.458 11.484 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.757 -3.719 10.857 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.472 -2.222 12.266 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.681 -2.851 11.953 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.800 -2.618 12.726 1.00 0.00 O ATOM 0 H TYR A 86 -8.745 -4.506 7.017 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.690 -1.807 8.370 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.052 -4.631 9.375 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.292 -3.227 10.097 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.678 -4.630 9.224 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.406 -1.971 11.726 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.692 -4.204 10.618 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.414 -1.554 13.112 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.525 -2.362 13.631 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.221 -3.787 7.412 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.885 -3.741 6.752 1.00 0.00 C ATOM 1515 C ALA A 87 -4.857 -4.747 5.593 1.00 0.00 C ATOM 1516 O ALA A 87 -5.865 -5.350 5.275 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.886 -4.140 7.839 1.00 0.00 C ATOM 0 H ALA A 87 -6.516 -4.712 7.724 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.652 -2.759 6.339 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.877 -4.129 7.427 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.948 -3.434 8.667 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.120 -5.142 8.199 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.721 -4.938 4.956 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.659 -5.908 3.824 1.00 0.00 C ATOM 1525 C ASP A 88 -2.614 -6.996 4.110 1.00 0.00 C ATOM 1526 O ASP A 88 -1.426 -6.768 3.971 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.245 -5.070 2.617 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.817 -5.692 1.342 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.833 -6.910 1.256 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.229 -4.942 0.473 1.00 0.00 O ATOM 0 H ASP A 88 -2.844 -4.465 5.173 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.608 -6.419 3.663 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.607 -4.048 2.729 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.158 -5.018 2.553 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.040 -8.182 4.500 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.041 -9.276 4.781 1.00 0.00 C ATOM 1537 C LYS A 89 -1.230 -9.580 3.514 1.00 0.00 C ATOM 1538 O LYS A 89 -0.033 -9.790 3.579 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.839 -10.517 5.208 1.00 0.00 C ATOM 1540 CG LYS A 89 -3.026 -10.506 6.725 1.00 0.00 C ATOM 1541 CD LYS A 89 -3.363 -11.918 7.208 1.00 0.00 C ATOM 1542 CE LYS A 89 -2.082 -12.751 7.274 1.00 0.00 C ATOM 1543 NZ LYS A 89 -2.538 -14.129 7.613 1.00 0.00 N ATOM 0 H LYS A 89 -4.018 -8.438 4.634 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.344 -8.977 5.564 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.809 -10.527 4.711 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.315 -11.422 4.902 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.117 -10.151 7.211 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.824 -9.816 6.999 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -3.834 -11.876 8.190 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -4.079 -12.385 6.531 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -1.550 -12.734 6.323 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -1.398 -12.364 8.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -1.715 -14.761 7.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -3.035 -14.115 8.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -3.183 -14.473 6.873 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.867 -9.600 2.358 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.098 -9.889 1.094 1.00 0.00 C ATOM 1559 C LEU A 90 -0.002 -8.830 0.902 1.00 0.00 C ATOM 1560 O LEU A 90 1.118 -9.154 0.551 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.105 -9.825 -0.065 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.437 -10.319 -1.348 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.113 -11.808 -1.214 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.387 -10.109 -2.528 1.00 0.00 C ATOM 0 H LEU A 90 -2.866 -9.432 2.235 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.619 -10.867 1.137 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.977 -10.438 0.163 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.459 -8.803 -0.197 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.516 -9.761 -1.517 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.637 -12.160 -2.129 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.438 -11.959 -0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.034 -12.367 -1.046 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.913 -10.461 -3.444 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.307 -10.668 -2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.619 -9.048 -2.624 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.306 -7.567 1.136 1.00 0.00 N ATOM 1577 CA LEU A 91 0.750 -6.506 0.967 1.00 0.00 C ATOM 1578 C LEU A 91 1.853 -6.734 2.003 1.00 0.00 C ATOM 1579 O LEU A 91 3.020 -6.795 1.663 1.00 0.00 O ATOM 1580 CB LEU A 91 0.071 -5.148 1.196 1.00 0.00 C ATOM 1581 CG LEU A 91 1.047 -4.017 0.856 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.435 -4.084 -0.624 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.376 -2.672 1.143 1.00 0.00 C ATOM 0 H LEU A 91 -1.222 -7.230 1.431 1.00 0.00 H new ATOM 0 HA LEU A 91 1.197 -6.539 -0.026 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.822 -5.069 0.577 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.252 -5.063 2.234 1.00 0.00 H new ATOM 0 HG LEU A 91 1.945 -4.123 1.464 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.129 -3.276 -0.855 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.911 -5.042 -0.832 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.541 -3.982 -1.239 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.066 -1.863 0.903 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.522 -2.576 0.533 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.106 -2.618 2.198 1.00 0.00 H new ATOM 1595 N ILE A 92 1.499 -6.890 3.268 1.00 0.00 N ATOM 1596 CA ILE A 92 2.561 -7.148 4.306 1.00 0.00 C ATOM 1597 C ILE A 92 3.319 -8.442 3.932 1.00 0.00 C ATOM 1598 O ILE A 92 4.518 -8.531 4.119 1.00 0.00 O ATOM 1599 CB ILE A 92 1.834 -7.281 5.666 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.256 -5.909 6.052 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.819 -7.745 6.749 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.535 -5.991 7.406 1.00 0.00 C ATOM 0 H ILE A 92 0.542 -6.851 3.619 1.00 0.00 H new ATOM 0 HA ILE A 92 3.293 -6.343 4.362 1.00 0.00 H new ATOM 0 HB ILE A 92 1.034 -8.016 5.582 1.00 0.00 H new ATOM 0 HG12 ILE A 92 2.057 -5.172 6.104 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.561 -5.571 5.283 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.297 -7.835 7.701 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.236 -8.713 6.471 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.624 -7.017 6.844 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.132 -5.011 7.664 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.279 -6.713 7.341 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.240 -6.307 8.175 1.00 0.00 H new ATOM 1614 N ALA A 93 2.636 -9.435 3.383 1.00 0.00 N ATOM 1615 CA ALA A 93 3.353 -10.696 2.982 1.00 0.00 C ATOM 1616 C ALA A 93 4.356 -10.377 1.861 1.00 0.00 C ATOM 1617 O ALA A 93 5.492 -10.813 1.905 1.00 0.00 O ATOM 1618 CB ALA A 93 2.284 -11.679 2.476 1.00 0.00 C ATOM 0 H ALA A 93 1.633 -9.425 3.200 1.00 0.00 H new ATOM 0 HA ALA A 93 3.902 -11.126 3.820 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.761 -12.611 2.173 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.568 -11.880 3.273 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.764 -11.244 1.623 1.00 0.00 H new ATOM 1624 N LYS A 94 3.958 -9.605 0.861 1.00 0.00 N ATOM 1625 CA LYS A 94 4.929 -9.262 -0.241 1.00 0.00 C ATOM 1626 C LYS A 94 6.144 -8.529 0.344 1.00 0.00 C ATOM 1627 O LYS A 94 7.272 -8.839 0.006 1.00 0.00 O ATOM 1628 CB LYS A 94 4.188 -8.365 -1.252 1.00 0.00 C ATOM 1629 CG LYS A 94 3.537 -9.237 -2.332 1.00 0.00 C ATOM 1630 CD LYS A 94 2.137 -8.718 -2.647 1.00 0.00 C ATOM 1631 CE LYS A 94 1.735 -9.152 -4.059 1.00 0.00 C ATOM 1632 NZ LYS A 94 1.708 -10.639 -4.012 1.00 0.00 N ATOM 0 H LYS A 94 3.024 -9.207 0.763 1.00 0.00 H new ATOM 0 HA LYS A 94 5.290 -10.164 -0.735 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.428 -7.774 -0.741 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.885 -7.662 -1.709 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.148 -9.230 -3.234 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.483 -10.271 -1.992 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.423 -9.104 -1.920 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.115 -7.631 -2.569 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.761 -8.748 -4.334 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.449 -8.793 -4.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.119 -11.000 -4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.676 -11.007 -4.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.311 -10.950 -3.103 1.00 0.00 H new ATOM 1646 N TRP A 95 5.935 -7.572 1.227 1.00 0.00 N ATOM 1647 CA TRP A 95 7.116 -6.848 1.829 1.00 0.00 C ATOM 1648 C TRP A 95 8.038 -7.848 2.551 1.00 0.00 C ATOM 1649 O TRP A 95 9.247 -7.703 2.531 1.00 0.00 O ATOM 1650 CB TRP A 95 6.556 -5.820 2.831 1.00 0.00 C ATOM 1651 CG TRP A 95 6.217 -4.536 2.127 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.930 -3.979 1.118 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.096 -3.637 2.374 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.315 -2.805 0.729 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.183 -2.550 1.472 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.021 -3.661 3.281 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.239 -1.523 1.470 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.068 -2.627 3.282 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.179 -1.561 2.378 1.00 0.00 C ATOM 0 H TRP A 95 5.019 -7.264 1.553 1.00 0.00 H new ATOM 0 HA TRP A 95 7.703 -6.353 1.056 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.667 -6.222 3.316 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.289 -5.630 3.615 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.833 -4.387 0.688 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.657 -2.200 -0.018 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.927 -4.478 3.981 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.327 -0.704 0.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.246 -2.654 3.983 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.445 -0.769 2.384 1.00 0.00 H new ATOM 1670 N ARG A 96 7.485 -8.870 3.176 1.00 0.00 N ATOM 1671 CA ARG A 96 8.355 -9.879 3.880 1.00 0.00 C ATOM 1672 C ARG A 96 8.843 -10.956 2.890 1.00 0.00 C ATOM 1673 O ARG A 96 9.917 -11.502 3.056 1.00 0.00 O ATOM 1674 CB ARG A 96 7.485 -10.513 4.976 1.00 0.00 C ATOM 1675 CG ARG A 96 7.154 -9.462 6.041 1.00 0.00 C ATOM 1676 CD ARG A 96 5.724 -9.675 6.547 1.00 0.00 C ATOM 1677 NE ARG A 96 5.828 -10.784 7.544 1.00 0.00 N ATOM 1678 CZ ARG A 96 6.351 -10.586 8.743 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.802 -9.407 9.108 1.00 0.00 N ATOM 1680 NH2 ARG A 96 6.424 -11.581 9.590 1.00 0.00 N ATOM 0 H ARG A 96 6.482 -9.048 3.229 1.00 0.00 H new ATOM 0 HA ARG A 96 9.241 -9.406 4.304 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.566 -10.908 4.542 1.00 0.00 H new ATOM 0 HB3 ARG A 96 8.010 -11.353 5.430 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.858 -9.535 6.870 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.257 -8.461 5.623 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.328 -8.768 7.005 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.052 -9.940 5.731 1.00 0.00 H new ATOM 0 HE ARG A 96 5.489 -11.713 7.295 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.753 -8.620 8.461 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.201 -9.279 10.038 1.00 0.00 H new ATOM 0 HH21 ARG A 96 6.079 -12.503 9.324 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.826 -11.434 10.516 1.00 0.00 H new ATOM 1694 N LYS A 97 8.071 -11.270 1.863 1.00 0.00 N ATOM 1695 CA LYS A 97 8.518 -12.320 0.869 1.00 0.00 C ATOM 1696 C LYS A 97 9.918 -11.988 0.319 1.00 0.00 C ATOM 1697 O LYS A 97 10.530 -11.014 0.714 1.00 0.00 O ATOM 1698 CB LYS A 97 7.507 -12.283 -0.288 1.00 0.00 C ATOM 1699 CG LYS A 97 6.354 -13.247 -0.025 1.00 0.00 C ATOM 1700 CD LYS A 97 6.880 -14.687 0.055 1.00 0.00 C ATOM 1701 CE LYS A 97 6.869 -15.164 1.510 1.00 0.00 C ATOM 1702 NZ LYS A 97 5.587 -15.908 1.661 1.00 0.00 N ATOM 0 H LYS A 97 7.161 -10.851 1.671 1.00 0.00 H new ATOM 0 HA LYS A 97 8.564 -13.300 1.345 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.121 -11.271 -0.409 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.004 -12.548 -1.221 1.00 0.00 H new ATOM 0 HG2 LYS A 97 5.853 -12.982 0.906 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.613 -13.166 -0.820 1.00 0.00 H new ATOM 0 HD2 LYS A 97 6.262 -15.344 -0.557 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.892 -14.737 -0.346 1.00 0.00 H new ATOM 0 HE2 LYS A 97 7.725 -15.805 1.722 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.921 -14.323 2.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 5.506 -16.267 2.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 4.790 -15.271 1.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.569 -16.707 0.995 1.00 0.00 H new ATOM 1716 N THR A 98 10.420 -12.781 -0.608 1.00 0.00 N ATOM 1717 CA THR A 98 11.769 -12.488 -1.191 1.00 0.00 C ATOM 1718 C THR A 98 11.603 -11.844 -2.575 1.00 0.00 C ATOM 1719 O THR A 98 10.801 -12.288 -3.376 1.00 0.00 O ATOM 1720 CB THR A 98 12.483 -13.846 -1.308 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.349 -14.578 -0.083 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.965 -13.619 -1.631 1.00 0.00 C ATOM 0 H THR A 98 9.956 -13.609 -0.980 1.00 0.00 H new ATOM 0 HA THR A 98 12.341 -11.796 -0.573 1.00 0.00 H new ATOM 0 HB THR A 98 12.027 -14.426 -2.111 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.805 -15.442 -0.166 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.471 -14.581 -1.714 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.053 -13.080 -2.574 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.426 -13.034 -0.835 1.00 0.00 H new ATOM 1730 N GLY A 99 12.342 -10.794 -2.863 1.00 0.00 N ATOM 1731 CA GLY A 99 12.209 -10.121 -4.190 1.00 0.00 C ATOM 1732 C GLY A 99 11.272 -8.894 -4.100 1.00 0.00 C ATOM 1733 O GLY A 99 10.903 -8.332 -5.114 1.00 0.00 O ATOM 0 H GLY A 99 13.029 -10.378 -2.234 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.192 -9.807 -4.542 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.819 -10.828 -4.922 1.00 0.00 H new ATOM 1737 N TYR A 100 10.885 -8.458 -2.909 1.00 0.00 N ATOM 1738 CA TYR A 100 9.988 -7.269 -2.800 1.00 0.00 C ATOM 1739 C TYR A 100 10.704 -6.151 -2.026 1.00 0.00 C ATOM 1740 O TYR A 100 10.370 -5.865 -0.891 1.00 0.00 O ATOM 1741 CB TYR A 100 8.771 -7.764 -2.019 1.00 0.00 C ATOM 1742 CG TYR A 100 7.924 -8.646 -2.901 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.302 -8.117 -4.036 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.759 -9.997 -2.577 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.513 -8.939 -4.850 1.00 0.00 C ATOM 1746 CE2 TYR A 100 6.972 -10.820 -3.387 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.348 -10.292 -4.524 1.00 0.00 C ATOM 1748 OH TYR A 100 5.570 -11.104 -5.325 1.00 0.00 O ATOM 0 H TYR A 100 11.156 -8.879 -2.020 1.00 0.00 H new ATOM 0 HA TYR A 100 9.709 -6.864 -3.773 1.00 0.00 H new ATOM 0 HB2 TYR A 100 9.094 -8.318 -1.137 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.184 -6.916 -1.666 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.430 -7.074 -4.285 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.240 -10.404 -1.700 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.033 -8.531 -5.727 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.845 -11.863 -3.136 1.00 0.00 H new ATOM 0 HH TYR A 100 5.561 -12.013 -4.959 1.00 0.00 H new ATOM 1758 N GLU A 101 11.690 -5.519 -2.625 1.00 0.00 N ATOM 1759 CA GLU A 101 12.421 -4.422 -1.904 1.00 0.00 C ATOM 1760 C GLU A 101 11.826 -3.047 -2.251 1.00 0.00 C ATOM 1761 O GLU A 101 11.811 -2.157 -1.421 1.00 0.00 O ATOM 1762 CB GLU A 101 13.881 -4.507 -2.368 1.00 0.00 C ATOM 1763 CG GLU A 101 14.790 -3.874 -1.314 1.00 0.00 C ATOM 1764 CD GLU A 101 16.236 -3.886 -1.811 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.525 -3.158 -2.748 1.00 0.00 O ATOM 1766 OE2 GLU A 101 17.029 -4.622 -1.249 1.00 0.00 O ATOM 0 H GLU A 101 12.018 -5.712 -3.571 1.00 0.00 H new ATOM 0 HA GLU A 101 12.337 -4.538 -0.823 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.163 -5.548 -2.528 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.001 -3.994 -3.322 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.473 -2.851 -1.112 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.713 -4.423 -0.375 1.00 0.00 H new ATOM 1773 N LYS A 102 11.346 -2.852 -3.466 1.00 0.00 N ATOM 1774 CA LYS A 102 10.773 -1.521 -3.831 1.00 0.00 C ATOM 1775 C LYS A 102 9.382 -1.676 -4.469 1.00 0.00 C ATOM 1776 O LYS A 102 9.234 -1.556 -5.672 1.00 0.00 O ATOM 1777 CB LYS A 102 11.761 -0.938 -4.842 1.00 0.00 C ATOM 1778 CG LYS A 102 12.929 -0.283 -4.100 1.00 0.00 C ATOM 1779 CD LYS A 102 12.663 1.218 -3.943 1.00 0.00 C ATOM 1780 CE LYS A 102 13.423 1.992 -5.024 1.00 0.00 C ATOM 1781 NZ LYS A 102 13.961 3.195 -4.329 1.00 0.00 N ATOM 0 H LYS A 102 11.329 -3.553 -4.207 1.00 0.00 H new ATOM 0 HA LYS A 102 10.642 -0.881 -2.959 1.00 0.00 H new ATOM 0 HB2 LYS A 102 12.130 -1.725 -5.500 1.00 0.00 H new ATOM 0 HB3 LYS A 102 11.260 -0.204 -5.473 1.00 0.00 H new ATOM 0 HG2 LYS A 102 13.055 -0.744 -3.121 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.857 -0.442 -4.649 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.594 1.418 -4.022 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.977 1.552 -2.954 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.226 1.390 -5.450 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.764 2.272 -5.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.495 3.777 -5.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.174 3.752 -3.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.590 2.897 -3.556 1.00 0.00 H new ATOM 1795 N LEU A 103 8.354 -1.922 -3.678 1.00 0.00 N ATOM 1796 CA LEU A 103 6.986 -2.057 -4.261 1.00 0.00 C ATOM 1797 C LEU A 103 6.018 -1.078 -3.559 1.00 0.00 C ATOM 1798 O LEU A 103 6.295 -0.611 -2.470 1.00 0.00 O ATOM 1799 CB LEU A 103 6.589 -3.534 -4.054 1.00 0.00 C ATOM 1800 CG LEU A 103 6.149 -3.802 -2.608 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.652 -3.503 -2.471 1.00 0.00 C ATOM 1802 CD2 LEU A 103 6.410 -5.269 -2.261 1.00 0.00 C ATOM 0 H LEU A 103 8.410 -2.033 -2.666 1.00 0.00 H new ATOM 0 HA LEU A 103 6.951 -1.805 -5.321 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.779 -3.793 -4.736 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.433 -4.177 -4.303 1.00 0.00 H new ATOM 0 HG LEU A 103 6.713 -3.163 -1.929 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.336 -3.692 -1.445 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.465 -2.459 -2.722 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.089 -4.145 -3.149 1.00 0.00 H new ATOM 0 HD21 LEU A 103 6.098 -5.461 -1.234 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.844 -5.909 -2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.474 -5.483 -2.363 1.00 0.00 H new ATOM 1814 N CYS A 104 4.905 -0.748 -4.181 1.00 0.00 N ATOM 1815 CA CYS A 104 3.956 0.223 -3.541 1.00 0.00 C ATOM 1816 C CYS A 104 2.542 -0.355 -3.289 1.00 0.00 C ATOM 1817 O CYS A 104 1.913 0.016 -2.320 1.00 0.00 O ATOM 1818 CB CYS A 104 3.923 1.439 -4.474 1.00 0.00 C ATOM 1819 SG CYS A 104 3.371 0.992 -6.142 1.00 0.00 S ATOM 0 H CYS A 104 4.617 -1.104 -5.092 1.00 0.00 H new ATOM 0 HA CYS A 104 4.303 0.483 -2.541 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.256 2.196 -4.061 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.917 1.884 -4.527 1.00 0.00 H new ATOM 1824 N CYS A 105 2.021 -1.243 -4.115 1.00 0.00 N ATOM 1825 CA CYS A 105 0.645 -1.791 -3.832 1.00 0.00 C ATOM 1826 C CYS A 105 0.596 -3.297 -4.147 1.00 0.00 C ATOM 1827 O CYS A 105 1.618 -3.920 -4.368 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.343 -1.057 -4.756 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.027 0.732 -4.836 1.00 0.00 S ATOM 0 H CYS A 105 2.476 -1.605 -4.953 1.00 0.00 H new ATOM 0 HA CYS A 105 0.392 -1.645 -2.782 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.279 -1.479 -5.759 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.360 -1.227 -4.403 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.588 -3.887 -4.187 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.686 -5.352 -4.510 1.00 0.00 C ATOM 1836 C LEU A 106 -0.972 -5.544 -6.009 1.00 0.00 C ATOM 1837 O LEU A 106 -0.406 -6.418 -6.639 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.839 -5.903 -3.661 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.406 -6.019 -2.196 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.574 -6.564 -1.371 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.206 -6.973 -2.076 1.00 0.00 C ATOM 0 H LEU A 106 -1.478 -3.420 -4.012 1.00 0.00 H new ATOM 0 HA LEU A 106 0.245 -5.875 -4.290 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.706 -5.247 -3.741 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.143 -6.880 -4.037 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.116 -5.036 -1.826 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.273 -6.649 -0.327 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.423 -5.885 -1.450 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.859 -7.546 -1.748 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.095 -7.049 -1.031 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.487 -7.959 -2.446 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.626 -6.588 -2.666 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.814 -4.714 -6.603 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.082 -4.845 -8.077 1.00 0.00 C ATOM 1855 C ARG A 107 -1.272 -3.783 -8.860 1.00 0.00 C ATOM 1856 O ARG A 107 -1.674 -3.348 -9.921 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.588 -4.614 -8.251 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.071 -5.288 -9.545 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.282 -6.178 -9.247 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.208 -5.971 -10.402 1.00 0.00 N ATOM 1861 CZ ARG A 107 -6.939 -4.873 -10.509 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -6.880 -3.918 -9.607 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -7.740 -4.726 -11.533 1.00 0.00 N ATOM 0 H ARG A 107 -2.319 -3.962 -6.134 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.785 -5.822 -8.459 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.129 -5.019 -7.395 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.800 -3.545 -8.286 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -4.338 -4.531 -10.282 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.267 -5.885 -9.977 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -4.990 -7.224 -9.158 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.756 -5.898 -8.306 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.278 -6.690 -11.122 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -6.261 -4.014 -8.802 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -7.454 -3.081 -9.712 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -7.799 -5.456 -12.243 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -8.306 -3.882 -11.621 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.138 -3.361 -8.337 1.00 0.00 N ATOM 1878 CA CYS A 108 0.707 -2.331 -9.020 1.00 0.00 C ATOM 1879 C CYS A 108 2.155 -2.887 -9.171 1.00 0.00 C ATOM 1880 O CYS A 108 3.079 -2.139 -9.419 1.00 0.00 O ATOM 1881 CB CYS A 108 0.657 -1.185 -7.996 1.00 0.00 C ATOM 1882 SG CYS A 108 0.774 0.479 -8.696 1.00 0.00 S ATOM 0 H CYS A 108 0.240 -3.696 -7.451 1.00 0.00 H new ATOM 0 HA CYS A 108 0.383 -2.039 -10.019 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.274 -1.261 -7.435 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.471 -1.320 -7.283 1.00 0.00 H new ATOM 1887 N ILE A 109 2.361 -4.200 -9.005 1.00 0.00 N ATOM 1888 CA ILE A 109 3.740 -4.793 -9.111 1.00 0.00 C ATOM 1889 C ILE A 109 3.658 -6.306 -9.434 1.00 0.00 C ATOM 1890 O ILE A 109 4.436 -7.084 -8.913 1.00 0.00 O ATOM 1891 CB ILE A 109 4.361 -4.628 -7.705 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.452 -5.299 -6.648 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.528 -3.146 -7.361 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.285 -6.215 -5.743 1.00 0.00 C ATOM 0 H ILE A 109 1.623 -4.874 -8.801 1.00 0.00 H new ATOM 0 HA ILE A 109 4.319 -4.308 -9.897 1.00 0.00 H new ATOM 0 HB ILE A 109 5.341 -5.105 -7.703 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.954 -4.537 -6.048 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.671 -5.876 -7.142 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.966 -3.050 -6.368 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.183 -2.674 -8.094 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.554 -2.657 -7.376 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.636 -6.683 -5.002 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.762 -6.987 -6.347 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.050 -5.627 -5.236 1.00 0.00 H new ATOM 1906 N GLN A 110 2.713 -6.740 -10.247 1.00 0.00 N ATOM 1907 CA GLN A 110 2.598 -8.209 -10.532 1.00 0.00 C ATOM 1908 C GLN A 110 2.825 -8.522 -12.020 1.00 0.00 C ATOM 1909 O GLN A 110 2.272 -7.873 -12.886 1.00 0.00 O ATOM 1910 CB GLN A 110 1.169 -8.573 -10.127 1.00 0.00 C ATOM 1911 CG GLN A 110 1.152 -9.977 -9.518 1.00 0.00 C ATOM 1912 CD GLN A 110 -0.272 -10.544 -9.580 1.00 0.00 C ATOM 1913 OE1 GLN A 110 -0.694 -11.034 -10.608 1.00 0.00 O ATOM 1914 NE2 GLN A 110 -1.040 -10.500 -8.518 1.00 0.00 N ATOM 0 H GLN A 110 2.028 -6.148 -10.717 1.00 0.00 H new ATOM 0 HA GLN A 110 3.351 -8.779 -9.988 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.788 -7.848 -9.407 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.512 -8.534 -10.996 1.00 0.00 H new ATOM 0 HG2 GLN A 110 1.838 -10.628 -10.060 1.00 0.00 H new ATOM 0 HG3 GLN A 110 1.496 -9.941 -8.484 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -0.690 -10.089 -7.652 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -1.987 -10.876 -8.558 1.00 0.00 H new ATOM 1923 N LYS A 111 3.622 -9.529 -12.323 1.00 0.00 N ATOM 1924 CA LYS A 111 3.871 -9.890 -13.751 1.00 0.00 C ATOM 1925 C LYS A 111 3.675 -11.403 -13.956 1.00 0.00 C ATOM 1926 O LYS A 111 3.191 -12.082 -13.076 1.00 0.00 O ATOM 1927 CB LYS A 111 5.324 -9.477 -14.021 1.00 0.00 C ATOM 1928 CG LYS A 111 6.270 -10.235 -13.084 1.00 0.00 C ATOM 1929 CD LYS A 111 7.714 -10.040 -13.551 1.00 0.00 C ATOM 1930 CE LYS A 111 8.222 -8.674 -13.084 1.00 0.00 C ATOM 1931 NZ LYS A 111 8.645 -8.882 -11.672 1.00 0.00 N ATOM 0 H LYS A 111 4.106 -10.111 -11.640 1.00 0.00 H new ATOM 0 HA LYS A 111 3.182 -9.392 -14.433 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.583 -9.686 -15.059 1.00 0.00 H new ATOM 0 HB3 LYS A 111 5.438 -8.403 -13.875 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.155 -9.873 -12.062 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.019 -11.296 -13.076 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.347 -10.832 -13.150 1.00 0.00 H new ATOM 0 HD3 LYS A 111 7.768 -10.108 -14.638 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.054 -8.331 -13.699 1.00 0.00 H new ATOM 0 HE3 LYS A 111 7.441 -7.917 -13.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 8.394 -8.045 -11.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 8.163 -9.718 -11.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 9.674 -9.028 -11.636 1.00 0.00 H new ATOM 1945 N ASN A 112 4.048 -11.931 -15.112 1.00 0.00 N ATOM 1946 CA ASN A 112 3.889 -13.400 -15.394 1.00 0.00 C ATOM 1947 C ASN A 112 2.408 -13.831 -15.317 1.00 0.00 C ATOM 1948 O ASN A 112 1.786 -14.061 -16.338 1.00 0.00 O ATOM 1949 CB ASN A 112 4.746 -14.141 -14.354 1.00 0.00 C ATOM 1950 CG ASN A 112 6.230 -13.871 -14.631 1.00 0.00 C ATOM 1951 OD1 ASN A 112 6.608 -13.608 -15.755 1.00 0.00 O ATOM 1952 ND2 ASN A 112 7.099 -13.924 -13.649 1.00 0.00 N ATOM 0 H ASN A 112 4.460 -11.396 -15.877 1.00 0.00 H new ATOM 0 HA ASN A 112 4.217 -13.639 -16.406 1.00 0.00 H new ATOM 0 HB2 ASN A 112 4.486 -13.809 -13.349 1.00 0.00 H new ATOM 0 HB3 ASN A 112 4.545 -15.212 -14.398 1.00 0.00 H new ATOM 0 HD21 ASN A 112 8.086 -13.745 -13.832 1.00 0.00 H new ATOM 0 HD22 ASN A 112 6.787 -14.144 -12.703 1.00 0.00 H new ATOM 1959 N GLU A 113 1.834 -13.944 -14.135 1.00 0.00 N ATOM 1960 CA GLU A 113 0.401 -14.361 -14.037 1.00 0.00 C ATOM 1961 C GLU A 113 -0.456 -13.199 -13.510 1.00 0.00 C ATOM 1962 O GLU A 113 -0.193 -12.665 -12.448 1.00 0.00 O ATOM 1963 CB GLU A 113 0.387 -15.529 -13.049 1.00 0.00 C ATOM 1964 CG GLU A 113 0.438 -16.850 -13.818 1.00 0.00 C ATOM 1965 CD GLU A 113 -0.907 -17.092 -14.506 1.00 0.00 C ATOM 1966 OE1 GLU A 113 -1.915 -17.053 -13.819 1.00 0.00 O ATOM 1967 OE2 GLU A 113 -0.905 -17.312 -15.706 1.00 0.00 O ATOM 0 H GLU A 113 2.297 -13.766 -13.244 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.010 -14.646 -15.006 1.00 0.00 H new ATOM 0 HB2 GLU A 113 1.239 -15.457 -12.373 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -0.512 -15.488 -12.435 1.00 0.00 H new ATOM 0 HG2 GLU A 113 1.237 -16.821 -14.558 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.663 -17.671 -13.137 1.00 0.00 H new ATOM 1974 N THR A 114 -1.480 -12.801 -14.239 1.00 0.00 N ATOM 1975 CA THR A 114 -2.342 -11.675 -13.769 1.00 0.00 C ATOM 1976 C THR A 114 -3.825 -12.009 -14.002 1.00 0.00 C ATOM 1977 O THR A 114 -4.151 -13.069 -14.504 1.00 0.00 O ATOM 1978 CB THR A 114 -1.924 -10.475 -14.618 1.00 0.00 C ATOM 1979 OG1 THR A 114 -1.857 -10.862 -15.983 1.00 0.00 O ATOM 1980 CG2 THR A 114 -0.551 -9.977 -14.161 1.00 0.00 C ATOM 0 H THR A 114 -1.750 -13.209 -15.134 1.00 0.00 H new ATOM 0 HA THR A 114 -2.223 -11.481 -12.703 1.00 0.00 H new ATOM 0 HB THR A 114 -2.656 -9.676 -14.501 1.00 0.00 H new ATOM 0 HG1 THR A 114 -1.591 -10.093 -16.528 1.00 0.00 H new ATOM 0 HG21 THR A 114 -0.254 -9.121 -14.767 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.602 -9.679 -13.114 1.00 0.00 H new ATOM 0 HG23 THR A 114 0.182 -10.775 -14.276 1.00 0.00 H new ATOM 1988 N ASN A 115 -4.726 -11.116 -13.645 1.00 0.00 N ATOM 1989 CA ASN A 115 -6.179 -11.394 -13.851 1.00 0.00 C ATOM 1990 C ASN A 115 -6.792 -10.351 -14.800 1.00 0.00 C ATOM 1991 O ASN A 115 -7.352 -10.697 -15.824 1.00 0.00 O ATOM 1992 CB ASN A 115 -6.806 -11.288 -12.460 1.00 0.00 C ATOM 1993 CG ASN A 115 -8.052 -12.181 -12.392 1.00 0.00 C ATOM 1994 OD1 ASN A 115 -7.959 -13.339 -12.036 1.00 0.00 O ATOM 1995 ND2 ASN A 115 -9.224 -11.693 -12.717 1.00 0.00 N ATOM 0 H ASN A 115 -4.513 -10.212 -13.222 1.00 0.00 H new ATOM 0 HA ASN A 115 -6.351 -12.372 -14.301 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -6.086 -11.592 -11.700 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -7.075 -10.253 -12.248 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -10.054 -12.285 -12.671 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -9.307 -10.721 -13.016 1.00 0.00 H new ATOM 2002 N ASN A 116 -6.695 -9.077 -14.473 1.00 0.00 N ATOM 2003 CA ASN A 116 -7.276 -8.028 -15.363 1.00 0.00 C ATOM 2004 C ASN A 116 -6.191 -7.018 -15.772 1.00 0.00 C ATOM 2005 O ASN A 116 -5.811 -6.165 -14.992 1.00 0.00 O ATOM 2006 CB ASN A 116 -8.352 -7.345 -14.519 1.00 0.00 C ATOM 2007 CG ASN A 116 -9.709 -8.008 -14.783 1.00 0.00 C ATOM 2008 OD1 ASN A 116 -10.052 -8.983 -14.143 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -10.506 -7.524 -15.706 1.00 0.00 N ATOM 0 H ASN A 116 -6.239 -8.726 -13.630 1.00 0.00 H new ATOM 0 HA ASN A 116 -7.684 -8.446 -16.283 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -8.100 -7.418 -13.461 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -8.401 -6.284 -14.763 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -11.408 -7.966 -15.883 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -10.223 -6.706 -16.246 1.00 0.00 H new ATOM 2016 N GLY A 117 -5.688 -7.105 -16.988 1.00 0.00 N ATOM 2017 CA GLY A 117 -4.632 -6.147 -17.431 1.00 0.00 C ATOM 2018 C GLY A 117 -3.252 -6.802 -17.285 1.00 0.00 C ATOM 2019 O GLY A 117 -3.103 -7.989 -17.510 1.00 0.00 O ATOM 0 H GLY A 117 -5.966 -7.797 -17.684 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -4.801 -5.857 -18.468 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -4.679 -5.236 -16.834 1.00 0.00 H new ATOM 2023 N SER A 118 -2.240 -6.045 -16.911 1.00 0.00 N ATOM 2024 CA SER A 118 -0.878 -6.641 -16.756 1.00 0.00 C ATOM 2025 C SER A 118 -0.122 -5.956 -15.605 1.00 0.00 C ATOM 2026 O SER A 118 -0.707 -5.224 -14.829 1.00 0.00 O ATOM 2027 CB SER A 118 -0.180 -6.375 -18.090 1.00 0.00 C ATOM 2028 OG SER A 118 -1.015 -6.816 -19.152 1.00 0.00 O ATOM 0 H SER A 118 -2.303 -5.047 -16.709 1.00 0.00 H new ATOM 0 HA SER A 118 -0.917 -7.704 -16.518 1.00 0.00 H new ATOM 0 HB2 SER A 118 0.033 -5.311 -18.197 1.00 0.00 H new ATOM 0 HB3 SER A 118 0.777 -6.896 -18.124 1.00 0.00 H new ATOM 0 HG SER A 118 -0.572 -6.646 -20.009 1.00 0.00 H new ATOM 2034 N THR A 119 1.172 -6.185 -15.486 1.00 0.00 N ATOM 2035 CA THR A 119 1.944 -5.527 -14.369 1.00 0.00 C ATOM 2036 C THR A 119 1.862 -4.003 -14.503 1.00 0.00 C ATOM 2037 O THR A 119 1.432 -3.492 -15.521 1.00 0.00 O ATOM 2038 CB THR A 119 3.408 -5.977 -14.513 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.446 -7.319 -14.975 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.115 -5.878 -13.157 1.00 0.00 C ATOM 0 H THR A 119 1.719 -6.787 -16.101 1.00 0.00 H new ATOM 0 HA THR A 119 1.537 -5.808 -13.398 1.00 0.00 H new ATOM 0 HB THR A 119 3.917 -5.332 -15.229 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.723 -7.830 -14.555 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.152 -6.198 -13.263 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.087 -4.846 -12.807 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.609 -6.520 -12.435 1.00 0.00 H new ATOM 2048 N CYS A 120 2.291 -3.270 -13.496 1.00 0.00 N ATOM 2049 CA CYS A 120 2.250 -1.780 -13.599 1.00 0.00 C ATOM 2050 C CYS A 120 3.618 -1.269 -14.078 1.00 0.00 C ATOM 2051 O CYS A 120 4.624 -1.927 -13.884 1.00 0.00 O ATOM 2052 CB CYS A 120 1.936 -1.258 -12.196 1.00 0.00 C ATOM 2053 SG CYS A 120 1.696 0.526 -12.287 1.00 0.00 S ATOM 0 H CYS A 120 2.662 -3.638 -12.620 1.00 0.00 H new ATOM 0 HA CYS A 120 1.498 -1.439 -14.311 1.00 0.00 H new ATOM 0 HB2 CYS A 120 1.041 -1.741 -11.804 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.751 -1.496 -11.513 1.00 0.00 H new ATOM 2058 N ILE A 121 3.670 -0.119 -14.716 1.00 0.00 N ATOM 2059 CA ILE A 121 4.996 0.396 -15.216 1.00 0.00 C ATOM 2060 C ILE A 121 5.883 0.864 -14.046 1.00 0.00 C ATOM 2061 O ILE A 121 7.087 0.691 -14.083 1.00 0.00 O ATOM 2062 CB ILE A 121 4.676 1.558 -16.188 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.939 1.938 -16.995 1.00 0.00 C ATOM 2064 CG2 ILE A 121 4.128 2.778 -15.427 1.00 0.00 C ATOM 2065 CD1 ILE A 121 7.000 2.638 -16.124 1.00 0.00 C ATOM 0 H ILE A 121 2.867 0.479 -14.911 1.00 0.00 H new ATOM 0 HA ILE A 121 5.557 -0.387 -15.725 1.00 0.00 H new ATOM 0 HB ILE A 121 3.904 1.225 -16.882 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.370 1.039 -17.436 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.658 2.594 -17.819 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.911 3.580 -16.133 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.214 2.499 -14.903 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.870 3.120 -14.706 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.868 2.885 -16.736 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.580 3.552 -15.704 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.304 1.973 -15.316 1.00 0.00 H new ATOM 2077 N CYS A 122 5.316 1.470 -13.020 1.00 0.00 N ATOM 2078 CA CYS A 122 6.182 1.958 -11.883 1.00 0.00 C ATOM 2079 C CYS A 122 7.063 0.819 -11.326 1.00 0.00 C ATOM 2080 O CYS A 122 8.193 1.051 -10.937 1.00 0.00 O ATOM 2081 CB CYS A 122 5.232 2.569 -10.818 1.00 0.00 C ATOM 2082 SG CYS A 122 4.423 1.291 -9.805 1.00 0.00 S ATOM 0 H CYS A 122 4.316 1.645 -12.919 1.00 0.00 H new ATOM 0 HA CYS A 122 6.885 2.721 -12.219 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.798 3.239 -10.171 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.472 3.172 -11.315 1.00 0.00 H new ATOM 2087 N ARG A 123 6.578 -0.408 -11.310 1.00 0.00 N ATOM 2088 CA ARG A 123 7.443 -1.537 -10.802 1.00 0.00 C ATOM 2089 C ARG A 123 8.720 -1.633 -11.658 1.00 0.00 C ATOM 2090 O ARG A 123 9.783 -1.948 -11.154 1.00 0.00 O ATOM 2091 CB ARG A 123 6.623 -2.829 -10.943 1.00 0.00 C ATOM 2092 CG ARG A 123 7.049 -3.825 -9.863 1.00 0.00 C ATOM 2093 CD ARG A 123 6.943 -5.250 -10.412 1.00 0.00 C ATOM 2094 NE ARG A 123 8.107 -5.394 -11.339 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.343 -5.517 -10.879 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.597 -5.520 -9.590 1.00 0.00 N ATOM 2097 NH2 ARG A 123 10.336 -5.641 -11.721 1.00 0.00 N ATOM 0 H ARG A 123 5.643 -0.675 -11.619 1.00 0.00 H new ATOM 0 HA ARG A 123 7.735 -1.373 -9.765 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.559 -2.609 -10.850 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.774 -3.262 -11.932 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.072 -3.620 -9.548 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.416 -3.715 -8.982 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.984 -5.986 -9.609 1.00 0.00 H new ATOM 0 HD3 ARG A 123 6.000 -5.402 -10.936 1.00 0.00 H new ATOM 0 HE ARG A 123 7.946 -5.398 -12.346 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.834 -5.426 -8.920 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.557 -5.616 -9.260 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.156 -5.643 -12.725 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.290 -5.736 -11.374 1.00 0.00 H new ATOM 2111 N VAL A 124 8.630 -1.357 -12.948 1.00 0.00 N ATOM 2112 CA VAL A 124 9.857 -1.431 -13.816 1.00 0.00 C ATOM 2113 C VAL A 124 10.700 -0.154 -13.643 1.00 0.00 C ATOM 2114 O VAL A 124 10.197 0.935 -13.836 1.00 0.00 O ATOM 2115 CB VAL A 124 9.358 -1.538 -15.268 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.553 -1.680 -16.213 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.447 -2.760 -15.410 1.00 0.00 C ATOM 0 H VAL A 124 7.772 -1.088 -13.429 1.00 0.00 H new ATOM 0 HA VAL A 124 10.481 -2.284 -13.548 1.00 0.00 H new ATOM 0 HB VAL A 124 8.799 -0.638 -15.523 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.197 -1.756 -17.241 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.199 -0.808 -16.116 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.115 -2.578 -15.957 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.095 -2.834 -16.439 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.004 -3.661 -15.152 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.593 -2.657 -14.741 1.00 0.00 H new ATOM 2127 N PRO A 125 11.961 -0.313 -13.292 1.00 0.00 N ATOM 2128 CA PRO A 125 12.848 0.869 -13.114 1.00 0.00 C ATOM 2129 C PRO A 125 13.056 1.602 -14.450 1.00 0.00 C ATOM 2130 O PRO A 125 12.544 1.188 -15.473 1.00 0.00 O ATOM 2131 CB PRO A 125 14.159 0.263 -12.607 1.00 0.00 C ATOM 2132 CG PRO A 125 14.125 -1.152 -13.079 1.00 0.00 C ATOM 2133 CD PRO A 125 12.681 -1.569 -13.033 1.00 0.00 C ATOM 0 HA PRO A 125 12.436 1.611 -12.430 1.00 0.00 H new ATOM 0 HB2 PRO A 125 15.023 0.794 -13.007 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.227 0.317 -11.520 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.523 -1.236 -14.090 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.736 -1.791 -12.442 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.456 -2.325 -13.785 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.415 -1.994 -12.065 1.00 0.00 H new ATOM 2141 N ARG A 126 13.802 2.692 -14.450 1.00 0.00 N ATOM 2142 CA ARG A 126 14.028 3.444 -15.738 1.00 0.00 C ATOM 2143 C ARG A 126 15.028 2.692 -16.632 1.00 0.00 C ATOM 2144 O ARG A 126 14.877 2.666 -17.839 1.00 0.00 O ATOM 2145 CB ARG A 126 14.593 4.821 -15.354 1.00 0.00 C ATOM 2146 CG ARG A 126 13.440 5.781 -15.055 1.00 0.00 C ATOM 2147 CD ARG A 126 12.800 6.237 -16.368 1.00 0.00 C ATOM 2148 NE ARG A 126 12.467 7.680 -16.157 1.00 0.00 N ATOM 2149 CZ ARG A 126 13.413 8.604 -16.107 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.682 8.293 -16.240 1.00 0.00 N ATOM 2151 NH2 ARG A 126 13.084 9.857 -15.921 1.00 0.00 N ATOM 0 H ARG A 126 14.257 3.088 -13.628 1.00 0.00 H new ATOM 0 HA ARG A 126 13.098 3.542 -16.298 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.240 4.730 -14.481 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.206 5.214 -16.165 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.697 5.289 -14.428 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.806 6.643 -14.498 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.485 6.109 -17.206 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.907 5.655 -16.594 1.00 0.00 H new ATOM 0 HE ARG A 126 11.491 7.957 -16.050 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.956 7.321 -16.385 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.393 9.023 -16.198 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.103 10.117 -15.816 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.808 10.574 -15.881 1.00 0.00 H new ATOM 2165 N ALA A 127 16.051 2.082 -16.060 1.00 0.00 N ATOM 2166 CA ALA A 127 17.049 1.342 -16.918 1.00 0.00 C ATOM 2167 C ALA A 127 16.337 0.248 -17.725 1.00 0.00 C ATOM 2168 O ALA A 127 16.599 0.076 -18.901 1.00 0.00 O ATOM 2169 CB ALA A 127 18.078 0.713 -15.964 1.00 0.00 C ATOM 0 H ALA A 127 16.236 2.064 -15.057 1.00 0.00 H new ATOM 0 HA ALA A 127 17.535 2.015 -17.624 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.823 0.165 -16.542 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.570 1.498 -15.390 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.572 0.029 -15.283 1.00 0.00 H new ATOM 2175 N GLN A 128 15.428 -0.486 -17.112 1.00 0.00 N ATOM 2176 CA GLN A 128 14.702 -1.555 -17.884 1.00 0.00 C ATOM 2177 C GLN A 128 13.779 -0.892 -18.914 1.00 0.00 C ATOM 2178 O GLN A 128 13.694 -1.331 -20.047 1.00 0.00 O ATOM 2179 CB GLN A 128 13.881 -2.363 -16.867 1.00 0.00 C ATOM 2180 CG GLN A 128 13.411 -3.667 -17.514 1.00 0.00 C ATOM 2181 CD GLN A 128 13.302 -4.761 -16.444 1.00 0.00 C ATOM 2182 OE1 GLN A 128 12.707 -4.549 -15.407 1.00 0.00 O ATOM 2183 NE2 GLN A 128 13.856 -5.932 -16.649 1.00 0.00 N ATOM 0 H GLN A 128 15.162 -0.394 -16.132 1.00 0.00 H new ATOM 0 HA GLN A 128 15.394 -2.208 -18.416 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.484 -2.579 -15.985 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.023 -1.781 -16.531 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.445 -3.518 -17.996 1.00 0.00 H new ATOM 0 HG3 GLN A 128 14.112 -3.973 -18.291 1.00 0.00 H new ATOM 0 HE21 GLN A 128 14.357 -6.114 -17.519 1.00 0.00 H new ATOM 0 HE22 GLN A 128 13.786 -6.661 -15.939 1.00 0.00 H new ATOM 2192 N LEU A 129 13.095 0.174 -18.541 1.00 0.00 N ATOM 2193 CA LEU A 129 12.194 0.861 -19.532 1.00 0.00 C ATOM 2194 C LEU A 129 13.034 1.439 -20.682 1.00 0.00 C ATOM 2195 O LEU A 129 12.629 1.393 -21.828 1.00 0.00 O ATOM 2196 CB LEU A 129 11.482 1.994 -18.775 1.00 0.00 C ATOM 2197 CG LEU A 129 10.310 1.420 -17.979 1.00 0.00 C ATOM 2198 CD1 LEU A 129 10.116 2.232 -16.696 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.036 1.492 -18.824 1.00 0.00 C ATOM 0 H LEU A 129 13.121 0.591 -17.610 1.00 0.00 H new ATOM 0 HA LEU A 129 11.471 0.165 -19.958 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.181 2.492 -18.104 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.124 2.746 -19.478 1.00 0.00 H new ATOM 0 HG LEU A 129 10.520 0.381 -17.723 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.280 1.822 -16.129 1.00 0.00 H new ATOM 0 HD12 LEU A 129 11.023 2.182 -16.093 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.907 3.271 -16.951 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.200 1.083 -18.257 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.827 2.531 -19.080 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.172 0.914 -19.738 1.00 0.00 H new ATOM 2211 N GLU A 130 14.206 1.979 -20.393 1.00 0.00 N ATOM 2212 CA GLU A 130 15.054 2.549 -21.501 1.00 0.00 C ATOM 2213 C GLU A 130 15.405 1.445 -22.510 1.00 0.00 C ATOM 2214 O GLU A 130 15.395 1.673 -23.706 1.00 0.00 O ATOM 2215 CB GLU A 130 16.334 3.095 -20.848 1.00 0.00 C ATOM 2216 CG GLU A 130 16.086 4.521 -20.354 1.00 0.00 C ATOM 2217 CD GLU A 130 17.406 5.292 -20.337 1.00 0.00 C ATOM 2218 OE1 GLU A 130 18.099 5.264 -21.340 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.702 5.900 -19.321 1.00 0.00 O ATOM 0 H GLU A 130 14.604 2.048 -19.457 1.00 0.00 H new ATOM 0 HA GLU A 130 14.524 3.337 -22.036 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.631 2.457 -20.016 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.154 3.085 -21.566 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.368 5.022 -21.003 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.652 4.501 -19.354 1.00 0.00 H new ATOM 2226 N GLU A 131 15.709 0.246 -22.046 1.00 0.00 N ATOM 2227 CA GLU A 131 16.052 -0.859 -23.013 1.00 0.00 C ATOM 2228 C GLU A 131 14.873 -1.114 -23.966 1.00 0.00 C ATOM 2229 O GLU A 131 15.071 -1.389 -25.136 1.00 0.00 O ATOM 2230 CB GLU A 131 16.333 -2.117 -22.173 1.00 0.00 C ATOM 2231 CG GLU A 131 17.046 -3.158 -23.038 1.00 0.00 C ATOM 2232 CD GLU A 131 18.549 -2.870 -23.050 1.00 0.00 C ATOM 2233 OE1 GLU A 131 18.911 -1.728 -23.279 1.00 0.00 O ATOM 2234 OE2 GLU A 131 19.311 -3.796 -22.830 1.00 0.00 O ATOM 0 H GLU A 131 15.734 -0.012 -21.059 1.00 0.00 H new ATOM 0 HA GLU A 131 16.918 -0.591 -23.618 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.949 -1.862 -21.311 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.399 -2.526 -21.788 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.860 -4.159 -22.648 1.00 0.00 H new ATOM 0 HG3 GLU A 131 16.652 -3.133 -24.054 1.00 0.00 H new ATOM 2241 N GLU A 132 13.648 -1.023 -23.485 1.00 0.00 N ATOM 2242 CA GLU A 132 12.471 -1.264 -24.394 1.00 0.00 C ATOM 2243 C GLU A 132 12.481 -0.243 -25.542 1.00 0.00 C ATOM 2244 O GLU A 132 12.281 -0.599 -26.688 1.00 0.00 O ATOM 2245 CB GLU A 132 11.204 -1.087 -23.541 1.00 0.00 C ATOM 2246 CG GLU A 132 10.917 -2.382 -22.778 1.00 0.00 C ATOM 2247 CD GLU A 132 9.897 -2.108 -21.671 1.00 0.00 C ATOM 2248 OE1 GLU A 132 8.713 -2.168 -21.957 1.00 0.00 O ATOM 2249 OE2 GLU A 132 10.318 -1.842 -20.557 1.00 0.00 O ATOM 0 H GLU A 132 13.414 -0.796 -22.518 1.00 0.00 H new ATOM 0 HA GLU A 132 12.509 -2.262 -24.830 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.336 -0.262 -22.841 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.357 -0.832 -24.178 1.00 0.00 H new ATOM 0 HG2 GLU A 132 10.534 -3.141 -23.460 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.838 -2.775 -22.349 1.00 0.00 H new ATOM 2256 N ALA A 133 12.712 1.023 -25.249 1.00 0.00 N ATOM 2257 CA ALA A 133 12.733 2.045 -26.356 1.00 0.00 C ATOM 2258 C ALA A 133 13.863 1.717 -27.341 1.00 0.00 C ATOM 2259 O ALA A 133 13.661 1.725 -28.542 1.00 0.00 O ATOM 2260 CB ALA A 133 12.979 3.411 -25.697 1.00 0.00 C ATOM 0 H ALA A 133 12.883 1.387 -24.312 1.00 0.00 H new ATOM 0 HA ALA A 133 11.795 2.048 -26.911 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.002 4.186 -26.463 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.177 3.624 -24.990 1.00 0.00 H new ATOM 0 HB3 ALA A 133 13.933 3.394 -25.169 1.00 0.00 H new ATOM 2266 N ARG A 134 15.051 1.421 -26.850 1.00 0.00 N ATOM 2267 CA ARG A 134 16.181 1.084 -27.790 1.00 0.00 C ATOM 2268 C ARG A 134 15.813 -0.146 -28.641 1.00 0.00 C ATOM 2269 O ARG A 134 16.181 -0.229 -29.798 1.00 0.00 O ATOM 2270 CB ARG A 134 17.409 0.773 -26.917 1.00 0.00 C ATOM 2271 CG ARG A 134 18.679 0.893 -27.763 1.00 0.00 C ATOM 2272 CD ARG A 134 18.889 2.355 -28.178 1.00 0.00 C ATOM 2273 NE ARG A 134 20.110 2.799 -27.439 1.00 0.00 N ATOM 2274 CZ ARG A 134 21.321 2.420 -27.819 1.00 0.00 C ATOM 2275 NH1 ARG A 134 21.499 1.643 -28.864 1.00 0.00 N ATOM 2276 NH2 ARG A 134 22.367 2.825 -27.145 1.00 0.00 N ATOM 0 H ARG A 134 15.285 1.398 -25.858 1.00 0.00 H new ATOM 0 HA ARG A 134 16.383 1.912 -28.470 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.454 1.463 -26.074 1.00 0.00 H new ATOM 0 HB3 ARG A 134 17.329 -0.232 -26.502 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.540 0.539 -27.196 1.00 0.00 H new ATOM 0 HG3 ARG A 134 18.599 0.262 -28.648 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.027 2.443 -29.256 1.00 0.00 H new ATOM 0 HD3 ARG A 134 18.026 2.967 -27.916 1.00 0.00 H new ATOM 0 HE ARG A 134 20.009 3.406 -26.626 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.695 1.319 -29.401 1.00 0.00 H new ATOM 0 HH12 ARG A 134 22.441 1.364 -29.138 1.00 0.00 H new ATOM 0 HH21 ARG A 134 22.247 3.429 -26.332 1.00 0.00 H new ATOM 0 HH22 ARG A 134 23.302 2.537 -27.433 1.00 0.00 H new ATOM 2290 N LYS A 135 15.089 -1.101 -28.085 1.00 0.00 N ATOM 2291 CA LYS A 135 14.711 -2.316 -28.894 1.00 0.00 C ATOM 2292 C LYS A 135 13.612 -1.971 -29.917 1.00 0.00 C ATOM 2293 O LYS A 135 13.576 -2.541 -30.992 1.00 0.00 O ATOM 2294 CB LYS A 135 14.194 -3.366 -27.897 1.00 0.00 C ATOM 2295 CG LYS A 135 15.374 -3.969 -27.132 1.00 0.00 C ATOM 2296 CD LYS A 135 14.948 -5.296 -26.501 1.00 0.00 C ATOM 2297 CE LYS A 135 16.187 -6.146 -26.213 1.00 0.00 C ATOM 2298 NZ LYS A 135 15.899 -6.817 -24.915 1.00 0.00 N ATOM 0 H LYS A 135 14.749 -1.093 -27.123 1.00 0.00 H new ATOM 0 HA LYS A 135 15.569 -2.688 -29.454 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.492 -2.907 -27.201 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.652 -4.149 -28.426 1.00 0.00 H new ATOM 0 HG2 LYS A 135 16.215 -4.128 -27.807 1.00 0.00 H new ATOM 0 HG3 LYS A 135 15.711 -3.278 -26.359 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.398 -5.112 -25.578 1.00 0.00 H new ATOM 0 HD3 LYS A 135 14.275 -5.830 -27.172 1.00 0.00 H new ATOM 0 HE2 LYS A 135 16.359 -6.875 -27.005 1.00 0.00 H new ATOM 0 HE3 LYS A 135 17.083 -5.529 -26.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 16.704 -7.419 -24.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 15.747 -6.098 -24.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.045 -7.403 -25.009 1.00 0.00 H new ATOM 2312 N LYS A 136 12.717 -1.050 -29.606 1.00 0.00 N ATOM 2313 CA LYS A 136 11.638 -0.702 -30.594 1.00 0.00 C ATOM 2314 C LYS A 136 11.981 0.578 -31.386 1.00 0.00 C ATOM 2315 O LYS A 136 11.096 1.230 -31.907 1.00 0.00 O ATOM 2316 CB LYS A 136 10.367 -0.487 -29.761 1.00 0.00 C ATOM 2317 CG LYS A 136 9.157 -1.032 -30.523 1.00 0.00 C ATOM 2318 CD LYS A 136 8.160 -1.638 -29.534 1.00 0.00 C ATOM 2319 CE LYS A 136 8.695 -2.978 -29.024 1.00 0.00 C ATOM 2320 NZ LYS A 136 7.902 -3.267 -27.797 1.00 0.00 N ATOM 0 H LYS A 136 12.688 -0.534 -28.726 1.00 0.00 H new ATOM 0 HA LYS A 136 11.518 -1.495 -31.332 1.00 0.00 H new ATOM 0 HB2 LYS A 136 10.461 -0.991 -28.799 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.231 0.574 -29.553 1.00 0.00 H new ATOM 0 HG2 LYS A 136 8.681 -0.232 -31.091 1.00 0.00 H new ATOM 0 HG3 LYS A 136 9.477 -1.787 -31.242 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.001 -0.956 -28.698 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.194 -1.781 -30.017 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.569 -3.763 -29.770 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.760 -2.919 -28.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 8.212 -4.172 -27.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 8.047 -2.506 -27.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.893 -3.325 -28.041 1.00 0.00 H new ATOM 2334 N GLY A 137 13.248 0.945 -31.501 1.00 0.00 N ATOM 2335 CA GLY A 137 13.615 2.174 -32.277 1.00 0.00 C ATOM 2336 C GLY A 137 12.795 3.386 -31.797 1.00 0.00 C ATOM 2337 O GLY A 137 12.259 4.128 -32.600 1.00 0.00 O ATOM 0 H GLY A 137 14.035 0.444 -31.090 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.679 2.379 -32.160 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.437 2.006 -33.339 1.00 0.00 H new ATOM 2341 N THR A 138 12.693 3.597 -30.500 1.00 0.00 N ATOM 2342 CA THR A 138 11.907 4.767 -29.995 1.00 0.00 C ATOM 2343 C THR A 138 12.502 5.285 -28.673 1.00 0.00 C ATOM 2344 O THR A 138 13.616 4.947 -28.320 1.00 0.00 O ATOM 2345 CB THR A 138 10.484 4.234 -29.786 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.657 5.284 -29.301 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.494 3.087 -28.772 1.00 0.00 C ATOM 0 H THR A 138 13.117 3.013 -29.779 1.00 0.00 H new ATOM 0 HA THR A 138 11.924 5.606 -30.691 1.00 0.00 H new ATOM 0 HB THR A 138 10.098 3.865 -30.736 1.00 0.00 H new ATOM 0 HG1 THR A 138 8.746 4.948 -29.168 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.479 2.717 -28.632 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.127 2.280 -29.142 1.00 0.00 H new ATOM 0 HG23 THR A 138 10.884 3.447 -27.820 1.00 0.00 H new ATOM 2355 N GLN A 139 11.773 6.106 -27.942 1.00 0.00 N ATOM 2356 CA GLN A 139 12.309 6.637 -26.653 1.00 0.00 C ATOM 2357 C GLN A 139 11.264 6.475 -25.537 1.00 0.00 C ATOM 2358 O GLN A 139 10.076 6.441 -25.801 1.00 0.00 O ATOM 2359 CB GLN A 139 12.585 8.117 -26.918 1.00 0.00 C ATOM 2360 CG GLN A 139 13.687 8.248 -27.971 1.00 0.00 C ATOM 2361 CD GLN A 139 14.478 9.539 -27.727 1.00 0.00 C ATOM 2362 OE1 GLN A 139 14.630 9.963 -26.599 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.995 10.190 -28.741 1.00 0.00 N ATOM 0 H GLN A 139 10.836 6.426 -28.186 1.00 0.00 H new ATOM 0 HA GLN A 139 13.205 6.107 -26.329 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.677 8.612 -27.263 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.887 8.613 -25.996 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.353 7.387 -27.924 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.251 8.260 -28.970 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.870 9.838 -29.690 1.00 0.00 H new ATOM 0 HE22 GLN A 139 15.522 11.048 -28.581 1.00 0.00 H new ATOM 2372 N VAL A 140 11.690 6.376 -24.294 1.00 0.00 N ATOM 2373 CA VAL A 140 10.709 6.218 -23.177 1.00 0.00 C ATOM 2374 C VAL A 140 11.024 7.210 -22.044 1.00 0.00 C ATOM 2375 O VAL A 140 12.124 7.723 -21.953 1.00 0.00 O ATOM 2376 CB VAL A 140 10.878 4.769 -22.696 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.320 4.535 -22.221 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.904 4.504 -21.541 1.00 0.00 C ATOM 0 H VAL A 140 12.670 6.398 -24.011 1.00 0.00 H new ATOM 0 HA VAL A 140 9.687 6.421 -23.495 1.00 0.00 H new ATOM 0 HB VAL A 140 10.665 4.089 -23.520 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.429 3.505 -21.882 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.009 4.721 -23.045 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.547 5.213 -21.398 1.00 0.00 H new ATOM 0 HG21 VAL A 140 10.020 3.477 -21.196 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.118 5.189 -20.720 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.881 4.658 -21.885 1.00 0.00 H new ATOM 2388 N SER A 141 10.068 7.484 -21.178 1.00 0.00 N ATOM 2389 CA SER A 141 10.326 8.445 -20.055 1.00 0.00 C ATOM 2390 C SER A 141 9.185 8.395 -19.021 1.00 0.00 C ATOM 2391 O SER A 141 8.241 9.161 -19.098 1.00 0.00 O ATOM 2392 CB SER A 141 10.383 9.813 -20.727 1.00 0.00 C ATOM 2393 OG SER A 141 10.610 10.813 -19.742 1.00 0.00 O ATOM 0 H SER A 141 9.129 7.086 -21.202 1.00 0.00 H new ATOM 0 HA SER A 141 11.242 8.211 -19.513 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.179 9.832 -21.471 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.450 10.011 -21.254 1.00 0.00 H new ATOM 0 HG SER A 141 10.649 11.693 -20.172 1.00 0.00 H new ATOM 2399 N PHE A 142 9.258 7.497 -18.060 1.00 0.00 N ATOM 2400 CA PHE A 142 8.170 7.399 -17.037 1.00 0.00 C ATOM 2401 C PHE A 142 8.605 8.056 -15.708 1.00 0.00 C ATOM 2402 O PHE A 142 9.778 8.252 -15.454 1.00 0.00 O ATOM 2403 CB PHE A 142 7.934 5.886 -16.861 1.00 0.00 C ATOM 2404 CG PHE A 142 7.073 5.608 -15.641 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.686 5.799 -15.683 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.679 5.164 -14.464 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.912 5.542 -14.541 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.910 4.911 -13.334 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.529 5.096 -13.363 1.00 0.00 C ATOM 0 H PHE A 142 10.023 6.832 -17.944 1.00 0.00 H new ATOM 0 HA PHE A 142 7.263 7.919 -17.345 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.450 5.484 -17.751 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.891 5.374 -16.759 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.214 6.143 -16.591 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.748 5.017 -14.431 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.842 5.687 -14.569 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.386 4.569 -12.427 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.936 4.897 -12.482 1.00 0.00 H new ATOM 2419 N HIS A 143 7.652 8.375 -14.856 1.00 0.00 N ATOM 2420 CA HIS A 143 7.980 8.994 -13.536 1.00 0.00 C ATOM 2421 C HIS A 143 7.073 8.381 -12.456 1.00 0.00 C ATOM 2422 O HIS A 143 7.540 7.747 -11.529 1.00 0.00 O ATOM 2423 CB HIS A 143 7.684 10.485 -13.710 1.00 0.00 C ATOM 2424 CG HIS A 143 8.940 11.200 -14.125 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.916 12.344 -14.906 1.00 0.00 N ATOM 2426 CD2 HIS A 143 10.266 10.945 -13.873 1.00 0.00 C ATOM 2427 CE1 HIS A 143 10.191 12.732 -15.097 1.00 0.00 C ATOM 2428 NE2 HIS A 143 11.054 11.915 -14.488 1.00 0.00 N ATOM 0 H HIS A 143 6.657 8.230 -15.025 1.00 0.00 H new ATOM 0 HA HIS A 143 9.013 8.827 -13.232 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.907 10.627 -14.461 1.00 0.00 H new ATOM 0 HB3 HIS A 143 7.306 10.903 -12.777 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.640 10.118 -13.287 1.00 0.00 H new ATOM 0 HE1 HIS A 143 10.481 13.599 -15.673 1.00 0.00 H new ATOM 0 HE2 HIS A 143 12.071 11.986 -14.476 1.00 0.00 H new ATOM 2436 N GLN A 144 5.774 8.541 -12.590 1.00 0.00 N ATOM 2437 CA GLN A 144 4.825 7.947 -11.602 1.00 0.00 C ATOM 2438 C GLN A 144 3.672 7.277 -12.365 1.00 0.00 C ATOM 2439 O GLN A 144 3.330 7.700 -13.455 1.00 0.00 O ATOM 2440 CB GLN A 144 4.320 9.124 -10.747 1.00 0.00 C ATOM 2441 CG GLN A 144 3.583 10.148 -11.617 1.00 0.00 C ATOM 2442 CD GLN A 144 3.100 11.311 -10.742 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.917 11.581 -10.677 1.00 0.00 O ATOM 2444 NE2 GLN A 144 3.967 12.021 -10.062 1.00 0.00 N ATOM 0 H GLN A 144 5.333 9.062 -13.348 1.00 0.00 H new ATOM 0 HA GLN A 144 5.288 7.188 -10.971 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.653 8.754 -9.968 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.161 9.603 -10.246 1.00 0.00 H new ATOM 0 HG2 GLN A 144 4.245 10.519 -12.400 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.735 9.676 -12.113 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.961 11.798 -10.113 1.00 0.00 H new ATOM 0 HE22 GLN A 144 3.648 12.796 -9.481 1.00 0.00 H new ATOM 2453 N CYS A 145 3.076 6.236 -11.822 1.00 0.00 N ATOM 2454 CA CYS A 145 1.954 5.564 -12.567 1.00 0.00 C ATOM 2455 C CYS A 145 0.592 6.144 -12.157 1.00 0.00 C ATOM 2456 O CYS A 145 0.433 6.662 -11.068 1.00 0.00 O ATOM 2457 CB CYS A 145 2.043 4.054 -12.263 1.00 0.00 C ATOM 2458 SG CYS A 145 1.690 3.698 -10.513 1.00 0.00 S ATOM 0 H CYS A 145 3.310 5.829 -10.916 1.00 0.00 H new ATOM 0 HA CYS A 145 2.047 5.737 -13.639 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.337 3.514 -12.894 1.00 0.00 H new ATOM 0 HB3 CYS A 145 3.039 3.690 -12.515 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.393 6.067 -13.032 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.748 6.628 -12.686 1.00 0.00 C ATOM 2465 C VAL A 146 -2.484 5.737 -11.663 1.00 0.00 C ATOM 2466 O VAL A 146 -3.337 6.218 -10.941 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.548 6.722 -14.003 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.778 5.325 -14.598 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -3.902 7.380 -13.726 1.00 0.00 C ATOM 0 H VAL A 146 -0.319 5.646 -13.958 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.642 7.609 -12.223 1.00 0.00 H new ATOM 0 HB VAL A 146 -1.979 7.318 -14.716 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.344 5.413 -15.526 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.817 4.854 -14.803 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.337 4.715 -13.889 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.470 7.448 -14.654 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.457 6.781 -13.004 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.745 8.380 -13.323 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.177 4.446 -11.588 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.892 3.556 -10.591 1.00 0.00 C ATOM 2481 C HIS A 147 -2.875 4.202 -9.192 1.00 0.00 C ATOM 2482 O HIS A 147 -3.912 4.411 -8.590 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.127 2.215 -10.562 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.201 1.515 -11.906 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.025 1.944 -12.946 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.548 0.402 -12.389 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -2.844 1.100 -13.979 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -1.957 0.146 -13.694 1.00 0.00 N ATOM 0 H HIS A 147 -1.476 3.979 -12.163 1.00 0.00 H new ATOM 0 HA HIS A 147 -3.933 3.409 -10.877 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.085 2.393 -10.298 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.546 1.570 -9.789 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.827 -0.184 -11.838 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.356 1.185 -14.926 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.645 -0.610 -14.303 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.708 4.525 -8.674 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.632 5.159 -7.329 1.00 0.00 C ATOM 2498 C CYS A 148 -0.715 6.400 -7.375 1.00 0.00 C ATOM 2499 O CYS A 148 -0.392 6.896 -8.439 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.049 4.057 -6.433 1.00 0.00 C ATOM 2501 SG CYS A 148 0.683 3.710 -6.875 1.00 0.00 S ATOM 0 H CYS A 148 -0.809 4.374 -9.131 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.596 5.514 -6.964 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.108 4.363 -5.388 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.643 3.149 -6.533 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.269 6.883 -6.234 1.00 0.00 N ATOM 2507 CA GLY A 149 0.649 8.059 -6.224 1.00 0.00 C ATOM 2508 C GLY A 149 2.075 7.546 -5.980 1.00 0.00 C ATOM 2509 O GLY A 149 2.685 7.847 -4.972 1.00 0.00 O ATOM 0 H GLY A 149 -0.504 6.510 -5.314 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.593 8.594 -7.172 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.358 8.763 -5.444 1.00 0.00 H new ATOM 2513 N CYS A 150 2.603 6.752 -6.890 1.00 0.00 N ATOM 2514 CA CYS A 150 3.982 6.199 -6.701 1.00 0.00 C ATOM 2515 C CYS A 150 4.980 6.947 -7.598 1.00 0.00 C ATOM 2516 O CYS A 150 4.676 7.268 -8.729 1.00 0.00 O ATOM 2517 CB CYS A 150 3.857 4.719 -7.111 1.00 0.00 C ATOM 2518 SG CYS A 150 5.472 3.898 -7.151 1.00 0.00 S ATOM 0 H CYS A 150 2.137 6.466 -7.751 1.00 0.00 H new ATOM 0 HA CYS A 150 4.350 6.308 -5.681 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.202 4.201 -6.410 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.390 4.651 -8.093 1.00 0.00 H new ATOM 2523 N ARG A 151 6.177 7.206 -7.111 1.00 0.00 N ATOM 2524 CA ARG A 151 7.189 7.914 -7.961 1.00 0.00 C ATOM 2525 C ARG A 151 8.113 6.881 -8.622 1.00 0.00 C ATOM 2526 O ARG A 151 9.323 6.964 -8.514 1.00 0.00 O ATOM 2527 CB ARG A 151 7.982 8.822 -7.010 1.00 0.00 C ATOM 2528 CG ARG A 151 8.224 10.179 -7.676 1.00 0.00 C ATOM 2529 CD ARG A 151 8.390 11.255 -6.600 1.00 0.00 C ATOM 2530 NE ARG A 151 8.716 12.505 -7.352 1.00 0.00 N ATOM 2531 CZ ARG A 151 9.916 12.698 -7.880 1.00 0.00 C ATOM 2532 NH1 ARG A 151 10.868 11.801 -7.761 1.00 0.00 N ATOM 2533 NH2 ARG A 151 10.164 13.803 -8.533 1.00 0.00 N ATOM 0 H ARG A 151 6.491 6.960 -6.172 1.00 0.00 H new ATOM 0 HA ARG A 151 6.723 8.496 -8.756 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.433 8.956 -6.078 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.934 8.356 -6.756 1.00 0.00 H new ATOM 0 HG2 ARG A 151 9.116 10.135 -8.302 1.00 0.00 H new ATOM 0 HG3 ARG A 151 7.388 10.429 -8.329 1.00 0.00 H new ATOM 0 HD2 ARG A 151 7.478 11.373 -6.015 1.00 0.00 H new ATOM 0 HD3 ARG A 151 9.185 10.996 -5.901 1.00 0.00 H new ATOM 0 HE ARG A 151 8.001 13.224 -7.461 1.00 0.00 H new ATOM 0 HH11 ARG A 151 10.691 10.934 -7.254 1.00 0.00 H new ATOM 0 HH12 ARG A 151 11.784 11.971 -8.176 1.00 0.00 H new ATOM 0 HH21 ARG A 151 9.436 14.510 -8.634 1.00 0.00 H new ATOM 0 HH22 ARG A 151 11.086 13.958 -8.942 1.00 0.00 H new ATOM 2547 N GLY A 152 7.553 5.902 -9.305 1.00 0.00 N ATOM 2548 CA GLY A 152 8.396 4.868 -9.966 1.00 0.00 C ATOM 2549 C GLY A 152 9.123 4.034 -8.901 1.00 0.00 C ATOM 2550 O GLY A 152 10.164 4.427 -8.409 1.00 0.00 O ATOM 0 H GLY A 152 6.548 5.782 -9.428 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.776 4.222 -10.587 1.00 0.00 H new ATOM 0 HA3 GLY A 152 9.121 5.344 -10.626 1.00 0.00 H new ATOM 2554 N CYS A 153 8.591 2.880 -8.543 1.00 0.00 N ATOM 2555 CA CYS A 153 9.273 2.032 -7.514 1.00 0.00 C ATOM 2556 C CYS A 153 9.918 0.798 -8.178 1.00 0.00 C ATOM 2557 O CYS A 153 9.273 0.068 -8.907 1.00 0.00 O ATOM 2558 CB CYS A 153 8.184 1.636 -6.491 1.00 0.00 C ATOM 2559 SG CYS A 153 6.949 0.516 -7.217 1.00 0.00 S ATOM 0 H CYS A 153 7.723 2.497 -8.917 1.00 0.00 H new ATOM 0 HA CYS A 153 10.082 2.567 -7.017 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.651 1.154 -5.632 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.688 2.534 -6.123 1.00 0.00 H new ATOM 2564 N ALA A 154 11.194 0.569 -7.939 1.00 0.00 N ATOM 2565 CA ALA A 154 11.878 -0.607 -8.563 1.00 0.00 C ATOM 2566 C ALA A 154 13.056 -1.066 -7.689 1.00 0.00 C ATOM 2567 O ALA A 154 13.676 -0.266 -7.015 1.00 0.00 O ATOM 2568 CB ALA A 154 12.375 -0.098 -9.913 1.00 0.00 C ATOM 0 H ALA A 154 11.785 1.146 -7.341 1.00 0.00 H new ATOM 0 HA ALA A 154 11.214 -1.465 -8.668 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.891 -0.902 -10.438 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.527 0.239 -10.509 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.063 0.733 -9.758 1.00 0.00 H new ATOM 2574 N SER A 155 13.368 -2.345 -7.688 1.00 0.00 N ATOM 2575 CA SER A 155 14.508 -2.834 -6.843 1.00 0.00 C ATOM 2576 C SER A 155 15.744 -3.126 -7.711 1.00 0.00 C ATOM 2577 O SER A 155 16.845 -2.739 -7.366 1.00 0.00 O ATOM 2578 CB SER A 155 14.007 -4.116 -6.174 1.00 0.00 C ATOM 2579 OG SER A 155 12.597 -4.026 -5.979 1.00 0.00 O ATOM 0 H SER A 155 12.888 -3.063 -8.230 1.00 0.00 H new ATOM 0 HA SER A 155 14.810 -2.087 -6.109 1.00 0.00 H new ATOM 0 HB2 SER A 155 14.246 -4.980 -6.794 1.00 0.00 H new ATOM 0 HB3 SER A 155 14.509 -4.261 -5.218 1.00 0.00 H new ATOM 0 HG SER A 155 12.273 -4.846 -5.552 1.00 0.00 H new ATOM 2585 N THR A 156 15.584 -3.807 -8.831 1.00 0.00 N ATOM 2586 CA THR A 156 16.781 -4.115 -9.703 1.00 0.00 C ATOM 2587 C THR A 156 17.563 -2.830 -10.028 1.00 0.00 C ATOM 2588 O THR A 156 18.780 -2.836 -10.062 1.00 0.00 O ATOM 2589 CB THR A 156 16.237 -4.737 -10.998 1.00 0.00 C ATOM 2590 OG1 THR A 156 15.167 -5.619 -10.684 1.00 0.00 O ATOM 2591 CG2 THR A 156 17.351 -5.515 -11.700 1.00 0.00 C ATOM 0 H THR A 156 14.691 -4.159 -9.177 1.00 0.00 H new ATOM 0 HA THR A 156 17.464 -4.794 -9.191 1.00 0.00 H new ATOM 0 HB THR A 156 15.877 -3.947 -11.658 1.00 0.00 H new ATOM 0 HG1 THR A 156 14.817 -6.016 -11.509 1.00 0.00 H new ATOM 0 HG21 THR A 156 16.964 -5.956 -12.619 1.00 0.00 H new ATOM 0 HG22 THR A 156 18.172 -4.839 -11.940 1.00 0.00 H new ATOM 0 HG23 THR A 156 17.713 -6.306 -11.043 1.00 0.00 H new ATOM 2599 N ASP A 157 16.879 -1.732 -10.263 1.00 0.00 N ATOM 2600 CA ASP A 157 17.592 -0.457 -10.581 1.00 0.00 C ATOM 2601 C ASP A 157 16.964 0.707 -9.810 1.00 0.00 C ATOM 2602 O ASP A 157 15.999 0.470 -9.103 1.00 0.00 O ATOM 2603 CB ASP A 157 17.409 -0.264 -12.087 1.00 0.00 C ATOM 2604 CG ASP A 157 18.553 -0.949 -12.836 1.00 0.00 C ATOM 2605 OD1 ASP A 157 19.684 -0.519 -12.674 1.00 0.00 O ATOM 2606 OD2 ASP A 157 18.280 -1.892 -13.559 1.00 0.00 O ATOM 2607 OXT ASP A 157 17.460 1.813 -9.940 1.00 0.00 O ATOM 0 H ASP A 157 15.861 -1.667 -10.248 1.00 0.00 H new ATOM 0 HA ASP A 157 18.645 -0.492 -10.300 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.453 -0.681 -12.403 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.389 0.799 -12.328 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 1.183 1.479 -6.662 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 5.008 1.688 -7.608 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 2.170 1.455 -10.253 1.00 0.00 ZN