USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 920 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: B 68 ASN : amide:sc= -0.278! K(o=0.96!,f=-5.2) USER MOD Set 1.2: B 70 LYS NZ :NH3+ 143:sc= 1.24 (180deg=0) USER MOD Set 2.1: A 25 GLN : amide:sc= -0.063 K(o=0.91,f=2) USER MOD Set 2.2: A 58 SER OG : rot -90:sc= 0.97 USER MOD Single : A 3 TYR OH : rot -157:sc= 0.821 USER MOD Single : A 13 LYS NZ :NH3+ 148:sc= 1.27 (180deg=0.948) USER MOD Single : A 17 LYS NZ :NH3+ 136:sc= 0.986 (180deg=-0.0464) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -173:sc= 2.23 (180deg=1.75) USER MOD Single : A 28 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0385) USER MOD Single : A 29 LYS NZ :NH3+ 175:sc=-0.00377 (180deg=-0.0311) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.044 X(o=-0.044,f=-0.54) USER MOD Single : A 43 LYS NZ :NH3+ -172:sc= 1.01 (180deg=0.956) USER MOD Single : A 47 MET CE :methyl 144:sc= -0.357 (180deg=-0.684) USER MOD Single : A 50 CYS SG : rot 160:sc= -0.254 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 146:sc= 1.18 (180deg=0.372!) USER MOD Single : A 54 LYS NZ :NH3+ -173:sc= 1.27 (180deg=1.19) USER MOD Single : A 57 SER OG : rot 180:sc= 0.00859 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot -179:sc= 1.09 USER MOD Single : A 65 GLN : amide:sc= -1.21! K(o=-1.2!,f=-0.035) USER MOD Single : A 70 LYS NZ :NH3+ 174:sc= 1.23 (180deg=1.14) USER MOD Single : A 77 SER OG : rot 140:sc= -0.241 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 75 THR OG1 : rot -71:sc= 1.08 USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 2 7.469 12.579 -5.796 1.00 0.00 N ATOM 19 CA ALA A 2 8.894 12.336 -5.676 1.00 0.00 C ATOM 20 C ALA A 2 9.152 10.879 -5.970 1.00 0.00 C ATOM 21 O ALA A 2 10.023 10.526 -6.768 1.00 0.00 O ATOM 22 CB ALA A 2 9.387 12.715 -4.293 1.00 0.00 C ATOM 0 HA ALA A 2 9.441 12.953 -6.389 1.00 0.00 H new ATOM 0 HB1 ALA A 2 10.458 12.525 -4.224 1.00 0.00 H new ATOM 0 HB2 ALA A 2 9.194 13.773 -4.115 1.00 0.00 H new ATOM 0 HB3 ALA A 2 8.864 12.120 -3.545 1.00 0.00 H new ATOM 28 N TYR A 3 8.370 10.051 -5.342 1.00 0.00 N ATOM 29 CA TYR A 3 8.374 8.638 -5.596 1.00 0.00 C ATOM 30 C TYR A 3 7.298 8.336 -6.595 1.00 0.00 C ATOM 31 O TYR A 3 6.237 8.970 -6.578 1.00 0.00 O ATOM 32 CB TYR A 3 8.129 7.839 -4.308 1.00 0.00 C ATOM 33 CG TYR A 3 9.337 7.674 -3.395 1.00 0.00 C ATOM 34 CD1 TYR A 3 9.935 8.763 -2.768 1.00 0.00 C ATOM 35 CD2 TYR A 3 9.855 6.406 -3.139 1.00 0.00 C ATOM 36 CE1 TYR A 3 11.014 8.590 -1.913 1.00 0.00 C ATOM 37 CE2 TYR A 3 10.934 6.226 -2.294 1.00 0.00 C ATOM 38 CZ TYR A 3 11.512 7.317 -1.683 1.00 0.00 C ATOM 39 OH TYR A 3 12.564 7.138 -0.797 1.00 0.00 O ATOM 0 H TYR A 3 7.701 10.341 -4.628 1.00 0.00 H new ATOM 0 HA TYR A 3 9.350 8.347 -5.984 1.00 0.00 H new ATOM 0 HB2 TYR A 3 7.334 8.328 -3.744 1.00 0.00 H new ATOM 0 HB3 TYR A 3 7.764 6.849 -4.580 1.00 0.00 H new ATOM 0 HD1 TYR A 3 9.554 9.757 -2.950 1.00 0.00 H new ATOM 0 HD2 TYR A 3 9.404 5.546 -3.611 1.00 0.00 H new ATOM 0 HE1 TYR A 3 11.464 9.444 -1.429 1.00 0.00 H new ATOM 0 HE2 TYR A 3 11.322 5.234 -2.114 1.00 0.00 H new ATOM 0 HH TYR A 3 13.029 6.301 -1.006 1.00 0.00 H new ATOM 49 N PHE A 4 7.567 7.419 -7.482 1.00 0.00 N ATOM 50 CA PHE A 4 6.577 7.023 -8.470 1.00 0.00 C ATOM 51 C PHE A 4 5.585 6.054 -7.843 1.00 0.00 C ATOM 52 O PHE A 4 5.779 5.624 -6.696 1.00 0.00 O ATOM 53 CB PHE A 4 7.244 6.390 -9.682 1.00 0.00 C ATOM 54 CG PHE A 4 8.287 7.259 -10.302 1.00 0.00 C ATOM 55 CD1 PHE A 4 7.936 8.342 -11.086 1.00 0.00 C ATOM 56 CD2 PHE A 4 9.624 7.002 -10.081 1.00 0.00 C ATOM 57 CE1 PHE A 4 8.904 9.148 -11.638 1.00 0.00 C ATOM 58 CE2 PHE A 4 10.594 7.796 -10.622 1.00 0.00 C ATOM 59 CZ PHE A 4 10.239 8.876 -11.406 1.00 0.00 C ATOM 0 H PHE A 4 8.458 6.927 -7.549 1.00 0.00 H new ATOM 0 HA PHE A 4 6.044 7.912 -8.806 1.00 0.00 H new ATOM 0 HB2 PHE A 4 7.698 5.444 -9.386 1.00 0.00 H new ATOM 0 HB3 PHE A 4 6.483 6.159 -10.428 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.893 8.557 -11.267 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.908 6.158 -9.470 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.622 9.991 -12.251 1.00 0.00 H new ATOM 0 HE2 PHE A 4 11.636 7.580 -10.437 1.00 0.00 H new ATOM 0 HZ PHE A 4 11.003 9.507 -11.837 1.00 0.00 H new ATOM 69 N LEU A 5 4.548 5.690 -8.565 1.00 0.00 N ATOM 70 CA LEU A 5 3.557 4.823 -8.015 1.00 0.00 C ATOM 71 C LEU A 5 3.515 3.496 -8.768 1.00 0.00 C ATOM 72 O LEU A 5 3.463 3.472 -10.003 1.00 0.00 O ATOM 73 CB LEU A 5 2.206 5.532 -8.067 1.00 0.00 C ATOM 74 CG LEU A 5 1.010 4.775 -7.538 1.00 0.00 C ATOM 75 CD1 LEU A 5 1.186 4.441 -6.058 1.00 0.00 C ATOM 76 CD2 LEU A 5 -0.230 5.599 -7.755 1.00 0.00 C ATOM 0 H LEU A 5 4.379 5.984 -9.527 1.00 0.00 H new ATOM 0 HA LEU A 5 3.804 4.593 -6.979 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.291 6.463 -7.507 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.005 5.800 -9.104 1.00 0.00 H new ATOM 0 HG LEU A 5 0.916 3.832 -8.077 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.312 3.896 -5.701 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.076 3.825 -5.927 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.296 5.363 -5.488 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.097 5.058 -7.375 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.134 6.547 -7.226 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.359 5.789 -8.821 1.00 0.00 H new ATOM 88 N ASP A 6 3.573 2.418 -8.031 1.00 0.00 N ATOM 89 CA ASP A 6 3.457 1.063 -8.602 1.00 0.00 C ATOM 90 C ASP A 6 2.450 0.262 -7.823 1.00 0.00 C ATOM 91 O ASP A 6 2.270 0.483 -6.624 1.00 0.00 O ATOM 92 CB ASP A 6 4.800 0.286 -8.644 1.00 0.00 C ATOM 93 CG ASP A 6 5.518 0.327 -9.990 1.00 0.00 C ATOM 94 OD1 ASP A 6 5.135 -0.415 -10.901 1.00 0.00 O ATOM 95 OD2 ASP A 6 6.502 1.072 -10.148 1.00 0.00 O ATOM 0 H ASP A 6 3.701 2.433 -7.019 1.00 0.00 H new ATOM 0 HA ASP A 6 3.134 1.198 -9.634 1.00 0.00 H new ATOM 0 HB2 ASP A 6 5.464 0.693 -7.881 1.00 0.00 H new ATOM 0 HB3 ASP A 6 4.611 -0.754 -8.380 1.00 0.00 H new ATOM 100 N PHE A 7 1.783 -0.636 -8.489 1.00 0.00 N ATOM 101 CA PHE A 7 0.799 -1.503 -7.865 1.00 0.00 C ATOM 102 C PHE A 7 0.930 -2.929 -8.337 1.00 0.00 C ATOM 103 O PHE A 7 1.171 -3.177 -9.504 1.00 0.00 O ATOM 104 CB PHE A 7 -0.631 -1.041 -8.158 1.00 0.00 C ATOM 105 CG PHE A 7 -1.207 -0.019 -7.228 1.00 0.00 C ATOM 106 CD1 PHE A 7 -1.058 1.330 -7.462 1.00 0.00 C ATOM 107 CD2 PHE A 7 -1.943 -0.426 -6.127 1.00 0.00 C ATOM 108 CE1 PHE A 7 -1.632 2.253 -6.615 1.00 0.00 C ATOM 109 CE2 PHE A 7 -2.514 0.496 -5.277 1.00 0.00 C ATOM 110 CZ PHE A 7 -2.357 1.837 -5.522 1.00 0.00 C ATOM 0 H PHE A 7 1.901 -0.796 -9.489 1.00 0.00 H new ATOM 0 HA PHE A 7 0.993 -1.449 -6.794 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -0.658 -0.635 -9.169 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -1.281 -1.916 -8.148 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -0.488 1.667 -8.315 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -2.071 -1.481 -5.932 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -1.512 3.308 -6.810 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -3.083 0.164 -4.421 1.00 0.00 H new ATOM 0 HZ PHE A 7 -2.801 2.564 -4.859 1.00 0.00 H new ATOM 120 N ASP A 8 0.825 -3.836 -7.411 1.00 0.00 N ATOM 121 CA ASP A 8 0.720 -5.270 -7.682 1.00 0.00 C ATOM 122 C ASP A 8 -0.544 -5.535 -8.491 1.00 0.00 C ATOM 123 O ASP A 8 -1.588 -4.939 -8.209 1.00 0.00 O ATOM 124 CB ASP A 8 0.691 -6.036 -6.331 1.00 0.00 C ATOM 125 CG ASP A 8 -0.084 -7.350 -6.353 1.00 0.00 C ATOM 126 OD1 ASP A 8 0.305 -8.284 -7.060 1.00 0.00 O ATOM 127 OD2 ASP A 8 -1.134 -7.437 -5.667 1.00 0.00 O ATOM 0 H ASP A 8 0.808 -3.610 -6.416 1.00 0.00 H new ATOM 0 HA ASP A 8 1.577 -5.615 -8.260 1.00 0.00 H new ATOM 0 HB2 ASP A 8 1.717 -6.241 -6.025 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.255 -5.387 -5.571 1.00 0.00 H new ATOM 132 N GLU A 9 -0.447 -6.394 -9.499 1.00 0.00 N ATOM 133 CA GLU A 9 -1.576 -6.734 -10.371 1.00 0.00 C ATOM 134 C GLU A 9 -2.794 -7.182 -9.598 1.00 0.00 C ATOM 135 O GLU A 9 -3.914 -6.812 -9.936 1.00 0.00 O ATOM 136 CB GLU A 9 -1.170 -7.777 -11.402 1.00 0.00 C ATOM 137 CG GLU A 9 -0.809 -7.191 -12.757 1.00 0.00 C ATOM 138 CD GLU A 9 -2.024 -6.956 -13.637 1.00 0.00 C ATOM 139 OE1 GLU A 9 -2.783 -5.967 -13.446 1.00 0.00 O ATOM 140 OE2 GLU A 9 -2.236 -7.759 -14.576 1.00 0.00 O ATOM 0 H GLU A 9 0.418 -6.878 -9.739 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.857 -5.820 -10.894 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.317 -8.339 -11.021 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.988 -8.486 -11.529 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.283 -6.247 -12.612 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.121 -7.864 -13.268 1.00 0.00 H new ATOM 147 N ARG A 10 -2.583 -7.914 -8.537 1.00 0.00 N ATOM 148 CA ARG A 10 -3.688 -8.400 -7.737 1.00 0.00 C ATOM 149 C ARG A 10 -4.322 -7.199 -7.035 1.00 0.00 C ATOM 150 O ARG A 10 -5.532 -7.060 -7.003 1.00 0.00 O ATOM 151 CB ARG A 10 -3.186 -9.421 -6.716 1.00 0.00 C ATOM 152 CG ARG A 10 -2.227 -10.430 -7.312 1.00 0.00 C ATOM 153 CD ARG A 10 -1.587 -11.300 -6.258 1.00 0.00 C ATOM 154 NE ARG A 10 -0.417 -12.001 -6.800 1.00 0.00 N ATOM 155 CZ ARG A 10 0.203 -13.038 -6.238 1.00 0.00 C ATOM 156 NH1 ARG A 10 -0.287 -13.602 -5.149 1.00 0.00 N ATOM 157 NH2 ARG A 10 1.319 -13.512 -6.775 1.00 0.00 N ATOM 0 H ARG A 10 -1.660 -8.189 -8.202 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.428 -8.896 -8.365 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.691 -8.896 -5.899 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -4.039 -9.947 -6.287 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -2.761 -11.059 -8.025 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -1.450 -9.906 -7.869 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.288 -10.688 -5.407 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -2.312 -12.025 -5.889 1.00 0.00 H new ATOM 0 HE ARG A 10 -0.045 -11.664 -7.688 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -1.146 -13.244 -4.732 1.00 0.00 H new ATOM 0 HH12 ARG A 10 0.194 -14.395 -4.725 1.00 0.00 H new ATOM 0 HH21 ARG A 10 1.702 -13.083 -7.617 1.00 0.00 H new ATOM 0 HH22 ARG A 10 1.794 -14.306 -6.346 1.00 0.00 H new ATOM 171 N ALA A 11 -3.468 -6.307 -6.531 1.00 0.00 N ATOM 172 CA ALA A 11 -3.868 -5.067 -5.854 1.00 0.00 C ATOM 173 C ALA A 11 -4.708 -4.145 -6.751 1.00 0.00 C ATOM 174 O ALA A 11 -5.591 -3.437 -6.249 1.00 0.00 O ATOM 175 CB ALA A 11 -2.658 -4.326 -5.298 1.00 0.00 C ATOM 0 H ALA A 11 -2.456 -6.427 -6.582 1.00 0.00 H new ATOM 0 HA ALA A 11 -4.505 -5.363 -5.021 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -2.987 -3.412 -4.803 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -2.140 -4.962 -4.580 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.980 -4.073 -6.113 1.00 0.00 H new ATOM 181 N LEU A 12 -4.445 -4.144 -8.072 1.00 0.00 N ATOM 182 CA LEU A 12 -5.292 -3.375 -9.001 1.00 0.00 C ATOM 183 C LEU A 12 -6.727 -3.845 -8.917 1.00 0.00 C ATOM 184 O LEU A 12 -7.666 -3.047 -8.844 1.00 0.00 O ATOM 185 CB LEU A 12 -4.838 -3.432 -10.489 1.00 0.00 C ATOM 186 CG LEU A 12 -3.675 -2.522 -10.940 1.00 0.00 C ATOM 187 CD1 LEU A 12 -2.344 -3.023 -10.477 1.00 0.00 C ATOM 188 CD2 LEU A 12 -3.686 -2.345 -12.447 1.00 0.00 C ATOM 0 H LEU A 12 -3.676 -4.651 -8.510 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.194 -2.338 -8.679 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.558 -4.462 -10.711 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.703 -3.196 -11.109 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.831 -1.551 -10.469 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.561 -2.347 -10.821 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.331 -3.069 -9.388 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.168 -4.019 -10.884 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.859 -1.700 -12.744 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.579 -3.317 -12.928 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -4.628 -1.890 -12.753 1.00 0.00 H new ATOM 200 N LYS A 13 -6.887 -5.143 -8.847 1.00 0.00 N ATOM 201 CA LYS A 13 -8.196 -5.738 -8.865 1.00 0.00 C ATOM 202 C LYS A 13 -8.822 -5.577 -7.478 1.00 0.00 C ATOM 203 O LYS A 13 -10.040 -5.493 -7.339 1.00 0.00 O ATOM 204 CB LYS A 13 -8.118 -7.233 -9.277 1.00 0.00 C ATOM 205 CG LYS A 13 -7.025 -7.566 -10.310 1.00 0.00 C ATOM 206 CD LYS A 13 -7.043 -6.678 -11.567 1.00 0.00 C ATOM 207 CE LYS A 13 -5.714 -6.826 -12.302 1.00 0.00 C ATOM 208 NZ LYS A 13 -5.516 -5.853 -13.390 1.00 0.00 N ATOM 0 H LYS A 13 -6.119 -5.811 -8.777 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.820 -5.236 -9.604 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -7.947 -7.833 -8.383 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -9.084 -7.534 -9.682 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -6.050 -7.476 -9.831 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -7.135 -8.607 -10.614 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -7.867 -6.966 -12.219 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -7.205 -5.637 -11.289 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -4.901 -6.722 -11.584 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -5.649 -7.833 -12.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -4.504 -5.629 -13.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.857 -6.259 -14.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.047 -4.984 -13.179 1.00 0.00 H new ATOM 222 N GLU A 14 -7.954 -5.484 -6.472 1.00 0.00 N ATOM 223 CA GLU A 14 -8.344 -5.281 -5.088 1.00 0.00 C ATOM 224 C GLU A 14 -9.012 -3.941 -4.895 1.00 0.00 C ATOM 225 O GLU A 14 -10.013 -3.847 -4.200 1.00 0.00 O ATOM 226 CB GLU A 14 -7.148 -5.381 -4.155 1.00 0.00 C ATOM 227 CG GLU A 14 -6.513 -6.757 -4.070 1.00 0.00 C ATOM 228 CD GLU A 14 -7.358 -7.805 -3.373 1.00 0.00 C ATOM 229 OE1 GLU A 14 -8.578 -7.914 -3.633 1.00 0.00 O ATOM 230 OE2 GLU A 14 -6.781 -8.577 -2.576 1.00 0.00 O ATOM 0 H GLU A 14 -6.945 -5.549 -6.604 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.054 -6.071 -4.843 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.391 -4.668 -4.482 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -7.460 -5.079 -3.155 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -6.291 -7.102 -5.080 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -5.561 -6.671 -3.546 1.00 0.00 H new ATOM 237 N TRP A 15 -8.490 -2.892 -5.508 1.00 0.00 N ATOM 238 CA TRP A 15 -9.143 -1.617 -5.321 1.00 0.00 C ATOM 239 C TRP A 15 -10.458 -1.566 -6.084 1.00 0.00 C ATOM 240 O TRP A 15 -11.352 -0.818 -5.733 1.00 0.00 O ATOM 241 CB TRP A 15 -8.247 -0.363 -5.589 1.00 0.00 C ATOM 242 CG TRP A 15 -8.016 0.070 -7.030 1.00 0.00 C ATOM 243 CD1 TRP A 15 -8.945 0.576 -7.898 1.00 0.00 C ATOM 244 CD2 TRP A 15 -6.767 0.132 -7.723 1.00 0.00 C ATOM 245 NE1 TRP A 15 -8.356 0.915 -9.082 1.00 0.00 N ATOM 246 CE2 TRP A 15 -7.027 0.653 -9.008 1.00 0.00 C ATOM 247 CE3 TRP A 15 -5.464 -0.214 -7.399 1.00 0.00 C ATOM 248 CZ2 TRP A 15 -6.031 0.838 -9.954 1.00 0.00 C ATOM 249 CZ3 TRP A 15 -4.477 -0.025 -8.343 1.00 0.00 C ATOM 250 CH2 TRP A 15 -4.765 0.494 -9.602 1.00 0.00 C ATOM 0 H TRP A 15 -7.663 -2.895 -6.106 1.00 0.00 H new ATOM 0 HA TRP A 15 -9.356 -1.554 -4.254 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -8.688 0.480 -5.056 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -7.272 -0.550 -5.139 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.996 0.691 -7.677 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.838 1.303 -9.893 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.227 -0.623 -6.428 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.253 1.240 -10.932 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.457 -0.286 -8.100 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -3.964 0.626 -10.315 1.00 0.00 H new ATOM 261 N ARG A 16 -10.585 -2.404 -7.104 1.00 0.00 N ATOM 262 CA ARG A 16 -11.808 -2.425 -7.910 1.00 0.00 C ATOM 263 C ARG A 16 -12.941 -3.133 -7.161 1.00 0.00 C ATOM 264 O ARG A 16 -14.114 -2.865 -7.396 1.00 0.00 O ATOM 265 CB ARG A 16 -11.613 -3.139 -9.260 1.00 0.00 C ATOM 266 CG ARG A 16 -10.452 -2.662 -10.111 1.00 0.00 C ATOM 267 CD ARG A 16 -10.402 -1.165 -10.297 1.00 0.00 C ATOM 268 NE ARG A 16 -11.562 -0.568 -10.964 1.00 0.00 N ATOM 269 CZ ARG A 16 -11.486 0.558 -11.695 1.00 0.00 C ATOM 270 NH1 ARG A 16 -10.294 1.000 -12.098 1.00 0.00 N ATOM 271 NH2 ARG A 16 -12.584 1.195 -12.085 1.00 0.00 N ATOM 0 H ARG A 16 -9.870 -3.071 -7.394 1.00 0.00 H new ATOM 0 HA ARG A 16 -12.062 -1.381 -8.096 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -11.482 -4.204 -9.068 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -12.530 -3.030 -9.840 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -9.520 -2.992 -9.653 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.513 -3.138 -11.090 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -10.290 -0.699 -9.318 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -9.509 -0.918 -10.872 1.00 0.00 H new ATOM 0 HE ARG A 16 -12.468 -1.027 -10.870 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -9.449 0.485 -11.851 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -10.227 1.853 -12.653 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -13.502 0.831 -11.830 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -12.509 2.048 -12.639 1.00 0.00 H new ATOM 285 N LYS A 17 -12.584 -4.044 -6.268 1.00 0.00 N ATOM 286 CA LYS A 17 -13.578 -4.831 -5.538 1.00 0.00 C ATOM 287 C LYS A 17 -14.030 -4.162 -4.246 1.00 0.00 C ATOM 288 O LYS A 17 -14.898 -4.685 -3.534 1.00 0.00 O ATOM 289 CB LYS A 17 -13.084 -6.293 -5.320 1.00 0.00 C ATOM 290 CG LYS A 17 -11.683 -6.424 -4.717 1.00 0.00 C ATOM 291 CD LYS A 17 -11.627 -6.255 -3.198 1.00 0.00 C ATOM 292 CE LYS A 17 -11.949 -7.546 -2.470 1.00 0.00 C ATOM 293 NZ LYS A 17 -11.031 -8.643 -2.865 1.00 0.00 N ATOM 0 H LYS A 17 -11.616 -4.259 -6.029 1.00 0.00 H new ATOM 0 HA LYS A 17 -14.471 -4.881 -6.162 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -13.792 -6.806 -4.669 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -13.100 -6.812 -6.279 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.280 -7.403 -4.976 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -11.032 -5.680 -5.177 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.633 -5.913 -2.908 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.332 -5.481 -2.893 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -11.881 -7.384 -1.394 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -12.977 -7.837 -2.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -10.725 -9.162 -2.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -11.524 -9.293 -3.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -10.199 -8.244 -3.345 1.00 0.00 H new ATOM 307 N LEU A 18 -13.464 -3.019 -3.946 1.00 0.00 N ATOM 308 CA LEU A 18 -13.839 -2.283 -2.759 1.00 0.00 C ATOM 309 C LEU A 18 -14.513 -0.958 -3.121 1.00 0.00 C ATOM 310 O LEU A 18 -14.505 -0.556 -4.290 1.00 0.00 O ATOM 311 CB LEU A 18 -12.643 -2.128 -1.780 1.00 0.00 C ATOM 312 CG LEU A 18 -11.341 -1.504 -2.319 1.00 0.00 C ATOM 313 CD1 LEU A 18 -11.436 0.002 -2.493 1.00 0.00 C ATOM 314 CD2 LEU A 18 -10.171 -1.866 -1.436 1.00 0.00 C ATOM 0 H LEU A 18 -12.739 -2.575 -4.509 1.00 0.00 H new ATOM 0 HA LEU A 18 -14.586 -2.863 -2.217 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.978 -1.524 -0.937 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -12.402 -3.116 -1.388 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.181 -1.924 -3.312 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.490 0.385 -2.875 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.233 0.237 -3.198 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.653 0.466 -1.531 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.262 -1.416 -1.834 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -10.348 -1.494 -0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -10.057 -2.950 -1.409 1.00 0.00 H new ATOM 326 N GLY A 19 -15.096 -0.309 -2.128 1.00 0.00 N ATOM 327 CA GLY A 19 -15.827 0.936 -2.322 1.00 0.00 C ATOM 328 C GLY A 19 -15.029 2.052 -2.980 1.00 0.00 C ATOM 329 O GLY A 19 -13.849 2.264 -2.664 1.00 0.00 O ATOM 0 H GLY A 19 -15.077 -0.630 -1.160 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.708 0.732 -2.930 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.183 1.286 -1.353 1.00 0.00 H new ATOM 333 N SER A 20 -15.688 2.775 -3.867 1.00 0.00 N ATOM 334 CA SER A 20 -15.092 3.857 -4.632 1.00 0.00 C ATOM 335 C SER A 20 -14.488 4.955 -3.735 1.00 0.00 C ATOM 336 O SER A 20 -13.381 5.430 -3.993 1.00 0.00 O ATOM 337 CB SER A 20 -16.144 4.442 -5.573 1.00 0.00 C ATOM 338 OG SER A 20 -16.713 3.413 -6.375 1.00 0.00 O ATOM 0 H SER A 20 -16.674 2.624 -4.081 1.00 0.00 H new ATOM 0 HA SER A 20 -14.264 3.446 -5.209 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.925 4.936 -4.995 1.00 0.00 H new ATOM 0 HB3 SER A 20 -15.690 5.201 -6.210 1.00 0.00 H new ATOM 0 HG SER A 20 -17.387 3.799 -6.973 1.00 0.00 H new ATOM 344 N THR A 21 -15.176 5.311 -2.666 1.00 0.00 N ATOM 345 CA THR A 21 -14.707 6.361 -1.783 1.00 0.00 C ATOM 346 C THR A 21 -13.556 5.833 -0.915 1.00 0.00 C ATOM 347 O THR A 21 -12.674 6.580 -0.477 1.00 0.00 O ATOM 348 CB THR A 21 -15.863 6.866 -0.898 1.00 0.00 C ATOM 349 OG1 THR A 21 -17.029 7.069 -1.727 1.00 0.00 O ATOM 350 CG2 THR A 21 -15.497 8.187 -0.239 1.00 0.00 C ATOM 0 H THR A 21 -16.062 4.888 -2.389 1.00 0.00 H new ATOM 0 HA THR A 21 -14.342 7.196 -2.381 1.00 0.00 H new ATOM 0 HB THR A 21 -16.063 6.127 -0.122 1.00 0.00 H new ATOM 0 HG1 THR A 21 -17.772 7.389 -1.174 1.00 0.00 H new ATOM 0 HG21 THR A 21 -16.327 8.526 0.381 1.00 0.00 H new ATOM 0 HG22 THR A 21 -14.612 8.051 0.382 1.00 0.00 H new ATOM 0 HG23 THR A 21 -15.290 8.932 -1.007 1.00 0.00 H new ATOM 358 N VAL A 22 -13.550 4.531 -0.720 1.00 0.00 N ATOM 359 CA VAL A 22 -12.525 3.874 0.047 1.00 0.00 C ATOM 360 C VAL A 22 -11.183 3.971 -0.683 1.00 0.00 C ATOM 361 O VAL A 22 -10.163 4.313 -0.074 1.00 0.00 O ATOM 362 CB VAL A 22 -12.888 2.386 0.325 1.00 0.00 C ATOM 363 CG1 VAL A 22 -11.773 1.683 1.064 1.00 0.00 C ATOM 364 CG2 VAL A 22 -14.185 2.291 1.122 1.00 0.00 C ATOM 0 H VAL A 22 -14.260 3.901 -1.092 1.00 0.00 H new ATOM 0 HA VAL A 22 -12.445 4.379 1.010 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.027 1.892 -0.636 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.054 0.645 1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -10.863 1.713 0.464 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.596 2.182 2.017 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.423 1.243 1.307 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.066 2.809 2.073 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.994 2.752 0.556 1.00 0.00 H new ATOM 374 N ARG A 23 -11.203 3.736 -1.996 1.00 0.00 N ATOM 375 CA ARG A 23 -9.974 3.771 -2.776 1.00 0.00 C ATOM 376 C ARG A 23 -9.420 5.207 -2.847 1.00 0.00 C ATOM 377 O ARG A 23 -8.219 5.402 -2.866 1.00 0.00 O ATOM 378 CB ARG A 23 -10.158 3.202 -4.213 1.00 0.00 C ATOM 379 CG ARG A 23 -10.755 4.181 -5.200 1.00 0.00 C ATOM 380 CD ARG A 23 -10.810 3.654 -6.618 1.00 0.00 C ATOM 381 NE ARG A 23 -10.869 4.778 -7.558 1.00 0.00 N ATOM 382 CZ ARG A 23 -11.204 4.723 -8.848 1.00 0.00 C ATOM 383 NH1 ARG A 23 -11.611 3.583 -9.403 1.00 0.00 N ATOM 384 NH2 ARG A 23 -11.148 5.823 -9.574 1.00 0.00 N ATOM 0 H ARG A 23 -12.045 3.523 -2.531 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.260 3.128 -2.262 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -9.189 2.873 -4.587 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -10.797 2.320 -4.163 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -11.764 4.439 -4.878 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.170 5.101 -5.185 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -9.933 3.041 -6.823 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.683 3.014 -6.745 1.00 0.00 H new ATOM 0 HE ARG A 23 -10.629 5.697 -7.187 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -11.670 2.734 -8.840 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -11.863 3.558 -10.391 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -10.851 6.701 -9.148 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -11.401 5.796 -10.562 1.00 0.00 H new ATOM 398 N GLU A 24 -10.311 6.208 -2.853 1.00 0.00 N ATOM 399 CA GLU A 24 -9.892 7.605 -2.961 1.00 0.00 C ATOM 400 C GLU A 24 -9.198 8.067 -1.693 1.00 0.00 C ATOM 401 O GLU A 24 -8.266 8.879 -1.747 1.00 0.00 O ATOM 402 CB GLU A 24 -11.063 8.522 -3.300 1.00 0.00 C ATOM 403 CG GLU A 24 -11.757 8.191 -4.612 1.00 0.00 C ATOM 404 CD GLU A 24 -10.842 8.241 -5.829 1.00 0.00 C ATOM 405 OE1 GLU A 24 -10.376 9.337 -6.211 1.00 0.00 O ATOM 406 OE2 GLU A 24 -10.585 7.191 -6.438 1.00 0.00 O ATOM 0 H GLU A 24 -11.320 6.074 -2.785 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.178 7.664 -3.783 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.794 8.472 -2.493 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.704 9.550 -3.342 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.193 7.195 -4.539 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.581 8.889 -4.761 1.00 0.00 H new ATOM 413 N GLN A 25 -9.646 7.551 -0.556 1.00 0.00 N ATOM 414 CA GLN A 25 -8.996 7.841 0.715 1.00 0.00 C ATOM 415 C GLN A 25 -7.565 7.321 0.683 1.00 0.00 C ATOM 416 O GLN A 25 -6.618 8.039 1.033 1.00 0.00 O ATOM 417 CB GLN A 25 -9.744 7.206 1.882 1.00 0.00 C ATOM 418 CG GLN A 25 -11.122 7.774 2.153 1.00 0.00 C ATOM 419 CD GLN A 25 -11.779 7.095 3.337 1.00 0.00 C ATOM 420 OE1 GLN A 25 -11.618 7.506 4.488 1.00 0.00 O ATOM 421 NE2 GLN A 25 -12.533 6.073 3.069 1.00 0.00 N ATOM 0 H GLN A 25 -10.454 6.932 -0.488 1.00 0.00 H new ATOM 0 HA GLN A 25 -8.999 8.921 0.860 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -9.841 6.137 1.692 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -9.140 7.316 2.783 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -11.045 8.845 2.343 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -11.748 7.652 1.269 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -12.644 5.760 2.105 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -13.015 5.583 3.823 1.00 0.00 H new ATOM 430 N LEU A 26 -7.417 6.088 0.210 1.00 0.00 N ATOM 431 CA LEU A 26 -6.115 5.441 0.091 1.00 0.00 C ATOM 432 C LEU A 26 -5.199 6.245 -0.826 1.00 0.00 C ATOM 433 O LEU A 26 -4.045 6.459 -0.508 1.00 0.00 O ATOM 434 CB LEU A 26 -6.273 4.010 -0.438 1.00 0.00 C ATOM 435 CG LEU A 26 -7.083 3.046 0.444 1.00 0.00 C ATOM 436 CD1 LEU A 26 -7.247 1.702 -0.244 1.00 0.00 C ATOM 437 CD2 LEU A 26 -6.415 2.865 1.803 1.00 0.00 C ATOM 0 H LEU A 26 -8.197 5.509 -0.102 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.662 5.398 1.082 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.747 4.058 -1.418 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.279 3.587 -0.585 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.071 3.480 0.600 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -7.823 1.034 0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.771 1.839 -1.190 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.265 1.267 -0.432 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.006 2.179 2.410 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.414 2.457 1.665 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.348 3.829 2.307 1.00 0.00 H new ATOM 449 N LYS A 27 -5.761 6.733 -1.928 1.00 0.00 N ATOM 450 CA LYS A 27 -5.038 7.545 -2.907 1.00 0.00 C ATOM 451 C LYS A 27 -4.455 8.813 -2.287 1.00 0.00 C ATOM 452 O LYS A 27 -3.337 9.206 -2.599 1.00 0.00 O ATOM 453 CB LYS A 27 -5.951 7.914 -4.089 1.00 0.00 C ATOM 454 CG LYS A 27 -6.258 6.759 -5.041 1.00 0.00 C ATOM 455 CD LYS A 27 -7.354 7.116 -6.054 1.00 0.00 C ATOM 456 CE LYS A 27 -7.051 8.394 -6.829 1.00 0.00 C ATOM 457 NZ LYS A 27 -8.146 8.756 -7.758 1.00 0.00 N ATOM 0 H LYS A 27 -6.739 6.576 -2.170 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.207 6.939 -3.268 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -6.890 8.304 -3.697 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.483 8.719 -4.655 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.350 6.480 -5.575 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.569 5.888 -4.464 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.476 6.291 -6.756 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.303 7.231 -5.530 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -6.886 9.212 -6.128 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.126 8.265 -7.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.850 9.560 -8.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -8.367 7.943 -8.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.991 9.020 -7.212 1.00 0.00 H new ATOM 471 N LYS A 28 -5.183 9.436 -1.392 1.00 0.00 N ATOM 472 CA LYS A 28 -4.691 10.655 -0.767 1.00 0.00 C ATOM 473 C LYS A 28 -3.672 10.382 0.305 1.00 0.00 C ATOM 474 O LYS A 28 -2.777 11.209 0.570 1.00 0.00 O ATOM 475 CB LYS A 28 -5.807 11.615 -0.331 1.00 0.00 C ATOM 476 CG LYS A 28 -6.285 12.507 -1.475 1.00 0.00 C ATOM 477 CD LYS A 28 -6.865 11.710 -2.634 1.00 0.00 C ATOM 478 CE LYS A 28 -6.850 12.502 -3.923 1.00 0.00 C ATOM 479 NZ LYS A 28 -7.600 13.778 -3.824 1.00 0.00 N ATOM 0 H LYS A 28 -6.105 9.131 -1.079 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.158 11.197 -1.548 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.649 11.039 0.054 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.447 12.239 0.487 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.040 13.199 -1.101 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -5.451 13.109 -1.834 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -6.294 10.791 -2.765 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.888 11.418 -2.398 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.818 12.714 -4.202 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -7.278 11.896 -4.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -7.687 14.204 -4.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -8.548 13.594 -3.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -7.092 14.432 -3.195 1.00 0.00 H new ATOM 493 N LYS A 29 -3.745 9.213 0.879 1.00 0.00 N ATOM 494 CA LYS A 29 -2.739 8.804 1.815 1.00 0.00 C ATOM 495 C LYS A 29 -1.482 8.409 1.043 1.00 0.00 C ATOM 496 O LYS A 29 -0.382 8.383 1.586 1.00 0.00 O ATOM 497 CB LYS A 29 -3.230 7.656 2.717 1.00 0.00 C ATOM 498 CG LYS A 29 -4.454 7.998 3.590 1.00 0.00 C ATOM 499 CD LYS A 29 -4.223 9.241 4.465 1.00 0.00 C ATOM 500 CE LYS A 29 -3.074 9.063 5.456 1.00 0.00 C ATOM 501 NZ LYS A 29 -3.386 8.105 6.542 1.00 0.00 N ATOM 0 H LYS A 29 -4.486 8.532 0.716 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.510 9.637 2.479 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.477 6.800 2.089 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.412 7.349 3.368 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.319 8.165 2.948 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -4.690 7.147 4.228 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.014 10.097 3.824 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.137 9.469 5.013 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.190 8.719 4.920 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -2.826 10.030 5.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -2.542 7.962 7.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.158 8.483 7.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -3.678 7.196 6.130 1.00 0.00 H new ATOM 515 N LEU A 30 -1.653 8.157 -0.245 1.00 0.00 N ATOM 516 CA LEU A 30 -0.553 7.796 -1.094 1.00 0.00 C ATOM 517 C LEU A 30 0.169 9.017 -1.590 1.00 0.00 C ATOM 518 O LEU A 30 1.363 8.997 -1.696 1.00 0.00 O ATOM 519 CB LEU A 30 -0.984 6.915 -2.273 1.00 0.00 C ATOM 520 CG LEU A 30 -1.458 5.500 -1.935 1.00 0.00 C ATOM 521 CD1 LEU A 30 -1.904 4.777 -3.194 1.00 0.00 C ATOM 522 CD2 LEU A 30 -0.353 4.714 -1.240 1.00 0.00 C ATOM 0 H LEU A 30 -2.555 8.199 -0.719 1.00 0.00 H new ATOM 0 HA LEU A 30 0.130 7.206 -0.483 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -1.788 7.426 -2.804 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.145 6.837 -2.964 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.307 5.577 -1.255 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.238 3.772 -2.937 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.725 5.325 -3.657 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.070 4.714 -3.893 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.711 3.711 -1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.514 4.647 -1.897 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.071 5.221 -0.317 1.00 0.00 H new ATOM 534 N VAL A 31 -0.555 10.104 -1.858 1.00 0.00 N ATOM 535 CA VAL A 31 0.095 11.322 -2.353 1.00 0.00 C ATOM 536 C VAL A 31 1.075 11.880 -1.317 1.00 0.00 C ATOM 537 O VAL A 31 2.143 12.387 -1.671 1.00 0.00 O ATOM 538 CB VAL A 31 -0.910 12.427 -2.862 1.00 0.00 C ATOM 539 CG1 VAL A 31 -1.789 12.970 -1.760 1.00 0.00 C ATOM 540 CG2 VAL A 31 -0.171 13.563 -3.560 1.00 0.00 C ATOM 0 H VAL A 31 -1.567 10.169 -1.745 1.00 0.00 H new ATOM 0 HA VAL A 31 0.658 11.023 -3.237 1.00 0.00 H new ATOM 0 HB VAL A 31 -1.565 11.937 -3.583 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.459 13.726 -2.169 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.376 12.159 -1.330 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.166 13.418 -0.985 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.889 14.309 -3.900 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.529 14.024 -2.863 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.376 13.169 -4.417 1.00 0.00 H new ATOM 550 N GLU A 32 0.742 11.727 -0.037 1.00 0.00 N ATOM 551 CA GLU A 32 1.644 12.176 1.005 1.00 0.00 C ATOM 552 C GLU A 32 2.877 11.260 1.142 1.00 0.00 C ATOM 553 O GLU A 32 3.982 11.738 1.396 1.00 0.00 O ATOM 554 CB GLU A 32 0.927 12.388 2.343 1.00 0.00 C ATOM 555 CG GLU A 32 0.099 11.214 2.809 1.00 0.00 C ATOM 556 CD GLU A 32 -0.471 11.417 4.184 1.00 0.00 C ATOM 557 OE1 GLU A 32 -1.301 12.323 4.379 1.00 0.00 O ATOM 558 OE2 GLU A 32 -0.116 10.645 5.096 1.00 0.00 O ATOM 0 H GLU A 32 -0.126 11.305 0.292 1.00 0.00 H new ATOM 0 HA GLU A 32 2.015 13.153 0.695 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.671 12.616 3.106 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.280 13.261 2.258 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.715 11.046 2.104 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.715 10.315 2.805 1.00 0.00 H new ATOM 565 N VAL A 33 2.713 9.947 0.925 1.00 0.00 N ATOM 566 CA VAL A 33 3.877 9.051 1.032 1.00 0.00 C ATOM 567 C VAL A 33 4.759 9.203 -0.178 1.00 0.00 C ATOM 568 O VAL A 33 5.946 9.023 -0.110 1.00 0.00 O ATOM 569 CB VAL A 33 3.521 7.549 1.232 1.00 0.00 C ATOM 570 CG1 VAL A 33 2.487 7.415 2.254 1.00 0.00 C ATOM 571 CG2 VAL A 33 3.108 6.847 -0.041 1.00 0.00 C ATOM 0 H VAL A 33 1.830 9.496 0.685 1.00 0.00 H new ATOM 0 HA VAL A 33 4.401 9.360 1.937 1.00 0.00 H new ATOM 0 HB VAL A 33 4.434 7.053 1.561 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.243 6.361 2.389 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.851 7.826 3.196 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.594 7.957 1.942 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.875 5.805 0.177 1.00 0.00 H new ATOM 0 HG22 VAL A 33 2.227 7.336 -0.457 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.923 6.893 -0.763 1.00 0.00 H new ATOM 581 N LEU A 34 4.171 9.602 -1.272 1.00 0.00 N ATOM 582 CA LEU A 34 4.921 9.778 -2.505 1.00 0.00 C ATOM 583 C LEU A 34 5.891 10.961 -2.400 1.00 0.00 C ATOM 584 O LEU A 34 6.740 11.170 -3.269 1.00 0.00 O ATOM 585 CB LEU A 34 4.011 9.906 -3.746 1.00 0.00 C ATOM 586 CG LEU A 34 3.179 8.670 -4.134 1.00 0.00 C ATOM 587 CD1 LEU A 34 2.323 8.961 -5.341 1.00 0.00 C ATOM 588 CD2 LEU A 34 4.069 7.490 -4.430 1.00 0.00 C ATOM 0 H LEU A 34 3.176 9.814 -1.345 1.00 0.00 H new ATOM 0 HA LEU A 34 5.507 8.869 -2.645 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.325 10.737 -3.579 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.636 10.175 -4.598 1.00 0.00 H new ATOM 0 HG LEU A 34 2.538 8.428 -3.286 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.743 8.074 -5.598 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.646 9.785 -5.117 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.961 9.234 -6.182 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.456 6.631 -4.701 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.736 7.735 -5.257 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.660 7.249 -3.546 1.00 0.00 H new ATOM 600 N GLU A 35 5.731 11.724 -1.346 1.00 0.00 N ATOM 601 CA GLU A 35 6.598 12.813 -1.021 1.00 0.00 C ATOM 602 C GLU A 35 7.671 12.291 -0.042 1.00 0.00 C ATOM 603 O GLU A 35 8.882 12.436 -0.267 1.00 0.00 O ATOM 604 CB GLU A 35 5.761 13.907 -0.360 1.00 0.00 C ATOM 605 CG GLU A 35 6.486 15.201 -0.100 1.00 0.00 C ATOM 606 CD GLU A 35 6.921 15.879 -1.359 1.00 0.00 C ATOM 607 OE1 GLU A 35 6.066 16.260 -2.173 1.00 0.00 O ATOM 608 OE2 GLU A 35 8.120 16.110 -1.537 1.00 0.00 O ATOM 0 H GLU A 35 4.972 11.595 -0.677 1.00 0.00 H new ATOM 0 HA GLU A 35 7.083 13.219 -1.909 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.898 14.114 -0.993 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.378 13.527 0.587 1.00 0.00 H new ATOM 0 HG2 GLU A 35 5.836 15.871 0.463 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.359 15.005 0.523 1.00 0.00 H new ATOM 615 N SER A 36 7.200 11.623 0.997 1.00 0.00 N ATOM 616 CA SER A 36 8.026 11.071 2.060 1.00 0.00 C ATOM 617 C SER A 36 7.355 9.778 2.556 1.00 0.00 C ATOM 618 O SER A 36 6.404 9.822 3.342 1.00 0.00 O ATOM 619 CB SER A 36 8.175 12.085 3.219 1.00 0.00 C ATOM 620 OG SER A 36 8.792 13.303 2.791 1.00 0.00 O ATOM 0 H SER A 36 6.205 11.444 1.129 1.00 0.00 H new ATOM 0 HA SER A 36 9.026 10.857 1.684 1.00 0.00 H new ATOM 0 HB2 SER A 36 7.193 12.304 3.637 1.00 0.00 H new ATOM 0 HB3 SER A 36 8.769 11.639 4.017 1.00 0.00 H new ATOM 0 HG SER A 36 8.866 13.917 3.551 1.00 0.00 H new ATOM 626 N PRO A 37 7.791 8.616 2.041 1.00 0.00 N ATOM 627 CA PRO A 37 7.133 7.339 2.306 1.00 0.00 C ATOM 628 C PRO A 37 7.632 6.584 3.521 1.00 0.00 C ATOM 629 O PRO A 37 7.064 5.555 3.879 1.00 0.00 O ATOM 630 CB PRO A 37 7.441 6.553 1.045 1.00 0.00 C ATOM 631 CG PRO A 37 8.808 7.009 0.665 1.00 0.00 C ATOM 632 CD PRO A 37 8.909 8.457 1.090 1.00 0.00 C ATOM 0 HA PRO A 37 6.078 7.492 2.532 1.00 0.00 H new ATOM 0 HB2 PRO A 37 7.414 5.479 1.227 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.717 6.761 0.257 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.570 6.405 1.158 1.00 0.00 H new ATOM 0 HG3 PRO A 37 8.967 6.907 -0.409 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.869 8.671 1.560 1.00 0.00 H new ATOM 0 HD3 PRO A 37 8.812 9.132 0.240 1.00 0.00 H new ATOM 640 N ARG A 38 8.654 7.068 4.158 1.00 0.00 N ATOM 641 CA ARG A 38 9.203 6.341 5.274 1.00 0.00 C ATOM 642 C ARG A 38 8.521 6.784 6.531 1.00 0.00 C ATOM 643 O ARG A 38 8.991 7.677 7.227 1.00 0.00 O ATOM 644 CB ARG A 38 10.712 6.519 5.383 1.00 0.00 C ATOM 645 CG ARG A 38 11.472 6.109 4.141 1.00 0.00 C ATOM 646 CD ARG A 38 12.944 6.370 4.316 1.00 0.00 C ATOM 647 NE ARG A 38 13.709 6.086 3.109 1.00 0.00 N ATOM 648 CZ ARG A 38 14.897 6.622 2.839 1.00 0.00 C ATOM 649 NH1 ARG A 38 15.484 7.420 3.730 1.00 0.00 N ATOM 650 NH2 ARG A 38 15.499 6.351 1.692 1.00 0.00 N ATOM 0 H ARG A 38 9.122 7.946 3.934 1.00 0.00 H new ATOM 0 HA ARG A 38 9.025 5.277 5.116 1.00 0.00 H new ATOM 0 HB2 ARG A 38 10.929 7.565 5.601 1.00 0.00 H new ATOM 0 HB3 ARG A 38 11.076 5.935 6.228 1.00 0.00 H new ATOM 0 HG2 ARG A 38 11.305 5.051 3.938 1.00 0.00 H new ATOM 0 HG3 ARG A 38 11.098 6.662 3.279 1.00 0.00 H new ATOM 0 HD2 ARG A 38 13.094 7.412 4.600 1.00 0.00 H new ATOM 0 HD3 ARG A 38 13.323 5.759 5.135 1.00 0.00 H new ATOM 0 HE ARG A 38 13.310 5.437 2.430 1.00 0.00 H new ATOM 0 HH11 ARG A 38 15.023 7.619 4.618 1.00 0.00 H new ATOM 0 HH12 ARG A 38 16.394 7.831 3.524 1.00 0.00 H new ATOM 0 HH21 ARG A 38 15.053 5.732 1.016 1.00 0.00 H new ATOM 0 HH22 ARG A 38 16.409 6.761 1.484 1.00 0.00 H new ATOM 664 N ILE A 39 7.373 6.228 6.779 1.00 0.00 N ATOM 665 CA ILE A 39 6.622 6.590 7.927 1.00 0.00 C ATOM 666 C ILE A 39 6.800 5.497 8.946 1.00 0.00 C ATOM 667 O ILE A 39 6.010 4.565 9.020 1.00 0.00 O ATOM 668 CB ILE A 39 5.119 6.806 7.606 1.00 0.00 C ATOM 669 CG1 ILE A 39 4.974 7.725 6.365 1.00 0.00 C ATOM 670 CG2 ILE A 39 4.423 7.433 8.818 1.00 0.00 C ATOM 671 CD1 ILE A 39 3.550 7.989 5.940 1.00 0.00 C ATOM 0 H ILE A 39 6.939 5.516 6.191 1.00 0.00 H new ATOM 0 HA ILE A 39 6.985 7.543 8.311 1.00 0.00 H new ATOM 0 HB ILE A 39 4.651 5.846 7.386 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.458 8.678 6.577 1.00 0.00 H new ATOM 0 HG13 ILE A 39 5.510 7.273 5.530 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.367 7.585 8.593 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.519 6.769 9.677 1.00 0.00 H new ATOM 0 HG23 ILE A 39 4.887 8.392 9.048 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.546 8.640 5.066 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.063 7.046 5.692 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.011 8.472 6.755 1.00 0.00 H new ATOM 683 N GLU A 40 7.885 5.603 9.676 1.00 0.00 N ATOM 684 CA GLU A 40 8.341 4.605 10.652 1.00 0.00 C ATOM 685 C GLU A 40 7.271 4.258 11.698 1.00 0.00 C ATOM 686 O GLU A 40 7.233 3.144 12.214 1.00 0.00 O ATOM 687 CB GLU A 40 9.677 5.045 11.313 1.00 0.00 C ATOM 688 CG GLU A 40 9.619 6.301 12.198 1.00 0.00 C ATOM 689 CD GLU A 40 9.066 7.521 11.504 1.00 0.00 C ATOM 690 OE1 GLU A 40 9.761 8.118 10.661 1.00 0.00 O ATOM 691 OE2 GLU A 40 7.907 7.878 11.765 1.00 0.00 O ATOM 0 H GLU A 40 8.506 6.410 9.615 1.00 0.00 H new ATOM 0 HA GLU A 40 8.525 3.684 10.100 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.048 4.218 11.918 1.00 0.00 H new ATOM 0 HB3 GLU A 40 10.409 5.216 10.524 1.00 0.00 H new ATOM 0 HG2 GLU A 40 9.007 6.087 13.074 1.00 0.00 H new ATOM 0 HG3 GLU A 40 10.623 6.525 12.558 1.00 0.00 H new ATOM 698 N ALA A 41 6.399 5.204 11.987 1.00 0.00 N ATOM 699 CA ALA A 41 5.275 4.967 12.887 1.00 0.00 C ATOM 700 C ALA A 41 4.355 3.859 12.334 1.00 0.00 C ATOM 701 O ALA A 41 3.848 3.020 13.072 1.00 0.00 O ATOM 702 CB ALA A 41 4.489 6.254 13.091 1.00 0.00 C ATOM 0 H ALA A 41 6.444 6.151 11.612 1.00 0.00 H new ATOM 0 HA ALA A 41 5.667 4.636 13.849 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.652 6.067 13.764 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.140 7.013 13.524 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.111 6.605 12.131 1.00 0.00 H new ATOM 708 N ASN A 42 4.216 3.828 11.023 1.00 0.00 N ATOM 709 CA ASN A 42 3.344 2.883 10.341 1.00 0.00 C ATOM 710 C ASN A 42 4.101 1.666 9.846 1.00 0.00 C ATOM 711 O ASN A 42 3.576 0.924 9.033 1.00 0.00 O ATOM 712 CB ASN A 42 2.673 3.565 9.143 1.00 0.00 C ATOM 713 CG ASN A 42 1.647 4.603 9.529 1.00 0.00 C ATOM 714 OD1 ASN A 42 0.951 4.472 10.533 1.00 0.00 O ATOM 715 ND2 ASN A 42 1.567 5.648 8.761 1.00 0.00 N ATOM 0 H ASN A 42 4.708 4.462 10.393 1.00 0.00 H new ATOM 0 HA ASN A 42 2.597 2.554 11.064 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.440 4.037 8.529 1.00 0.00 H new ATOM 0 HB3 ASN A 42 2.193 2.805 8.526 1.00 0.00 H new ATOM 0 HD21 ASN A 42 0.909 6.395 8.984 1.00 0.00 H new ATOM 0 HD22 ASN A 42 2.162 5.721 7.936 1.00 0.00 H new ATOM 722 N LYS A 43 5.322 1.458 10.328 1.00 0.00 N ATOM 723 CA LYS A 43 6.145 0.314 9.891 1.00 0.00 C ATOM 724 C LYS A 43 5.451 -1.020 10.162 1.00 0.00 C ATOM 725 O LYS A 43 4.666 -1.151 11.121 1.00 0.00 O ATOM 726 CB LYS A 43 7.518 0.310 10.579 1.00 0.00 C ATOM 727 CG LYS A 43 7.469 -0.041 12.069 1.00 0.00 C ATOM 728 CD LYS A 43 8.848 -0.030 12.713 1.00 0.00 C ATOM 729 CE LYS A 43 9.815 -1.016 12.058 1.00 0.00 C ATOM 730 NZ LYS A 43 9.360 -2.431 12.135 1.00 0.00 N ATOM 0 H LYS A 43 5.771 2.059 11.019 1.00 0.00 H new ATOM 0 HA LYS A 43 6.283 0.431 8.816 1.00 0.00 H new ATOM 0 HB2 LYS A 43 8.166 -0.403 10.070 1.00 0.00 H new ATOM 0 HB3 LYS A 43 7.974 1.293 10.463 1.00 0.00 H new ATOM 0 HG2 LYS A 43 6.824 0.669 12.586 1.00 0.00 H new ATOM 0 HG3 LYS A 43 7.021 -1.027 12.193 1.00 0.00 H new ATOM 0 HD2 LYS A 43 9.265 0.975 12.652 1.00 0.00 H new ATOM 0 HD3 LYS A 43 8.752 -0.271 13.772 1.00 0.00 H new ATOM 0 HE2 LYS A 43 9.948 -0.742 11.012 1.00 0.00 H new ATOM 0 HE3 LYS A 43 10.790 -0.929 12.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 10.117 -3.058 11.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 9.129 -2.668 13.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 8.515 -2.557 11.541 1.00 0.00 H new ATOM 744 N LEU A 44 5.738 -1.988 9.322 1.00 0.00 N ATOM 745 CA LEU A 44 5.214 -3.320 9.472 1.00 0.00 C ATOM 746 C LEU A 44 6.084 -4.077 10.481 1.00 0.00 C ATOM 747 O LEU A 44 7.190 -3.621 10.829 1.00 0.00 O ATOM 748 CB LEU A 44 5.171 -4.022 8.089 1.00 0.00 C ATOM 749 CG LEU A 44 4.526 -5.420 8.005 1.00 0.00 C ATOM 750 CD1 LEU A 44 3.091 -5.392 8.488 1.00 0.00 C ATOM 751 CD2 LEU A 44 4.567 -5.935 6.580 1.00 0.00 C ATOM 0 H LEU A 44 6.346 -1.869 8.511 1.00 0.00 H new ATOM 0 HA LEU A 44 4.193 -3.296 9.853 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.639 -3.367 7.399 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.195 -4.105 7.725 1.00 0.00 H new ATOM 0 HG LEU A 44 5.098 -6.087 8.650 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.663 -6.392 8.417 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.063 -5.058 9.525 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.512 -4.705 7.870 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.108 -6.923 6.537 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.020 -5.252 5.930 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.603 -6.001 6.247 1.00 0.00 H new ATOM 763 N ARG A 45 5.598 -5.187 10.956 1.00 0.00 N ATOM 764 CA ARG A 45 6.274 -5.958 11.969 1.00 0.00 C ATOM 765 C ARG A 45 6.995 -7.135 11.331 1.00 0.00 C ATOM 766 O ARG A 45 6.437 -8.213 11.194 1.00 0.00 O ATOM 767 CB ARG A 45 5.236 -6.443 12.972 1.00 0.00 C ATOM 768 CG ARG A 45 5.757 -7.115 14.208 1.00 0.00 C ATOM 769 CD ARG A 45 4.589 -7.567 15.068 1.00 0.00 C ATOM 770 NE ARG A 45 5.016 -8.071 16.370 1.00 0.00 N ATOM 771 CZ ARG A 45 4.202 -8.296 17.406 1.00 0.00 C ATOM 772 NH1 ARG A 45 2.874 -8.164 17.276 1.00 0.00 N ATOM 773 NH2 ARG A 45 4.713 -8.668 18.569 1.00 0.00 N ATOM 0 H ARG A 45 4.712 -5.590 10.650 1.00 0.00 H new ATOM 0 HA ARG A 45 7.018 -5.345 12.479 1.00 0.00 H new ATOM 0 HB2 ARG A 45 4.633 -5.588 13.278 1.00 0.00 H new ATOM 0 HB3 ARG A 45 4.569 -7.138 12.462 1.00 0.00 H new ATOM 0 HG2 ARG A 45 6.375 -7.971 13.937 1.00 0.00 H new ATOM 0 HG3 ARG A 45 6.391 -6.428 14.769 1.00 0.00 H new ATOM 0 HD2 ARG A 45 3.903 -6.732 15.212 1.00 0.00 H new ATOM 0 HD3 ARG A 45 4.036 -8.346 14.544 1.00 0.00 H new ATOM 0 HE ARG A 45 6.009 -8.266 16.499 1.00 0.00 H new ATOM 0 HH11 ARG A 45 2.474 -7.889 16.379 1.00 0.00 H new ATOM 0 HH12 ARG A 45 2.264 -8.339 18.074 1.00 0.00 H new ATOM 0 HH21 ARG A 45 5.722 -8.781 18.670 1.00 0.00 H new ATOM 0 HH22 ARG A 45 4.098 -8.841 19.364 1.00 0.00 H new ATOM 787 N GLY A 46 8.194 -6.897 10.870 1.00 0.00 N ATOM 788 CA GLY A 46 8.963 -7.947 10.248 1.00 0.00 C ATOM 789 C GLY A 46 9.606 -7.475 8.972 1.00 0.00 C ATOM 790 O GLY A 46 10.771 -7.757 8.711 1.00 0.00 O ATOM 0 H GLY A 46 8.660 -5.990 10.912 1.00 0.00 H new ATOM 0 HA2 GLY A 46 9.732 -8.294 10.938 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.316 -8.798 10.038 1.00 0.00 H new ATOM 794 N MET A 47 8.859 -6.726 8.192 1.00 0.00 N ATOM 795 CA MET A 47 9.366 -6.183 6.940 1.00 0.00 C ATOM 796 C MET A 47 9.614 -4.698 7.136 1.00 0.00 C ATOM 797 O MET A 47 8.666 -3.924 7.203 1.00 0.00 O ATOM 798 CB MET A 47 8.355 -6.348 5.801 1.00 0.00 C ATOM 799 CG MET A 47 7.871 -7.760 5.531 1.00 0.00 C ATOM 800 SD MET A 47 9.183 -8.908 5.083 1.00 0.00 S ATOM 801 CE MET A 47 8.194 -10.340 4.657 1.00 0.00 C ATOM 0 H MET A 47 7.892 -6.475 8.399 1.00 0.00 H new ATOM 0 HA MET A 47 10.277 -6.719 6.675 1.00 0.00 H new ATOM 0 HB2 MET A 47 7.488 -5.725 6.020 1.00 0.00 H new ATOM 0 HB3 MET A 47 8.803 -5.959 4.887 1.00 0.00 H new ATOM 0 HG2 MET A 47 7.361 -8.135 6.419 1.00 0.00 H new ATOM 0 HG3 MET A 47 7.135 -7.734 4.728 1.00 0.00 H new ATOM 0 HE1 MET A 47 8.656 -10.866 3.822 1.00 0.00 H new ATOM 0 HE2 MET A 47 8.132 -11.008 5.516 1.00 0.00 H new ATOM 0 HE3 MET A 47 7.192 -10.019 4.374 1.00 0.00 H new ATOM 811 N PRO A 48 10.878 -4.270 7.264 1.00 0.00 N ATOM 812 CA PRO A 48 11.211 -2.854 7.507 1.00 0.00 C ATOM 813 C PRO A 48 10.971 -1.968 6.282 1.00 0.00 C ATOM 814 O PRO A 48 10.930 -0.744 6.385 1.00 0.00 O ATOM 815 CB PRO A 48 12.699 -2.898 7.857 1.00 0.00 C ATOM 816 CG PRO A 48 13.217 -4.116 7.166 1.00 0.00 C ATOM 817 CD PRO A 48 12.095 -5.116 7.179 1.00 0.00 C ATOM 0 HA PRO A 48 10.586 -2.420 8.287 1.00 0.00 H new ATOM 0 HB2 PRO A 48 13.213 -2.000 7.514 1.00 0.00 H new ATOM 0 HB3 PRO A 48 12.850 -2.960 8.935 1.00 0.00 H new ATOM 0 HG2 PRO A 48 13.520 -3.885 6.145 1.00 0.00 H new ATOM 0 HG3 PRO A 48 14.095 -4.510 7.678 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.095 -5.731 6.279 1.00 0.00 H new ATOM 0 HD3 PRO A 48 12.172 -5.795 8.028 1.00 0.00 H new ATOM 825 N ASP A 49 10.793 -2.596 5.138 1.00 0.00 N ATOM 826 CA ASP A 49 10.589 -1.878 3.880 1.00 0.00 C ATOM 827 C ASP A 49 9.117 -1.656 3.629 1.00 0.00 C ATOM 828 O ASP A 49 8.744 -0.967 2.681 1.00 0.00 O ATOM 829 CB ASP A 49 11.152 -2.671 2.684 1.00 0.00 C ATOM 830 CG ASP A 49 12.625 -2.962 2.773 1.00 0.00 C ATOM 831 OD1 ASP A 49 13.005 -3.942 3.437 1.00 0.00 O ATOM 832 OD2 ASP A 49 13.438 -2.233 2.166 1.00 0.00 O ATOM 0 H ASP A 49 10.784 -3.612 5.045 1.00 0.00 H new ATOM 0 HA ASP A 49 11.111 -0.925 3.971 1.00 0.00 H new ATOM 0 HB2 ASP A 49 10.612 -3.614 2.601 1.00 0.00 H new ATOM 0 HB3 ASP A 49 10.959 -2.112 1.769 1.00 0.00 H new ATOM 837 N CYS A 50 8.281 -2.241 4.461 1.00 0.00 N ATOM 838 CA CYS A 50 6.855 -2.189 4.253 1.00 0.00 C ATOM 839 C CYS A 50 6.169 -1.447 5.385 1.00 0.00 C ATOM 840 O CYS A 50 6.611 -1.508 6.540 1.00 0.00 O ATOM 841 CB CYS A 50 6.299 -3.600 4.118 1.00 0.00 C ATOM 842 SG CYS A 50 7.117 -4.584 2.835 1.00 0.00 S ATOM 0 H CYS A 50 8.569 -2.760 5.291 1.00 0.00 H new ATOM 0 HA CYS A 50 6.657 -1.644 3.330 1.00 0.00 H new ATOM 0 HB2 CYS A 50 6.397 -4.113 5.075 1.00 0.00 H new ATOM 0 HB3 CYS A 50 5.234 -3.542 3.895 1.00 0.00 H new ATOM 0 HG CYS A 50 6.906 -5.847 3.057 1.00 0.00 H new ATOM 848 N TYR A 51 5.117 -0.739 5.049 1.00 0.00 N ATOM 849 CA TYR A 51 4.356 0.044 5.999 1.00 0.00 C ATOM 850 C TYR A 51 2.871 -0.185 5.713 1.00 0.00 C ATOM 851 O TYR A 51 2.517 -0.614 4.600 1.00 0.00 O ATOM 852 CB TYR A 51 4.697 1.543 5.843 1.00 0.00 C ATOM 853 CG TYR A 51 6.184 1.876 5.942 1.00 0.00 C ATOM 854 CD1 TYR A 51 7.007 1.830 4.824 1.00 0.00 C ATOM 855 CD2 TYR A 51 6.757 2.223 7.146 1.00 0.00 C ATOM 856 CE1 TYR A 51 8.353 2.119 4.914 1.00 0.00 C ATOM 857 CE2 TYR A 51 8.104 2.512 7.242 1.00 0.00 C ATOM 858 CZ TYR A 51 8.895 2.459 6.124 1.00 0.00 C ATOM 859 OH TYR A 51 10.240 2.743 6.221 1.00 0.00 O ATOM 0 H TYR A 51 4.759 -0.689 4.095 1.00 0.00 H new ATOM 0 HA TYR A 51 4.598 -0.258 7.018 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.326 1.887 4.878 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.162 2.104 6.609 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.585 1.563 3.866 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.141 2.270 8.032 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.977 2.077 4.033 1.00 0.00 H new ATOM 0 HE2 TYR A 51 8.533 2.779 8.196 1.00 0.00 H new ATOM 0 HH TYR A 51 10.461 2.967 7.149 1.00 0.00 H new ATOM 869 N LYS A 52 2.008 0.095 6.682 1.00 0.00 N ATOM 870 CA LYS A 52 0.580 -0.123 6.514 1.00 0.00 C ATOM 871 C LYS A 52 -0.122 1.166 6.784 1.00 0.00 C ATOM 872 O LYS A 52 0.118 1.805 7.812 1.00 0.00 O ATOM 873 CB LYS A 52 -0.054 -1.146 7.521 1.00 0.00 C ATOM 874 CG LYS A 52 0.768 -2.358 7.956 1.00 0.00 C ATOM 875 CD LYS A 52 1.884 -1.976 8.933 1.00 0.00 C ATOM 876 CE LYS A 52 1.375 -1.315 10.235 1.00 0.00 C ATOM 877 NZ LYS A 52 0.628 -2.239 11.117 1.00 0.00 N ATOM 0 H LYS A 52 2.274 0.473 7.591 1.00 0.00 H new ATOM 0 HA LYS A 52 0.464 -0.513 5.503 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.331 -0.595 8.420 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.978 -1.516 7.077 1.00 0.00 H new ATOM 0 HG2 LYS A 52 0.112 -3.091 8.425 1.00 0.00 H new ATOM 0 HG3 LYS A 52 1.203 -2.835 7.078 1.00 0.00 H new ATOM 0 HD2 LYS A 52 2.452 -2.870 9.189 1.00 0.00 H new ATOM 0 HD3 LYS A 52 2.572 -1.293 8.435 1.00 0.00 H new ATOM 0 HE2 LYS A 52 2.226 -0.911 10.784 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.732 -0.473 9.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.807 -1.991 12.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.390 -2.161 10.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.941 -3.215 10.942 1.00 0.00 H new ATOM 891 N ILE A 53 -0.963 1.542 5.905 1.00 0.00 N ATOM 892 CA ILE A 53 -1.816 2.651 6.114 1.00 0.00 C ATOM 893 C ILE A 53 -3.196 2.072 6.289 1.00 0.00 C ATOM 894 O ILE A 53 -3.499 1.034 5.708 1.00 0.00 O ATOM 895 CB ILE A 53 -1.832 3.607 4.914 1.00 0.00 C ATOM 896 CG1 ILE A 53 -0.401 3.944 4.486 1.00 0.00 C ATOM 897 CG2 ILE A 53 -2.583 4.874 5.313 1.00 0.00 C ATOM 898 CD1 ILE A 53 -0.315 4.800 3.243 1.00 0.00 C ATOM 0 H ILE A 53 -1.084 1.083 5.002 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.474 3.227 6.974 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.333 3.134 4.069 1.00 0.00 H new ATOM 0 HG12 ILE A 53 0.100 4.460 5.305 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.144 3.016 4.313 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.604 5.565 4.470 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.604 4.618 5.597 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.079 5.345 6.157 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.731 4.994 3.006 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.785 4.279 2.409 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.829 5.745 3.416 1.00 0.00 H new ATOM 910 N LYS A 54 -4.002 2.689 7.078 1.00 0.00 N ATOM 911 CA LYS A 54 -5.309 2.198 7.337 1.00 0.00 C ATOM 912 C LYS A 54 -6.278 3.343 7.464 1.00 0.00 C ATOM 913 O LYS A 54 -5.891 4.470 7.787 1.00 0.00 O ATOM 914 CB LYS A 54 -5.273 1.313 8.581 1.00 0.00 C ATOM 915 CG LYS A 54 -4.612 1.986 9.765 1.00 0.00 C ATOM 916 CD LYS A 54 -4.224 0.996 10.842 1.00 0.00 C ATOM 917 CE LYS A 54 -5.425 0.272 11.446 1.00 0.00 C ATOM 918 NZ LYS A 54 -5.029 -0.635 12.546 1.00 0.00 N ATOM 0 H LYS A 54 -3.772 3.555 7.566 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.658 1.586 6.505 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -6.291 1.033 8.851 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -4.740 0.391 8.349 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -3.724 2.520 9.428 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.291 2.729 10.184 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -3.537 0.261 10.422 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.687 1.519 11.633 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -6.140 1.005 11.820 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.932 -0.300 10.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -5.852 -1.194 12.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -4.279 -1.275 12.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -4.677 -0.075 13.348 1.00 0.00 H new ATOM 932 N LEU A 55 -7.496 3.066 7.163 1.00 0.00 N ATOM 933 CA LEU A 55 -8.549 4.022 7.196 1.00 0.00 C ATOM 934 C LEU A 55 -9.277 3.871 8.506 1.00 0.00 C ATOM 935 O LEU A 55 -9.843 2.808 8.783 1.00 0.00 O ATOM 936 CB LEU A 55 -9.481 3.780 6.008 1.00 0.00 C ATOM 937 CG LEU A 55 -8.815 3.844 4.628 1.00 0.00 C ATOM 938 CD1 LEU A 55 -9.818 3.550 3.534 1.00 0.00 C ATOM 939 CD2 LEU A 55 -8.158 5.199 4.405 1.00 0.00 C ATOM 0 H LEU A 55 -7.800 2.135 6.877 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.164 5.039 7.120 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.944 2.800 6.124 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.283 4.517 6.041 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.038 3.080 4.593 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.324 3.601 2.564 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -10.232 2.552 3.678 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.622 4.285 3.570 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.693 5.220 3.420 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.912 5.984 4.467 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.398 5.365 5.169 1.00 0.00 H new ATOM 951 N ARG A 56 -9.257 4.935 9.285 1.00 0.00 N ATOM 952 CA ARG A 56 -9.765 4.959 10.663 1.00 0.00 C ATOM 953 C ARG A 56 -11.213 4.499 10.736 1.00 0.00 C ATOM 954 O ARG A 56 -11.562 3.632 11.535 1.00 0.00 O ATOM 955 CB ARG A 56 -9.672 6.384 11.232 1.00 0.00 C ATOM 956 CG ARG A 56 -8.304 7.046 11.091 1.00 0.00 C ATOM 957 CD ARG A 56 -7.205 6.315 11.847 1.00 0.00 C ATOM 958 NE ARG A 56 -7.364 6.376 13.309 1.00 0.00 N ATOM 959 CZ ARG A 56 -6.350 6.565 14.174 1.00 0.00 C ATOM 960 NH1 ARG A 56 -5.111 6.769 13.720 1.00 0.00 N ATOM 961 NH2 ARG A 56 -6.577 6.546 15.487 1.00 0.00 N ATOM 0 H ARG A 56 -8.881 5.833 8.980 1.00 0.00 H new ATOM 0 HA ARG A 56 -9.151 4.274 11.248 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.414 7.008 10.733 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.938 6.355 12.289 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -8.039 7.096 10.035 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -8.365 8.072 11.453 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.190 5.271 11.533 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.240 6.743 11.575 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.303 6.268 13.692 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -4.931 6.782 12.716 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.344 6.912 14.377 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -7.521 6.388 15.839 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -5.807 6.690 16.140 1.00 0.00 H new ATOM 975 N SER A 57 -12.031 5.059 9.891 1.00 0.00 N ATOM 976 CA SER A 57 -13.433 4.775 9.910 1.00 0.00 C ATOM 977 C SER A 57 -13.821 3.665 8.929 1.00 0.00 C ATOM 978 O SER A 57 -14.645 2.812 9.249 1.00 0.00 O ATOM 979 CB SER A 57 -14.201 6.065 9.631 1.00 0.00 C ATOM 980 OG SER A 57 -13.715 6.708 8.454 1.00 0.00 O ATOM 0 H SER A 57 -11.743 5.723 9.172 1.00 0.00 H new ATOM 0 HA SER A 57 -13.697 4.399 10.898 1.00 0.00 H new ATOM 0 HB2 SER A 57 -15.262 5.843 9.516 1.00 0.00 H new ATOM 0 HB3 SER A 57 -14.107 6.739 10.482 1.00 0.00 H new ATOM 0 HG SER A 57 -14.224 7.530 8.296 1.00 0.00 H new ATOM 986 N SER A 58 -13.209 3.660 7.753 1.00 0.00 N ATOM 987 CA SER A 58 -13.576 2.706 6.723 1.00 0.00 C ATOM 988 C SER A 58 -13.141 1.265 7.050 1.00 0.00 C ATOM 989 O SER A 58 -13.825 0.315 6.669 1.00 0.00 O ATOM 990 CB SER A 58 -13.029 3.156 5.384 1.00 0.00 C ATOM 991 OG SER A 58 -13.428 4.491 5.117 1.00 0.00 O ATOM 0 H SER A 58 -12.461 4.303 7.492 1.00 0.00 H new ATOM 0 HA SER A 58 -14.665 2.683 6.677 1.00 0.00 H new ATOM 0 HB2 SER A 58 -11.941 3.087 5.385 1.00 0.00 H new ATOM 0 HB3 SER A 58 -13.389 2.496 4.595 1.00 0.00 H new ATOM 0 HG SER A 58 -14.283 4.487 4.637 1.00 0.00 H new ATOM 997 N GLY A 59 -12.015 1.105 7.734 1.00 0.00 N ATOM 998 CA GLY A 59 -11.574 -0.230 8.124 1.00 0.00 C ATOM 999 C GLY A 59 -10.744 -0.944 7.069 1.00 0.00 C ATOM 1000 O GLY A 59 -10.320 -2.084 7.271 1.00 0.00 O ATOM 0 H GLY A 59 -11.401 1.865 8.026 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -10.989 -0.154 9.041 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.450 -0.837 8.354 1.00 0.00 H new ATOM 1004 N TYR A 60 -10.518 -0.296 5.953 1.00 0.00 N ATOM 1005 CA TYR A 60 -9.700 -0.868 4.891 1.00 0.00 C ATOM 1006 C TYR A 60 -8.272 -0.423 5.069 1.00 0.00 C ATOM 1007 O TYR A 60 -8.012 0.527 5.793 1.00 0.00 O ATOM 1008 CB TYR A 60 -10.223 -0.487 3.501 1.00 0.00 C ATOM 1009 CG TYR A 60 -11.523 -1.168 3.114 1.00 0.00 C ATOM 1010 CD1 TYR A 60 -12.742 -0.746 3.627 1.00 0.00 C ATOM 1011 CD2 TYR A 60 -11.522 -2.236 2.229 1.00 0.00 C ATOM 1012 CE1 TYR A 60 -13.917 -1.374 3.276 1.00 0.00 C ATOM 1013 CE2 TYR A 60 -12.693 -2.869 1.869 1.00 0.00 C ATOM 1014 CZ TYR A 60 -13.887 -2.436 2.395 1.00 0.00 C ATOM 1015 OH TYR A 60 -15.057 -3.080 2.055 1.00 0.00 O ATOM 0 H TYR A 60 -10.887 0.633 5.748 1.00 0.00 H new ATOM 0 HA TYR A 60 -9.753 -1.955 4.960 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.367 0.593 3.463 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.463 -0.733 2.760 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -12.770 0.088 4.312 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -10.586 -2.579 1.814 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -14.857 -1.037 3.688 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -12.672 -3.699 1.179 1.00 0.00 H new ATOM 0 HH TYR A 60 -14.861 -3.804 1.424 1.00 0.00 H new ATOM 1025 N ARG A 61 -7.361 -1.090 4.430 1.00 0.00 N ATOM 1026 CA ARG A 61 -5.967 -0.784 4.586 1.00 0.00 C ATOM 1027 C ARG A 61 -5.218 -0.992 3.283 1.00 0.00 C ATOM 1028 O ARG A 61 -5.765 -1.531 2.312 1.00 0.00 O ATOM 1029 CB ARG A 61 -5.361 -1.661 5.678 1.00 0.00 C ATOM 1030 CG ARG A 61 -5.506 -3.143 5.404 1.00 0.00 C ATOM 1031 CD ARG A 61 -4.834 -3.963 6.458 1.00 0.00 C ATOM 1032 NE ARG A 61 -5.401 -3.751 7.797 1.00 0.00 N ATOM 1033 CZ ARG A 61 -4.692 -3.531 8.895 1.00 0.00 C ATOM 1034 NH1 ARG A 61 -3.378 -3.318 8.811 1.00 0.00 N ATOM 1035 NH2 ARG A 61 -5.291 -3.504 10.073 1.00 0.00 N ATOM 0 H ARG A 61 -7.558 -1.858 3.788 1.00 0.00 H new ATOM 0 HA ARG A 61 -5.876 0.264 4.871 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -4.303 -1.420 5.783 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -5.838 -1.426 6.630 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -6.563 -3.404 5.358 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -5.077 -3.378 4.430 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -4.916 -5.018 6.197 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -3.771 -3.721 6.477 1.00 0.00 H new ATOM 0 HE ARG A 61 -6.417 -3.775 7.888 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -2.917 -3.324 7.901 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -2.834 -3.149 9.657 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -6.298 -3.652 10.137 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -4.746 -3.335 10.918 1.00 0.00 H new ATOM 1049 N LEU A 62 -3.978 -0.592 3.288 1.00 0.00 N ATOM 1050 CA LEU A 62 -3.103 -0.685 2.161 1.00 0.00 C ATOM 1051 C LEU A 62 -1.695 -0.928 2.693 1.00 0.00 C ATOM 1052 O LEU A 62 -1.316 -0.367 3.702 1.00 0.00 O ATOM 1053 CB LEU A 62 -3.223 0.629 1.339 1.00 0.00 C ATOM 1054 CG LEU A 62 -2.353 0.802 0.083 1.00 0.00 C ATOM 1055 CD1 LEU A 62 -2.987 1.836 -0.829 1.00 0.00 C ATOM 1056 CD2 LEU A 62 -0.947 1.275 0.449 1.00 0.00 C ATOM 0 H LEU A 62 -3.536 -0.178 4.108 1.00 0.00 H new ATOM 0 HA LEU A 62 -3.360 -1.508 1.494 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.265 0.734 1.035 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.002 1.459 2.010 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.283 -0.164 -0.418 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.372 1.961 -1.720 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -3.984 1.503 -1.119 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.061 2.788 -0.303 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.354 1.389 -0.458 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.008 2.233 0.965 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.475 0.541 1.102 1.00 0.00 H new ATOM 1068 N VAL A 63 -0.960 -1.786 2.051 1.00 0.00 N ATOM 1069 CA VAL A 63 0.396 -2.113 2.447 1.00 0.00 C ATOM 1070 C VAL A 63 1.292 -1.786 1.289 1.00 0.00 C ATOM 1071 O VAL A 63 1.013 -2.205 0.162 1.00 0.00 O ATOM 1072 CB VAL A 63 0.547 -3.627 2.764 1.00 0.00 C ATOM 1073 CG1 VAL A 63 1.950 -3.960 3.272 1.00 0.00 C ATOM 1074 CG2 VAL A 63 -0.500 -4.086 3.749 1.00 0.00 C ATOM 0 H VAL A 63 -1.281 -2.291 1.225 1.00 0.00 H new ATOM 0 HA VAL A 63 0.653 -1.548 3.343 1.00 0.00 H new ATOM 0 HB VAL A 63 0.395 -4.168 1.830 1.00 0.00 H new ATOM 0 HG11 VAL A 63 2.017 -5.027 3.483 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.685 -3.693 2.512 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.150 -3.397 4.184 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -0.368 -5.149 3.951 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -0.397 -3.525 4.678 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -1.492 -3.916 3.331 1.00 0.00 H new ATOM 1084 N TYR A 64 2.335 -1.052 1.533 1.00 0.00 N ATOM 1085 CA TYR A 64 3.235 -0.677 0.478 1.00 0.00 C ATOM 1086 C TYR A 64 4.663 -0.927 0.907 1.00 0.00 C ATOM 1087 O TYR A 64 4.946 -1.039 2.098 1.00 0.00 O ATOM 1088 CB TYR A 64 3.038 0.801 0.074 1.00 0.00 C ATOM 1089 CG TYR A 64 3.414 1.808 1.148 1.00 0.00 C ATOM 1090 CD1 TYR A 64 2.524 2.152 2.154 1.00 0.00 C ATOM 1091 CD2 TYR A 64 4.674 2.395 1.162 1.00 0.00 C ATOM 1092 CE1 TYR A 64 2.878 3.051 3.137 1.00 0.00 C ATOM 1093 CE2 TYR A 64 5.035 3.287 2.144 1.00 0.00 C ATOM 1094 CZ TYR A 64 4.132 3.612 3.132 1.00 0.00 C ATOM 1095 OH TYR A 64 4.487 4.495 4.129 1.00 0.00 O ATOM 0 H TYR A 64 2.587 -0.698 2.456 1.00 0.00 H new ATOM 0 HA TYR A 64 3.015 -1.290 -0.396 1.00 0.00 H new ATOM 0 HB2 TYR A 64 3.632 1.002 -0.817 1.00 0.00 H new ATOM 0 HB3 TYR A 64 1.993 0.953 -0.198 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.539 1.709 2.168 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.383 2.146 0.386 1.00 0.00 H new ATOM 0 HE1 TYR A 64 2.171 3.314 3.910 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.020 3.730 2.141 1.00 0.00 H new ATOM 0 HH TYR A 64 5.401 4.814 3.974 1.00 0.00 H new ATOM 1105 N GLN A 65 5.527 -1.010 -0.050 1.00 0.00 N ATOM 1106 CA GLN A 65 6.918 -1.212 0.165 1.00 0.00 C ATOM 1107 C GLN A 65 7.640 -0.037 -0.456 1.00 0.00 C ATOM 1108 O GLN A 65 7.257 0.430 -1.533 1.00 0.00 O ATOM 1109 CB GLN A 65 7.357 -2.502 -0.511 1.00 0.00 C ATOM 1110 CG GLN A 65 8.784 -2.928 -0.196 1.00 0.00 C ATOM 1111 CD GLN A 65 9.219 -4.146 -0.978 1.00 0.00 C ATOM 1112 OE1 GLN A 65 10.004 -4.959 -0.498 1.00 0.00 O ATOM 1113 NE2 GLN A 65 8.761 -4.252 -2.199 1.00 0.00 N ATOM 0 H GLN A 65 5.274 -0.936 -1.035 1.00 0.00 H new ATOM 0 HA GLN A 65 7.142 -1.287 1.229 1.00 0.00 H new ATOM 0 HB2 GLN A 65 6.679 -3.302 -0.213 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.257 -2.384 -1.590 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.461 -2.102 -0.413 1.00 0.00 H new ATOM 0 HG3 GLN A 65 8.869 -3.137 0.870 1.00 0.00 H new ATOM 0 HE21 GLN A 65 8.110 -3.556 -2.562 1.00 0.00 H new ATOM 0 HE22 GLN A 65 9.055 -5.031 -2.788 1.00 0.00 H new ATOM 1122 N VAL A 66 8.641 0.442 0.198 1.00 0.00 N ATOM 1123 CA VAL A 66 9.391 1.576 -0.296 1.00 0.00 C ATOM 1124 C VAL A 66 10.644 1.092 -0.994 1.00 0.00 C ATOM 1125 O VAL A 66 11.567 0.583 -0.356 1.00 0.00 O ATOM 1126 CB VAL A 66 9.771 2.561 0.838 1.00 0.00 C ATOM 1127 CG1 VAL A 66 10.532 3.760 0.288 1.00 0.00 C ATOM 1128 CG2 VAL A 66 8.531 3.025 1.563 1.00 0.00 C ATOM 0 H VAL A 66 8.973 0.070 1.088 1.00 0.00 H new ATOM 0 HA VAL A 66 8.754 2.113 -0.999 1.00 0.00 H new ATOM 0 HB VAL A 66 10.420 2.036 1.539 1.00 0.00 H new ATOM 0 HG11 VAL A 66 10.786 4.435 1.105 1.00 0.00 H new ATOM 0 HG12 VAL A 66 11.446 3.419 -0.199 1.00 0.00 H new ATOM 0 HG13 VAL A 66 9.909 4.285 -0.436 1.00 0.00 H new ATOM 0 HG21 VAL A 66 8.811 3.717 2.357 1.00 0.00 H new ATOM 0 HG22 VAL A 66 7.866 3.529 0.861 1.00 0.00 H new ATOM 0 HG23 VAL A 66 8.019 2.165 1.995 1.00 0.00 H new ATOM 1138 N ILE A 67 10.660 1.212 -2.292 1.00 0.00 N ATOM 1139 CA ILE A 67 11.793 0.808 -3.081 1.00 0.00 C ATOM 1140 C ILE A 67 12.629 2.043 -3.395 1.00 0.00 C ATOM 1141 O ILE A 67 12.211 2.894 -4.182 1.00 0.00 O ATOM 1142 CB ILE A 67 11.334 0.136 -4.403 1.00 0.00 C ATOM 1143 CG1 ILE A 67 10.374 -1.033 -4.104 1.00 0.00 C ATOM 1144 CG2 ILE A 67 12.541 -0.363 -5.190 1.00 0.00 C ATOM 1145 CD1 ILE A 67 9.847 -1.749 -5.337 1.00 0.00 C ATOM 0 H ILE A 67 9.886 1.594 -2.836 1.00 0.00 H new ATOM 0 HA ILE A 67 12.382 0.083 -2.520 1.00 0.00 H new ATOM 0 HB ILE A 67 10.807 0.877 -5.004 1.00 0.00 H new ATOM 0 HG12 ILE A 67 10.889 -1.756 -3.472 1.00 0.00 H new ATOM 0 HG13 ILE A 67 9.528 -0.654 -3.531 1.00 0.00 H new ATOM 0 HG21 ILE A 67 12.204 -0.832 -6.114 1.00 0.00 H new ATOM 0 HG22 ILE A 67 13.194 0.477 -5.426 1.00 0.00 H new ATOM 0 HG23 ILE A 67 13.089 -1.092 -4.593 1.00 0.00 H new ATOM 0 HD11 ILE A 67 9.180 -2.556 -5.032 1.00 0.00 H new ATOM 0 HD12 ILE A 67 9.300 -1.043 -5.962 1.00 0.00 H new ATOM 0 HD13 ILE A 67 10.682 -2.163 -5.902 1.00 0.00 H new ATOM 1157 N ASP A 68 13.788 2.146 -2.784 1.00 0.00 N ATOM 1158 CA ASP A 68 14.644 3.322 -2.961 1.00 0.00 C ATOM 1159 C ASP A 68 15.374 3.305 -4.275 1.00 0.00 C ATOM 1160 O ASP A 68 15.523 4.345 -4.910 1.00 0.00 O ATOM 1161 CB ASP A 68 15.649 3.515 -1.816 1.00 0.00 C ATOM 1162 CG ASP A 68 15.025 4.015 -0.540 1.00 0.00 C ATOM 1163 OD1 ASP A 68 14.455 5.134 -0.542 1.00 0.00 O ATOM 1164 OD2 ASP A 68 15.144 3.344 0.506 1.00 0.00 O ATOM 0 H ASP A 68 14.169 1.436 -2.158 1.00 0.00 H new ATOM 0 HA ASP A 68 13.959 4.170 -2.952 1.00 0.00 H new ATOM 0 HB2 ASP A 68 16.148 2.566 -1.619 1.00 0.00 H new ATOM 0 HB3 ASP A 68 16.418 4.219 -2.134 1.00 0.00 H new ATOM 1169 N GLU A 69 15.809 2.126 -4.694 1.00 0.00 N ATOM 1170 CA GLU A 69 16.565 1.977 -5.948 1.00 0.00 C ATOM 1171 C GLU A 69 15.768 2.446 -7.182 1.00 0.00 C ATOM 1172 O GLU A 69 16.297 3.129 -8.052 1.00 0.00 O ATOM 1173 CB GLU A 69 17.039 0.529 -6.140 1.00 0.00 C ATOM 1174 CG GLU A 69 15.922 -0.493 -6.071 1.00 0.00 C ATOM 1175 CD GLU A 69 16.334 -1.859 -6.523 1.00 0.00 C ATOM 1176 OE1 GLU A 69 16.256 -2.139 -7.739 1.00 0.00 O ATOM 1177 OE2 GLU A 69 16.699 -2.693 -5.681 1.00 0.00 O ATOM 0 H GLU A 69 15.656 1.253 -4.190 1.00 0.00 H new ATOM 0 HA GLU A 69 17.436 2.626 -5.860 1.00 0.00 H new ATOM 0 HB2 GLU A 69 17.537 0.444 -7.106 1.00 0.00 H new ATOM 0 HB3 GLU A 69 17.781 0.295 -5.377 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.558 -0.553 -5.045 1.00 0.00 H new ATOM 0 HG3 GLU A 69 15.089 -0.151 -6.686 1.00 0.00 H new ATOM 1184 N LYS A 70 14.494 2.091 -7.233 1.00 0.00 N ATOM 1185 CA LYS A 70 13.643 2.436 -8.370 1.00 0.00 C ATOM 1186 C LYS A 70 12.802 3.669 -8.059 1.00 0.00 C ATOM 1187 O LYS A 70 12.077 4.167 -8.919 1.00 0.00 O ATOM 1188 CB LYS A 70 12.735 1.250 -8.743 1.00 0.00 C ATOM 1189 CG LYS A 70 13.476 -0.011 -9.192 1.00 0.00 C ATOM 1190 CD LYS A 70 12.496 -1.134 -9.526 1.00 0.00 C ATOM 1191 CE LYS A 70 13.201 -2.404 -10.018 1.00 0.00 C ATOM 1192 NZ LYS A 70 14.044 -3.052 -8.977 1.00 0.00 N ATOM 0 H LYS A 70 14.022 1.562 -6.500 1.00 0.00 H new ATOM 0 HA LYS A 70 14.286 2.663 -9.220 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.114 1.002 -7.882 1.00 0.00 H new ATOM 0 HB3 LYS A 70 12.063 1.563 -9.542 1.00 0.00 H new ATOM 0 HG2 LYS A 70 14.088 0.214 -10.066 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.154 -0.338 -8.404 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.905 -1.370 -8.641 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.801 -0.789 -10.291 1.00 0.00 H new ATOM 0 HE2 LYS A 70 12.452 -3.116 -10.363 1.00 0.00 H new ATOM 0 HE3 LYS A 70 13.824 -2.155 -10.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.410 -3.955 -9.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 14.840 -2.427 -8.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.472 -3.227 -8.126 1.00 0.00 H new ATOM 1206 N VAL A 71 12.949 4.153 -6.820 1.00 0.00 N ATOM 1207 CA VAL A 71 12.226 5.314 -6.262 1.00 0.00 C ATOM 1208 C VAL A 71 10.730 5.165 -6.485 1.00 0.00 C ATOM 1209 O VAL A 71 10.131 5.882 -7.280 1.00 0.00 O ATOM 1210 CB VAL A 71 12.688 6.678 -6.845 1.00 0.00 C ATOM 1211 CG1 VAL A 71 12.212 7.822 -5.970 1.00 0.00 C ATOM 1212 CG2 VAL A 71 14.178 6.732 -7.013 1.00 0.00 C ATOM 0 H VAL A 71 13.596 3.736 -6.151 1.00 0.00 H new ATOM 0 HA VAL A 71 12.460 5.321 -5.197 1.00 0.00 H new ATOM 0 HB VAL A 71 12.239 6.781 -7.833 1.00 0.00 H new ATOM 0 HG11 VAL A 71 12.546 8.769 -6.395 1.00 0.00 H new ATOM 0 HG12 VAL A 71 11.123 7.811 -5.918 1.00 0.00 H new ATOM 0 HG13 VAL A 71 12.624 7.709 -4.967 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.463 7.701 -7.423 1.00 0.00 H new ATOM 0 HG22 VAL A 71 14.659 6.592 -6.045 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.496 5.942 -7.694 1.00 0.00 H new ATOM 1222 N VAL A 72 10.132 4.230 -5.824 1.00 0.00 N ATOM 1223 CA VAL A 72 8.758 3.967 -6.074 1.00 0.00 C ATOM 1224 C VAL A 72 8.080 3.318 -4.877 1.00 0.00 C ATOM 1225 O VAL A 72 8.688 2.514 -4.148 1.00 0.00 O ATOM 1226 CB VAL A 72 8.598 3.097 -7.364 1.00 0.00 C ATOM 1227 CG1 VAL A 72 9.285 1.749 -7.239 1.00 0.00 C ATOM 1228 CG2 VAL A 72 7.153 2.937 -7.752 1.00 0.00 C ATOM 0 H VAL A 72 10.569 3.642 -5.114 1.00 0.00 H new ATOM 0 HA VAL A 72 8.257 4.921 -6.239 1.00 0.00 H new ATOM 0 HB VAL A 72 9.099 3.638 -8.166 1.00 0.00 H new ATOM 0 HG11 VAL A 72 9.145 1.183 -8.160 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.350 1.898 -7.063 1.00 0.00 H new ATOM 0 HG13 VAL A 72 8.853 1.197 -6.404 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.083 2.327 -8.652 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.610 2.451 -6.941 1.00 0.00 H new ATOM 0 HG23 VAL A 72 6.717 3.917 -7.944 1.00 0.00 H new ATOM 1238 N VAL A 73 6.860 3.723 -4.648 1.00 0.00 N ATOM 1239 CA VAL A 73 6.023 3.154 -3.652 1.00 0.00 C ATOM 1240 C VAL A 73 5.250 2.051 -4.307 1.00 0.00 C ATOM 1241 O VAL A 73 4.377 2.289 -5.140 1.00 0.00 O ATOM 1242 CB VAL A 73 5.064 4.208 -3.072 1.00 0.00 C ATOM 1243 CG1 VAL A 73 4.088 3.601 -2.078 1.00 0.00 C ATOM 1244 CG2 VAL A 73 5.868 5.297 -2.419 1.00 0.00 C ATOM 0 H VAL A 73 6.418 4.480 -5.169 1.00 0.00 H new ATOM 0 HA VAL A 73 6.621 2.774 -2.824 1.00 0.00 H new ATOM 0 HB VAL A 73 4.472 4.621 -3.889 1.00 0.00 H new ATOM 0 HG11 VAL A 73 3.430 4.380 -1.693 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.492 2.835 -2.574 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.641 3.153 -1.253 1.00 0.00 H new ATOM 0 HG21 VAL A 73 5.195 6.048 -2.005 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.473 4.872 -1.618 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.520 5.762 -3.159 1.00 0.00 H new ATOM 1254 N PHE A 74 5.613 0.869 -3.980 1.00 0.00 N ATOM 1255 CA PHE A 74 5.023 -0.282 -4.569 1.00 0.00 C ATOM 1256 C PHE A 74 3.995 -0.880 -3.639 1.00 0.00 C ATOM 1257 O PHE A 74 4.335 -1.536 -2.662 1.00 0.00 O ATOM 1258 CB PHE A 74 6.117 -1.286 -4.955 1.00 0.00 C ATOM 1259 CG PHE A 74 5.614 -2.604 -5.463 1.00 0.00 C ATOM 1260 CD1 PHE A 74 4.572 -2.669 -6.370 1.00 0.00 C ATOM 1261 CD2 PHE A 74 6.177 -3.780 -5.013 1.00 0.00 C ATOM 1262 CE1 PHE A 74 4.108 -3.875 -6.815 1.00 0.00 C ATOM 1263 CE2 PHE A 74 5.713 -4.991 -5.457 1.00 0.00 C ATOM 1264 CZ PHE A 74 4.677 -5.035 -6.359 1.00 0.00 C ATOM 0 H PHE A 74 6.335 0.666 -3.289 1.00 0.00 H new ATOM 0 HA PHE A 74 4.499 0.000 -5.482 1.00 0.00 H new ATOM 0 HB2 PHE A 74 6.749 -0.836 -5.720 1.00 0.00 H new ATOM 0 HB3 PHE A 74 6.748 -1.466 -4.085 1.00 0.00 H new ATOM 0 HD1 PHE A 74 4.120 -1.757 -6.731 1.00 0.00 H new ATOM 0 HD2 PHE A 74 6.991 -3.746 -4.304 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.295 -3.914 -7.524 1.00 0.00 H new ATOM 0 HE2 PHE A 74 6.160 -5.907 -5.099 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.310 -5.988 -6.710 1.00 0.00 H new ATOM 1274 N VAL A 75 2.757 -0.613 -3.921 1.00 0.00 N ATOM 1275 CA VAL A 75 1.668 -1.125 -3.145 1.00 0.00 C ATOM 1276 C VAL A 75 1.474 -2.591 -3.472 1.00 0.00 C ATOM 1277 O VAL A 75 1.291 -2.956 -4.622 1.00 0.00 O ATOM 1278 CB VAL A 75 0.369 -0.356 -3.420 1.00 0.00 C ATOM 1279 CG1 VAL A 75 -0.748 -0.881 -2.539 1.00 0.00 C ATOM 1280 CG2 VAL A 75 0.575 1.138 -3.214 1.00 0.00 C ATOM 0 H VAL A 75 2.470 -0.027 -4.705 1.00 0.00 H new ATOM 0 HA VAL A 75 1.909 -1.002 -2.089 1.00 0.00 H new ATOM 0 HB VAL A 75 0.084 -0.512 -4.460 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.664 -0.327 -2.744 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.909 -1.939 -2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.475 -0.755 -1.491 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.358 1.665 -3.414 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.884 1.324 -2.185 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.347 1.496 -3.895 1.00 0.00 H new ATOM 1290 N ILE A 76 1.534 -3.403 -2.469 1.00 0.00 N ATOM 1291 CA ILE A 76 1.452 -4.826 -2.628 1.00 0.00 C ATOM 1292 C ILE A 76 0.067 -5.369 -2.271 1.00 0.00 C ATOM 1293 O ILE A 76 -0.440 -6.259 -2.920 1.00 0.00 O ATOM 1294 CB ILE A 76 2.569 -5.512 -1.788 1.00 0.00 C ATOM 1295 CG1 ILE A 76 3.938 -5.088 -2.354 1.00 0.00 C ATOM 1296 CG2 ILE A 76 2.417 -7.042 -1.754 1.00 0.00 C ATOM 1297 CD1 ILE A 76 5.137 -5.605 -1.603 1.00 0.00 C ATOM 0 H ILE A 76 1.643 -3.098 -1.502 1.00 0.00 H new ATOM 0 HA ILE A 76 1.608 -5.060 -3.681 1.00 0.00 H new ATOM 0 HB ILE A 76 2.484 -5.185 -0.752 1.00 0.00 H new ATOM 0 HG12 ILE A 76 4.005 -5.426 -3.388 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.983 -3.999 -2.371 1.00 0.00 H new ATOM 0 HG21 ILE A 76 3.219 -7.474 -1.156 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.455 -7.302 -1.313 1.00 0.00 H new ATOM 0 HG23 ILE A 76 2.469 -7.435 -2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 76 6.048 -5.249 -2.083 1.00 0.00 H new ATOM 0 HD12 ILE A 76 5.105 -5.246 -0.574 1.00 0.00 H new ATOM 0 HD13 ILE A 76 5.127 -6.695 -1.607 1.00 0.00 H new ATOM 1309 N SER A 77 -0.553 -4.835 -1.258 1.00 0.00 N ATOM 1310 CA SER A 77 -1.837 -5.358 -0.843 1.00 0.00 C ATOM 1311 C SER A 77 -2.819 -4.233 -0.569 1.00 0.00 C ATOM 1312 O SER A 77 -2.430 -3.182 -0.083 1.00 0.00 O ATOM 1313 CB SER A 77 -1.636 -6.234 0.384 1.00 0.00 C ATOM 1314 OG SER A 77 -0.642 -7.211 0.111 1.00 0.00 O ATOM 0 H SER A 77 -0.204 -4.051 -0.708 1.00 0.00 H new ATOM 0 HA SER A 77 -2.264 -5.961 -1.645 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.336 -5.623 1.235 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.574 -6.720 0.655 1.00 0.00 H new ATOM 0 HG SER A 77 -0.069 -7.323 0.898 1.00 0.00 H new ATOM 1320 N VAL A 78 -4.073 -4.450 -0.907 1.00 0.00 N ATOM 1321 CA VAL A 78 -5.130 -3.465 -0.724 1.00 0.00 C ATOM 1322 C VAL A 78 -6.401 -4.206 -0.324 1.00 0.00 C ATOM 1323 O VAL A 78 -6.746 -5.199 -0.949 1.00 0.00 O ATOM 1324 CB VAL A 78 -5.430 -2.665 -2.049 1.00 0.00 C ATOM 1325 CG1 VAL A 78 -6.534 -1.650 -1.838 1.00 0.00 C ATOM 1326 CG2 VAL A 78 -4.197 -1.964 -2.587 1.00 0.00 C ATOM 0 H VAL A 78 -4.395 -5.324 -1.322 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.807 -2.756 0.038 1.00 0.00 H new ATOM 0 HB VAL A 78 -5.753 -3.401 -2.785 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.718 -1.114 -2.769 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.445 -2.162 -1.528 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -6.235 -0.942 -1.065 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.453 -1.427 -3.500 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.826 -1.259 -1.843 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.425 -2.702 -2.805 1.00 0.00 H new ATOM 1336 N GLY A 79 -7.040 -3.775 0.733 1.00 0.00 N ATOM 1337 CA GLY A 79 -8.303 -4.356 1.115 1.00 0.00 C ATOM 1338 C GLY A 79 -8.379 -4.540 2.594 1.00 0.00 C ATOM 1339 O GLY A 79 -7.724 -3.813 3.334 1.00 0.00 O ATOM 0 H GLY A 79 -6.709 -3.027 1.343 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.119 -3.714 0.782 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.431 -5.318 0.618 1.00 0.00 H new ATOM 1343 N LYS A 80 -9.167 -5.479 3.047 1.00 0.00 N ATOM 1344 CA LYS A 80 -9.261 -5.728 4.461 1.00 0.00 C ATOM 1345 C LYS A 80 -8.505 -6.971 4.860 1.00 0.00 C ATOM 1346 O LYS A 80 -8.675 -8.051 4.275 1.00 0.00 O ATOM 1347 CB LYS A 80 -10.710 -5.806 4.970 1.00 0.00 C ATOM 1348 CG LYS A 80 -11.520 -4.546 4.745 1.00 0.00 C ATOM 1349 CD LYS A 80 -12.884 -4.602 5.425 1.00 0.00 C ATOM 1350 CE LYS A 80 -12.764 -4.467 6.939 1.00 0.00 C ATOM 1351 NZ LYS A 80 -14.076 -4.571 7.611 1.00 0.00 N ATOM 0 H LYS A 80 -9.749 -6.080 2.463 1.00 0.00 H new ATOM 0 HA LYS A 80 -8.798 -4.864 4.938 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -11.211 -6.639 4.477 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -10.696 -6.029 6.037 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -10.964 -3.688 5.122 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -11.657 -4.392 3.675 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -13.517 -3.804 5.037 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -13.374 -5.545 5.181 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -12.099 -5.242 7.320 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -12.307 -3.508 7.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -13.948 -4.474 8.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -14.703 -3.816 7.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -14.501 -5.497 7.401 1.00 0.00 H new ATOM 1715 N GLU B 54 -2.181 -7.534 13.918 1.00 0.00 N ATOM 1716 CA GLU B 54 -2.614 -7.363 12.533 1.00 0.00 C ATOM 1717 C GLU B 54 -1.434 -7.616 11.604 1.00 0.00 C ATOM 1718 O GLU B 54 -1.538 -8.337 10.623 1.00 0.00 O ATOM 1719 CB GLU B 54 -3.202 -5.951 12.257 1.00 0.00 C ATOM 1720 CG GLU B 54 -2.284 -4.776 12.622 1.00 0.00 C ATOM 1721 CD GLU B 54 -2.654 -3.504 11.904 1.00 0.00 C ATOM 1722 OE1 GLU B 54 -3.716 -2.919 12.204 1.00 0.00 O ATOM 1723 OE2 GLU B 54 -1.908 -3.080 10.979 1.00 0.00 O ATOM 0 HA GLU B 54 -3.411 -8.083 12.348 1.00 0.00 H new ATOM 0 HB2 GLU B 54 -3.452 -5.880 11.198 1.00 0.00 H new ATOM 0 HB3 GLU B 54 -4.134 -5.849 12.812 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -2.328 -4.607 13.698 1.00 0.00 H new ATOM 0 HG3 GLU B 54 -1.253 -5.037 12.382 1.00 0.00 H new ATOM 1730 N ASP B 55 -0.291 -7.071 11.991 1.00 0.00 N ATOM 1731 CA ASP B 55 0.955 -7.124 11.232 1.00 0.00 C ATOM 1732 C ASP B 55 1.375 -8.527 10.953 1.00 0.00 C ATOM 1733 O ASP B 55 1.958 -8.806 9.922 1.00 0.00 O ATOM 1734 CB ASP B 55 2.057 -6.426 11.992 1.00 0.00 C ATOM 1735 CG ASP B 55 1.795 -4.975 12.188 1.00 0.00 C ATOM 1736 OD1 ASP B 55 0.993 -4.619 13.065 1.00 0.00 O ATOM 1737 OD2 ASP B 55 2.373 -4.171 11.472 1.00 0.00 O ATOM 0 H ASP B 55 -0.199 -6.562 12.870 1.00 0.00 H new ATOM 0 HA ASP B 55 0.775 -6.621 10.282 1.00 0.00 H new ATOM 0 HB2 ASP B 55 2.179 -6.903 12.965 1.00 0.00 H new ATOM 0 HB3 ASP B 55 2.997 -6.551 11.455 1.00 0.00 H new ATOM 1742 N ALA B 56 1.038 -9.411 11.865 1.00 0.00 N ATOM 1743 CA ALA B 56 1.336 -10.825 11.735 1.00 0.00 C ATOM 1744 C ALA B 56 0.659 -11.417 10.500 1.00 0.00 C ATOM 1745 O ALA B 56 1.149 -12.377 9.915 1.00 0.00 O ATOM 1746 CB ALA B 56 0.903 -11.564 12.979 1.00 0.00 C ATOM 0 H ALA B 56 0.546 -9.170 12.725 1.00 0.00 H new ATOM 0 HA ALA B 56 2.413 -10.938 11.614 1.00 0.00 H new ATOM 0 HB1 ALA B 56 1.131 -12.624 12.870 1.00 0.00 H new ATOM 0 HB2 ALA B 56 1.435 -11.165 13.843 1.00 0.00 H new ATOM 0 HB3 ALA B 56 -0.170 -11.437 13.123 1.00 0.00 H new ATOM 1752 N GLU B 57 -0.444 -10.825 10.088 1.00 0.00 N ATOM 1753 CA GLU B 57 -1.129 -11.273 8.916 1.00 0.00 C ATOM 1754 C GLU B 57 -0.611 -10.538 7.694 1.00 0.00 C ATOM 1755 O GLU B 57 -0.402 -11.127 6.642 1.00 0.00 O ATOM 1756 CB GLU B 57 -2.649 -11.123 9.043 1.00 0.00 C ATOM 1757 CG GLU B 57 -3.346 -11.415 7.718 1.00 0.00 C ATOM 1758 CD GLU B 57 -4.831 -11.550 7.776 1.00 0.00 C ATOM 1759 OE1 GLU B 57 -5.543 -10.548 7.965 1.00 0.00 O ATOM 1760 OE2 GLU B 57 -5.324 -12.674 7.531 1.00 0.00 O ATOM 0 H GLU B 57 -0.878 -10.030 10.557 1.00 0.00 H new ATOM 0 HA GLU B 57 -0.926 -12.338 8.800 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -3.021 -11.802 9.810 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -2.891 -10.111 9.369 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -3.101 -10.617 7.018 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -2.933 -12.337 7.308 1.00 0.00 H new ATOM 1767 N LEU B 58 -0.360 -9.265 7.839 1.00 0.00 N ATOM 1768 CA LEU B 58 0.112 -8.478 6.717 1.00 0.00 C ATOM 1769 C LEU B 58 1.473 -8.944 6.199 1.00 0.00 C ATOM 1770 O LEU B 58 1.732 -8.855 5.009 1.00 0.00 O ATOM 1771 CB LEU B 58 0.091 -6.959 6.977 1.00 0.00 C ATOM 1772 CG LEU B 58 -1.288 -6.254 6.994 1.00 0.00 C ATOM 1773 CD1 LEU B 58 -2.102 -6.585 5.759 1.00 0.00 C ATOM 1774 CD2 LEU B 58 -2.079 -6.550 8.243 1.00 0.00 C ATOM 0 H LEU B 58 -0.471 -8.749 8.712 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.612 -8.659 5.923 1.00 0.00 H new ATOM 0 HB2 LEU B 58 0.574 -6.776 7.937 1.00 0.00 H new ATOM 0 HB3 LEU B 58 0.704 -6.479 6.215 1.00 0.00 H new ATOM 0 HG LEU B 58 -1.077 -5.185 6.991 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -3.062 -6.072 5.808 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -1.562 -6.260 4.870 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -2.268 -7.661 5.710 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -3.036 -6.030 8.200 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -2.253 -7.623 8.318 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -1.521 -6.211 9.116 1.00 0.00 H new ATOM 1786 N VAL B 59 2.310 -9.488 7.081 1.00 0.00 N ATOM 1787 CA VAL B 59 3.622 -9.983 6.667 1.00 0.00 C ATOM 1788 C VAL B 59 3.512 -11.205 5.754 1.00 0.00 C ATOM 1789 O VAL B 59 4.295 -11.349 4.824 1.00 0.00 O ATOM 1790 CB VAL B 59 4.593 -10.277 7.852 1.00 0.00 C ATOM 1791 CG1 VAL B 59 4.869 -9.026 8.641 1.00 0.00 C ATOM 1792 CG2 VAL B 59 4.083 -11.391 8.758 1.00 0.00 C ATOM 0 H VAL B 59 2.107 -9.597 8.075 1.00 0.00 H new ATOM 0 HA VAL B 59 4.061 -9.161 6.102 1.00 0.00 H new ATOM 0 HB VAL B 59 5.529 -10.627 7.417 1.00 0.00 H new ATOM 0 HG11 VAL B 59 5.548 -9.256 9.462 1.00 0.00 H new ATOM 0 HG12 VAL B 59 5.325 -8.279 7.991 1.00 0.00 H new ATOM 0 HG13 VAL B 59 3.934 -8.635 9.043 1.00 0.00 H new ATOM 0 HG21 VAL B 59 4.795 -11.557 9.567 1.00 0.00 H new ATOM 0 HG22 VAL B 59 3.118 -11.106 9.177 1.00 0.00 H new ATOM 0 HG23 VAL B 59 3.971 -12.308 8.179 1.00 0.00 H new ATOM 1802 N GLU B 60 2.510 -12.049 5.982 1.00 0.00 N ATOM 1803 CA GLU B 60 2.349 -13.245 5.174 1.00 0.00 C ATOM 1804 C GLU B 60 1.703 -12.924 3.828 1.00 0.00 C ATOM 1805 O GLU B 60 1.936 -13.611 2.837 1.00 0.00 O ATOM 1806 CB GLU B 60 1.607 -14.379 5.920 1.00 0.00 C ATOM 1807 CG GLU B 60 0.260 -14.003 6.512 1.00 0.00 C ATOM 1808 CD GLU B 60 -0.494 -15.183 7.055 1.00 0.00 C ATOM 1809 OE1 GLU B 60 -0.235 -15.607 8.204 1.00 0.00 O ATOM 1810 OE2 GLU B 60 -1.366 -15.714 6.358 1.00 0.00 O ATOM 0 H GLU B 60 1.807 -11.926 6.711 1.00 0.00 H new ATOM 0 HA GLU B 60 3.351 -13.625 4.975 1.00 0.00 H new ATOM 0 HB2 GLU B 60 1.461 -15.209 5.229 1.00 0.00 H new ATOM 0 HB3 GLU B 60 2.248 -14.742 6.723 1.00 0.00 H new ATOM 0 HG2 GLU B 60 0.411 -13.277 7.311 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -0.343 -13.515 5.747 1.00 0.00 H new ATOM 1817 N ILE B 61 0.918 -11.868 3.795 1.00 0.00 N ATOM 1818 CA ILE B 61 0.263 -11.428 2.567 1.00 0.00 C ATOM 1819 C ILE B 61 1.274 -10.738 1.643 1.00 0.00 C ATOM 1820 O ILE B 61 1.354 -11.043 0.440 1.00 0.00 O ATOM 1821 CB ILE B 61 -0.909 -10.453 2.872 1.00 0.00 C ATOM 1822 CG1 ILE B 61 -1.944 -11.137 3.780 1.00 0.00 C ATOM 1823 CG2 ILE B 61 -1.565 -9.973 1.580 1.00 0.00 C ATOM 1824 CD1 ILE B 61 -3.121 -10.263 4.155 1.00 0.00 C ATOM 0 H ILE B 61 0.713 -11.289 4.609 1.00 0.00 H new ATOM 0 HA ILE B 61 -0.140 -12.311 2.072 1.00 0.00 H new ATOM 0 HB ILE B 61 -0.508 -9.583 3.391 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -2.316 -12.030 3.278 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -1.447 -11.467 4.692 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -2.382 -9.292 1.818 1.00 0.00 H new ATOM 0 HG22 ILE B 61 -0.827 -9.454 0.968 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -1.955 -10.829 1.030 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -3.801 -10.824 4.796 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -2.764 -9.381 4.688 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -3.646 -9.953 3.252 1.00 0.00 H new ATOM 1836 N VAL B 62 2.066 -9.843 2.219 1.00 0.00 N ATOM 1837 CA VAL B 62 3.029 -9.067 1.464 1.00 0.00 C ATOM 1838 C VAL B 62 4.094 -9.968 0.817 1.00 0.00 C ATOM 1839 O VAL B 62 4.346 -9.866 -0.387 1.00 0.00 O ATOM 1840 CB VAL B 62 3.676 -7.908 2.320 1.00 0.00 C ATOM 1841 CG1 VAL B 62 4.492 -8.421 3.488 1.00 0.00 C ATOM 1842 CG2 VAL B 62 4.512 -6.986 1.470 1.00 0.00 C ATOM 0 H VAL B 62 2.056 -9.638 3.218 1.00 0.00 H new ATOM 0 HA VAL B 62 2.480 -8.580 0.658 1.00 0.00 H new ATOM 0 HB VAL B 62 2.838 -7.344 2.730 1.00 0.00 H new ATOM 0 HG11 VAL B 62 4.911 -7.578 4.038 1.00 0.00 H new ATOM 0 HG12 VAL B 62 3.852 -9.004 4.150 1.00 0.00 H new ATOM 0 HG13 VAL B 62 5.301 -9.051 3.118 1.00 0.00 H new ATOM 0 HG21 VAL B 62 4.940 -6.202 2.095 1.00 0.00 H new ATOM 0 HG22 VAL B 62 5.315 -7.553 0.999 1.00 0.00 H new ATOM 0 HG23 VAL B 62 3.887 -6.535 0.700 1.00 0.00 H new ATOM 1852 N LYS B 63 4.632 -10.913 1.598 1.00 0.00 N ATOM 1853 CA LYS B 63 5.682 -11.801 1.114 1.00 0.00 C ATOM 1854 C LYS B 63 5.135 -12.766 0.065 1.00 0.00 C ATOM 1855 O LYS B 63 5.858 -13.207 -0.821 1.00 0.00 O ATOM 1856 CB LYS B 63 6.345 -12.554 2.282 1.00 0.00 C ATOM 1857 CG LYS B 63 5.466 -13.584 2.982 1.00 0.00 C ATOM 1858 CD LYS B 63 6.129 -14.134 4.249 1.00 0.00 C ATOM 1859 CE LYS B 63 7.495 -14.732 3.961 1.00 0.00 C ATOM 1860 NZ LYS B 63 8.072 -15.389 5.148 1.00 0.00 N ATOM 0 H LYS B 63 4.354 -11.078 2.566 1.00 0.00 H new ATOM 0 HA LYS B 63 6.450 -11.194 0.636 1.00 0.00 H new ATOM 0 HB2 LYS B 63 7.236 -13.057 1.908 1.00 0.00 H new ATOM 0 HB3 LYS B 63 6.677 -11.824 3.020 1.00 0.00 H new ATOM 0 HG2 LYS B 63 4.510 -13.129 3.241 1.00 0.00 H new ATOM 0 HG3 LYS B 63 5.254 -14.405 2.298 1.00 0.00 H new ATOM 0 HD2 LYS B 63 6.231 -13.334 4.982 1.00 0.00 H new ATOM 0 HD3 LYS B 63 5.487 -14.894 4.694 1.00 0.00 H new ATOM 0 HE2 LYS B 63 7.410 -15.457 3.151 1.00 0.00 H new ATOM 0 HE3 LYS B 63 8.169 -13.947 3.617 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 9.004 -15.783 4.908 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 8.178 -14.693 5.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 7.442 -16.155 5.461 1.00 0.00 H new ATOM 1874 N GLU B 64 3.842 -13.053 0.161 1.00 0.00 N ATOM 1875 CA GLU B 64 3.160 -13.918 -0.781 1.00 0.00 C ATOM 1876 C GLU B 64 3.154 -13.309 -2.157 1.00 0.00 C ATOM 1877 O GLU B 64 3.581 -13.923 -3.132 1.00 0.00 O ATOM 1878 CB GLU B 64 1.716 -14.199 -0.323 1.00 0.00 C ATOM 1879 CG GLU B 64 0.826 -14.813 -1.402 1.00 0.00 C ATOM 1880 CD GLU B 64 -0.541 -15.205 -0.913 1.00 0.00 C ATOM 1881 OE1 GLU B 64 -0.709 -16.336 -0.379 1.00 0.00 O ATOM 1882 OE2 GLU B 64 -1.490 -14.408 -1.065 1.00 0.00 O ATOM 0 H GLU B 64 3.239 -12.689 0.899 1.00 0.00 H new ATOM 0 HA GLU B 64 3.703 -14.863 -0.819 1.00 0.00 H new ATOM 0 HB2 GLU B 64 1.743 -14.870 0.535 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.266 -13.266 0.016 1.00 0.00 H new ATOM 0 HG2 GLU B 64 0.718 -14.100 -2.219 1.00 0.00 H new ATOM 0 HG3 GLU B 64 1.322 -15.694 -1.810 1.00 0.00 H new ATOM 1889 N ARG B 65 2.686 -12.101 -2.231 1.00 0.00 N ATOM 1890 CA ARG B 65 2.562 -11.436 -3.493 1.00 0.00 C ATOM 1891 C ARG B 65 3.912 -10.974 -3.988 1.00 0.00 C ATOM 1892 O ARG B 65 4.166 -11.011 -5.167 1.00 0.00 O ATOM 1893 CB ARG B 65 1.633 -10.252 -3.376 1.00 0.00 C ATOM 1894 CG ARG B 65 0.222 -10.573 -2.951 1.00 0.00 C ATOM 1895 CD ARG B 65 -0.621 -9.320 -2.983 1.00 0.00 C ATOM 1896 NE ARG B 65 -1.953 -9.520 -2.419 1.00 0.00 N ATOM 1897 CZ ARG B 65 -3.039 -8.819 -2.750 1.00 0.00 C ATOM 1898 NH1 ARG B 65 -2.994 -7.933 -3.752 1.00 0.00 N ATOM 1899 NH2 ARG B 65 -4.173 -9.013 -2.068 1.00 0.00 N ATOM 0 H ARG B 65 2.382 -11.552 -1.427 1.00 0.00 H new ATOM 0 HA ARG B 65 2.148 -12.146 -4.209 1.00 0.00 H new ATOM 0 HB2 ARG B 65 2.058 -9.548 -2.660 1.00 0.00 H new ATOM 0 HB3 ARG B 65 1.597 -9.744 -4.340 1.00 0.00 H new ATOM 0 HG2 ARG B 65 -0.205 -11.326 -3.614 1.00 0.00 H new ATOM 0 HG3 ARG B 65 0.223 -10.996 -1.946 1.00 0.00 H new ATOM 0 HD2 ARG B 65 -0.112 -8.531 -2.430 1.00 0.00 H new ATOM 0 HD3 ARG B 65 -0.715 -8.977 -4.013 1.00 0.00 H new ATOM 0 HE ARG B 65 -2.062 -10.252 -1.718 1.00 0.00 H new ATOM 0 HH11 ARG B 65 -2.126 -7.790 -4.268 1.00 0.00 H new ATOM 0 HH12 ARG B 65 -3.828 -7.401 -4.000 1.00 0.00 H new ATOM 0 HH21 ARG B 65 -4.200 -9.690 -1.306 1.00 0.00 H new ATOM 0 HH22 ARG B 65 -5.011 -8.484 -2.310 1.00 0.00 H new ATOM 1913 N LEU B 66 4.792 -10.618 -3.056 1.00 0.00 N ATOM 1914 CA LEU B 66 6.100 -10.033 -3.358 1.00 0.00 C ATOM 1915 C LEU B 66 6.948 -10.884 -4.303 1.00 0.00 C ATOM 1916 O LEU B 66 7.695 -10.352 -5.121 1.00 0.00 O ATOM 1917 CB LEU B 66 6.859 -9.791 -2.065 1.00 0.00 C ATOM 1918 CG LEU B 66 8.162 -9.001 -2.181 1.00 0.00 C ATOM 1919 CD1 LEU B 66 7.926 -7.695 -2.931 1.00 0.00 C ATOM 1920 CD2 LEU B 66 8.707 -8.722 -0.795 1.00 0.00 C ATOM 0 H LEU B 66 4.617 -10.728 -2.057 1.00 0.00 H new ATOM 0 HA LEU B 66 5.910 -9.093 -3.876 1.00 0.00 H new ATOM 0 HB2 LEU B 66 6.200 -9.264 -1.375 1.00 0.00 H new ATOM 0 HB3 LEU B 66 7.084 -10.758 -1.615 1.00 0.00 H new ATOM 0 HG LEU B 66 8.889 -9.589 -2.741 1.00 0.00 H new ATOM 0 HD11 LEU B 66 8.863 -7.144 -3.005 1.00 0.00 H new ATOM 0 HD12 LEU B 66 7.552 -7.912 -3.932 1.00 0.00 H new ATOM 0 HD13 LEU B 66 7.193 -7.094 -2.393 1.00 0.00 H new ATOM 0 HD21 LEU B 66 9.637 -8.159 -0.876 1.00 0.00 H new ATOM 0 HD22 LEU B 66 7.979 -8.142 -0.228 1.00 0.00 H new ATOM 0 HD23 LEU B 66 8.898 -9.665 -0.282 1.00 0.00 H new ATOM 1932 N ARG B 67 6.810 -12.183 -4.205 1.00 0.00 N ATOM 1933 CA ARG B 67 7.597 -13.088 -5.021 1.00 0.00 C ATOM 1934 C ARG B 67 7.177 -13.078 -6.490 1.00 0.00 C ATOM 1935 O ARG B 67 7.940 -13.508 -7.347 1.00 0.00 O ATOM 1936 CB ARG B 67 7.589 -14.492 -4.439 1.00 0.00 C ATOM 1937 CG ARG B 67 6.215 -15.109 -4.306 1.00 0.00 C ATOM 1938 CD ARG B 67 6.264 -16.340 -3.433 1.00 0.00 C ATOM 1939 NE ARG B 67 6.794 -16.010 -2.101 1.00 0.00 N ATOM 1940 CZ ARG B 67 6.512 -16.646 -0.976 1.00 0.00 C ATOM 1941 NH1 ARG B 67 5.626 -17.623 -0.956 1.00 0.00 N ATOM 1942 NH2 ARG B 67 7.101 -16.269 0.140 1.00 0.00 N ATOM 0 H ARG B 67 6.160 -12.643 -3.568 1.00 0.00 H new ATOM 0 HA ARG B 67 8.624 -12.722 -5.001 1.00 0.00 H new ATOM 0 HB2 ARG B 67 8.203 -15.136 -5.069 1.00 0.00 H new ATOM 0 HB3 ARG B 67 8.058 -14.466 -3.456 1.00 0.00 H new ATOM 0 HG2 ARG B 67 5.524 -14.382 -3.879 1.00 0.00 H new ATOM 0 HG3 ARG B 67 5.832 -15.372 -5.292 1.00 0.00 H new ATOM 0 HD2 ARG B 67 5.265 -16.765 -3.338 1.00 0.00 H new ATOM 0 HD3 ARG B 67 6.890 -17.100 -3.901 1.00 0.00 H new ATOM 0 HE ARG B 67 7.436 -15.220 -2.039 1.00 0.00 H new ATOM 0 HH11 ARG B 67 5.149 -17.896 -1.815 1.00 0.00 H new ATOM 0 HH12 ARG B 67 5.418 -18.105 -0.081 1.00 0.00 H new ATOM 0 HH21 ARG B 67 7.765 -15.495 0.130 1.00 0.00 H new ATOM 0 HH22 ARG B 67 6.893 -16.751 1.015 1.00 0.00 H new ATOM 1956 N ASN B 68 5.978 -12.586 -6.787 1.00 0.00 N ATOM 1957 CA ASN B 68 5.526 -12.479 -8.176 1.00 0.00 C ATOM 1958 C ASN B 68 4.235 -11.655 -8.261 1.00 0.00 C ATOM 1959 O ASN B 68 3.142 -12.210 -8.423 1.00 0.00 O ATOM 1960 CB ASN B 68 5.302 -13.854 -8.818 1.00 0.00 C ATOM 1961 CG ASN B 68 5.201 -13.792 -10.326 1.00 0.00 C ATOM 1962 OD1 ASN B 68 4.466 -14.563 -10.931 1.00 0.00 O ATOM 1963 ND2 ASN B 68 5.961 -12.919 -10.948 1.00 0.00 N ATOM 0 H ASN B 68 5.305 -12.257 -6.094 1.00 0.00 H new ATOM 0 HA ASN B 68 6.318 -11.975 -8.729 1.00 0.00 H new ATOM 0 HB2 ASN B 68 6.122 -14.516 -8.541 1.00 0.00 H new ATOM 0 HB3 ASN B 68 4.389 -14.292 -8.416 1.00 0.00 H new ATOM 0 HD21 ASN B 68 5.951 -12.868 -11.967 1.00 0.00 H new ATOM 0 HD22 ASN B 68 6.561 -12.292 -10.412 1.00 0.00 H new ATOM 1970 N PRO B 69 4.333 -10.338 -8.081 1.00 0.00 N ATOM 1971 CA PRO B 69 3.168 -9.460 -8.068 1.00 0.00 C ATOM 1972 C PRO B 69 2.804 -8.853 -9.434 1.00 0.00 C ATOM 1973 O PRO B 69 1.623 -8.726 -9.765 1.00 0.00 O ATOM 1974 CB PRO B 69 3.590 -8.347 -7.108 1.00 0.00 C ATOM 1975 CG PRO B 69 5.096 -8.430 -6.979 1.00 0.00 C ATOM 1976 CD PRO B 69 5.570 -9.595 -7.800 1.00 0.00 C ATOM 0 HA PRO B 69 2.275 -10.015 -7.781 1.00 0.00 H new ATOM 0 HB2 PRO B 69 3.288 -7.372 -7.490 1.00 0.00 H new ATOM 0 HB3 PRO B 69 3.111 -8.472 -6.137 1.00 0.00 H new ATOM 0 HG2 PRO B 69 5.559 -7.506 -7.326 1.00 0.00 H new ATOM 0 HG3 PRO B 69 5.382 -8.558 -5.935 1.00 0.00 H new ATOM 0 HD2 PRO B 69 6.060 -9.268 -8.717 1.00 0.00 H new ATOM 0 HD3 PRO B 69 6.290 -10.205 -7.254 1.00 0.00 H new ATOM 1984 N LYS B 70 3.830 -8.544 -10.234 1.00 0.00 N ATOM 1985 CA LYS B 70 3.706 -7.806 -11.503 1.00 0.00 C ATOM 1986 C LYS B 70 3.320 -6.352 -11.248 1.00 0.00 C ATOM 1987 O LYS B 70 2.151 -6.000 -11.281 1.00 0.00 O ATOM 1988 CB LYS B 70 2.735 -8.415 -12.548 1.00 0.00 C ATOM 1989 CG LYS B 70 3.108 -9.757 -13.166 1.00 0.00 C ATOM 1990 CD LYS B 70 2.896 -10.935 -12.233 1.00 0.00 C ATOM 1991 CE LYS B 70 2.936 -12.212 -13.027 1.00 0.00 C ATOM 1992 NZ LYS B 70 2.436 -13.375 -12.264 1.00 0.00 N ATOM 0 H LYS B 70 4.792 -8.804 -10.016 1.00 0.00 H new ATOM 0 HA LYS B 70 4.699 -7.880 -11.946 1.00 0.00 H new ATOM 0 HB2 LYS B 70 1.759 -8.524 -12.075 1.00 0.00 H new ATOM 0 HB3 LYS B 70 2.619 -7.694 -13.357 1.00 0.00 H new ATOM 0 HG2 LYS B 70 2.517 -9.909 -14.069 1.00 0.00 H new ATOM 0 HG3 LYS B 70 4.154 -9.729 -13.471 1.00 0.00 H new ATOM 0 HD2 LYS B 70 3.668 -10.948 -11.463 1.00 0.00 H new ATOM 0 HD3 LYS B 70 1.938 -10.841 -11.722 1.00 0.00 H new ATOM 0 HE2 LYS B 70 2.339 -12.092 -13.931 1.00 0.00 H new ATOM 0 HE3 LYS B 70 3.960 -12.405 -13.345 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 1.906 -14.005 -12.899 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 3.239 -13.893 -11.854 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 1.810 -13.047 -11.501 1.00 0.00 H new ATOM 2006 N PRO B 71 4.294 -5.503 -10.921 1.00 0.00 N ATOM 2007 CA PRO B 71 4.040 -4.085 -10.676 1.00 0.00 C ATOM 2008 C PRO B 71 3.729 -3.303 -11.963 1.00 0.00 C ATOM 2009 O PRO B 71 4.393 -3.476 -13.007 1.00 0.00 O ATOM 2010 CB PRO B 71 5.338 -3.595 -10.039 1.00 0.00 C ATOM 2011 CG PRO B 71 6.387 -4.523 -10.549 1.00 0.00 C ATOM 2012 CD PRO B 71 5.713 -5.857 -10.727 1.00 0.00 C ATOM 0 HA PRO B 71 3.162 -3.934 -10.048 1.00 0.00 H new ATOM 0 HB2 PRO B 71 5.552 -2.564 -10.320 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.280 -3.623 -8.951 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.798 -4.165 -11.493 1.00 0.00 H new ATOM 0 HG3 PRO B 71 7.217 -4.596 -9.847 1.00 0.00 H new ATOM 0 HD2 PRO B 71 6.113 -6.397 -11.585 1.00 0.00 H new ATOM 0 HD3 PRO B 71 5.852 -6.496 -9.855 1.00 0.00 H new ATOM 2020 N VAL B 72 2.711 -2.492 -11.890 1.00 0.00 N ATOM 2021 CA VAL B 72 2.283 -1.648 -12.970 1.00 0.00 C ATOM 2022 C VAL B 72 2.521 -0.194 -12.564 1.00 0.00 C ATOM 2023 O VAL B 72 1.993 0.266 -11.542 1.00 0.00 O ATOM 2024 CB VAL B 72 0.773 -1.857 -13.273 1.00 0.00 C ATOM 2025 CG1 VAL B 72 0.339 -1.036 -14.477 1.00 0.00 C ATOM 2026 CG2 VAL B 72 0.459 -3.332 -13.487 1.00 0.00 C ATOM 0 H VAL B 72 2.139 -2.397 -11.051 1.00 0.00 H new ATOM 0 HA VAL B 72 2.848 -1.898 -13.868 1.00 0.00 H new ATOM 0 HB VAL B 72 0.209 -1.512 -12.407 1.00 0.00 H new ATOM 0 HG11 VAL B 72 -0.722 -1.201 -14.667 1.00 0.00 H new ATOM 0 HG12 VAL B 72 0.512 0.022 -14.278 1.00 0.00 H new ATOM 0 HG13 VAL B 72 0.915 -1.339 -15.351 1.00 0.00 H new ATOM 0 HG21 VAL B 72 -0.604 -3.451 -13.697 1.00 0.00 H new ATOM 0 HG22 VAL B 72 1.040 -3.709 -14.329 1.00 0.00 H new ATOM 0 HG23 VAL B 72 0.716 -3.893 -12.588 1.00 0.00 H new ATOM 2036 N ARG B 73 3.325 0.494 -13.343 1.00 0.00 N ATOM 2037 CA ARG B 73 3.697 1.874 -13.075 1.00 0.00 C ATOM 2038 C ARG B 73 2.547 2.816 -13.419 1.00 0.00 C ATOM 2039 O ARG B 73 2.120 2.912 -14.586 1.00 0.00 O ATOM 2040 CB ARG B 73 4.973 2.224 -13.864 1.00 0.00 C ATOM 2041 CG ARG B 73 5.461 3.670 -13.755 1.00 0.00 C ATOM 2042 CD ARG B 73 5.781 4.089 -12.326 1.00 0.00 C ATOM 2043 NE ARG B 73 6.760 3.213 -11.682 1.00 0.00 N ATOM 2044 CZ ARG B 73 8.073 3.419 -11.599 1.00 0.00 C ATOM 2045 NH1 ARG B 73 8.645 4.425 -12.234 1.00 0.00 N ATOM 2046 NH2 ARG B 73 8.807 2.588 -10.883 1.00 0.00 N ATOM 0 H ARG B 73 3.746 0.112 -14.190 1.00 0.00 H new ATOM 0 HA ARG B 73 3.906 1.994 -12.012 1.00 0.00 H new ATOM 0 HB2 ARG B 73 5.774 1.566 -13.528 1.00 0.00 H new ATOM 0 HB3 ARG B 73 4.797 2.001 -14.916 1.00 0.00 H new ATOM 0 HG2 ARG B 73 6.352 3.794 -14.371 1.00 0.00 H new ATOM 0 HG3 ARG B 73 4.699 4.336 -14.160 1.00 0.00 H new ATOM 0 HD2 ARG B 73 6.161 5.111 -12.329 1.00 0.00 H new ATOM 0 HD3 ARG B 73 4.862 4.092 -11.739 1.00 0.00 H new ATOM 0 HE ARG B 73 6.401 2.360 -11.254 1.00 0.00 H new ATOM 0 HH11 ARG B 73 8.080 5.059 -12.799 1.00 0.00 H new ATOM 0 HH12 ARG B 73 9.652 4.568 -12.160 1.00 0.00 H new ATOM 0 HH21 ARG B 73 8.367 1.802 -10.404 1.00 0.00 H new ATOM 0 HH22 ARG B 73 9.814 2.731 -10.809 1.00 0.00 H new ATOM 2060 N VAL B 74 2.051 3.489 -12.413 1.00 0.00 N ATOM 2061 CA VAL B 74 0.927 4.383 -12.541 1.00 0.00 C ATOM 2062 C VAL B 74 1.147 5.675 -11.738 1.00 0.00 C ATOM 2063 O VAL B 74 2.258 5.933 -11.194 1.00 0.00 O ATOM 2064 CB VAL B 74 -0.416 3.706 -12.071 1.00 0.00 C ATOM 2065 CG1 VAL B 74 -0.852 2.603 -13.027 1.00 0.00 C ATOM 2066 CG2 VAL B 74 -0.276 3.140 -10.664 1.00 0.00 C ATOM 0 H VAL B 74 2.423 3.431 -11.465 1.00 0.00 H new ATOM 0 HA VAL B 74 0.845 4.627 -13.600 1.00 0.00 H new ATOM 0 HB VAL B 74 -1.182 4.481 -12.069 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -1.782 2.159 -12.671 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -1.008 3.023 -14.021 1.00 0.00 H new ATOM 0 HG13 VAL B 74 -0.079 1.836 -13.075 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -1.216 2.678 -10.362 1.00 0.00 H new ATOM 0 HG22 VAL B 74 0.517 2.392 -10.650 1.00 0.00 H new ATOM 0 HG23 VAL B 74 -0.028 3.944 -9.971 1.00 0.00 H new ATOM 2076 N THR B 75 0.120 6.494 -11.738 1.00 0.00 N ATOM 2077 CA THR B 75 0.031 7.719 -10.987 1.00 0.00 C ATOM 2078 C THR B 75 -1.340 7.728 -10.286 1.00 0.00 C ATOM 2079 O THR B 75 -2.174 6.875 -10.575 1.00 0.00 O ATOM 2080 CB THR B 75 0.178 8.968 -11.904 1.00 0.00 C ATOM 2081 OG1 THR B 75 -0.784 8.933 -12.971 1.00 0.00 O ATOM 2082 CG2 THR B 75 1.578 9.068 -12.487 1.00 0.00 C ATOM 0 H THR B 75 -0.717 6.311 -12.291 1.00 0.00 H new ATOM 0 HA THR B 75 0.843 7.766 -10.262 1.00 0.00 H new ATOM 0 HB THR B 75 -0.004 9.846 -11.284 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.536 8.235 -13.612 1.00 0.00 H new ATOM 0 HG21 THR B 75 1.645 9.951 -13.122 1.00 0.00 H new ATOM 0 HG22 THR B 75 2.304 9.146 -11.678 1.00 0.00 H new ATOM 0 HG23 THR B 75 1.790 8.178 -13.080 1.00 0.00 H new ATOM 2090 N LEU B 76 -1.591 8.677 -9.410 1.00 0.00 N ATOM 2091 CA LEU B 76 -2.854 8.713 -8.662 1.00 0.00 C ATOM 2092 C LEU B 76 -3.943 9.386 -9.459 1.00 0.00 C ATOM 2093 O LEU B 76 -5.128 9.110 -9.276 1.00 0.00 O ATOM 2094 CB LEU B 76 -2.659 9.442 -7.345 1.00 0.00 C ATOM 2095 CG LEU B 76 -1.724 8.772 -6.366 1.00 0.00 C ATOM 2096 CD1 LEU B 76 -1.407 9.703 -5.226 1.00 0.00 C ATOM 2097 CD2 LEU B 76 -2.331 7.490 -5.825 1.00 0.00 C ATOM 0 H LEU B 76 -0.947 9.437 -9.190 1.00 0.00 H new ATOM 0 HA LEU B 76 -3.158 7.684 -8.468 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -2.281 10.443 -7.555 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -3.632 9.562 -6.868 1.00 0.00 H new ATOM 0 HG LEU B 76 -0.804 8.525 -6.896 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -0.732 9.207 -4.528 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -0.931 10.604 -5.613 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -2.328 9.973 -4.710 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -1.638 7.027 -5.123 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -3.267 7.718 -5.315 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -2.525 6.803 -6.649 1.00 0.00 H new ATOM 2109 N ASP B 77 -3.535 10.244 -10.359 1.00 0.00 N ATOM 2110 CA ASP B 77 -4.459 11.007 -11.187 1.00 0.00 C ATOM 2111 C ASP B 77 -5.167 10.092 -12.168 1.00 0.00 C ATOM 2112 O ASP B 77 -6.333 10.295 -12.504 1.00 0.00 O ATOM 2113 CB ASP B 77 -3.709 12.109 -11.946 1.00 0.00 C ATOM 2114 CG ASP B 77 -4.628 13.043 -12.703 1.00 0.00 C ATOM 2115 OD1 ASP B 77 -4.987 12.759 -13.860 1.00 0.00 O ATOM 2116 OD2 ASP B 77 -5.001 14.094 -12.156 1.00 0.00 O ATOM 0 H ASP B 77 -2.552 10.440 -10.545 1.00 0.00 H new ATOM 0 HA ASP B 77 -5.203 11.470 -10.538 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -3.115 12.688 -11.239 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -3.012 11.649 -12.646 1.00 0.00 H new ATOM 2121 N GLU B 78 -4.482 9.049 -12.586 1.00 0.00 N ATOM 2122 CA GLU B 78 -5.037 8.138 -13.562 1.00 0.00 C ATOM 2123 C GLU B 78 -5.865 7.040 -12.892 1.00 0.00 C ATOM 2124 O GLU B 78 -6.586 6.310 -13.566 1.00 0.00 O ATOM 2125 CB GLU B 78 -3.938 7.539 -14.443 1.00 0.00 C ATOM 2126 CG GLU B 78 -2.932 6.688 -13.696 1.00 0.00 C ATOM 2127 CD GLU B 78 -1.822 6.212 -14.579 1.00 0.00 C ATOM 2128 OE1 GLU B 78 -2.017 5.250 -15.310 1.00 0.00 O ATOM 2129 OE2 GLU B 78 -0.722 6.807 -14.536 1.00 0.00 O ATOM 0 H GLU B 78 -3.543 8.812 -12.266 1.00 0.00 H new ATOM 0 HA GLU B 78 -5.707 8.710 -14.204 1.00 0.00 H new ATOM 0 HB2 GLU B 78 -4.403 6.933 -15.220 1.00 0.00 H new ATOM 0 HB3 GLU B 78 -3.409 8.349 -14.944 1.00 0.00 H new ATOM 0 HG2 GLU B 78 -2.514 7.264 -12.870 1.00 0.00 H new ATOM 0 HG3 GLU B 78 -3.440 5.828 -13.260 1.00 0.00 H new ATOM 2136 N LEU B 79 -5.750 6.917 -11.574 1.00 0.00 N ATOM 2137 CA LEU B 79 -6.517 5.913 -10.853 1.00 0.00 C ATOM 2138 C LEU B 79 -7.963 6.357 -10.741 1.00 0.00 C ATOM 2139 O LEU B 79 -8.256 7.261 -9.919 1.00 0.00 O ATOM 2140 CB LEU B 79 -5.935 5.635 -9.462 1.00 0.00 C ATOM 2141 CG LEU B 79 -4.483 5.161 -9.408 1.00 0.00 C ATOM 2142 CD1 LEU B 79 -4.095 4.822 -7.985 1.00 0.00 C ATOM 2143 CD2 LEU B 79 -4.247 3.974 -10.330 1.00 0.00 C ATOM 2144 OXT LEU B 79 -8.809 5.840 -11.489 1.00 0.00 O ATOM 0 H LEU B 79 -5.141 7.492 -10.992 1.00 0.00 H new ATOM 0 HA LEU B 79 -6.463 4.982 -11.417 1.00 0.00 H new ATOM 0 HB2 LEU B 79 -6.018 6.547 -8.870 1.00 0.00 H new ATOM 0 HB3 LEU B 79 -6.557 4.883 -8.977 1.00 0.00 H new ATOM 0 HG LEU B 79 -3.850 5.976 -9.759 1.00 0.00 H new ATOM 0 HD11 LEU B 79 -3.058 4.486 -7.961 1.00 0.00 H new ATOM 0 HD12 LEU B 79 -4.204 5.707 -7.358 1.00 0.00 H new ATOM 0 HD13 LEU B 79 -4.742 4.029 -7.610 1.00 0.00 H new ATOM 0 HD21 LEU B 79 -3.204 3.665 -10.265 1.00 0.00 H new ATOM 0 HD22 LEU B 79 -4.890 3.147 -10.030 1.00 0.00 H new ATOM 0 HD23 LEU B 79 -4.478 4.259 -11.356 1.00 0.00 H new