USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 680 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 16 CYS SG : rot 64:sc= -0.206 USER MOD Set 1.2: A 78 CYS SG : rot 92:sc= -0.254 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ -131:sc= 1.19 (180deg=-0.29!) USER MOD Single : A 17 MET CE :methyl -179:sc= -0.533 (180deg=-0.536) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 0.431 K(o=0.43,f=-0.44) USER MOD Single : A 29 ASN : amide:sc= -1.1 K(o=-1.1,f=-2) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot -68:sc= 0.0116 USER MOD Single : A 37 MET CE :methyl 163:sc= -0.505 (180deg=-0.877) USER MOD Single : A 39 MET CE :methyl -178:sc=-0.000904 (180deg=-0.01) USER MOD Single : A 41 THR OG1 : rot 78:sc= 1.2 USER MOD Single : A 42 LYS NZ :NH3+ -165:sc= 1.24 (180deg=1.18) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.0087) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.443 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 144:sc= 0.935 USER MOD Single : A 49 LYS NZ :NH3+ 155:sc= 2.41 (180deg=1.97) USER MOD Single : A 52 THR OG1 : rot 120:sc= 0.112 USER MOD Single : A 56 MET CE :methyl -175:sc= -0.0983 (180deg=-0.131) USER MOD Single : A 57 LYS NZ :NH3+ -161:sc= 1.2 (180deg=1.17) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 145:sc= 1.23 (180deg=1.13) USER MOD Single : A 67 LYS NZ :NH3+ 158:sc= 1.18 (180deg=0.834) USER MOD Single : A 68 ASN : amide:sc= -4.54! C(o=-4.5!,f=-3.6!) USER MOD Single : A 76 THR OG1 : rot 97:sc= 1.13 USER MOD Single : A 79 SER OG : rot -26:sc= 0.937 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= 0.437 K(o=0.44,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 35.059 -20.621 2.723 1.00 0.00 N ATOM 2 CA ALA A 1 35.101 -20.218 1.308 1.00 0.00 C ATOM 3 C ALA A 1 34.881 -21.403 0.365 1.00 0.00 C ATOM 4 O ALA A 1 35.642 -22.370 0.361 1.00 0.00 O ATOM 5 CB ALA A 1 36.401 -19.498 0.950 1.00 0.00 C ATOM 0 H1 ALA A 1 35.213 -19.788 3.326 1.00 0.00 H new ATOM 0 H2 ALA A 1 34.131 -21.038 2.938 1.00 0.00 H new ATOM 0 H3 ALA A 1 35.804 -21.323 2.906 1.00 0.00 H new ATOM 0 HA ALA A 1 34.277 -19.517 1.173 1.00 0.00 H new ATOM 0 HB1 ALA A 1 36.385 -19.221 -0.104 1.00 0.00 H new ATOM 0 HB2 ALA A 1 36.500 -18.600 1.560 1.00 0.00 H new ATOM 0 HB3 ALA A 1 37.247 -20.159 1.138 1.00 0.00 H new ATOM 13 N ALA A 2 33.818 -21.339 -0.429 1.00 0.00 N ATOM 14 CA ALA A 2 33.555 -22.439 -1.365 1.00 0.00 C ATOM 15 C ALA A 2 32.951 -21.926 -2.681 1.00 0.00 C ATOM 16 O ALA A 2 31.811 -21.460 -2.709 1.00 0.00 O ATOM 17 CB ALA A 2 32.652 -23.517 -0.760 1.00 0.00 C ATOM 0 H ALA A 2 33.145 -20.573 -0.450 1.00 0.00 H new ATOM 0 HA ALA A 2 34.522 -22.895 -1.577 1.00 0.00 H new ATOM 0 HB1 ALA A 2 32.488 -24.308 -1.492 1.00 0.00 H new ATOM 0 HB2 ALA A 2 33.129 -23.936 0.126 1.00 0.00 H new ATOM 0 HB3 ALA A 2 31.695 -23.076 -0.482 1.00 0.00 H new ATOM 23 N PRO A 3 33.691 -22.023 -3.794 1.00 0.00 N ATOM 24 CA PRO A 3 33.127 -21.561 -5.066 1.00 0.00 C ATOM 25 C PRO A 3 32.340 -22.695 -5.730 1.00 0.00 C ATOM 26 O PRO A 3 32.891 -23.546 -6.431 1.00 0.00 O ATOM 27 CB PRO A 3 34.329 -21.121 -5.909 1.00 0.00 C ATOM 28 CG PRO A 3 35.591 -21.365 -5.077 1.00 0.00 C ATOM 29 CD PRO A 3 35.145 -21.874 -3.708 1.00 0.00 C ATOM 0 HA PRO A 3 32.424 -20.737 -4.942 1.00 0.00 H new ATOM 0 HB2 PRO A 3 34.370 -21.684 -6.841 1.00 0.00 H new ATOM 0 HB3 PRO A 3 34.244 -20.068 -6.177 1.00 0.00 H new ATOM 0 HG2 PRO A 3 36.238 -22.094 -5.565 1.00 0.00 H new ATOM 0 HG3 PRO A 3 36.167 -20.445 -4.975 1.00 0.00 H new ATOM 0 HD2 PRO A 3 35.622 -22.824 -3.469 1.00 0.00 H new ATOM 0 HD3 PRO A 3 35.421 -21.172 -2.921 1.00 0.00 H new ATOM 37 N LYS A 4 31.030 -22.699 -5.516 1.00 0.00 N ATOM 38 CA LYS A 4 30.215 -23.790 -6.074 1.00 0.00 C ATOM 39 C LYS A 4 29.355 -23.346 -7.270 1.00 0.00 C ATOM 40 O LYS A 4 28.142 -23.556 -7.312 1.00 0.00 O ATOM 41 CB LYS A 4 29.399 -24.542 -4.999 1.00 0.00 C ATOM 42 CG LYS A 4 28.825 -23.627 -3.905 1.00 0.00 C ATOM 43 CD LYS A 4 27.747 -22.685 -4.449 1.00 0.00 C ATOM 44 CE LYS A 4 27.107 -21.894 -3.307 1.00 0.00 C ATOM 45 NZ LYS A 4 26.195 -20.872 -3.852 1.00 0.00 N ATOM 0 H LYS A 4 30.519 -21.995 -4.984 1.00 0.00 H new ATOM 0 HA LYS A 4 30.926 -24.514 -6.471 1.00 0.00 H new ATOM 0 HB2 LYS A 4 28.579 -25.073 -5.483 1.00 0.00 H new ATOM 0 HB3 LYS A 4 30.035 -25.295 -4.534 1.00 0.00 H new ATOM 0 HG2 LYS A 4 28.403 -24.238 -3.107 1.00 0.00 H new ATOM 0 HG3 LYS A 4 29.631 -23.039 -3.465 1.00 0.00 H new ATOM 0 HD2 LYS A 4 28.186 -21.999 -5.174 1.00 0.00 H new ATOM 0 HD3 LYS A 4 26.984 -23.259 -4.975 1.00 0.00 H new ATOM 0 HE2 LYS A 4 26.559 -22.568 -2.649 1.00 0.00 H new ATOM 0 HE3 LYS A 4 27.881 -21.419 -2.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 25.764 -20.339 -3.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 26.729 -20.221 -4.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 25.448 -21.335 -4.409 1.00 0.00 H new ATOM 59 N ALA A 5 29.996 -22.747 -8.269 1.00 0.00 N ATOM 60 CA ALA A 5 29.254 -22.361 -9.476 1.00 0.00 C ATOM 61 C ALA A 5 29.476 -23.365 -10.612 1.00 0.00 C ATOM 62 O ALA A 5 30.585 -23.513 -11.126 1.00 0.00 O ATOM 63 CB ALA A 5 29.593 -20.941 -9.938 1.00 0.00 C ATOM 0 H ALA A 5 30.991 -22.522 -8.276 1.00 0.00 H new ATOM 0 HA ALA A 5 28.198 -22.372 -9.208 1.00 0.00 H new ATOM 0 HB1 ALA A 5 29.019 -20.703 -10.833 1.00 0.00 H new ATOM 0 HB2 ALA A 5 29.344 -20.232 -9.148 1.00 0.00 H new ATOM 0 HB3 ALA A 5 30.658 -20.876 -10.162 1.00 0.00 H new ATOM 69 N ARG A 6 28.419 -24.080 -10.996 1.00 0.00 N ATOM 70 CA ARG A 6 28.579 -25.095 -12.053 1.00 0.00 C ATOM 71 C ARG A 6 27.362 -25.155 -12.990 1.00 0.00 C ATOM 72 O ARG A 6 26.214 -25.009 -12.568 1.00 0.00 O ATOM 73 CB ARG A 6 28.891 -26.494 -11.486 1.00 0.00 C ATOM 74 CG ARG A 6 30.351 -26.593 -11.029 1.00 0.00 C ATOM 75 CD ARG A 6 30.682 -27.981 -10.482 1.00 0.00 C ATOM 76 NE ARG A 6 32.116 -28.041 -10.158 1.00 0.00 N ATOM 77 CZ ARG A 6 32.503 -28.563 -9.000 1.00 0.00 C ATOM 78 NH1 ARG A 6 31.833 -29.562 -8.454 1.00 0.00 N ATOM 79 NH2 ARG A 6 33.579 -28.097 -8.399 1.00 0.00 N ATOM 0 H ARG A 6 27.478 -23.988 -10.614 1.00 0.00 H new ATOM 0 HA ARG A 6 29.441 -24.776 -12.640 1.00 0.00 H new ATOM 0 HB2 ARG A 6 28.229 -26.705 -10.646 1.00 0.00 H new ATOM 0 HB3 ARG A 6 28.693 -27.250 -12.246 1.00 0.00 H new ATOM 0 HG2 ARG A 6 31.010 -26.366 -11.867 1.00 0.00 H new ATOM 0 HG3 ARG A 6 30.543 -25.844 -10.260 1.00 0.00 H new ATOM 0 HD2 ARG A 6 30.087 -28.187 -9.592 1.00 0.00 H new ATOM 0 HD3 ARG A 6 30.430 -28.745 -11.218 1.00 0.00 H new ATOM 0 HE ARG A 6 32.807 -27.684 -10.818 1.00 0.00 H new ATOM 0 HH11 ARG A 6 31.009 -29.940 -8.922 1.00 0.00 H new ATOM 0 HH12 ARG A 6 32.139 -29.955 -7.564 1.00 0.00 H new ATOM 0 HH21 ARG A 6 34.112 -27.338 -8.823 1.00 0.00 H new ATOM 0 HH22 ARG A 6 33.879 -28.496 -7.509 1.00 0.00 H new ATOM 93 N ALA A 7 27.617 -25.391 -14.275 1.00 0.00 N ATOM 94 CA ALA A 7 26.503 -25.449 -15.234 1.00 0.00 C ATOM 95 C ALA A 7 26.567 -26.704 -16.117 1.00 0.00 C ATOM 96 O ALA A 7 27.606 -27.033 -16.689 1.00 0.00 O ATOM 97 CB ALA A 7 26.436 -24.185 -16.092 1.00 0.00 C ATOM 0 H ALA A 7 28.545 -25.541 -14.671 1.00 0.00 H new ATOM 0 HA ALA A 7 25.587 -25.508 -14.647 1.00 0.00 H new ATOM 0 HB1 ALA A 7 25.602 -24.262 -16.789 1.00 0.00 H new ATOM 0 HB2 ALA A 7 26.293 -23.316 -15.449 1.00 0.00 H new ATOM 0 HB3 ALA A 7 27.366 -24.074 -16.650 1.00 0.00 H new ATOM 103 N LEU A 8 25.444 -27.408 -16.239 1.00 0.00 N ATOM 104 CA LEU A 8 25.475 -28.664 -17.000 1.00 0.00 C ATOM 105 C LEU A 8 24.671 -28.655 -18.302 1.00 0.00 C ATOM 106 O LEU A 8 23.887 -27.749 -18.588 1.00 0.00 O ATOM 107 CB LEU A 8 24.963 -29.820 -16.128 1.00 0.00 C ATOM 108 CG LEU A 8 26.055 -30.848 -15.848 1.00 0.00 C ATOM 109 CD1 LEU A 8 25.620 -31.692 -14.659 1.00 0.00 C ATOM 110 CD2 LEU A 8 26.299 -31.729 -17.081 1.00 0.00 C ATOM 0 H LEU A 8 24.539 -27.151 -15.844 1.00 0.00 H new ATOM 0 HA LEU A 8 26.521 -28.793 -17.279 1.00 0.00 H new ATOM 0 HB2 LEU A 8 24.587 -29.424 -15.185 1.00 0.00 H new ATOM 0 HB3 LEU A 8 24.125 -30.307 -16.626 1.00 0.00 H new ATOM 0 HG LEU A 8 26.993 -30.342 -15.619 1.00 0.00 H new ATOM 0 HD11 LEU A 8 26.387 -32.435 -14.440 1.00 0.00 H new ATOM 0 HD12 LEU A 8 25.478 -31.050 -13.790 1.00 0.00 H new ATOM 0 HD13 LEU A 8 24.683 -32.196 -14.894 1.00 0.00 H new ATOM 0 HD21 LEU A 8 27.081 -32.455 -16.860 1.00 0.00 H new ATOM 0 HD22 LEU A 8 25.380 -32.254 -17.341 1.00 0.00 H new ATOM 0 HD23 LEU A 8 26.610 -31.105 -17.919 1.00 0.00 H new ATOM 122 N GLY A 9 24.864 -29.711 -19.088 1.00 0.00 N ATOM 123 CA GLY A 9 24.034 -29.881 -20.279 1.00 0.00 C ATOM 124 C GLY A 9 24.325 -31.233 -20.960 1.00 0.00 C ATOM 125 O GLY A 9 25.485 -31.598 -21.159 1.00 0.00 O ATOM 0 H GLY A 9 25.561 -30.439 -18.932 1.00 0.00 H new ATOM 0 HA2 GLY A 9 22.981 -29.826 -20.005 1.00 0.00 H new ATOM 0 HA3 GLY A 9 24.224 -29.068 -20.979 1.00 0.00 H new ATOM 129 N PRO A 10 23.285 -31.981 -21.356 1.00 0.00 N ATOM 130 CA PRO A 10 23.518 -33.168 -22.201 1.00 0.00 C ATOM 131 C PRO A 10 23.718 -32.712 -23.659 1.00 0.00 C ATOM 132 O PRO A 10 24.556 -33.222 -24.402 1.00 0.00 O ATOM 133 CB PRO A 10 22.266 -34.033 -22.013 1.00 0.00 C ATOM 134 CG PRO A 10 21.421 -33.390 -20.906 1.00 0.00 C ATOM 135 CD PRO A 10 22.093 -32.073 -20.515 1.00 0.00 C ATOM 0 HA PRO A 10 24.411 -33.735 -21.936 1.00 0.00 H new ATOM 0 HB2 PRO A 10 21.699 -34.093 -22.942 1.00 0.00 H new ATOM 0 HB3 PRO A 10 22.542 -35.052 -21.741 1.00 0.00 H new ATOM 0 HG2 PRO A 10 20.404 -33.212 -21.256 1.00 0.00 H new ATOM 0 HG3 PRO A 10 21.350 -34.054 -20.044 1.00 0.00 H new ATOM 0 HD2 PRO A 10 21.427 -31.227 -20.684 1.00 0.00 H new ATOM 0 HD3 PRO A 10 22.357 -32.065 -19.457 1.00 0.00 H new ATOM 143 N GLU A 11 22.895 -31.752 -24.057 1.00 0.00 N ATOM 144 CA GLU A 11 23.226 -30.895 -25.180 1.00 0.00 C ATOM 145 C GLU A 11 24.412 -29.942 -24.799 1.00 0.00 C ATOM 146 O GLU A 11 24.339 -28.725 -24.986 1.00 0.00 O ATOM 147 CB GLU A 11 21.959 -30.167 -25.673 1.00 0.00 C ATOM 148 CG GLU A 11 21.257 -29.374 -24.559 1.00 0.00 C ATOM 149 CD GLU A 11 19.920 -28.830 -25.042 1.00 0.00 C ATOM 150 OE1 GLU A 11 19.893 -28.116 -26.068 1.00 0.00 O ATOM 151 OE2 GLU A 11 18.889 -29.112 -24.395 1.00 0.00 O ATOM 0 H GLU A 11 21.997 -31.550 -23.619 1.00 0.00 H new ATOM 0 HA GLU A 11 23.581 -31.487 -26.024 1.00 0.00 H new ATOM 0 HB2 GLU A 11 22.227 -29.488 -26.482 1.00 0.00 H new ATOM 0 HB3 GLU A 11 21.264 -30.897 -26.087 1.00 0.00 H new ATOM 0 HG2 GLU A 11 21.101 -30.016 -23.692 1.00 0.00 H new ATOM 0 HG3 GLU A 11 21.894 -28.551 -24.236 1.00 0.00 H new ATOM 158 N GLU A 12 25.383 -30.442 -23.999 1.00 0.00 N ATOM 159 CA GLU A 12 26.605 -29.657 -23.737 1.00 0.00 C ATOM 160 C GLU A 12 27.123 -28.836 -24.927 1.00 0.00 C ATOM 161 O GLU A 12 27.848 -27.857 -24.754 1.00 0.00 O ATOM 162 CB GLU A 12 27.749 -30.489 -23.118 1.00 0.00 C ATOM 163 CG GLU A 12 27.744 -31.968 -23.543 1.00 0.00 C ATOM 164 CD GLU A 12 28.015 -32.150 -25.030 1.00 0.00 C ATOM 165 OE1 GLU A 12 28.942 -31.502 -25.559 1.00 0.00 O ATOM 166 OE2 GLU A 12 27.307 -32.953 -25.675 1.00 0.00 O ATOM 0 H GLU A 12 25.346 -31.352 -23.540 1.00 0.00 H new ATOM 0 HA GLU A 12 26.268 -28.934 -22.994 1.00 0.00 H new ATOM 0 HB2 GLU A 12 28.703 -30.043 -23.400 1.00 0.00 H new ATOM 0 HB3 GLU A 12 27.679 -30.433 -22.032 1.00 0.00 H new ATOM 0 HG2 GLU A 12 28.498 -32.509 -22.971 1.00 0.00 H new ATOM 0 HG3 GLU A 12 26.779 -32.410 -23.296 1.00 0.00 H new ATOM 173 N LYS A 13 26.782 -29.245 -26.145 1.00 0.00 N ATOM 174 CA LYS A 13 27.019 -28.340 -27.284 1.00 0.00 C ATOM 175 C LYS A 13 26.304 -26.985 -27.102 1.00 0.00 C ATOM 176 O LYS A 13 26.888 -25.915 -27.275 1.00 0.00 O ATOM 177 CB LYS A 13 26.657 -28.963 -28.645 1.00 0.00 C ATOM 178 CG LYS A 13 27.893 -29.492 -29.388 1.00 0.00 C ATOM 179 CD LYS A 13 28.501 -30.711 -28.687 1.00 0.00 C ATOM 180 CE LYS A 13 27.639 -31.959 -28.888 1.00 0.00 C ATOM 181 NZ LYS A 13 28.224 -33.093 -28.150 1.00 0.00 N ATOM 0 H LYS A 13 26.362 -30.146 -26.372 1.00 0.00 H new ATOM 0 HA LYS A 13 28.095 -28.164 -27.293 1.00 0.00 H new ATOM 0 HB2 LYS A 13 25.950 -29.779 -28.493 1.00 0.00 H new ATOM 0 HB3 LYS A 13 26.156 -28.217 -29.262 1.00 0.00 H new ATOM 0 HG2 LYS A 13 27.617 -29.760 -30.408 1.00 0.00 H new ATOM 0 HG3 LYS A 13 28.641 -28.702 -29.457 1.00 0.00 H new ATOM 0 HD2 LYS A 13 29.503 -30.893 -29.075 1.00 0.00 H new ATOM 0 HD3 LYS A 13 28.604 -30.506 -27.621 1.00 0.00 H new ATOM 0 HE2 LYS A 13 26.624 -31.771 -28.539 1.00 0.00 H new ATOM 0 HE3 LYS A 13 27.572 -32.199 -29.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 28.286 -33.920 -28.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 29.176 -32.838 -27.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 27.623 -33.322 -27.332 1.00 0.00 H new ATOM 195 N ASP A 14 25.015 -27.051 -26.783 1.00 0.00 N ATOM 196 CA ASP A 14 24.302 -25.855 -26.322 1.00 0.00 C ATOM 197 C ASP A 14 25.008 -25.130 -25.163 1.00 0.00 C ATOM 198 O ASP A 14 25.099 -23.904 -25.147 1.00 0.00 O ATOM 199 CB ASP A 14 22.849 -26.168 -25.940 1.00 0.00 C ATOM 200 CG ASP A 14 21.996 -24.906 -25.876 1.00 0.00 C ATOM 201 OD1 ASP A 14 21.609 -24.385 -26.944 1.00 0.00 O ATOM 202 OD2 ASP A 14 21.711 -24.429 -24.756 1.00 0.00 O ATOM 0 H ASP A 14 24.449 -27.898 -26.832 1.00 0.00 H new ATOM 0 HA ASP A 14 24.304 -25.176 -27.174 1.00 0.00 H new ATOM 0 HB2 ASP A 14 22.423 -26.858 -26.668 1.00 0.00 H new ATOM 0 HB3 ASP A 14 22.828 -26.671 -24.973 1.00 0.00 H new ATOM 207 N GLU A 15 25.513 -25.887 -24.184 1.00 0.00 N ATOM 208 CA GLU A 15 26.307 -25.249 -23.113 1.00 0.00 C ATOM 209 C GLU A 15 27.498 -24.460 -23.648 1.00 0.00 C ATOM 210 O GLU A 15 27.826 -23.377 -23.169 1.00 0.00 O ATOM 211 CB GLU A 15 26.857 -26.243 -22.071 1.00 0.00 C ATOM 212 CG GLU A 15 25.892 -26.435 -20.895 1.00 0.00 C ATOM 213 CD GLU A 15 25.786 -25.174 -20.042 1.00 0.00 C ATOM 214 OE1 GLU A 15 26.746 -24.863 -19.305 1.00 0.00 O ATOM 215 OE2 GLU A 15 24.743 -24.487 -20.111 1.00 0.00 O ATOM 0 H GLU A 15 25.398 -26.897 -24.104 1.00 0.00 H new ATOM 0 HA GLU A 15 25.590 -24.581 -22.636 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.041 -27.205 -22.550 1.00 0.00 H new ATOM 0 HB3 GLU A 15 27.816 -25.884 -21.698 1.00 0.00 H new ATOM 0 HG2 GLU A 15 24.905 -26.703 -21.273 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.232 -27.266 -20.277 1.00 0.00 H new ATOM 222 N CYS A 16 28.183 -25.036 -24.620 1.00 0.00 N ATOM 223 CA CYS A 16 29.339 -24.332 -25.185 1.00 0.00 C ATOM 224 C CYS A 16 28.951 -23.094 -26.023 1.00 0.00 C ATOM 225 O CYS A 16 29.705 -22.123 -26.080 1.00 0.00 O ATOM 226 CB CYS A 16 30.335 -25.253 -25.888 1.00 0.00 C ATOM 227 SG CYS A 16 30.743 -26.661 -24.806 1.00 0.00 S ATOM 0 H CYS A 16 27.979 -25.949 -25.026 1.00 0.00 H new ATOM 0 HA CYS A 16 29.880 -23.940 -24.324 1.00 0.00 H new ATOM 0 HB2 CYS A 16 29.912 -25.614 -26.825 1.00 0.00 H new ATOM 0 HB3 CYS A 16 31.241 -24.701 -26.139 1.00 0.00 H new ATOM 0 HG CYS A 16 29.675 -27.372 -24.598 1.00 0.00 H new ATOM 233 N MET A 17 27.781 -23.089 -26.674 1.00 0.00 N ATOM 234 CA MET A 17 27.292 -21.797 -27.212 1.00 0.00 C ATOM 235 C MET A 17 26.688 -20.907 -26.102 1.00 0.00 C ATOM 236 O MET A 17 26.528 -19.700 -26.272 1.00 0.00 O ATOM 237 CB MET A 17 26.344 -21.853 -28.426 1.00 0.00 C ATOM 238 CG MET A 17 26.641 -20.724 -29.435 1.00 0.00 C ATOM 239 SD MET A 17 27.317 -21.399 -30.971 1.00 0.00 S ATOM 240 CE MET A 17 28.904 -20.527 -31.064 1.00 0.00 C ATOM 0 H MET A 17 27.185 -23.900 -26.838 1.00 0.00 H new ATOM 0 HA MET A 17 28.204 -21.349 -27.608 1.00 0.00 H new ATOM 0 HB2 MET A 17 26.444 -22.819 -28.921 1.00 0.00 H new ATOM 0 HB3 MET A 17 25.312 -21.774 -28.085 1.00 0.00 H new ATOM 0 HG2 MET A 17 25.727 -20.170 -29.647 1.00 0.00 H new ATOM 0 HG3 MET A 17 27.348 -20.018 -29.000 1.00 0.00 H new ATOM 0 HE1 MET A 17 29.431 -20.826 -31.970 1.00 0.00 H new ATOM 0 HE2 MET A 17 28.728 -19.452 -31.084 1.00 0.00 H new ATOM 0 HE3 MET A 17 29.509 -20.779 -30.193 1.00 0.00 H new ATOM 250 N LYS A 18 26.352 -21.499 -24.953 1.00 0.00 N ATOM 251 CA LYS A 18 25.902 -20.694 -23.820 1.00 0.00 C ATOM 252 C LYS A 18 27.079 -19.950 -23.164 1.00 0.00 C ATOM 253 O LYS A 18 27.026 -18.742 -22.928 1.00 0.00 O ATOM 254 CB LYS A 18 25.124 -21.555 -22.807 1.00 0.00 C ATOM 255 CG LYS A 18 23.996 -20.784 -22.109 1.00 0.00 C ATOM 256 CD LYS A 18 24.519 -19.499 -21.474 1.00 0.00 C ATOM 257 CE LYS A 18 23.458 -18.832 -20.596 1.00 0.00 C ATOM 258 NZ LYS A 18 22.553 -18.019 -21.431 1.00 0.00 N ATOM 0 H LYS A 18 26.382 -22.505 -24.786 1.00 0.00 H new ATOM 0 HA LYS A 18 25.214 -19.935 -24.193 1.00 0.00 H new ATOM 0 HB2 LYS A 18 24.703 -22.419 -23.321 1.00 0.00 H new ATOM 0 HB3 LYS A 18 25.815 -21.936 -22.056 1.00 0.00 H new ATOM 0 HG2 LYS A 18 23.215 -20.545 -22.830 1.00 0.00 H new ATOM 0 HG3 LYS A 18 23.541 -21.413 -21.343 1.00 0.00 H new ATOM 0 HD2 LYS A 18 25.401 -19.722 -20.874 1.00 0.00 H new ATOM 0 HD3 LYS A 18 24.832 -18.807 -22.256 1.00 0.00 H new ATOM 0 HE2 LYS A 18 22.888 -19.591 -20.059 1.00 0.00 H new ATOM 0 HE3 LYS A 18 23.937 -18.203 -19.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 21.835 -17.569 -20.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 23.101 -17.285 -21.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 22.084 -18.629 -22.131 1.00 0.00 H new ATOM 272 N ILE A 19 28.158 -20.675 -22.868 1.00 0.00 N ATOM 273 CA ILE A 19 29.414 -19.991 -22.516 1.00 0.00 C ATOM 274 C ILE A 19 29.801 -18.968 -23.592 1.00 0.00 C ATOM 275 O ILE A 19 30.198 -17.845 -23.301 1.00 0.00 O ATOM 276 CB ILE A 19 30.556 -20.996 -22.226 1.00 0.00 C ATOM 277 CG1 ILE A 19 31.591 -20.494 -21.203 1.00 0.00 C ATOM 278 CG2 ILE A 19 31.254 -21.479 -23.489 1.00 0.00 C ATOM 279 CD1 ILE A 19 32.055 -19.064 -21.430 1.00 0.00 C ATOM 0 H ILE A 19 28.197 -21.694 -22.862 1.00 0.00 H new ATOM 0 HA ILE A 19 29.246 -19.442 -21.590 1.00 0.00 H new ATOM 0 HB ILE A 19 30.047 -21.846 -21.770 1.00 0.00 H new ATOM 0 HG12 ILE A 19 31.163 -20.570 -20.204 1.00 0.00 H new ATOM 0 HG13 ILE A 19 32.459 -21.153 -21.229 1.00 0.00 H new ATOM 0 HG21 ILE A 19 32.044 -22.181 -23.222 1.00 0.00 H new ATOM 0 HG22 ILE A 19 30.532 -21.975 -24.137 1.00 0.00 H new ATOM 0 HG23 ILE A 19 31.687 -20.627 -24.014 1.00 0.00 H new ATOM 0 HD11 ILE A 19 32.782 -18.792 -20.665 1.00 0.00 H new ATOM 0 HD12 ILE A 19 32.516 -18.983 -22.414 1.00 0.00 H new ATOM 0 HD13 ILE A 19 31.200 -18.391 -21.373 1.00 0.00 H new ATOM 291 N PHE A 20 29.640 -19.361 -24.852 1.00 0.00 N ATOM 292 CA PHE A 20 29.838 -18.405 -25.943 1.00 0.00 C ATOM 293 C PHE A 20 28.966 -17.141 -25.805 1.00 0.00 C ATOM 294 O PHE A 20 29.402 -16.025 -26.077 1.00 0.00 O ATOM 295 CB PHE A 20 29.576 -19.108 -27.291 1.00 0.00 C ATOM 296 CG PHE A 20 30.526 -18.681 -28.379 1.00 0.00 C ATOM 297 CD1 PHE A 20 30.620 -17.367 -28.667 1.00 0.00 C ATOM 298 CD2 PHE A 20 31.485 -19.532 -28.830 1.00 0.00 C ATOM 299 CE1 PHE A 20 31.817 -16.848 -29.016 1.00 0.00 C ATOM 300 CE2 PHE A 20 32.637 -19.021 -29.334 1.00 0.00 C ATOM 301 CZ PHE A 20 32.849 -17.680 -29.283 1.00 0.00 C ATOM 0 H PHE A 20 29.381 -20.304 -25.141 1.00 0.00 H new ATOM 0 HA PHE A 20 30.872 -18.062 -25.897 1.00 0.00 H new ATOM 0 HB2 PHE A 20 29.654 -20.186 -27.152 1.00 0.00 H new ATOM 0 HB3 PHE A 20 28.554 -18.901 -27.608 1.00 0.00 H new ATOM 0 HD1 PHE A 20 29.746 -16.735 -28.619 1.00 0.00 H new ATOM 0 HD2 PHE A 20 31.332 -20.600 -28.788 1.00 0.00 H new ATOM 0 HE1 PHE A 20 31.949 -15.778 -29.081 1.00 0.00 H new ATOM 0 HE2 PHE A 20 33.378 -19.674 -29.771 1.00 0.00 H new ATOM 0 HZ PHE A 20 33.837 -17.280 -29.455 1.00 0.00 H new ATOM 311 N ASP A 21 27.737 -17.330 -25.337 1.00 0.00 N ATOM 312 CA ASP A 21 26.828 -16.187 -25.138 1.00 0.00 C ATOM 313 C ASP A 21 27.184 -15.313 -23.928 1.00 0.00 C ATOM 314 O ASP A 21 27.090 -14.087 -23.972 1.00 0.00 O ATOM 315 CB ASP A 21 25.376 -16.670 -25.021 1.00 0.00 C ATOM 316 CG ASP A 21 24.363 -15.576 -25.336 1.00 0.00 C ATOM 317 OD1 ASP A 21 24.312 -15.114 -26.495 1.00 0.00 O ATOM 318 OD2 ASP A 21 23.599 -15.191 -24.425 1.00 0.00 O ATOM 0 H ASP A 21 27.346 -18.239 -25.091 1.00 0.00 H new ATOM 0 HA ASP A 21 26.946 -15.558 -26.020 1.00 0.00 H new ATOM 0 HB2 ASP A 21 25.221 -17.509 -25.700 1.00 0.00 H new ATOM 0 HB3 ASP A 21 25.201 -17.041 -24.011 1.00 0.00 H new ATOM 323 N ILE A 22 27.563 -15.947 -22.826 1.00 0.00 N ATOM 324 CA ILE A 22 28.018 -15.136 -21.678 1.00 0.00 C ATOM 325 C ILE A 22 29.382 -14.482 -21.970 1.00 0.00 C ATOM 326 O ILE A 22 29.603 -13.298 -21.713 1.00 0.00 O ATOM 327 CB ILE A 22 28.112 -15.841 -20.292 1.00 0.00 C ATOM 328 CG1 ILE A 22 26.796 -16.481 -19.818 1.00 0.00 C ATOM 329 CG2 ILE A 22 28.526 -14.810 -19.235 1.00 0.00 C ATOM 330 CD1 ILE A 22 27.069 -17.374 -18.601 1.00 0.00 C ATOM 0 H ILE A 22 27.571 -16.958 -22.692 1.00 0.00 H new ATOM 0 HA ILE A 22 27.213 -14.408 -21.581 1.00 0.00 H new ATOM 0 HB ILE A 22 28.842 -16.642 -20.414 1.00 0.00 H new ATOM 0 HG12 ILE A 22 26.075 -15.706 -19.559 1.00 0.00 H new ATOM 0 HG13 ILE A 22 26.355 -17.070 -20.623 1.00 0.00 H new ATOM 0 HG21 ILE A 22 28.594 -15.295 -18.261 1.00 0.00 H new ATOM 0 HG22 ILE A 22 29.496 -14.388 -19.499 1.00 0.00 H new ATOM 0 HG23 ILE A 22 27.783 -14.014 -19.193 1.00 0.00 H new ATOM 0 HD11 ILE A 22 26.136 -17.827 -18.266 1.00 0.00 H new ATOM 0 HD12 ILE A 22 27.775 -18.158 -18.876 1.00 0.00 H new ATOM 0 HD13 ILE A 22 27.490 -16.772 -17.796 1.00 0.00 H new ATOM 342 N PHE A 23 30.303 -15.273 -22.509 1.00 0.00 N ATOM 343 CA PHE A 23 31.680 -14.786 -22.677 1.00 0.00 C ATOM 344 C PHE A 23 31.937 -14.008 -23.979 1.00 0.00 C ATOM 345 O PHE A 23 33.082 -13.700 -24.315 1.00 0.00 O ATOM 346 CB PHE A 23 32.711 -15.916 -22.540 1.00 0.00 C ATOM 347 CG PHE A 23 32.993 -16.229 -21.078 1.00 0.00 C ATOM 348 CD1 PHE A 23 31.991 -16.126 -20.172 1.00 0.00 C ATOM 349 CD2 PHE A 23 34.267 -16.153 -20.639 1.00 0.00 C ATOM 350 CE1 PHE A 23 32.223 -15.509 -18.988 1.00 0.00 C ATOM 351 CE2 PHE A 23 34.522 -15.524 -19.463 1.00 0.00 C ATOM 352 CZ PHE A 23 33.490 -15.140 -18.665 1.00 0.00 C ATOM 0 H PHE A 23 30.137 -16.227 -22.831 1.00 0.00 H new ATOM 0 HA PHE A 23 31.805 -14.074 -21.861 1.00 0.00 H new ATOM 0 HB2 PHE A 23 32.343 -16.811 -23.042 1.00 0.00 H new ATOM 0 HB3 PHE A 23 33.637 -15.629 -23.038 1.00 0.00 H new ATOM 0 HD1 PHE A 23 31.015 -16.532 -20.392 1.00 0.00 H new ATOM 0 HD2 PHE A 23 35.072 -16.586 -21.215 1.00 0.00 H new ATOM 0 HE1 PHE A 23 31.408 -15.312 -18.307 1.00 0.00 H new ATOM 0 HE2 PHE A 23 35.541 -15.329 -19.162 1.00 0.00 H new ATOM 0 HZ PHE A 23 33.676 -14.547 -17.782 1.00 0.00 H new ATOM 362 N ASP A 24 30.887 -13.755 -24.756 1.00 0.00 N ATOM 363 CA ASP A 24 31.054 -12.983 -25.996 1.00 0.00 C ATOM 364 C ASP A 24 31.510 -11.509 -25.781 1.00 0.00 C ATOM 365 O ASP A 24 30.936 -10.600 -26.367 1.00 0.00 O ATOM 366 CB ASP A 24 29.746 -12.985 -26.813 1.00 0.00 C ATOM 367 CG ASP A 24 28.579 -12.296 -26.103 1.00 0.00 C ATOM 368 OD1 ASP A 24 28.733 -11.874 -24.936 1.00 0.00 O ATOM 369 OD2 ASP A 24 27.503 -12.163 -26.725 1.00 0.00 O ATOM 0 H ASP A 24 29.934 -14.061 -24.562 1.00 0.00 H new ATOM 0 HA ASP A 24 31.855 -13.486 -26.537 1.00 0.00 H new ATOM 0 HB2 ASP A 24 29.923 -12.490 -27.768 1.00 0.00 H new ATOM 0 HB3 ASP A 24 29.468 -14.015 -27.035 1.00 0.00 H new ATOM 374 N ARG A 25 32.496 -11.233 -24.918 1.00 0.00 N ATOM 375 CA ARG A 25 32.970 -9.839 -24.767 1.00 0.00 C ATOM 376 C ARG A 25 31.878 -8.809 -24.427 1.00 0.00 C ATOM 377 O ARG A 25 31.997 -7.632 -24.763 1.00 0.00 O ATOM 378 CB ARG A 25 33.719 -9.367 -26.019 1.00 0.00 C ATOM 379 CG ARG A 25 35.005 -10.157 -26.265 1.00 0.00 C ATOM 380 CD ARG A 25 36.236 -9.333 -25.871 1.00 0.00 C ATOM 381 NE ARG A 25 36.544 -8.367 -26.936 1.00 0.00 N ATOM 382 CZ ARG A 25 37.168 -7.234 -26.636 1.00 0.00 C ATOM 383 NH1 ARG A 25 37.929 -7.142 -25.561 1.00 0.00 N ATOM 384 NH2 ARG A 25 37.045 -6.198 -27.438 1.00 0.00 N ATOM 0 H ARG A 25 32.969 -11.921 -24.332 1.00 0.00 H new ATOM 0 HA ARG A 25 33.638 -9.882 -23.907 1.00 0.00 H new ATOM 0 HB2 ARG A 25 33.066 -9.463 -26.887 1.00 0.00 H new ATOM 0 HB3 ARG A 25 33.960 -8.309 -25.917 1.00 0.00 H new ATOM 0 HG2 ARG A 25 34.983 -11.083 -25.691 1.00 0.00 H new ATOM 0 HG3 ARG A 25 35.070 -10.436 -27.317 1.00 0.00 H new ATOM 0 HD2 ARG A 25 36.051 -8.809 -24.933 1.00 0.00 H new ATOM 0 HD3 ARG A 25 37.089 -9.991 -25.705 1.00 0.00 H new ATOM 0 HE ARG A 25 36.280 -8.566 -27.901 1.00 0.00 H new ATOM 0 HH11 ARG A 25 38.044 -7.948 -24.947 1.00 0.00 H new ATOM 0 HH12 ARG A 25 38.402 -6.264 -25.344 1.00 0.00 H new ATOM 0 HH21 ARG A 25 36.475 -6.270 -28.281 1.00 0.00 H new ATOM 0 HH22 ARG A 25 37.520 -5.323 -27.217 1.00 0.00 H new ATOM 398 N ASN A 26 30.808 -9.260 -23.777 1.00 0.00 N ATOM 399 CA ASN A 26 29.647 -8.369 -23.574 1.00 0.00 C ATOM 400 C ASN A 26 28.718 -8.525 -24.775 1.00 0.00 C ATOM 401 O ASN A 26 27.559 -8.921 -24.660 1.00 0.00 O ATOM 402 CB ASN A 26 29.942 -6.907 -23.134 1.00 0.00 C ATOM 403 CG ASN A 26 29.557 -5.822 -24.158 1.00 0.00 C ATOM 404 OD1 ASN A 26 28.462 -5.262 -24.103 1.00 0.00 O ATOM 405 ND2 ASN A 26 30.446 -5.475 -25.078 1.00 0.00 N ATOM 0 H ASN A 26 30.711 -10.199 -23.391 1.00 0.00 H new ATOM 0 HA ASN A 26 29.131 -8.699 -22.672 1.00 0.00 H new ATOM 0 HB2 ASN A 26 29.410 -6.710 -22.203 1.00 0.00 H new ATOM 0 HB3 ASN A 26 31.007 -6.818 -22.917 1.00 0.00 H new ATOM 0 HD21 ASN A 26 30.225 -4.738 -25.748 1.00 0.00 H new ATOM 0 HD22 ASN A 26 31.351 -5.945 -25.116 1.00 0.00 H new ATOM 412 N ALA A 27 29.258 -8.203 -25.938 1.00 0.00 N ATOM 413 CA ALA A 27 28.603 -8.625 -27.178 1.00 0.00 C ATOM 414 C ALA A 27 29.510 -8.526 -28.417 1.00 0.00 C ATOM 415 O ALA A 27 29.255 -7.756 -29.345 1.00 0.00 O ATOM 416 CB ALA A 27 27.272 -7.920 -27.440 1.00 0.00 C ATOM 0 H ALA A 27 30.119 -7.669 -26.057 1.00 0.00 H new ATOM 0 HA ALA A 27 28.388 -9.680 -27.010 1.00 0.00 H new ATOM 0 HB1 ALA A 27 26.846 -8.283 -28.375 1.00 0.00 H new ATOM 0 HB2 ALA A 27 26.583 -8.128 -26.622 1.00 0.00 H new ATOM 0 HB3 ALA A 27 27.437 -6.845 -27.510 1.00 0.00 H new ATOM 422 N GLU A 28 30.578 -9.316 -28.430 1.00 0.00 N ATOM 423 CA GLU A 28 31.422 -9.375 -29.634 1.00 0.00 C ATOM 424 C GLU A 28 32.214 -10.679 -29.833 1.00 0.00 C ATOM 425 O GLU A 28 33.017 -10.799 -30.759 1.00 0.00 O ATOM 426 CB GLU A 28 32.234 -8.084 -29.869 1.00 0.00 C ATOM 427 CG GLU A 28 33.415 -7.956 -28.900 1.00 0.00 C ATOM 428 CD GLU A 28 34.443 -6.948 -29.387 1.00 0.00 C ATOM 429 OE1 GLU A 28 34.080 -5.776 -29.620 1.00 0.00 O ATOM 430 OE2 GLU A 28 35.631 -7.317 -29.506 1.00 0.00 O ATOM 0 H GLU A 28 30.879 -9.907 -27.655 1.00 0.00 H new ATOM 0 HA GLU A 28 30.707 -9.420 -30.455 1.00 0.00 H new ATOM 0 HB2 GLU A 28 32.605 -8.072 -30.894 1.00 0.00 H new ATOM 0 HB3 GLU A 28 31.579 -7.220 -29.757 1.00 0.00 H new ATOM 0 HG2 GLU A 28 33.048 -7.655 -27.919 1.00 0.00 H new ATOM 0 HG3 GLU A 28 33.891 -8.929 -28.777 1.00 0.00 H new ATOM 437 N ASN A 29 31.978 -11.667 -28.975 1.00 0.00 N ATOM 438 CA ASN A 29 32.396 -13.043 -29.297 1.00 0.00 C ATOM 439 C ASN A 29 33.878 -13.390 -29.071 1.00 0.00 C ATOM 440 O ASN A 29 34.194 -14.535 -28.750 1.00 0.00 O ATOM 441 CB ASN A 29 31.888 -13.535 -30.670 1.00 0.00 C ATOM 442 CG ASN A 29 30.379 -13.804 -30.681 1.00 0.00 C ATOM 443 OD1 ASN A 29 29.924 -14.882 -31.054 1.00 0.00 O ATOM 444 ND2 ASN A 29 29.582 -12.825 -30.290 1.00 0.00 N ATOM 0 H ASN A 29 31.513 -11.555 -28.074 1.00 0.00 H new ATOM 0 HA ASN A 29 31.880 -13.616 -28.527 1.00 0.00 H new ATOM 0 HB2 ASN A 29 32.126 -12.790 -31.429 1.00 0.00 H new ATOM 0 HB3 ASN A 29 32.418 -14.448 -30.943 1.00 0.00 H new ATOM 0 HD21 ASN A 29 28.571 -12.958 -30.295 1.00 0.00 H new ATOM 0 HD22 ASN A 29 29.978 -11.936 -29.983 1.00 0.00 H new ATOM 451 N ILE A 30 34.801 -12.439 -29.209 1.00 0.00 N ATOM 452 CA ILE A 30 36.215 -12.831 -29.132 1.00 0.00 C ATOM 453 C ILE A 30 36.709 -12.969 -27.674 1.00 0.00 C ATOM 454 O ILE A 30 37.094 -12.007 -27.012 1.00 0.00 O ATOM 455 CB ILE A 30 37.147 -12.007 -30.051 1.00 0.00 C ATOM 456 CG1 ILE A 30 37.434 -10.610 -29.470 1.00 0.00 C ATOM 457 CG2 ILE A 30 36.526 -11.847 -31.441 1.00 0.00 C ATOM 458 CD1 ILE A 30 38.227 -9.735 -30.446 1.00 0.00 C ATOM 0 H ILE A 30 34.618 -11.448 -29.366 1.00 0.00 H new ATOM 0 HA ILE A 30 36.272 -13.835 -29.552 1.00 0.00 H new ATOM 0 HB ILE A 30 38.087 -12.555 -30.124 1.00 0.00 H new ATOM 0 HG12 ILE A 30 36.492 -10.119 -29.225 1.00 0.00 H new ATOM 0 HG13 ILE A 30 37.992 -10.712 -28.539 1.00 0.00 H new ATOM 0 HG21 ILE A 30 37.196 -11.265 -32.074 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.370 -12.830 -31.885 1.00 0.00 H new ATOM 0 HG23 ILE A 30 35.569 -11.332 -31.355 1.00 0.00 H new ATOM 0 HD11 ILE A 30 38.407 -8.759 -29.996 1.00 0.00 H new ATOM 0 HD12 ILE A 30 39.181 -10.213 -30.670 1.00 0.00 H new ATOM 0 HD13 ILE A 30 37.658 -9.610 -31.367 1.00 0.00 H new ATOM 470 N ALA A 31 36.685 -14.197 -27.173 1.00 0.00 N ATOM 471 CA ALA A 31 37.093 -14.437 -25.781 1.00 0.00 C ATOM 472 C ALA A 31 38.557 -14.903 -25.682 1.00 0.00 C ATOM 473 O ALA A 31 38.929 -15.900 -26.298 1.00 0.00 O ATOM 474 CB ALA A 31 36.192 -15.476 -25.110 1.00 0.00 C ATOM 0 H ALA A 31 36.396 -15.028 -27.688 1.00 0.00 H new ATOM 0 HA ALA A 31 36.994 -13.483 -25.263 1.00 0.00 H new ATOM 0 HB1 ALA A 31 36.519 -15.632 -24.082 1.00 0.00 H new ATOM 0 HB2 ALA A 31 35.162 -15.120 -25.113 1.00 0.00 H new ATOM 0 HB3 ALA A 31 36.253 -16.417 -25.656 1.00 0.00 H new ATOM 480 N PRO A 32 39.403 -14.264 -24.865 1.00 0.00 N ATOM 481 CA PRO A 32 40.830 -14.610 -24.890 1.00 0.00 C ATOM 482 C PRO A 32 41.119 -15.825 -23.979 1.00 0.00 C ATOM 483 O PRO A 32 40.205 -16.439 -23.427 1.00 0.00 O ATOM 484 CB PRO A 32 41.520 -13.328 -24.400 1.00 0.00 C ATOM 485 CG PRO A 32 40.431 -12.433 -23.797 1.00 0.00 C ATOM 486 CD PRO A 32 39.108 -12.917 -24.382 1.00 0.00 C ATOM 0 HA PRO A 32 41.187 -14.912 -25.874 1.00 0.00 H new ATOM 0 HB2 PRO A 32 42.283 -13.561 -23.657 1.00 0.00 H new ATOM 0 HB3 PRO A 32 42.022 -12.822 -25.224 1.00 0.00 H new ATOM 0 HG2 PRO A 32 40.425 -12.506 -22.709 1.00 0.00 H new ATOM 0 HG3 PRO A 32 40.606 -11.386 -24.045 1.00 0.00 H new ATOM 0 HD2 PRO A 32 38.319 -12.927 -23.629 1.00 0.00 H new ATOM 0 HD3 PRO A 32 38.769 -12.269 -25.190 1.00 0.00 H new ATOM 494 N VAL A 33 42.396 -16.199 -23.832 1.00 0.00 N ATOM 495 CA VAL A 33 42.729 -17.284 -22.856 1.00 0.00 C ATOM 496 C VAL A 33 42.106 -17.068 -21.473 1.00 0.00 C ATOM 497 O VAL A 33 41.456 -17.955 -20.922 1.00 0.00 O ATOM 498 CB VAL A 33 44.245 -17.514 -22.649 1.00 0.00 C ATOM 499 CG1 VAL A 33 44.742 -18.667 -23.518 1.00 0.00 C ATOM 500 CG2 VAL A 33 45.070 -16.247 -22.909 1.00 0.00 C ATOM 0 H VAL A 33 43.188 -15.802 -24.338 1.00 0.00 H new ATOM 0 HA VAL A 33 42.298 -18.166 -23.329 1.00 0.00 H new ATOM 0 HB VAL A 33 44.385 -17.778 -21.601 1.00 0.00 H new ATOM 0 HG11 VAL A 33 45.810 -18.810 -23.356 1.00 0.00 H new ATOM 0 HG12 VAL A 33 44.209 -19.580 -23.251 1.00 0.00 H new ATOM 0 HG13 VAL A 33 44.562 -18.435 -24.568 1.00 0.00 H new ATOM 0 HG21 VAL A 33 46.127 -16.462 -22.750 1.00 0.00 H new ATOM 0 HG22 VAL A 33 44.917 -15.918 -23.937 1.00 0.00 H new ATOM 0 HG23 VAL A 33 44.753 -15.460 -22.225 1.00 0.00 H new ATOM 510 N SER A 34 42.328 -15.897 -20.889 1.00 0.00 N ATOM 511 CA SER A 34 41.783 -15.648 -19.543 1.00 0.00 C ATOM 512 C SER A 34 40.267 -15.879 -19.436 1.00 0.00 C ATOM 513 O SER A 34 39.761 -16.337 -18.413 1.00 0.00 O ATOM 514 CB SER A 34 42.153 -14.261 -19.011 1.00 0.00 C ATOM 515 OG SER A 34 41.563 -13.252 -19.824 1.00 0.00 O ATOM 0 H SER A 34 42.858 -15.128 -21.298 1.00 0.00 H new ATOM 0 HA SER A 34 42.261 -16.396 -18.910 1.00 0.00 H new ATOM 0 HB2 SER A 34 41.812 -14.155 -17.981 1.00 0.00 H new ATOM 0 HB3 SER A 34 43.237 -14.144 -19.001 1.00 0.00 H new ATOM 0 HG SER A 34 41.804 -12.368 -19.475 1.00 0.00 H new ATOM 521 N ASP A 35 39.538 -15.551 -20.497 1.00 0.00 N ATOM 522 CA ASP A 35 38.115 -15.889 -20.531 1.00 0.00 C ATOM 523 C ASP A 35 37.862 -17.418 -20.509 1.00 0.00 C ATOM 524 O ASP A 35 36.952 -17.911 -19.837 1.00 0.00 O ATOM 525 CB ASP A 35 37.414 -15.186 -21.706 1.00 0.00 C ATOM 526 CG ASP A 35 36.978 -13.772 -21.338 1.00 0.00 C ATOM 527 OD1 ASP A 35 37.842 -12.954 -20.954 1.00 0.00 O ATOM 528 OD2 ASP A 35 35.771 -13.466 -21.451 1.00 0.00 O ATOM 0 H ASP A 35 39.892 -15.067 -21.322 1.00 0.00 H new ATOM 0 HA ASP A 35 37.667 -15.511 -19.612 1.00 0.00 H new ATOM 0 HB2 ASP A 35 38.088 -15.148 -22.562 1.00 0.00 H new ATOM 0 HB3 ASP A 35 36.544 -15.767 -22.011 1.00 0.00 H new ATOM 533 N THR A 36 38.701 -18.174 -21.221 1.00 0.00 N ATOM 534 CA THR A 36 38.652 -19.637 -21.119 1.00 0.00 C ATOM 535 C THR A 36 38.905 -20.145 -19.678 1.00 0.00 C ATOM 536 O THR A 36 38.277 -21.105 -19.231 1.00 0.00 O ATOM 537 CB THR A 36 39.561 -20.280 -22.195 1.00 0.00 C ATOM 538 OG1 THR A 36 39.000 -20.038 -23.477 1.00 0.00 O ATOM 539 CG2 THR A 36 39.717 -21.790 -22.026 1.00 0.00 C ATOM 0 H THR A 36 39.407 -17.810 -21.861 1.00 0.00 H new ATOM 0 HA THR A 36 37.635 -19.966 -21.334 1.00 0.00 H new ATOM 0 HB THR A 36 40.547 -19.828 -22.086 1.00 0.00 H new ATOM 0 HG1 THR A 36 38.163 -20.540 -23.568 1.00 0.00 H new ATOM 0 HG21 THR A 36 40.365 -22.179 -22.811 1.00 0.00 H new ATOM 0 HG22 THR A 36 40.158 -22.004 -21.052 1.00 0.00 H new ATOM 0 HG23 THR A 36 38.739 -22.267 -22.094 1.00 0.00 H new ATOM 547 N MET A 37 39.785 -19.481 -18.919 1.00 0.00 N ATOM 548 CA MET A 37 39.938 -19.861 -17.505 1.00 0.00 C ATOM 549 C MET A 37 38.741 -19.432 -16.650 1.00 0.00 C ATOM 550 O MET A 37 38.267 -20.183 -15.792 1.00 0.00 O ATOM 551 CB MET A 37 41.233 -19.319 -16.893 1.00 0.00 C ATOM 552 CG MET A 37 42.463 -19.973 -17.518 1.00 0.00 C ATOM 553 SD MET A 37 42.883 -19.149 -19.057 1.00 0.00 S ATOM 554 CE MET A 37 42.656 -20.531 -20.178 1.00 0.00 C ATOM 0 H MET A 37 40.377 -18.714 -19.237 1.00 0.00 H new ATOM 0 HA MET A 37 39.986 -20.950 -17.501 1.00 0.00 H new ATOM 0 HB2 MET A 37 41.281 -18.240 -17.037 1.00 0.00 H new ATOM 0 HB3 MET A 37 41.231 -19.498 -15.818 1.00 0.00 H new ATOM 0 HG2 MET A 37 43.304 -19.920 -16.827 1.00 0.00 H new ATOM 0 HG3 MET A 37 42.269 -21.029 -17.703 1.00 0.00 H new ATOM 0 HE1 MET A 37 42.574 -20.161 -21.200 1.00 0.00 H new ATOM 0 HE2 MET A 37 43.510 -21.204 -20.103 1.00 0.00 H new ATOM 0 HE3 MET A 37 41.746 -21.069 -19.913 1.00 0.00 H new ATOM 564 N ASP A 38 38.270 -18.202 -16.865 1.00 0.00 N ATOM 565 CA ASP A 38 37.030 -17.763 -16.206 1.00 0.00 C ATOM 566 C ASP A 38 35.930 -18.817 -16.234 1.00 0.00 C ATOM 567 O ASP A 38 35.369 -19.191 -15.203 1.00 0.00 O ATOM 568 CB ASP A 38 36.440 -16.503 -16.834 1.00 0.00 C ATOM 569 CG ASP A 38 36.900 -15.232 -16.131 1.00 0.00 C ATOM 570 OD1 ASP A 38 36.246 -14.829 -15.143 1.00 0.00 O ATOM 571 OD2 ASP A 38 37.910 -14.633 -16.557 1.00 0.00 O ATOM 0 H ASP A 38 38.709 -17.508 -17.470 1.00 0.00 H new ATOM 0 HA ASP A 38 37.341 -17.570 -15.179 1.00 0.00 H new ATOM 0 HB2 ASP A 38 36.725 -16.457 -17.885 1.00 0.00 H new ATOM 0 HB3 ASP A 38 35.352 -16.559 -16.801 1.00 0.00 H new ATOM 576 N MET A 39 35.618 -19.304 -17.429 1.00 0.00 N ATOM 577 CA MET A 39 34.470 -20.202 -17.531 1.00 0.00 C ATOM 578 C MET A 39 34.793 -21.677 -17.347 1.00 0.00 C ATOM 579 O MET A 39 34.021 -22.403 -16.732 1.00 0.00 O ATOM 580 CB MET A 39 33.579 -19.868 -18.716 1.00 0.00 C ATOM 581 CG MET A 39 32.294 -19.172 -18.234 1.00 0.00 C ATOM 582 SD MET A 39 32.705 -17.843 -17.093 1.00 0.00 S ATOM 583 CE MET A 39 31.054 -17.511 -16.454 1.00 0.00 C ATOM 0 H MET A 39 36.112 -19.108 -18.300 1.00 0.00 H new ATOM 0 HA MET A 39 33.856 -20.000 -16.653 1.00 0.00 H new ATOM 0 HB2 MET A 39 34.113 -19.220 -19.411 1.00 0.00 H new ATOM 0 HB3 MET A 39 33.326 -20.779 -19.259 1.00 0.00 H new ATOM 0 HG2 MET A 39 31.745 -18.773 -19.087 1.00 0.00 H new ATOM 0 HG3 MET A 39 31.641 -19.894 -17.744 1.00 0.00 H new ATOM 0 HE1 MET A 39 31.097 -16.682 -15.748 1.00 0.00 H new ATOM 0 HE2 MET A 39 30.390 -17.252 -17.279 1.00 0.00 H new ATOM 0 HE3 MET A 39 30.674 -18.399 -15.948 1.00 0.00 H new ATOM 593 N LEU A 40 35.943 -22.158 -17.788 1.00 0.00 N ATOM 594 CA LEU A 40 36.307 -23.519 -17.363 1.00 0.00 C ATOM 595 C LEU A 40 36.423 -23.642 -15.826 1.00 0.00 C ATOM 596 O LEU A 40 36.415 -24.739 -15.274 1.00 0.00 O ATOM 597 CB LEU A 40 37.483 -24.138 -18.142 1.00 0.00 C ATOM 598 CG LEU A 40 37.108 -24.715 -19.536 1.00 0.00 C ATOM 599 CD1 LEU A 40 35.601 -24.873 -19.773 1.00 0.00 C ATOM 600 CD2 LEU A 40 37.739 -23.885 -20.644 1.00 0.00 C ATOM 0 H LEU A 40 36.606 -21.677 -18.396 1.00 0.00 H new ATOM 0 HA LEU A 40 35.465 -24.151 -17.647 1.00 0.00 H new ATOM 0 HB2 LEU A 40 38.253 -23.378 -18.274 1.00 0.00 H new ATOM 0 HB3 LEU A 40 37.920 -24.935 -17.540 1.00 0.00 H new ATOM 0 HG LEU A 40 37.514 -25.726 -19.553 1.00 0.00 H new ATOM 0 HD11 LEU A 40 35.430 -25.281 -20.769 1.00 0.00 H new ATOM 0 HD12 LEU A 40 35.184 -25.550 -19.027 1.00 0.00 H new ATOM 0 HD13 LEU A 40 35.116 -23.900 -19.691 1.00 0.00 H new ATOM 0 HD21 LEU A 40 37.466 -24.303 -21.613 1.00 0.00 H new ATOM 0 HD22 LEU A 40 37.380 -22.858 -20.578 1.00 0.00 H new ATOM 0 HD23 LEU A 40 38.824 -23.898 -20.536 1.00 0.00 H new ATOM 612 N THR A 41 36.467 -22.510 -15.122 1.00 0.00 N ATOM 613 CA THR A 41 36.278 -22.559 -13.667 1.00 0.00 C ATOM 614 C THR A 41 34.785 -22.449 -13.274 1.00 0.00 C ATOM 615 O THR A 41 34.293 -23.193 -12.425 1.00 0.00 O ATOM 616 CB THR A 41 37.109 -21.494 -12.933 1.00 0.00 C ATOM 617 OG1 THR A 41 38.452 -21.538 -13.398 1.00 0.00 O ATOM 618 CG2 THR A 41 37.104 -21.732 -11.421 1.00 0.00 C ATOM 0 H THR A 41 36.625 -21.581 -15.513 1.00 0.00 H new ATOM 0 HA THR A 41 36.640 -23.536 -13.348 1.00 0.00 H new ATOM 0 HB THR A 41 36.665 -20.520 -13.136 1.00 0.00 H new ATOM 0 HG1 THR A 41 38.511 -21.094 -14.269 1.00 0.00 H new ATOM 0 HG21 THR A 41 37.700 -20.963 -10.930 1.00 0.00 H new ATOM 0 HG22 THR A 41 36.080 -21.690 -11.049 1.00 0.00 H new ATOM 0 HG23 THR A 41 37.528 -22.713 -11.206 1.00 0.00 H new ATOM 626 N LYS A 42 34.056 -21.526 -13.910 1.00 0.00 N ATOM 627 CA LYS A 42 32.649 -21.315 -13.519 1.00 0.00 C ATOM 628 C LYS A 42 31.631 -22.154 -14.308 1.00 0.00 C ATOM 629 O LYS A 42 30.702 -22.724 -13.735 1.00 0.00 O ATOM 630 CB LYS A 42 32.248 -19.832 -13.570 1.00 0.00 C ATOM 631 CG LYS A 42 33.109 -18.963 -12.642 1.00 0.00 C ATOM 632 CD LYS A 42 32.684 -17.491 -12.721 1.00 0.00 C ATOM 633 CE LYS A 42 33.313 -16.781 -13.926 1.00 0.00 C ATOM 634 NZ LYS A 42 34.676 -16.325 -13.592 1.00 0.00 N ATOM 0 H LYS A 42 34.394 -20.933 -14.668 1.00 0.00 H new ATOM 0 HA LYS A 42 32.610 -21.666 -12.488 1.00 0.00 H new ATOM 0 HB2 LYS A 42 32.340 -19.468 -14.593 1.00 0.00 H new ATOM 0 HB3 LYS A 42 31.200 -19.732 -13.289 1.00 0.00 H new ATOM 0 HG2 LYS A 42 33.017 -19.318 -11.616 1.00 0.00 H new ATOM 0 HG3 LYS A 42 34.159 -19.058 -12.919 1.00 0.00 H new ATOM 0 HD2 LYS A 42 31.598 -17.429 -12.789 1.00 0.00 H new ATOM 0 HD3 LYS A 42 32.976 -16.979 -11.804 1.00 0.00 H new ATOM 0 HE2 LYS A 42 33.347 -17.458 -14.780 1.00 0.00 H new ATOM 0 HE3 LYS A 42 32.698 -15.930 -14.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 34.996 -15.637 -14.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 34.672 -15.877 -12.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 35.322 -17.140 -13.584 1.00 0.00 H new ATOM 648 N LEU A 43 31.751 -22.177 -15.635 1.00 0.00 N ATOM 649 CA LEU A 43 30.875 -23.022 -16.427 1.00 0.00 C ATOM 650 C LEU A 43 30.830 -24.486 -15.948 1.00 0.00 C ATOM 651 O LEU A 43 29.801 -25.155 -16.019 1.00 0.00 O ATOM 652 CB LEU A 43 31.376 -22.897 -17.875 1.00 0.00 C ATOM 653 CG LEU A 43 30.613 -23.760 -18.855 1.00 0.00 C ATOM 654 CD1 LEU A 43 29.626 -22.917 -19.651 1.00 0.00 C ATOM 655 CD2 LEU A 43 31.593 -24.407 -19.827 1.00 0.00 C ATOM 0 H LEU A 43 32.430 -21.633 -16.168 1.00 0.00 H new ATOM 0 HA LEU A 43 29.841 -22.692 -16.329 1.00 0.00 H new ATOM 0 HB2 LEU A 43 31.303 -21.855 -18.187 1.00 0.00 H new ATOM 0 HB3 LEU A 43 32.431 -23.167 -17.910 1.00 0.00 H new ATOM 0 HG LEU A 43 30.069 -24.522 -18.297 1.00 0.00 H new ATOM 0 HD11 LEU A 43 29.086 -23.554 -20.351 1.00 0.00 H new ATOM 0 HD12 LEU A 43 28.918 -22.445 -18.970 1.00 0.00 H new ATOM 0 HD13 LEU A 43 30.167 -22.148 -20.203 1.00 0.00 H new ATOM 0 HD21 LEU A 43 31.046 -25.030 -20.535 1.00 0.00 H new ATOM 0 HD22 LEU A 43 32.134 -23.631 -20.369 1.00 0.00 H new ATOM 0 HD23 LEU A 43 32.301 -25.023 -19.273 1.00 0.00 H new ATOM 667 N GLY A 44 31.956 -24.979 -15.438 1.00 0.00 N ATOM 668 CA GLY A 44 31.953 -26.341 -14.902 1.00 0.00 C ATOM 669 C GLY A 44 33.199 -26.568 -14.056 1.00 0.00 C ATOM 670 O GLY A 44 33.197 -26.380 -12.840 1.00 0.00 O ATOM 0 H GLY A 44 32.846 -24.484 -15.384 1.00 0.00 H new ATOM 0 HA2 GLY A 44 31.059 -26.502 -14.299 1.00 0.00 H new ATOM 0 HA3 GLY A 44 31.921 -27.062 -15.719 1.00 0.00 H new ATOM 674 N GLN A 45 34.281 -26.963 -14.715 1.00 0.00 N ATOM 675 CA GLN A 45 35.521 -27.233 -13.965 1.00 0.00 C ATOM 676 C GLN A 45 36.668 -27.648 -14.897 1.00 0.00 C ATOM 677 O GLN A 45 37.717 -27.007 -14.950 1.00 0.00 O ATOM 678 CB GLN A 45 35.359 -28.274 -12.832 1.00 0.00 C ATOM 679 CG GLN A 45 35.847 -27.740 -11.476 1.00 0.00 C ATOM 680 CD GLN A 45 37.371 -27.711 -11.397 1.00 0.00 C ATOM 681 OE1 GLN A 45 38.027 -28.734 -11.211 1.00 0.00 O ATOM 682 NE2 GLN A 45 37.954 -26.534 -11.525 1.00 0.00 N ATOM 0 H GLN A 45 34.337 -27.102 -15.724 1.00 0.00 H new ATOM 0 HA GLN A 45 35.769 -26.285 -13.487 1.00 0.00 H new ATOM 0 HB2 GLN A 45 34.310 -28.560 -12.751 1.00 0.00 H new ATOM 0 HB3 GLN A 45 35.916 -29.175 -13.087 1.00 0.00 H new ATOM 0 HG2 GLN A 45 35.455 -26.735 -11.318 1.00 0.00 H new ATOM 0 HG3 GLN A 45 35.453 -28.366 -10.675 1.00 0.00 H new ATOM 0 HE21 GLN A 45 37.389 -25.699 -11.679 1.00 0.00 H new ATOM 0 HE22 GLN A 45 38.970 -26.459 -11.470 1.00 0.00 H new ATOM 691 N THR A 46 36.479 -28.750 -15.619 1.00 0.00 N ATOM 692 CA THR A 46 37.533 -29.229 -16.517 1.00 0.00 C ATOM 693 C THR A 46 36.997 -30.400 -17.397 1.00 0.00 C ATOM 694 O THR A 46 35.868 -30.849 -17.194 1.00 0.00 O ATOM 695 CB THR A 46 38.840 -29.595 -15.766 1.00 0.00 C ATOM 696 OG1 THR A 46 39.637 -30.477 -16.544 1.00 0.00 O ATOM 697 CG2 THR A 46 38.573 -30.249 -14.400 1.00 0.00 C ATOM 0 H THR A 46 35.631 -29.317 -15.604 1.00 0.00 H new ATOM 0 HA THR A 46 37.807 -28.408 -17.180 1.00 0.00 H new ATOM 0 HB THR A 46 39.368 -28.656 -15.600 1.00 0.00 H new ATOM 0 HG1 THR A 46 40.457 -30.695 -16.054 1.00 0.00 H new ATOM 0 HG21 THR A 46 39.522 -30.485 -13.918 1.00 0.00 H new ATOM 0 HG22 THR A 46 38.007 -29.561 -13.772 1.00 0.00 H new ATOM 0 HG23 THR A 46 38.000 -31.166 -14.541 1.00 0.00 H new ATOM 705 N TYR A 47 37.758 -30.909 -18.384 1.00 0.00 N ATOM 706 CA TYR A 47 37.182 -31.977 -19.217 1.00 0.00 C ATOM 707 C TYR A 47 37.857 -33.325 -18.877 1.00 0.00 C ATOM 708 O TYR A 47 37.672 -33.860 -17.782 1.00 0.00 O ATOM 709 CB TYR A 47 37.204 -31.631 -20.719 1.00 0.00 C ATOM 710 CG TYR A 47 35.876 -31.098 -21.255 1.00 0.00 C ATOM 711 CD1 TYR A 47 34.986 -31.940 -21.846 1.00 0.00 C ATOM 712 CD2 TYR A 47 35.679 -29.758 -21.358 1.00 0.00 C ATOM 713 CE1 TYR A 47 33.729 -31.479 -22.117 1.00 0.00 C ATOM 714 CE2 TYR A 47 34.428 -29.289 -21.634 1.00 0.00 C ATOM 715 CZ TYR A 47 33.451 -30.157 -21.990 1.00 0.00 C ATOM 716 OH TYR A 47 32.198 -29.691 -22.287 1.00 0.00 O ATOM 0 H TYR A 47 38.709 -30.622 -18.614 1.00 0.00 H new ATOM 0 HA TYR A 47 36.123 -32.075 -18.980 1.00 0.00 H new ATOM 0 HB2 TYR A 47 37.981 -30.888 -20.898 1.00 0.00 H new ATOM 0 HB3 TYR A 47 37.480 -32.522 -21.282 1.00 0.00 H new ATOM 0 HD1 TYR A 47 35.267 -32.952 -22.096 1.00 0.00 H new ATOM 0 HD2 TYR A 47 36.502 -29.072 -21.223 1.00 0.00 H new ATOM 0 HE1 TYR A 47 32.957 -32.166 -22.432 1.00 0.00 H new ATOM 0 HE2 TYR A 47 34.218 -28.232 -21.569 1.00 0.00 H new ATOM 0 HH TYR A 47 32.166 -28.722 -22.142 1.00 0.00 H new ATOM 726 N THR A 48 38.674 -33.864 -19.784 1.00 0.00 N ATOM 727 CA THR A 48 39.427 -35.081 -19.441 1.00 0.00 C ATOM 728 C THR A 48 40.724 -35.154 -20.255 1.00 0.00 C ATOM 729 O THR A 48 40.763 -34.789 -21.431 1.00 0.00 O ATOM 730 CB THR A 48 38.650 -36.403 -19.623 1.00 0.00 C ATOM 731 OG1 THR A 48 37.260 -36.197 -19.412 1.00 0.00 O ATOM 732 CG2 THR A 48 39.142 -37.463 -18.633 1.00 0.00 C ATOM 0 H THR A 48 38.831 -33.500 -20.724 1.00 0.00 H new ATOM 0 HA THR A 48 39.631 -34.988 -18.374 1.00 0.00 H new ATOM 0 HB THR A 48 38.822 -36.748 -20.643 1.00 0.00 H new ATOM 0 HG1 THR A 48 36.748 -36.767 -20.023 1.00 0.00 H new ATOM 0 HG21 THR A 48 38.581 -38.386 -18.779 1.00 0.00 H new ATOM 0 HG22 THR A 48 40.202 -37.653 -18.800 1.00 0.00 H new ATOM 0 HG23 THR A 48 38.994 -37.106 -17.614 1.00 0.00 H new ATOM 740 N LYS A 49 41.792 -35.652 -19.633 1.00 0.00 N ATOM 741 CA LYS A 49 43.072 -35.779 -20.358 1.00 0.00 C ATOM 742 C LYS A 49 43.739 -34.420 -20.627 1.00 0.00 C ATOM 743 O LYS A 49 43.188 -33.357 -20.335 1.00 0.00 O ATOM 744 CB LYS A 49 42.979 -36.596 -21.664 1.00 0.00 C ATOM 745 CG LYS A 49 42.251 -37.933 -21.472 1.00 0.00 C ATOM 746 CD LYS A 49 42.061 -38.639 -22.818 1.00 0.00 C ATOM 747 CE LYS A 49 40.908 -38.018 -23.614 1.00 0.00 C ATOM 748 NZ LYS A 49 41.092 -38.279 -25.054 1.00 0.00 N ATOM 0 H LYS A 49 41.808 -35.966 -18.663 1.00 0.00 H new ATOM 0 HA LYS A 49 43.706 -36.345 -19.676 1.00 0.00 H new ATOM 0 HB2 LYS A 49 42.458 -36.008 -22.420 1.00 0.00 H new ATOM 0 HB3 LYS A 49 43.984 -36.784 -22.043 1.00 0.00 H new ATOM 0 HG2 LYS A 49 42.822 -38.571 -20.798 1.00 0.00 H new ATOM 0 HG3 LYS A 49 41.281 -37.762 -21.004 1.00 0.00 H new ATOM 0 HD2 LYS A 49 42.982 -38.575 -23.398 1.00 0.00 H new ATOM 0 HD3 LYS A 49 41.862 -39.698 -22.651 1.00 0.00 H new ATOM 0 HE2 LYS A 49 39.958 -38.434 -23.279 1.00 0.00 H new ATOM 0 HE3 LYS A 49 40.867 -36.944 -23.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 40.169 -38.253 -25.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 41.714 -37.552 -25.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 41.523 -39.217 -25.185 1.00 0.00 H new ATOM 762 N ARG A 50 44.940 -34.450 -21.198 1.00 0.00 N ATOM 763 CA ARG A 50 45.610 -33.180 -21.518 1.00 0.00 C ATOM 764 C ARG A 50 45.165 -32.552 -22.857 1.00 0.00 C ATOM 765 O ARG A 50 45.602 -31.463 -23.232 1.00 0.00 O ATOM 766 CB ARG A 50 47.140 -33.303 -21.437 1.00 0.00 C ATOM 767 CG ARG A 50 47.777 -31.978 -21.006 1.00 0.00 C ATOM 768 CD ARG A 50 49.234 -32.169 -20.584 1.00 0.00 C ATOM 769 NE ARG A 50 49.660 -30.999 -19.800 1.00 0.00 N ATOM 770 CZ ARG A 50 50.574 -30.179 -20.300 1.00 0.00 C ATOM 771 NH1 ARG A 50 51.616 -30.651 -20.958 1.00 0.00 N ATOM 772 NH2 ARG A 50 50.454 -28.883 -20.110 1.00 0.00 N ATOM 0 H ARG A 50 45.456 -35.295 -21.442 1.00 0.00 H new ATOM 0 HA ARG A 50 45.284 -32.485 -20.745 1.00 0.00 H new ATOM 0 HB2 ARG A 50 47.408 -34.087 -20.728 1.00 0.00 H new ATOM 0 HB3 ARG A 50 47.536 -33.602 -22.408 1.00 0.00 H new ATOM 0 HG2 ARG A 50 47.726 -31.264 -21.828 1.00 0.00 H new ATOM 0 HG3 ARG A 50 47.210 -31.553 -20.178 1.00 0.00 H new ATOM 0 HD2 ARG A 50 49.339 -33.078 -19.992 1.00 0.00 H new ATOM 0 HD3 ARG A 50 49.869 -32.286 -21.462 1.00 0.00 H new ATOM 0 HE ARG A 50 49.256 -30.820 -18.881 1.00 0.00 H new ATOM 0 HH11 ARG A 50 51.725 -31.657 -21.087 1.00 0.00 H new ATOM 0 HH12 ARG A 50 52.312 -30.010 -21.338 1.00 0.00 H new ATOM 0 HH21 ARG A 50 49.662 -28.516 -19.582 1.00 0.00 H new ATOM 0 HH22 ARG A 50 51.153 -28.245 -20.491 1.00 0.00 H new ATOM 786 N GLU A 51 44.301 -33.241 -23.594 1.00 0.00 N ATOM 787 CA GLU A 51 43.797 -32.665 -24.851 1.00 0.00 C ATOM 788 C GLU A 51 42.816 -31.492 -24.627 1.00 0.00 C ATOM 789 O GLU A 51 42.785 -30.513 -25.376 1.00 0.00 O ATOM 790 CB GLU A 51 43.191 -33.733 -25.763 1.00 0.00 C ATOM 791 CG GLU A 51 44.201 -34.826 -26.133 1.00 0.00 C ATOM 792 CD GLU A 51 43.497 -36.006 -26.785 1.00 0.00 C ATOM 793 OE1 GLU A 51 43.284 -35.976 -28.015 1.00 0.00 O ATOM 794 OE2 GLU A 51 43.151 -36.969 -26.067 1.00 0.00 O ATOM 0 H GLU A 51 43.941 -34.167 -23.361 1.00 0.00 H new ATOM 0 HA GLU A 51 44.666 -32.248 -25.359 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.334 -34.187 -25.266 1.00 0.00 H new ATOM 0 HB3 GLU A 51 42.820 -33.262 -26.673 1.00 0.00 H new ATOM 0 HG2 GLU A 51 44.950 -34.421 -26.813 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.729 -35.159 -25.239 1.00 0.00 H new ATOM 801 N THR A 52 41.985 -31.571 -23.597 1.00 0.00 N ATOM 802 CA THR A 52 41.217 -30.377 -23.234 1.00 0.00 C ATOM 803 C THR A 52 42.137 -29.248 -22.712 1.00 0.00 C ATOM 804 O THR A 52 41.862 -28.060 -22.876 1.00 0.00 O ATOM 805 CB THR A 52 40.027 -30.644 -22.307 1.00 0.00 C ATOM 806 OG1 THR A 52 40.115 -31.955 -21.772 1.00 0.00 O ATOM 807 CG2 THR A 52 38.690 -30.532 -23.064 1.00 0.00 C ATOM 0 H THR A 52 41.826 -32.398 -23.022 1.00 0.00 H new ATOM 0 HA THR A 52 40.761 -30.031 -24.161 1.00 0.00 H new ATOM 0 HB THR A 52 40.059 -29.897 -21.514 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.165 -31.907 -20.794 1.00 0.00 H new ATOM 0 HG21 THR A 52 37.866 -30.727 -22.378 1.00 0.00 H new ATOM 0 HG22 THR A 52 38.589 -29.528 -23.477 1.00 0.00 H new ATOM 0 HG23 THR A 52 38.668 -31.261 -23.874 1.00 0.00 H new ATOM 815 N GLU A 53 43.250 -29.618 -22.082 1.00 0.00 N ATOM 816 CA GLU A 53 44.326 -28.624 -21.880 1.00 0.00 C ATOM 817 C GLU A 53 44.728 -27.970 -23.218 1.00 0.00 C ATOM 818 O GLU A 53 45.070 -26.791 -23.284 1.00 0.00 O ATOM 819 CB GLU A 53 45.580 -29.197 -21.197 1.00 0.00 C ATOM 820 CG GLU A 53 45.714 -28.730 -19.739 1.00 0.00 C ATOM 821 CD GLU A 53 47.153 -28.832 -19.257 1.00 0.00 C ATOM 822 OE1 GLU A 53 47.963 -27.937 -19.586 1.00 0.00 O ATOM 823 OE2 GLU A 53 47.486 -29.806 -18.549 1.00 0.00 O ATOM 0 H GLU A 53 43.436 -30.551 -21.714 1.00 0.00 H new ATOM 0 HA GLU A 53 43.907 -27.877 -21.206 1.00 0.00 H new ATOM 0 HB2 GLU A 53 45.541 -30.286 -21.225 1.00 0.00 H new ATOM 0 HB3 GLU A 53 46.466 -28.895 -21.756 1.00 0.00 H new ATOM 0 HG2 GLU A 53 45.371 -27.699 -19.652 1.00 0.00 H new ATOM 0 HG3 GLU A 53 45.070 -29.335 -19.100 1.00 0.00 H new ATOM 830 N ALA A 54 44.717 -28.774 -24.285 1.00 0.00 N ATOM 831 CA ALA A 54 44.832 -28.205 -25.642 1.00 0.00 C ATOM 832 C ALA A 54 43.804 -27.110 -25.898 1.00 0.00 C ATOM 833 O ALA A 54 44.136 -26.053 -26.429 1.00 0.00 O ATOM 834 CB ALA A 54 44.675 -29.231 -26.768 1.00 0.00 C ATOM 0 H ALA A 54 44.633 -29.790 -24.247 1.00 0.00 H new ATOM 0 HA ALA A 54 45.846 -27.806 -25.661 1.00 0.00 H new ATOM 0 HB1 ALA A 54 44.773 -28.731 -27.732 1.00 0.00 H new ATOM 0 HB2 ALA A 54 45.448 -29.994 -26.675 1.00 0.00 H new ATOM 0 HB3 ALA A 54 43.693 -29.699 -26.700 1.00 0.00 H new ATOM 840 N ILE A 55 42.534 -27.373 -25.562 1.00 0.00 N ATOM 841 CA ILE A 55 41.545 -26.261 -25.576 1.00 0.00 C ATOM 842 C ILE A 55 42.163 -24.993 -24.954 1.00 0.00 C ATOM 843 O ILE A 55 42.300 -23.938 -25.582 1.00 0.00 O ATOM 844 CB ILE A 55 40.254 -26.457 -24.729 1.00 0.00 C ATOM 845 CG1 ILE A 55 39.376 -27.639 -25.057 1.00 0.00 C ATOM 846 CG2 ILE A 55 39.397 -25.193 -24.786 1.00 0.00 C ATOM 847 CD1 ILE A 55 38.287 -27.822 -24.007 1.00 0.00 C ATOM 0 H ILE A 55 42.171 -28.287 -25.290 1.00 0.00 H new ATOM 0 HA ILE A 55 41.284 -26.205 -26.633 1.00 0.00 H new ATOM 0 HB ILE A 55 40.644 -26.668 -23.733 1.00 0.00 H new ATOM 0 HG12 ILE A 55 38.920 -27.497 -26.037 1.00 0.00 H new ATOM 0 HG13 ILE A 55 39.984 -28.542 -25.116 1.00 0.00 H new ATOM 0 HG21 ILE A 55 38.495 -25.338 -24.191 1.00 0.00 H new ATOM 0 HG22 ILE A 55 39.963 -24.351 -24.388 1.00 0.00 H new ATOM 0 HG23 ILE A 55 39.120 -24.987 -25.820 1.00 0.00 H new ATOM 0 HD11 ILE A 55 37.669 -28.681 -24.269 1.00 0.00 H new ATOM 0 HD12 ILE A 55 38.746 -27.989 -23.032 1.00 0.00 H new ATOM 0 HD13 ILE A 55 37.666 -26.927 -23.967 1.00 0.00 H new ATOM 859 N MET A 56 42.548 -25.146 -23.691 1.00 0.00 N ATOM 860 CA MET A 56 43.002 -23.995 -22.908 1.00 0.00 C ATOM 861 C MET A 56 44.264 -23.314 -23.453 1.00 0.00 C ATOM 862 O MET A 56 44.424 -22.096 -23.374 1.00 0.00 O ATOM 863 CB MET A 56 43.156 -24.406 -21.437 1.00 0.00 C ATOM 864 CG MET A 56 41.841 -24.977 -20.876 1.00 0.00 C ATOM 865 SD MET A 56 42.062 -26.697 -20.353 1.00 0.00 S ATOM 866 CE MET A 56 40.337 -27.264 -20.269 1.00 0.00 C ATOM 0 H MET A 56 42.557 -26.036 -23.193 1.00 0.00 H new ATOM 0 HA MET A 56 42.232 -23.229 -22.994 1.00 0.00 H new ATOM 0 HB2 MET A 56 43.947 -25.151 -21.346 1.00 0.00 H new ATOM 0 HB3 MET A 56 43.462 -23.543 -20.846 1.00 0.00 H new ATOM 0 HG2 MET A 56 41.508 -24.374 -20.031 1.00 0.00 H new ATOM 0 HG3 MET A 56 41.061 -24.920 -21.635 1.00 0.00 H new ATOM 0 HE1 MET A 56 40.307 -28.280 -19.874 1.00 0.00 H new ATOM 0 HE2 MET A 56 39.768 -26.603 -19.615 1.00 0.00 H new ATOM 0 HE3 MET A 56 39.900 -27.250 -21.268 1.00 0.00 H new ATOM 876 N LYS A 57 45.159 -24.107 -24.020 1.00 0.00 N ATOM 877 CA LYS A 57 46.377 -23.524 -24.602 1.00 0.00 C ATOM 878 C LYS A 57 46.166 -22.953 -26.018 1.00 0.00 C ATOM 879 O LYS A 57 46.692 -21.894 -26.362 1.00 0.00 O ATOM 880 CB LYS A 57 47.557 -24.512 -24.591 1.00 0.00 C ATOM 881 CG LYS A 57 48.415 -24.375 -23.325 1.00 0.00 C ATOM 882 CD LYS A 57 47.700 -24.945 -22.096 1.00 0.00 C ATOM 883 CE LYS A 57 48.551 -24.756 -20.839 1.00 0.00 C ATOM 884 NZ LYS A 57 47.849 -25.320 -19.673 1.00 0.00 N ATOM 0 H LYS A 57 45.080 -25.121 -24.094 1.00 0.00 H new ATOM 0 HA LYS A 57 46.627 -22.684 -23.954 1.00 0.00 H new ATOM 0 HB2 LYS A 57 47.176 -25.531 -24.662 1.00 0.00 H new ATOM 0 HB3 LYS A 57 48.179 -24.342 -25.470 1.00 0.00 H new ATOM 0 HG2 LYS A 57 49.363 -24.894 -23.469 1.00 0.00 H new ATOM 0 HG3 LYS A 57 48.650 -23.324 -23.156 1.00 0.00 H new ATOM 0 HD2 LYS A 57 46.737 -24.450 -21.967 1.00 0.00 H new ATOM 0 HD3 LYS A 57 47.496 -26.005 -22.247 1.00 0.00 H new ATOM 0 HE2 LYS A 57 49.517 -25.245 -20.965 1.00 0.00 H new ATOM 0 HE3 LYS A 57 48.749 -23.696 -20.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 48.250 -24.922 -18.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 46.838 -25.083 -19.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 47.963 -26.354 -19.666 1.00 0.00 H new ATOM 898 N GLU A 58 45.401 -23.658 -26.848 1.00 0.00 N ATOM 899 CA GLU A 58 45.173 -23.172 -28.222 1.00 0.00 C ATOM 900 C GLU A 58 44.309 -21.900 -28.319 1.00 0.00 C ATOM 901 O GLU A 58 44.413 -21.142 -29.282 1.00 0.00 O ATOM 902 CB GLU A 58 44.644 -24.279 -29.152 1.00 0.00 C ATOM 903 CG GLU A 58 43.141 -24.544 -28.964 1.00 0.00 C ATOM 904 CD GLU A 58 42.701 -25.793 -29.714 1.00 0.00 C ATOM 905 OE1 GLU A 58 43.034 -25.928 -30.911 1.00 0.00 O ATOM 906 OE2 GLU A 58 42.009 -26.642 -29.111 1.00 0.00 O ATOM 0 H GLU A 58 44.940 -24.537 -26.614 1.00 0.00 H new ATOM 0 HA GLU A 58 46.163 -22.878 -28.571 1.00 0.00 H new ATOM 0 HB2 GLU A 58 44.832 -23.998 -30.188 1.00 0.00 H new ATOM 0 HB3 GLU A 58 45.197 -25.200 -28.966 1.00 0.00 H new ATOM 0 HG2 GLU A 58 42.920 -24.658 -27.903 1.00 0.00 H new ATOM 0 HG3 GLU A 58 42.571 -23.685 -29.318 1.00 0.00 H new ATOM 913 N ALA A 59 43.458 -21.663 -27.318 1.00 0.00 N ATOM 914 CA ALA A 59 42.595 -20.472 -27.360 1.00 0.00 C ATOM 915 C ALA A 59 43.333 -19.173 -27.708 1.00 0.00 C ATOM 916 O ALA A 59 43.018 -18.507 -28.693 1.00 0.00 O ATOM 917 CB ALA A 59 41.790 -20.327 -26.068 1.00 0.00 C ATOM 0 H ALA A 59 43.346 -22.254 -26.494 1.00 0.00 H new ATOM 0 HA ALA A 59 41.904 -20.641 -28.186 1.00 0.00 H new ATOM 0 HB1 ALA A 59 41.162 -19.438 -26.129 1.00 0.00 H new ATOM 0 HB2 ALA A 59 41.162 -21.207 -25.930 1.00 0.00 H new ATOM 0 HB3 ALA A 59 42.472 -20.232 -25.223 1.00 0.00 H new ATOM 923 N ARG A 60 44.303 -18.791 -26.884 1.00 0.00 N ATOM 924 CA ARG A 60 45.183 -17.659 -27.297 1.00 0.00 C ATOM 925 C ARG A 60 45.782 -17.894 -28.693 1.00 0.00 C ATOM 926 O ARG A 60 45.197 -17.495 -29.699 1.00 0.00 O ATOM 927 CB ARG A 60 46.241 -17.298 -26.240 1.00 0.00 C ATOM 928 CG ARG A 60 47.113 -16.107 -26.685 1.00 0.00 C ATOM 929 CD ARG A 60 46.987 -14.916 -25.730 1.00 0.00 C ATOM 930 NE ARG A 60 45.702 -14.230 -25.940 1.00 0.00 N ATOM 931 CZ ARG A 60 45.494 -13.041 -25.383 1.00 0.00 C ATOM 932 NH1 ARG A 60 46.228 -12.632 -24.365 1.00 0.00 N ATOM 933 NH2 ARG A 60 44.533 -12.268 -25.842 1.00 0.00 N ATOM 0 H ARG A 60 44.508 -19.207 -25.976 1.00 0.00 H new ATOM 0 HA ARG A 60 44.547 -16.777 -27.370 1.00 0.00 H new ATOM 0 HB2 ARG A 60 45.747 -17.055 -25.299 1.00 0.00 H new ATOM 0 HB3 ARG A 60 46.877 -18.163 -26.052 1.00 0.00 H new ATOM 0 HG2 ARG A 60 48.156 -16.421 -26.738 1.00 0.00 H new ATOM 0 HG3 ARG A 60 46.821 -15.799 -27.689 1.00 0.00 H new ATOM 0 HD2 ARG A 60 47.060 -15.259 -24.698 1.00 0.00 H new ATOM 0 HD3 ARG A 60 47.810 -14.220 -25.894 1.00 0.00 H new ATOM 0 HE ARG A 60 44.976 -14.664 -26.509 1.00 0.00 H new ATOM 0 HH11 ARG A 60 46.966 -13.231 -23.996 1.00 0.00 H new ATOM 0 HH12 ARG A 60 46.057 -11.717 -23.948 1.00 0.00 H new ATOM 0 HH21 ARG A 60 43.953 -12.582 -26.620 1.00 0.00 H new ATOM 0 HH22 ARG A 60 44.368 -11.354 -25.419 1.00 0.00 H new ATOM 947 N GLY A 61 46.949 -18.521 -28.778 1.00 0.00 N ATOM 948 CA GLY A 61 47.506 -18.754 -30.099 1.00 0.00 C ATOM 949 C GLY A 61 49.035 -18.621 -30.050 1.00 0.00 C ATOM 950 O GLY A 61 49.550 -17.520 -29.851 1.00 0.00 O ATOM 0 H GLY A 61 47.502 -18.861 -27.991 1.00 0.00 H new ATOM 0 HA2 GLY A 61 47.229 -19.748 -30.450 1.00 0.00 H new ATOM 0 HA3 GLY A 61 47.092 -18.038 -30.810 1.00 0.00 H new ATOM 954 N PRO A 62 49.787 -19.726 -30.164 1.00 0.00 N ATOM 955 CA PRO A 62 51.252 -19.641 -30.146 1.00 0.00 C ATOM 956 C PRO A 62 51.775 -18.645 -31.195 1.00 0.00 C ATOM 957 O PRO A 62 51.597 -18.843 -32.397 1.00 0.00 O ATOM 958 CB PRO A 62 51.702 -21.070 -30.481 1.00 0.00 C ATOM 959 CG PRO A 62 50.464 -21.853 -30.947 1.00 0.00 C ATOM 960 CD PRO A 62 49.247 -20.948 -30.753 1.00 0.00 C ATOM 0 HA PRO A 62 51.635 -19.283 -29.190 1.00 0.00 H new ATOM 0 HB2 PRO A 62 52.463 -21.058 -31.261 1.00 0.00 H new ATOM 0 HB3 PRO A 62 52.148 -21.545 -29.607 1.00 0.00 H new ATOM 0 HG2 PRO A 62 50.564 -22.141 -31.993 1.00 0.00 H new ATOM 0 HG3 PRO A 62 50.353 -22.773 -30.372 1.00 0.00 H new ATOM 0 HD2 PRO A 62 48.749 -20.745 -31.701 1.00 0.00 H new ATOM 0 HD3 PRO A 62 48.509 -21.411 -30.098 1.00 0.00 H new ATOM 968 N LYS A 63 52.333 -17.525 -30.714 1.00 0.00 N ATOM 969 CA LYS A 63 52.886 -16.485 -31.682 1.00 0.00 C ATOM 970 C LYS A 63 51.841 -15.415 -32.049 1.00 0.00 C ATOM 971 O LYS A 63 52.150 -14.393 -32.663 1.00 0.00 O ATOM 972 CB LYS A 63 53.398 -17.108 -32.982 1.00 0.00 C ATOM 973 CG LYS A 63 54.511 -16.274 -33.630 1.00 0.00 C ATOM 974 CD LYS A 63 54.797 -16.757 -35.052 1.00 0.00 C ATOM 975 CE LYS A 63 55.769 -15.808 -35.755 1.00 0.00 C ATOM 976 NZ LYS A 63 56.015 -16.272 -37.132 1.00 0.00 N ATOM 0 H LYS A 63 52.426 -17.295 -29.725 1.00 0.00 H new ATOM 0 HA LYS A 63 53.716 -16.021 -31.149 1.00 0.00 H new ATOM 0 HB2 LYS A 63 53.771 -18.112 -32.779 1.00 0.00 H new ATOM 0 HB3 LYS A 63 52.570 -17.212 -33.683 1.00 0.00 H new ATOM 0 HG2 LYS A 63 54.219 -15.224 -33.650 1.00 0.00 H new ATOM 0 HG3 LYS A 63 55.418 -16.341 -33.029 1.00 0.00 H new ATOM 0 HD2 LYS A 63 55.218 -17.762 -35.023 1.00 0.00 H new ATOM 0 HD3 LYS A 63 53.866 -16.817 -35.616 1.00 0.00 H new ATOM 0 HE2 LYS A 63 55.358 -14.798 -35.770 1.00 0.00 H new ATOM 0 HE3 LYS A 63 56.708 -15.762 -35.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 56.676 -15.623 -37.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 56.425 -17.227 -37.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 55.117 -16.294 -37.657 1.00 0.00 H new ATOM 990 N GLY A 64 50.597 -15.662 -31.668 1.00 0.00 N ATOM 991 CA GLY A 64 49.501 -14.790 -32.100 1.00 0.00 C ATOM 992 C GLY A 64 49.561 -13.372 -31.493 1.00 0.00 C ATOM 993 O GLY A 64 48.887 -12.474 -31.991 1.00 0.00 O ATOM 0 H GLY A 64 50.318 -16.442 -31.072 1.00 0.00 H new ATOM 0 HA2 GLY A 64 49.518 -14.711 -33.187 1.00 0.00 H new ATOM 0 HA3 GLY A 64 48.552 -15.252 -31.828 1.00 0.00 H new ATOM 997 N ASP A 65 50.256 -13.202 -30.353 1.00 0.00 N ATOM 998 CA ASP A 65 50.452 -11.794 -29.804 1.00 0.00 C ATOM 999 C ASP A 65 49.325 -11.462 -28.822 1.00 0.00 C ATOM 1000 O ASP A 65 49.540 -11.220 -27.634 1.00 0.00 O ATOM 1001 CB ASP A 65 50.577 -10.717 -30.896 1.00 0.00 C ATOM 1002 CG ASP A 65 51.000 -9.368 -30.327 1.00 0.00 C ATOM 1003 OD1 ASP A 65 52.195 -9.195 -30.007 1.00 0.00 O ATOM 1004 OD2 ASP A 65 50.136 -8.472 -30.203 1.00 0.00 O ATOM 0 H ASP A 65 50.678 -13.951 -29.804 1.00 0.00 H new ATOM 0 HA ASP A 65 51.408 -11.785 -29.281 1.00 0.00 H new ATOM 0 HB2 ASP A 65 51.304 -11.040 -31.641 1.00 0.00 H new ATOM 0 HB3 ASP A 65 49.621 -10.610 -31.409 1.00 0.00 H new ATOM 1009 N LYS A 66 48.107 -11.466 -29.340 1.00 0.00 N ATOM 1010 CA LYS A 66 46.952 -11.173 -28.484 1.00 0.00 C ATOM 1011 C LYS A 66 45.679 -11.794 -29.071 1.00 0.00 C ATOM 1012 O LYS A 66 44.616 -11.174 -29.122 1.00 0.00 O ATOM 1013 CB LYS A 66 46.780 -9.670 -28.193 1.00 0.00 C ATOM 1014 CG LYS A 66 46.745 -8.834 -29.480 1.00 0.00 C ATOM 1015 CD LYS A 66 46.745 -7.336 -29.164 1.00 0.00 C ATOM 1016 CE LYS A 66 47.079 -6.511 -30.411 1.00 0.00 C ATOM 1017 NZ LYS A 66 48.542 -6.424 -30.586 1.00 0.00 N ATOM 0 H LYS A 66 47.888 -11.661 -30.317 1.00 0.00 H new ATOM 0 HA LYS A 66 47.145 -11.635 -27.516 1.00 0.00 H new ATOM 0 HB2 LYS A 66 45.858 -9.513 -27.634 1.00 0.00 H new ATOM 0 HB3 LYS A 66 47.599 -9.327 -27.561 1.00 0.00 H new ATOM 0 HG2 LYS A 66 47.608 -9.078 -30.100 1.00 0.00 H new ATOM 0 HG3 LYS A 66 45.856 -9.087 -30.058 1.00 0.00 H new ATOM 0 HD2 LYS A 66 45.768 -7.042 -28.780 1.00 0.00 H new ATOM 0 HD3 LYS A 66 47.472 -7.126 -28.380 1.00 0.00 H new ATOM 0 HE2 LYS A 66 46.626 -6.968 -31.291 1.00 0.00 H new ATOM 0 HE3 LYS A 66 46.656 -5.511 -30.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 48.771 -6.428 -31.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 48.891 -5.544 -30.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 48.996 -7.239 -30.125 1.00 0.00 H new ATOM 1031 N LYS A 67 45.781 -13.052 -29.489 1.00 0.00 N ATOM 1032 CA LYS A 67 44.637 -13.676 -30.155 1.00 0.00 C ATOM 1033 C LYS A 67 43.550 -14.111 -29.174 1.00 0.00 C ATOM 1034 O LYS A 67 43.813 -14.594 -28.072 1.00 0.00 O ATOM 1035 CB LYS A 67 45.063 -14.810 -31.107 1.00 0.00 C ATOM 1036 CG LYS A 67 43.857 -15.588 -31.658 1.00 0.00 C ATOM 1037 CD LYS A 67 44.285 -16.680 -32.645 1.00 0.00 C ATOM 1038 CE LYS A 67 43.393 -17.922 -32.518 1.00 0.00 C ATOM 1039 NZ LYS A 67 41.993 -17.597 -32.850 1.00 0.00 N ATOM 0 H LYS A 67 46.607 -13.642 -29.386 1.00 0.00 H new ATOM 0 HA LYS A 67 44.187 -12.903 -30.778 1.00 0.00 H new ATOM 0 HB2 LYS A 67 45.633 -14.391 -31.936 1.00 0.00 H new ATOM 0 HB3 LYS A 67 45.726 -15.496 -30.579 1.00 0.00 H new ATOM 0 HG2 LYS A 67 43.308 -16.040 -30.832 1.00 0.00 H new ATOM 0 HG3 LYS A 67 43.175 -14.897 -32.154 1.00 0.00 H new ATOM 0 HD2 LYS A 67 44.233 -16.294 -33.663 1.00 0.00 H new ATOM 0 HD3 LYS A 67 45.324 -16.954 -32.460 1.00 0.00 H new ATOM 0 HE2 LYS A 67 43.757 -18.706 -33.182 1.00 0.00 H new ATOM 0 HE3 LYS A 67 43.449 -18.313 -31.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 41.490 -18.466 -33.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 41.529 -17.173 -32.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 41.971 -16.922 -33.641 1.00 0.00 H new ATOM 1053 N ASN A 68 42.310 -13.892 -29.582 1.00 0.00 N ATOM 1054 CA ASN A 68 41.190 -14.359 -28.766 1.00 0.00 C ATOM 1055 C ASN A 68 40.362 -15.340 -29.588 1.00 0.00 C ATOM 1056 O ASN A 68 40.482 -15.406 -30.814 1.00 0.00 O ATOM 1057 CB ASN A 68 40.285 -13.242 -28.232 1.00 0.00 C ATOM 1058 CG ASN A 68 41.018 -11.910 -28.025 1.00 0.00 C ATOM 1059 OD1 ASN A 68 42.049 -11.836 -27.360 1.00 0.00 O ATOM 1060 ND2 ASN A 68 40.503 -10.842 -28.606 1.00 0.00 N ATOM 0 H ASN A 68 42.053 -13.410 -30.444 1.00 0.00 H new ATOM 0 HA ASN A 68 41.622 -14.834 -27.885 1.00 0.00 H new ATOM 0 HB2 ASN A 68 39.460 -13.090 -28.927 1.00 0.00 H new ATOM 0 HB3 ASN A 68 39.849 -13.559 -27.285 1.00 0.00 H new ATOM 0 HD21 ASN A 68 40.962 -9.936 -28.507 1.00 0.00 H new ATOM 0 HD22 ASN A 68 39.647 -10.923 -29.154 1.00 0.00 H new ATOM 1067 N ILE A 69 39.514 -16.118 -28.935 1.00 0.00 N ATOM 1068 CA ILE A 69 38.672 -17.024 -29.718 1.00 0.00 C ATOM 1069 C ILE A 69 37.258 -16.494 -29.908 1.00 0.00 C ATOM 1070 O ILE A 69 36.467 -16.340 -28.976 1.00 0.00 O ATOM 1071 CB ILE A 69 38.704 -18.488 -29.302 1.00 0.00 C ATOM 1072 CG1 ILE A 69 38.141 -18.720 -27.889 1.00 0.00 C ATOM 1073 CG2 ILE A 69 40.146 -18.991 -29.389 1.00 0.00 C ATOM 1074 CD1 ILE A 69 38.483 -20.114 -27.361 1.00 0.00 C ATOM 0 H ILE A 69 39.388 -16.148 -27.923 1.00 0.00 H new ATOM 0 HA ILE A 69 39.149 -17.032 -30.698 1.00 0.00 H new ATOM 0 HB ILE A 69 38.061 -19.046 -29.983 1.00 0.00 H new ATOM 0 HG12 ILE A 69 38.541 -17.967 -27.211 1.00 0.00 H new ATOM 0 HG13 ILE A 69 37.059 -18.593 -27.904 1.00 0.00 H new ATOM 0 HG21 ILE A 69 40.184 -20.039 -29.093 1.00 0.00 H new ATOM 0 HG22 ILE A 69 40.506 -18.889 -30.413 1.00 0.00 H new ATOM 0 HG23 ILE A 69 40.777 -18.403 -28.723 1.00 0.00 H new ATOM 0 HD11 ILE A 69 38.067 -20.236 -26.361 1.00 0.00 H new ATOM 0 HD12 ILE A 69 38.060 -20.868 -28.025 1.00 0.00 H new ATOM 0 HD13 ILE A 69 39.566 -20.232 -27.320 1.00 0.00 H new ATOM 1086 N GLY A 70 36.963 -16.231 -31.164 1.00 0.00 N ATOM 1087 CA GLY A 70 35.680 -15.607 -31.500 1.00 0.00 C ATOM 1088 C GLY A 70 34.578 -16.633 -31.794 1.00 0.00 C ATOM 1089 O GLY A 70 34.708 -17.817 -31.482 1.00 0.00 O ATOM 0 H GLY A 70 37.571 -16.430 -31.959 1.00 0.00 H new ATOM 0 HA2 GLY A 70 35.365 -14.969 -30.675 1.00 0.00 H new ATOM 0 HA3 GLY A 70 35.811 -14.963 -32.369 1.00 0.00 H new ATOM 1093 N PRO A 71 33.468 -16.150 -32.374 1.00 0.00 N ATOM 1094 CA PRO A 71 32.234 -16.954 -32.484 1.00 0.00 C ATOM 1095 C PRO A 71 32.411 -18.457 -32.745 1.00 0.00 C ATOM 1096 O PRO A 71 31.755 -19.290 -32.117 1.00 0.00 O ATOM 1097 CB PRO A 71 31.454 -16.299 -33.634 1.00 0.00 C ATOM 1098 CG PRO A 71 32.264 -15.099 -34.135 1.00 0.00 C ATOM 1099 CD PRO A 71 33.575 -15.072 -33.354 1.00 0.00 C ATOM 0 HA PRO A 71 31.727 -16.945 -31.519 1.00 0.00 H new ATOM 0 HB2 PRO A 71 31.294 -17.014 -34.441 1.00 0.00 H new ATOM 0 HB3 PRO A 71 30.470 -15.978 -33.292 1.00 0.00 H new ATOM 0 HG2 PRO A 71 32.457 -15.186 -35.204 1.00 0.00 H new ATOM 0 HG3 PRO A 71 31.709 -14.173 -33.985 1.00 0.00 H new ATOM 0 HD2 PRO A 71 34.428 -15.225 -34.014 1.00 0.00 H new ATOM 0 HD3 PRO A 71 33.720 -14.109 -32.864 1.00 0.00 H new ATOM 1107 N GLU A 72 33.268 -18.816 -33.685 1.00 0.00 N ATOM 1108 CA GLU A 72 33.316 -20.218 -34.113 1.00 0.00 C ATOM 1109 C GLU A 72 34.398 -21.102 -33.467 1.00 0.00 C ATOM 1110 O GLU A 72 34.247 -22.323 -33.415 1.00 0.00 O ATOM 1111 CB GLU A 72 33.302 -20.338 -35.641 1.00 0.00 C ATOM 1112 CG GLU A 72 34.685 -20.114 -36.281 1.00 0.00 C ATOM 1113 CD GLU A 72 35.166 -18.677 -36.120 1.00 0.00 C ATOM 1114 OE1 GLU A 72 34.722 -17.803 -36.896 1.00 0.00 O ATOM 1115 OE2 GLU A 72 35.989 -18.415 -35.217 1.00 0.00 O ATOM 0 H GLU A 72 33.920 -18.189 -34.156 1.00 0.00 H new ATOM 0 HA GLU A 72 32.394 -20.641 -33.715 1.00 0.00 H new ATOM 0 HB2 GLU A 72 32.937 -21.327 -35.918 1.00 0.00 H new ATOM 0 HB3 GLU A 72 32.598 -19.613 -36.049 1.00 0.00 H new ATOM 0 HG2 GLU A 72 35.408 -20.791 -35.826 1.00 0.00 H new ATOM 0 HG3 GLU A 72 34.638 -20.363 -37.341 1.00 0.00 H new ATOM 1122 N GLU A 73 35.484 -20.522 -32.963 1.00 0.00 N ATOM 1123 CA GLU A 73 36.577 -21.361 -32.461 1.00 0.00 C ATOM 1124 C GLU A 73 36.245 -22.099 -31.160 1.00 0.00 C ATOM 1125 O GLU A 73 36.549 -23.283 -31.011 1.00 0.00 O ATOM 1126 CB GLU A 73 37.892 -20.568 -32.385 1.00 0.00 C ATOM 1127 CG GLU A 73 39.009 -21.297 -31.611 1.00 0.00 C ATOM 1128 CD GLU A 73 40.388 -20.840 -32.076 1.00 0.00 C ATOM 1129 OE1 GLU A 73 40.511 -19.708 -32.595 1.00 0.00 O ATOM 1130 OE2 GLU A 73 41.359 -21.609 -31.916 1.00 0.00 O ATOM 0 H GLU A 73 35.633 -19.516 -32.890 1.00 0.00 H new ATOM 0 HA GLU A 73 36.717 -22.157 -33.192 1.00 0.00 H new ATOM 0 HB2 GLU A 73 38.239 -20.359 -33.397 1.00 0.00 H new ATOM 0 HB3 GLU A 73 37.700 -19.606 -31.909 1.00 0.00 H new ATOM 0 HG2 GLU A 73 38.900 -21.106 -30.543 1.00 0.00 H new ATOM 0 HG3 GLU A 73 38.912 -22.373 -31.754 1.00 0.00 H new ATOM 1137 N TRP A 74 35.592 -21.428 -30.217 1.00 0.00 N ATOM 1138 CA TRP A 74 35.328 -22.107 -28.939 1.00 0.00 C ATOM 1139 C TRP A 74 34.181 -23.147 -28.988 1.00 0.00 C ATOM 1140 O TRP A 74 34.241 -24.164 -28.296 1.00 0.00 O ATOM 1141 CB TRP A 74 35.563 -21.190 -27.704 1.00 0.00 C ATOM 1142 CG TRP A 74 34.426 -20.981 -26.700 1.00 0.00 C ATOM 1143 CD1 TRP A 74 33.794 -19.730 -26.669 1.00 0.00 C ATOM 1144 CD2 TRP A 74 34.497 -21.415 -25.376 1.00 0.00 C ATOM 1145 NE1 TRP A 74 33.442 -19.369 -25.360 1.00 0.00 N ATOM 1146 CE2 TRP A 74 33.871 -20.455 -24.585 1.00 0.00 C ATOM 1147 CE3 TRP A 74 35.579 -22.094 -24.855 1.00 0.00 C ATOM 1148 CZ2 TRP A 74 34.224 -20.333 -23.271 1.00 0.00 C ATOM 1149 CZ3 TRP A 74 35.874 -21.963 -23.525 1.00 0.00 C ATOM 1150 CH2 TRP A 74 35.054 -21.248 -22.717 1.00 0.00 C ATOM 0 H TRP A 74 35.250 -20.470 -30.295 1.00 0.00 H new ATOM 0 HA TRP A 74 36.114 -22.834 -28.734 1.00 0.00 H new ATOM 0 HB2 TRP A 74 36.415 -21.591 -27.155 1.00 0.00 H new ATOM 0 HB3 TRP A 74 35.857 -20.208 -28.076 1.00 0.00 H new ATOM 0 HD1 TRP A 74 33.603 -19.122 -27.541 1.00 0.00 H new ATOM 0 HE1 TRP A 74 32.981 -18.515 -25.046 1.00 0.00 H new ATOM 0 HE3 TRP A 74 36.187 -22.722 -25.490 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 33.844 -19.513 -22.679 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 36.760 -22.429 -23.120 1.00 0.00 H new ATOM 0 HH2 TRP A 74 35.062 -21.406 -21.649 1.00 0.00 H new ATOM 1161 N LEU A 75 33.212 -23.000 -29.907 1.00 0.00 N ATOM 1162 CA LEU A 75 32.274 -24.128 -30.141 1.00 0.00 C ATOM 1163 C LEU A 75 32.783 -25.133 -31.176 1.00 0.00 C ATOM 1164 O LEU A 75 32.339 -26.276 -31.196 1.00 0.00 O ATOM 1165 CB LEU A 75 30.835 -23.764 -30.544 1.00 0.00 C ATOM 1166 CG LEU A 75 29.775 -24.574 -29.755 1.00 0.00 C ATOM 1167 CD1 LEU A 75 28.471 -23.844 -29.863 1.00 0.00 C ATOM 1168 CD2 LEU A 75 29.484 -26.007 -30.271 1.00 0.00 C ATOM 0 H LEU A 75 33.055 -22.167 -30.474 1.00 0.00 H new ATOM 0 HA LEU A 75 32.238 -24.562 -29.142 1.00 0.00 H new ATOM 0 HB2 LEU A 75 30.673 -22.699 -30.377 1.00 0.00 H new ATOM 0 HB3 LEU A 75 30.704 -23.943 -31.611 1.00 0.00 H new ATOM 0 HG LEU A 75 30.186 -24.668 -28.750 1.00 0.00 H new ATOM 0 HD11 LEU A 75 27.702 -24.390 -29.317 1.00 0.00 H new ATOM 0 HD12 LEU A 75 28.577 -22.845 -29.440 1.00 0.00 H new ATOM 0 HD13 LEU A 75 28.184 -23.765 -30.912 1.00 0.00 H new ATOM 0 HD21 LEU A 75 28.727 -26.474 -29.641 1.00 0.00 H new ATOM 0 HD22 LEU A 75 29.121 -25.957 -31.297 1.00 0.00 H new ATOM 0 HD23 LEU A 75 30.399 -26.598 -30.238 1.00 0.00 H new ATOM 1180 N THR A 76 33.664 -24.736 -32.090 1.00 0.00 N ATOM 1181 CA THR A 76 34.181 -25.750 -33.014 1.00 0.00 C ATOM 1182 C THR A 76 35.112 -26.725 -32.300 1.00 0.00 C ATOM 1183 O THR A 76 34.947 -27.940 -32.399 1.00 0.00 O ATOM 1184 CB THR A 76 34.780 -25.231 -34.319 1.00 0.00 C ATOM 1185 OG1 THR A 76 33.895 -24.289 -34.910 1.00 0.00 O ATOM 1186 CG2 THR A 76 36.147 -24.579 -34.127 1.00 0.00 C ATOM 0 H THR A 76 34.018 -23.787 -32.212 1.00 0.00 H new ATOM 0 HA THR A 76 33.293 -26.286 -33.347 1.00 0.00 H new ATOM 0 HB THR A 76 34.918 -26.095 -34.969 1.00 0.00 H new ATOM 0 HG1 THR A 76 34.178 -23.381 -34.674 1.00 0.00 H new ATOM 0 HG21 THR A 76 36.522 -24.230 -35.089 1.00 0.00 H new ATOM 0 HG22 THR A 76 36.054 -23.734 -33.445 1.00 0.00 H new ATOM 0 HG23 THR A 76 36.842 -25.307 -33.709 1.00 0.00 H new ATOM 1194 N LEU A 77 36.086 -26.209 -31.551 1.00 0.00 N ATOM 1195 CA LEU A 77 36.841 -27.114 -30.682 1.00 0.00 C ATOM 1196 C LEU A 77 35.927 -27.737 -29.621 1.00 0.00 C ATOM 1197 O LEU A 77 36.019 -28.928 -29.376 1.00 0.00 O ATOM 1198 CB LEU A 77 38.170 -26.575 -30.107 1.00 0.00 C ATOM 1199 CG LEU A 77 37.943 -25.512 -29.032 1.00 0.00 C ATOM 1200 CD1 LEU A 77 38.235 -25.962 -27.620 1.00 0.00 C ATOM 1201 CD2 LEU A 77 38.858 -24.324 -29.282 1.00 0.00 C ATOM 0 H LEU A 77 36.361 -25.227 -31.524 1.00 0.00 H new ATOM 0 HA LEU A 77 37.196 -27.903 -31.345 1.00 0.00 H new ATOM 0 HB2 LEU A 77 38.743 -27.401 -29.685 1.00 0.00 H new ATOM 0 HB3 LEU A 77 38.768 -26.152 -30.914 1.00 0.00 H new ATOM 0 HG LEU A 77 36.882 -25.274 -29.108 1.00 0.00 H new ATOM 0 HD11 LEU A 77 38.045 -25.140 -26.930 1.00 0.00 H new ATOM 0 HD12 LEU A 77 37.592 -26.805 -27.367 1.00 0.00 H new ATOM 0 HD13 LEU A 77 39.279 -26.266 -27.544 1.00 0.00 H new ATOM 0 HD21 LEU A 77 38.692 -23.569 -28.513 1.00 0.00 H new ATOM 0 HD22 LEU A 77 39.897 -24.652 -29.251 1.00 0.00 H new ATOM 0 HD23 LEU A 77 38.641 -23.898 -30.262 1.00 0.00 H new ATOM 1213 N CYS A 78 34.974 -26.999 -29.042 1.00 0.00 N ATOM 1214 CA CYS A 78 34.072 -27.659 -28.080 1.00 0.00 C ATOM 1215 C CYS A 78 33.234 -28.782 -28.714 1.00 0.00 C ATOM 1216 O CYS A 78 33.003 -29.820 -28.094 1.00 0.00 O ATOM 1217 CB CYS A 78 33.190 -26.702 -27.279 1.00 0.00 C ATOM 1218 SG CYS A 78 34.199 -25.828 -26.034 1.00 0.00 S ATOM 0 H CYS A 78 34.808 -26.006 -29.204 1.00 0.00 H new ATOM 0 HA CYS A 78 34.751 -28.116 -27.361 1.00 0.00 H new ATOM 0 HB2 CYS A 78 32.717 -25.983 -27.948 1.00 0.00 H new ATOM 0 HB3 CYS A 78 32.389 -27.255 -26.788 1.00 0.00 H new ATOM 0 HG CYS A 78 34.640 -24.714 -26.537 1.00 0.00 H new ATOM 1224 N SER A 79 32.797 -28.606 -29.964 1.00 0.00 N ATOM 1225 CA SER A 79 32.101 -29.713 -30.638 1.00 0.00 C ATOM 1226 C SER A 79 33.019 -30.926 -30.863 1.00 0.00 C ATOM 1227 O SER A 79 32.672 -32.063 -30.540 1.00 0.00 O ATOM 1228 CB SER A 79 31.419 -29.282 -31.941 1.00 0.00 C ATOM 1229 OG SER A 79 32.391 -28.851 -32.884 1.00 0.00 O ATOM 0 H SER A 79 32.903 -27.752 -30.511 1.00 0.00 H new ATOM 0 HA SER A 79 31.309 -30.023 -29.956 1.00 0.00 H new ATOM 0 HB2 SER A 79 30.846 -30.113 -32.352 1.00 0.00 H new ATOM 0 HB3 SER A 79 30.713 -28.476 -31.741 1.00 0.00 H new ATOM 0 HG SER A 79 33.183 -28.523 -32.410 1.00 0.00 H new ATOM 1235 N LYS A 80 34.215 -30.676 -31.389 1.00 0.00 N ATOM 1236 CA LYS A 80 35.185 -31.773 -31.548 1.00 0.00 C ATOM 1237 C LYS A 80 35.740 -32.305 -30.210 1.00 0.00 C ATOM 1238 O LYS A 80 36.211 -33.438 -30.117 1.00 0.00 O ATOM 1239 CB LYS A 80 36.353 -31.402 -32.477 1.00 0.00 C ATOM 1240 CG LYS A 80 35.887 -30.803 -33.813 1.00 0.00 C ATOM 1241 CD LYS A 80 35.037 -31.790 -34.617 1.00 0.00 C ATOM 1242 CE LYS A 80 34.611 -31.169 -35.947 1.00 0.00 C ATOM 1243 NZ LYS A 80 33.722 -32.097 -36.668 1.00 0.00 N ATOM 0 H LYS A 80 34.535 -29.760 -31.705 1.00 0.00 H new ATOM 0 HA LYS A 80 34.609 -32.574 -32.011 1.00 0.00 H new ATOM 0 HB2 LYS A 80 37.001 -30.687 -31.970 1.00 0.00 H new ATOM 0 HB3 LYS A 80 36.952 -32.292 -32.673 1.00 0.00 H new ATOM 0 HG2 LYS A 80 35.310 -29.898 -33.623 1.00 0.00 H new ATOM 0 HG3 LYS A 80 36.756 -30.509 -34.402 1.00 0.00 H new ATOM 0 HD2 LYS A 80 35.604 -32.703 -34.800 1.00 0.00 H new ATOM 0 HD3 LYS A 80 34.155 -32.073 -34.042 1.00 0.00 H new ATOM 0 HE2 LYS A 80 34.099 -30.223 -35.770 1.00 0.00 H new ATOM 0 HE3 LYS A 80 35.489 -30.947 -36.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 33.435 -31.671 -37.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 34.225 -32.989 -36.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 32.878 -32.288 -36.091 1.00 0.00 H new ATOM 1257 N TRP A 81 35.691 -31.473 -29.178 1.00 0.00 N ATOM 1258 CA TRP A 81 36.155 -31.890 -27.858 1.00 0.00 C ATOM 1259 C TRP A 81 35.207 -32.895 -27.219 1.00 0.00 C ATOM 1260 O TRP A 81 35.611 -33.947 -26.724 1.00 0.00 O ATOM 1261 CB TRP A 81 36.352 -30.676 -26.914 1.00 0.00 C ATOM 1262 CG TRP A 81 37.786 -30.181 -26.917 1.00 0.00 C ATOM 1263 CD1 TRP A 81 38.349 -29.586 -28.045 1.00 0.00 C ATOM 1264 CD2 TRP A 81 38.748 -30.964 -26.352 1.00 0.00 C ATOM 1265 NE1 TRP A 81 39.664 -30.060 -28.246 1.00 0.00 N ATOM 1266 CE2 TRP A 81 39.865 -30.950 -27.178 1.00 0.00 C ATOM 1267 CE3 TRP A 81 38.428 -32.083 -25.638 1.00 0.00 C ATOM 1268 CZ2 TRP A 81 40.561 -32.109 -27.346 1.00 0.00 C ATOM 1269 CZ3 TRP A 81 39.202 -33.179 -25.735 1.00 0.00 C ATOM 1270 CH2 TRP A 81 40.230 -33.208 -26.610 1.00 0.00 C ATOM 0 H TRP A 81 35.340 -30.517 -29.226 1.00 0.00 H new ATOM 0 HA TRP A 81 37.120 -32.375 -28.006 1.00 0.00 H new ATOM 0 HB2 TRP A 81 35.689 -29.867 -27.220 1.00 0.00 H new ATOM 0 HB3 TRP A 81 36.067 -30.955 -25.900 1.00 0.00 H new ATOM 0 HD1 TRP A 81 37.850 -28.865 -28.676 1.00 0.00 H new ATOM 0 HE1 TRP A 81 40.315 -29.814 -28.992 1.00 0.00 H new ATOM 0 HE3 TRP A 81 37.558 -32.088 -24.998 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 41.371 -32.157 -28.059 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 39.001 -34.038 -25.112 1.00 0.00 H new ATOM 0 HH2 TRP A 81 40.800 -34.118 -26.729 1.00 0.00 H new ATOM 1281 N VAL A 82 33.925 -32.563 -27.236 1.00 0.00 N ATOM 1282 CA VAL A 82 32.930 -33.511 -26.704 1.00 0.00 C ATOM 1283 C VAL A 82 32.516 -34.598 -27.725 1.00 0.00 C ATOM 1284 O VAL A 82 31.747 -35.506 -27.408 1.00 0.00 O ATOM 1285 CB VAL A 82 31.710 -32.819 -26.064 1.00 0.00 C ATOM 1286 CG1 VAL A 82 30.977 -33.793 -25.132 1.00 0.00 C ATOM 1287 CG2 VAL A 82 32.141 -31.588 -25.258 1.00 0.00 C ATOM 0 H VAL A 82 33.549 -31.685 -27.594 1.00 0.00 H new ATOM 0 HA VAL A 82 33.442 -34.032 -25.895 1.00 0.00 H new ATOM 0 HB VAL A 82 31.044 -32.505 -26.868 1.00 0.00 H new ATOM 0 HG11 VAL A 82 30.117 -33.293 -24.686 1.00 0.00 H new ATOM 0 HG12 VAL A 82 30.638 -34.657 -25.703 1.00 0.00 H new ATOM 0 HG13 VAL A 82 31.654 -34.122 -24.344 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.263 -31.117 -24.816 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.826 -31.893 -24.467 1.00 0.00 H new ATOM 0 HG23 VAL A 82 32.641 -30.878 -25.917 1.00 0.00 H new ATOM 1297 N ARG A 83 33.018 -34.500 -28.960 1.00 0.00 N ATOM 1298 CA ARG A 83 32.772 -35.565 -29.955 1.00 0.00 C ATOM 1299 C ARG A 83 32.869 -36.992 -29.384 1.00 0.00 C ATOM 1300 O ARG A 83 31.929 -37.782 -29.476 1.00 0.00 O ATOM 1301 CB ARG A 83 33.696 -35.345 -31.169 1.00 0.00 C ATOM 1302 CG ARG A 83 33.730 -36.516 -32.172 1.00 0.00 C ATOM 1303 CD ARG A 83 34.936 -37.453 -31.966 1.00 0.00 C ATOM 1304 NE ARG A 83 36.198 -36.695 -31.863 1.00 0.00 N ATOM 1305 CZ ARG A 83 36.968 -36.873 -30.795 1.00 0.00 C ATOM 1306 NH1 ARG A 83 37.226 -38.086 -30.348 1.00 0.00 N ATOM 1307 NH2 ARG A 83 37.491 -35.832 -30.184 1.00 0.00 N ATOM 0 H ARG A 83 33.583 -33.720 -29.295 1.00 0.00 H new ATOM 0 HA ARG A 83 31.733 -35.486 -30.276 1.00 0.00 H new ATOM 0 HB2 ARG A 83 33.377 -34.444 -31.693 1.00 0.00 H new ATOM 0 HB3 ARG A 83 34.709 -35.162 -30.810 1.00 0.00 H new ATOM 0 HG2 ARG A 83 32.810 -37.093 -32.080 1.00 0.00 H new ATOM 0 HG3 ARG A 83 33.756 -36.117 -33.186 1.00 0.00 H new ATOM 0 HD2 ARG A 83 34.790 -38.043 -31.061 1.00 0.00 H new ATOM 0 HD3 ARG A 83 34.999 -38.155 -32.797 1.00 0.00 H new ATOM 0 HE ARG A 83 36.474 -36.045 -32.599 1.00 0.00 H new ATOM 0 HH11 ARG A 83 36.833 -38.899 -30.823 1.00 0.00 H new ATOM 0 HH12 ARG A 83 37.818 -38.212 -29.527 1.00 0.00 H new ATOM 0 HH21 ARG A 83 37.305 -34.891 -30.530 1.00 0.00 H new ATOM 0 HH22 ARG A 83 38.082 -35.966 -29.364 1.00 0.00 H new ATOM 1321 N GLN A 84 34.017 -37.328 -28.805 1.00 0.00 N ATOM 1322 CA GLN A 84 34.134 -38.633 -28.140 1.00 0.00 C ATOM 1323 C GLN A 84 35.370 -38.662 -27.241 1.00 0.00 C ATOM 1324 O GLN A 84 36.418 -39.206 -27.594 1.00 0.00 O ATOM 1325 CB GLN A 84 34.117 -39.834 -29.109 1.00 0.00 C ATOM 1326 CG GLN A 84 33.478 -41.083 -28.480 1.00 0.00 C ATOM 1327 CD GLN A 84 34.373 -41.717 -27.419 1.00 0.00 C ATOM 1328 OE1 GLN A 84 35.501 -42.127 -27.682 1.00 0.00 O ATOM 1329 NE2 GLN A 84 33.865 -41.822 -26.204 1.00 0.00 N ATOM 0 H GLN A 84 34.853 -36.745 -28.778 1.00 0.00 H new ATOM 0 HA GLN A 84 33.240 -38.746 -27.527 1.00 0.00 H new ATOM 0 HB2 GLN A 84 33.568 -39.563 -30.011 1.00 0.00 H new ATOM 0 HB3 GLN A 84 35.137 -40.066 -29.415 1.00 0.00 H new ATOM 0 HG2 GLN A 84 32.522 -40.813 -28.032 1.00 0.00 H new ATOM 0 HG3 GLN A 84 33.269 -41.814 -29.261 1.00 0.00 H new ATOM 0 HE21 GLN A 84 32.926 -41.473 -26.012 1.00 0.00 H new ATOM 0 HE22 GLN A 84 34.412 -42.252 -25.458 1.00 0.00 H new ATOM 1338 N ASP A 85 35.260 -38.028 -26.080 1.00 0.00 N ATOM 1339 CA ASP A 85 36.404 -37.999 -25.164 1.00 0.00 C ATOM 1340 C ASP A 85 35.959 -38.227 -23.720 1.00 0.00 C ATOM 1341 O ASP A 85 35.417 -37.338 -23.062 1.00 0.00 O ATOM 1342 CB ASP A 85 37.230 -36.711 -25.291 1.00 0.00 C ATOM 1343 CG ASP A 85 38.103 -36.732 -26.540 1.00 0.00 C ATOM 1344 OD1 ASP A 85 39.146 -37.420 -26.531 1.00 0.00 O ATOM 1345 OD2 ASP A 85 37.749 -36.069 -27.538 1.00 0.00 O ATOM 0 H ASP A 85 34.425 -37.542 -25.754 1.00 0.00 H new ATOM 0 HA ASP A 85 37.059 -38.821 -25.455 1.00 0.00 H new ATOM 0 HB2 ASP A 85 36.562 -35.850 -25.326 1.00 0.00 H new ATOM 0 HB3 ASP A 85 37.858 -36.591 -24.408 1.00 0.00 H new ATOM 1350 N ASP A 86 36.182 -39.440 -23.227 1.00 0.00 N ATOM 1351 CA ASP A 86 35.767 -39.740 -21.851 1.00 0.00 C ATOM 1352 C ASP A 86 36.716 -39.129 -20.820 1.00 0.00 C ATOM 1353 O ASP A 86 36.254 -38.334 -19.971 1.00 0.00 O ATOM 1354 CB ASP A 86 35.617 -41.247 -21.597 1.00 0.00 C ATOM 1355 CG ASP A 86 34.590 -41.880 -22.529 1.00 0.00 C ATOM 1356 OD1 ASP A 86 33.393 -41.918 -22.171 1.00 0.00 O ATOM 1357 OD2 ASP A 86 34.976 -42.344 -23.624 1.00 0.00 O ATOM 1358 OXT ASP A 86 37.930 -39.434 -20.859 1.00 0.00 O ATOM 0 H ASP A 86 36.628 -40.207 -23.730 1.00 0.00 H new ATOM 0 HA ASP A 86 34.786 -39.280 -21.732 1.00 0.00 H new ATOM 0 HB2 ASP A 86 36.581 -41.736 -21.733 1.00 0.00 H new ATOM 0 HB3 ASP A 86 35.319 -41.413 -20.562 1.00 0.00 H new TER 1363 ASP A 86