USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 102 GLN : amide:sc= -1.58 K(o=-1.6,f=-2.8!) USER MOD Set 1.2: A 125 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 60 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 63 HIS : no HD1:sc= -1.66 K(o=-1.7,f=-2.8!) USER MOD Single : A 17 SER OG : rot 39:sc= 0.0469 USER MOD Single : A 19 CYS SG : rot 170:sc= -0.298 USER MOD Single : A 25 MET CE :methyl -168:sc= -1.8 (180deg=-2.19!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 159:sc= 1.07 USER MOD Single : A 39 THR OG1 : rot -168:sc= -0.189 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -147:sc= 0.0734 USER MOD Single : A 49 GLN : amide:sc= -1.07 K(o=-1.1,f=-1.7) USER MOD Single : A 52 SER OG : rot 173:sc= 0.25 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 CYS SG : rot 29:sc= -0.206 USER MOD Single : A 58 MET CE :methyl 174:sc= -0.36 (180deg=-0.409) USER MOD Single : A 62 ASN : amide:sc= -0.924 K(o=-0.92,f=-2) USER MOD Single : A 64 CYS SG : rot 180:sc= -0.682 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.809 K(o=-0.81,f=-4.6!) USER MOD Single : A 69 ASN : amide:sc= -0.809 K(o=-0.81,f=-10!) USER MOD Single : A 73 GLN : amide:sc= -0.38 K(o=-0.38,f=-2.1) USER MOD Single : A 75 THR OG1 : rot 16:sc= 0.943 USER MOD Single : A 77 MET CE :methyl -176:sc= -0.0116 (180deg=-0.0211) USER MOD Single : A 79 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 70:sc= -1.34 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 ASN : amide:sc= -1.13 K(o=-1.1,f=-7.5!) USER MOD Single : A 98 TYR OH : rot 120:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0.0947 USER MOD Single : A 101 HIS : no HD1:sc= -0.273 X(o=-0.27,f=-0.27) USER MOD Single : A 105 TYR OH : rot 165:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -2.33 K(o=-2.3,f=-3.3) USER MOD Single : A 120 TYR OH : rot 30:sc= -0.419 USER MOD Single : A 122 TYR OH : rot 180:sc=-0.00891 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -137:sc= 1.07 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot -89:sc= 0.0611 USER MOD ----------------------------------------------------------------- ATOM 156 N GLY A 15 8.877 -18.053 -10.623 1.00 0.00 N ATOM 157 CA GLY A 15 7.442 -18.050 -10.412 1.00 0.00 C ATOM 158 C GLY A 15 6.839 -16.666 -10.548 1.00 0.00 C ATOM 159 O GLY A 15 7.508 -15.730 -10.988 1.00 0.00 O ATOM 0 HA2 GLY A 15 6.971 -18.720 -11.131 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.223 -18.442 -9.419 1.00 0.00 H new ATOM 163 N ARG A 16 5.571 -16.534 -10.171 1.00 0.00 N ATOM 164 CA ARG A 16 4.877 -15.255 -10.256 1.00 0.00 C ATOM 165 C ARG A 16 5.006 -14.479 -8.948 1.00 0.00 C ATOM 166 O ARG A 16 5.382 -15.037 -7.918 1.00 0.00 O ATOM 167 CB ARG A 16 3.400 -15.473 -10.589 1.00 0.00 C ATOM 168 CG ARG A 16 3.075 -15.291 -12.062 1.00 0.00 C ATOM 169 CD ARG A 16 2.806 -16.625 -12.742 1.00 0.00 C ATOM 170 NE ARG A 16 1.442 -16.711 -13.257 1.00 0.00 N ATOM 171 CZ ARG A 16 1.010 -17.699 -14.033 1.00 0.00 C ATOM 172 NH1 ARG A 16 1.832 -18.680 -14.381 1.00 0.00 N ATOM 173 NH2 ARG A 16 -0.245 -17.708 -14.462 1.00 0.00 N ATOM 0 H ARG A 16 5.004 -17.298 -9.804 1.00 0.00 H new ATOM 0 HA ARG A 16 5.339 -14.671 -11.052 1.00 0.00 H new ATOM 0 HB2 ARG A 16 3.112 -16.479 -10.284 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.798 -14.778 -10.004 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.203 -14.646 -12.166 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.905 -14.788 -12.559 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.512 -16.764 -13.561 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.978 -17.435 -12.033 1.00 0.00 H new ATOM 0 HE ARG A 16 0.785 -15.972 -13.007 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.798 -18.677 -14.053 1.00 0.00 H new ATOM 0 HH12 ARG A 16 1.498 -19.438 -14.977 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -0.880 -16.956 -14.196 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -0.575 -18.467 -15.058 1.00 0.00 H new ATOM 187 N SER A 17 4.691 -13.188 -8.999 1.00 0.00 N ATOM 188 CA SER A 17 4.776 -12.334 -7.820 1.00 0.00 C ATOM 189 C SER A 17 3.813 -11.157 -7.932 1.00 0.00 C ATOM 190 O SER A 17 4.046 -10.221 -8.697 1.00 0.00 O ATOM 191 CB SER A 17 6.206 -11.823 -7.636 1.00 0.00 C ATOM 192 OG SER A 17 6.903 -12.593 -6.672 1.00 0.00 O ATOM 0 H SER A 17 4.375 -12.711 -9.844 1.00 0.00 H new ATOM 0 HA SER A 17 4.496 -12.928 -6.950 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.735 -11.862 -8.588 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.185 -10.778 -7.326 1.00 0.00 H new ATOM 0 HG SER A 17 6.664 -13.538 -6.773 1.00 0.00 H new ATOM 198 N TRP A 18 2.730 -11.211 -7.165 1.00 0.00 N ATOM 199 CA TRP A 18 1.731 -10.149 -7.177 1.00 0.00 C ATOM 200 C TRP A 18 2.382 -8.786 -6.970 1.00 0.00 C ATOM 201 O TRP A 18 3.557 -8.697 -6.612 1.00 0.00 O ATOM 202 CB TRP A 18 0.680 -10.396 -6.094 1.00 0.00 C ATOM 203 CG TRP A 18 -0.161 -11.610 -6.348 1.00 0.00 C ATOM 204 CD1 TRP A 18 0.188 -12.911 -6.120 1.00 0.00 C ATOM 205 CD2 TRP A 18 -1.490 -11.636 -6.881 1.00 0.00 C ATOM 206 NE1 TRP A 18 -0.844 -13.744 -6.479 1.00 0.00 N ATOM 207 CE2 TRP A 18 -1.885 -12.987 -6.948 1.00 0.00 C ATOM 208 CE3 TRP A 18 -2.384 -10.651 -7.306 1.00 0.00 C ATOM 209 CZ2 TRP A 18 -3.135 -13.373 -7.424 1.00 0.00 C ATOM 210 CZ3 TRP A 18 -3.625 -11.036 -7.778 1.00 0.00 C ATOM 211 CH2 TRP A 18 -3.991 -12.387 -7.833 1.00 0.00 C ATOM 0 H TRP A 18 2.521 -11.979 -6.527 1.00 0.00 H new ATOM 0 HA TRP A 18 1.245 -10.154 -8.152 1.00 0.00 H new ATOM 0 HB2 TRP A 18 1.179 -10.504 -5.131 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.032 -9.523 -6.021 1.00 0.00 H new ATOM 0 HD1 TRP A 18 1.136 -13.237 -5.717 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -0.836 -14.761 -6.408 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -2.111 -9.607 -7.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.419 -14.414 -7.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -4.324 -10.283 -8.110 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -4.968 -12.656 -8.206 1.00 0.00 H new ATOM 222 N CYS A 19 1.612 -7.727 -7.196 1.00 0.00 N ATOM 223 CA CYS A 19 2.116 -6.367 -7.033 1.00 0.00 C ATOM 224 C CYS A 19 0.994 -5.348 -7.205 1.00 0.00 C ATOM 225 O CYS A 19 -0.171 -5.713 -7.369 1.00 0.00 O ATOM 226 CB CYS A 19 3.232 -6.091 -8.042 1.00 0.00 C ATOM 227 SG CYS A 19 2.655 -5.895 -9.745 1.00 0.00 S ATOM 0 H CYS A 19 0.638 -7.783 -7.492 1.00 0.00 H new ATOM 0 HA CYS A 19 2.517 -6.272 -6.024 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.762 -5.187 -7.743 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.951 -6.909 -8.005 1.00 0.00 H new ATOM 0 HG CYS A 19 3.629 -5.457 -10.486 1.00 0.00 H new ATOM 233 N LEU A 20 1.353 -4.070 -7.164 1.00 0.00 N ATOM 234 CA LEU A 20 0.376 -2.996 -7.313 1.00 0.00 C ATOM 235 C LEU A 20 0.655 -2.177 -8.569 1.00 0.00 C ATOM 236 O LEU A 20 1.136 -1.047 -8.491 1.00 0.00 O ATOM 237 CB LEU A 20 0.396 -2.087 -6.083 1.00 0.00 C ATOM 238 CG LEU A 20 -0.011 -2.738 -4.761 1.00 0.00 C ATOM 239 CD1 LEU A 20 0.020 -1.720 -3.632 1.00 0.00 C ATOM 240 CD2 LEU A 20 -1.393 -3.365 -4.878 1.00 0.00 C ATOM 0 H LEU A 20 2.313 -3.752 -7.029 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.612 -3.447 -7.407 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.402 -1.683 -5.971 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.268 -1.243 -6.269 1.00 0.00 H new ATOM 0 HG LEU A 20 0.706 -3.526 -4.531 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.273 -2.202 -2.699 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.028 -1.318 -3.532 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.673 -0.909 -3.854 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.666 -3.824 -3.928 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -2.122 -2.595 -5.132 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.382 -4.126 -5.658 1.00 0.00 H new ATOM 252 N ARG A 21 0.347 -2.754 -9.726 1.00 0.00 N ATOM 253 CA ARG A 21 0.564 -2.077 -10.999 1.00 0.00 C ATOM 254 C ARG A 21 -0.059 -0.685 -10.987 1.00 0.00 C ATOM 255 O ARG A 21 -1.282 -0.541 -10.975 1.00 0.00 O ATOM 256 CB ARG A 21 -0.025 -2.901 -12.146 1.00 0.00 C ATOM 257 CG ARG A 21 0.689 -2.697 -13.472 1.00 0.00 C ATOM 258 CD ARG A 21 -0.166 -3.158 -14.642 1.00 0.00 C ATOM 259 NE ARG A 21 -1.228 -2.204 -14.953 1.00 0.00 N ATOM 260 CZ ARG A 21 -1.854 -2.157 -16.123 1.00 0.00 C ATOM 261 NH1 ARG A 21 -1.527 -3.005 -17.088 1.00 0.00 N ATOM 262 NH2 ARG A 21 -2.810 -1.260 -16.331 1.00 0.00 N ATOM 0 H ARG A 21 -0.053 -3.688 -9.808 1.00 0.00 H new ATOM 0 HA ARG A 21 1.639 -1.974 -11.149 1.00 0.00 H new ATOM 0 HB2 ARG A 21 0.014 -3.957 -11.881 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.077 -2.641 -12.266 1.00 0.00 H new ATOM 0 HG2 ARG A 21 0.937 -1.643 -13.594 1.00 0.00 H new ATOM 0 HG3 ARG A 21 1.630 -3.247 -13.468 1.00 0.00 H new ATOM 0 HD2 ARG A 21 0.465 -3.297 -15.520 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -0.606 -4.128 -14.409 1.00 0.00 H new ATOM 0 HE ARG A 21 -1.504 -1.538 -14.232 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -0.793 -3.696 -16.933 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -2.010 -2.967 -17.986 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -3.065 -0.605 -15.591 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -3.290 -1.225 -17.230 1.00 0.00 H new ATOM 276 N ARG A 22 0.790 0.338 -10.990 1.00 0.00 N ATOM 277 CA ARG A 22 0.323 1.719 -10.977 1.00 0.00 C ATOM 278 C ARG A 22 -0.633 1.980 -12.138 1.00 0.00 C ATOM 279 O ARG A 22 -0.274 1.806 -13.302 1.00 0.00 O ATOM 280 CB ARG A 22 1.509 2.682 -11.053 1.00 0.00 C ATOM 281 CG ARG A 22 1.177 4.094 -10.601 1.00 0.00 C ATOM 282 CD ARG A 22 1.010 4.172 -9.092 1.00 0.00 C ATOM 283 NE ARG A 22 1.238 5.522 -8.584 1.00 0.00 N ATOM 284 CZ ARG A 22 2.444 6.025 -8.349 1.00 0.00 C ATOM 285 NH1 ARG A 22 3.527 5.294 -8.574 1.00 0.00 N ATOM 286 NH2 ARG A 22 2.570 7.263 -7.887 1.00 0.00 N ATOM 0 H ARG A 22 1.805 0.236 -11.001 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.212 1.886 -10.042 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.321 2.294 -10.438 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.874 2.715 -12.079 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.969 4.773 -10.916 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.260 4.426 -11.087 1.00 0.00 H new ATOM 0 HD2 ARG A 22 0.005 3.848 -8.822 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.706 3.483 -8.614 1.00 0.00 H new ATOM 0 HE ARG A 22 0.426 6.111 -8.400 1.00 0.00 H new ATOM 0 HH11 ARG A 22 3.435 4.342 -8.929 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.452 5.684 -8.392 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.740 7.829 -7.712 1.00 0.00 H new ATOM 0 HH22 ARG A 22 3.497 7.648 -7.707 1.00 0.00 H new ATOM 300 N VAL A 23 -1.852 2.398 -11.811 1.00 0.00 N ATOM 301 CA VAL A 23 -2.860 2.684 -12.825 1.00 0.00 C ATOM 302 C VAL A 23 -2.506 3.940 -13.613 1.00 0.00 C ATOM 303 O VAL A 23 -2.340 5.017 -13.042 1.00 0.00 O ATOM 304 CB VAL A 23 -4.254 2.861 -12.197 1.00 0.00 C ATOM 305 CG1 VAL A 23 -5.286 3.184 -13.267 1.00 0.00 C ATOM 306 CG2 VAL A 23 -4.651 1.614 -11.421 1.00 0.00 C ATOM 0 H VAL A 23 -2.165 2.546 -10.852 1.00 0.00 H new ATOM 0 HA VAL A 23 -2.881 1.829 -13.500 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.215 3.698 -11.500 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.265 3.305 -12.803 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.007 4.108 -13.774 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.326 2.370 -13.991 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.639 1.757 -10.984 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.673 0.758 -12.095 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.926 1.433 -10.628 1.00 0.00 H new ATOM 316 N GLY A 24 -2.392 3.794 -14.930 1.00 0.00 N ATOM 317 CA GLY A 24 -2.058 4.926 -15.775 1.00 0.00 C ATOM 318 C GLY A 24 -0.572 5.019 -16.059 1.00 0.00 C ATOM 319 O GLY A 24 -0.166 5.464 -17.132 1.00 0.00 O ATOM 0 H GLY A 24 -2.525 2.913 -15.426 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.600 4.845 -16.717 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.391 5.846 -15.294 1.00 0.00 H new ATOM 323 N MET A 25 0.240 4.602 -15.094 1.00 0.00 N ATOM 324 CA MET A 25 1.690 4.641 -15.246 1.00 0.00 C ATOM 325 C MET A 25 2.256 3.237 -15.427 1.00 0.00 C ATOM 326 O MET A 25 1.767 2.278 -14.829 1.00 0.00 O ATOM 327 CB MET A 25 2.334 5.310 -14.030 1.00 0.00 C ATOM 328 CG MET A 25 2.545 6.806 -14.199 1.00 0.00 C ATOM 329 SD MET A 25 2.472 7.699 -12.635 1.00 0.00 S ATOM 330 CE MET A 25 3.677 6.791 -11.670 1.00 0.00 C ATOM 0 H MET A 25 -0.081 4.233 -14.199 1.00 0.00 H new ATOM 0 HA MET A 25 1.921 5.224 -16.137 1.00 0.00 H new ATOM 0 HB2 MET A 25 1.707 5.137 -13.156 1.00 0.00 H new ATOM 0 HB3 MET A 25 3.295 4.836 -13.832 1.00 0.00 H new ATOM 0 HG2 MET A 25 3.513 6.982 -14.668 1.00 0.00 H new ATOM 0 HG3 MET A 25 1.787 7.202 -14.875 1.00 0.00 H new ATOM 0 HE1 MET A 25 3.596 7.080 -10.622 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.490 5.722 -11.767 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.679 7.018 -12.033 1.00 0.00 H new ATOM 340 N SER A 26 3.290 3.122 -16.256 1.00 0.00 N ATOM 341 CA SER A 26 3.919 1.833 -16.519 1.00 0.00 C ATOM 342 C SER A 26 5.093 1.600 -15.573 1.00 0.00 C ATOM 343 O SER A 26 5.927 0.725 -15.805 1.00 0.00 O ATOM 344 CB SER A 26 4.397 1.762 -17.970 1.00 0.00 C ATOM 345 OG SER A 26 3.301 1.682 -18.865 1.00 0.00 O ATOM 0 H SER A 26 3.709 3.906 -16.756 1.00 0.00 H new ATOM 0 HA SER A 26 3.177 1.052 -16.350 1.00 0.00 H new ATOM 0 HB2 SER A 26 4.996 2.642 -18.202 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.042 0.893 -18.102 1.00 0.00 H new ATOM 0 HG SER A 26 3.633 1.639 -19.786 1.00 0.00 H new ATOM 351 N ALA A 27 5.151 2.388 -14.505 1.00 0.00 N ATOM 352 CA ALA A 27 6.220 2.267 -13.522 1.00 0.00 C ATOM 353 C ALA A 27 5.675 2.370 -12.102 1.00 0.00 C ATOM 354 O ALA A 27 4.464 2.422 -11.894 1.00 0.00 O ATOM 355 CB ALA A 27 7.280 3.332 -13.761 1.00 0.00 C ATOM 0 H ALA A 27 4.469 3.118 -14.298 1.00 0.00 H new ATOM 0 HA ALA A 27 6.676 1.284 -13.637 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.072 3.230 -13.019 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.700 3.210 -14.760 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.828 4.320 -13.675 1.00 0.00 H new ATOM 361 N GLY A 28 6.578 2.398 -11.126 1.00 0.00 N ATOM 362 CA GLY A 28 6.168 2.494 -9.738 1.00 0.00 C ATOM 363 C GLY A 28 5.350 1.298 -9.291 1.00 0.00 C ATOM 364 O GLY A 28 4.432 1.433 -8.482 1.00 0.00 O ATOM 0 H GLY A 28 7.587 2.356 -11.273 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.052 2.582 -9.106 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.584 3.403 -9.597 1.00 0.00 H new ATOM 368 N TRP A 29 5.681 0.126 -9.820 1.00 0.00 N ATOM 369 CA TRP A 29 4.969 -1.098 -9.472 1.00 0.00 C ATOM 370 C TRP A 29 5.439 -1.637 -8.125 1.00 0.00 C ATOM 371 O TRP A 29 6.567 -2.112 -7.995 1.00 0.00 O ATOM 372 CB TRP A 29 5.172 -2.157 -10.558 1.00 0.00 C ATOM 373 CG TRP A 29 4.540 -1.794 -11.867 1.00 0.00 C ATOM 374 CD1 TRP A 29 3.923 -0.616 -12.181 1.00 0.00 C ATOM 375 CD2 TRP A 29 4.460 -2.615 -13.037 1.00 0.00 C ATOM 376 NE1 TRP A 29 3.465 -0.656 -13.476 1.00 0.00 N ATOM 377 CE2 TRP A 29 3.783 -1.871 -14.023 1.00 0.00 C ATOM 378 CE3 TRP A 29 4.897 -3.905 -13.349 1.00 0.00 C ATOM 379 CZ2 TRP A 29 3.532 -2.377 -15.296 1.00 0.00 C ATOM 380 CZ3 TRP A 29 4.647 -4.406 -14.612 1.00 0.00 C ATOM 381 CH2 TRP A 29 3.971 -3.643 -15.573 1.00 0.00 C ATOM 0 H TRP A 29 6.438 -0.003 -10.492 1.00 0.00 H new ATOM 0 HA TRP A 29 3.907 -0.863 -9.398 1.00 0.00 H new ATOM 0 HB2 TRP A 29 6.240 -2.312 -10.709 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.758 -3.105 -10.213 1.00 0.00 H new ATOM 0 HD1 TRP A 29 3.812 0.223 -11.510 1.00 0.00 H new ATOM 0 HE1 TRP A 29 2.969 0.097 -13.953 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.421 -4.500 -12.616 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 3.010 -1.791 -16.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 4.978 -5.403 -14.863 1.00 0.00 H new ATOM 0 HH2 TRP A 29 3.793 -4.062 -16.552 1.00 0.00 H new ATOM 392 N LEU A 30 4.567 -1.560 -7.126 1.00 0.00 N ATOM 393 CA LEU A 30 4.892 -2.040 -5.788 1.00 0.00 C ATOM 394 C LEU A 30 4.833 -3.563 -5.727 1.00 0.00 C ATOM 395 O LEU A 30 3.751 -4.153 -5.706 1.00 0.00 O ATOM 396 CB LEU A 30 3.931 -1.439 -4.761 1.00 0.00 C ATOM 397 CG LEU A 30 3.580 0.036 -4.953 1.00 0.00 C ATOM 398 CD1 LEU A 30 2.607 0.498 -3.880 1.00 0.00 C ATOM 399 CD2 LEU A 30 4.839 0.891 -4.938 1.00 0.00 C ATOM 0 H LEU A 30 3.629 -1.170 -7.217 1.00 0.00 H new ATOM 0 HA LEU A 30 5.908 -1.724 -5.553 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.007 -2.017 -4.776 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.367 -1.562 -3.770 1.00 0.00 H new ATOM 0 HG LEU A 30 3.099 0.151 -5.924 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.369 1.551 -4.033 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.693 -0.093 -3.939 1.00 0.00 H new ATOM 0 HD13 LEU A 30 3.060 0.368 -2.897 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.569 1.938 -5.076 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.349 0.771 -3.982 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.501 0.577 -5.745 1.00 0.00 H new ATOM 411 N LEU A 31 6.001 -4.195 -5.696 1.00 0.00 N ATOM 412 CA LEU A 31 6.082 -5.650 -5.634 1.00 0.00 C ATOM 413 C LEU A 31 5.433 -6.179 -4.359 1.00 0.00 C ATOM 414 O LEU A 31 5.555 -5.575 -3.292 1.00 0.00 O ATOM 415 CB LEU A 31 7.542 -6.103 -5.702 1.00 0.00 C ATOM 416 CG LEU A 31 7.793 -7.595 -5.485 1.00 0.00 C ATOM 417 CD1 LEU A 31 7.433 -8.385 -6.733 1.00 0.00 C ATOM 418 CD2 LEU A 31 9.244 -7.841 -5.096 1.00 0.00 C ATOM 0 H LEU A 31 6.905 -3.723 -5.713 1.00 0.00 H new ATOM 0 HA LEU A 31 5.542 -6.055 -6.489 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.942 -5.826 -6.677 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.109 -5.547 -4.955 1.00 0.00 H new ATOM 0 HG LEU A 31 7.156 -7.935 -4.669 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.619 -9.445 -6.559 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.379 -8.235 -6.967 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.043 -8.042 -7.569 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.404 -8.909 -4.946 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.899 -7.484 -5.891 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.469 -7.307 -4.173 1.00 0.00 H new ATOM 430 N LEU A 32 4.746 -7.310 -4.475 1.00 0.00 N ATOM 431 CA LEU A 32 4.080 -7.921 -3.331 1.00 0.00 C ATOM 432 C LEU A 32 4.568 -9.351 -3.117 1.00 0.00 C ATOM 433 O LEU A 32 3.838 -10.309 -3.364 1.00 0.00 O ATOM 434 CB LEU A 32 2.564 -7.913 -3.534 1.00 0.00 C ATOM 435 CG LEU A 32 1.880 -6.550 -3.428 1.00 0.00 C ATOM 436 CD1 LEU A 32 0.447 -6.631 -3.931 1.00 0.00 C ATOM 437 CD2 LEU A 32 1.915 -6.047 -1.992 1.00 0.00 C ATOM 0 H LEU A 32 4.636 -7.822 -5.350 1.00 0.00 H new ATOM 0 HA LEU A 32 4.325 -7.336 -2.444 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.347 -8.331 -4.517 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.115 -8.580 -2.798 1.00 0.00 H new ATOM 0 HG LEU A 32 2.423 -5.842 -4.054 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.024 -5.651 -3.848 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.445 -6.947 -4.974 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.109 -7.353 -3.332 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.424 -5.076 -1.935 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.396 -6.755 -1.346 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.950 -5.950 -1.666 1.00 0.00 H new ATOM 449 N GLU A 33 5.807 -9.484 -2.653 1.00 0.00 N ATOM 450 CA GLU A 33 6.391 -10.797 -2.404 1.00 0.00 C ATOM 451 C GLU A 33 5.519 -11.608 -1.450 1.00 0.00 C ATOM 452 O GLU A 33 5.130 -11.126 -0.386 1.00 0.00 O ATOM 453 CB GLU A 33 7.800 -10.651 -1.826 1.00 0.00 C ATOM 454 CG GLU A 33 8.900 -11.055 -2.793 1.00 0.00 C ATOM 455 CD GLU A 33 10.285 -10.915 -2.193 1.00 0.00 C ATOM 456 OE1 GLU A 33 10.394 -10.888 -0.949 1.00 0.00 O ATOM 457 OE2 GLU A 33 11.261 -10.832 -2.968 1.00 0.00 O ATOM 0 H GLU A 33 6.425 -8.700 -2.442 1.00 0.00 H new ATOM 0 HA GLU A 33 6.449 -11.327 -3.355 1.00 0.00 H new ATOM 0 HB2 GLU A 33 7.955 -9.615 -1.526 1.00 0.00 H new ATOM 0 HB3 GLU A 33 7.879 -11.259 -0.925 1.00 0.00 H new ATOM 0 HG2 GLU A 33 8.745 -12.089 -3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 33 8.833 -10.440 -3.691 1.00 0.00 H new ATOM 464 N ASP A 34 5.217 -12.842 -1.839 1.00 0.00 N ATOM 465 CA ASP A 34 4.392 -13.721 -1.019 1.00 0.00 C ATOM 466 C ASP A 34 5.073 -14.019 0.313 1.00 0.00 C ATOM 467 O ASP A 34 6.125 -14.656 0.356 1.00 0.00 O ATOM 468 CB ASP A 34 4.105 -15.027 -1.763 1.00 0.00 C ATOM 469 CG ASP A 34 3.643 -16.133 -0.834 1.00 0.00 C ATOM 470 OD1 ASP A 34 2.461 -16.114 -0.431 1.00 0.00 O ATOM 471 OD2 ASP A 34 4.463 -17.017 -0.511 1.00 0.00 O ATOM 0 H ASP A 34 5.531 -13.256 -2.717 1.00 0.00 H new ATOM 0 HA ASP A 34 3.450 -13.211 -0.819 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.341 -14.850 -2.520 1.00 0.00 H new ATOM 0 HB3 ASP A 34 5.005 -15.349 -2.287 1.00 0.00 H new ATOM 476 N GLY A 35 4.465 -13.553 1.400 1.00 0.00 N ATOM 477 CA GLY A 35 5.028 -13.778 2.719 1.00 0.00 C ATOM 478 C GLY A 35 5.907 -12.632 3.178 1.00 0.00 C ATOM 479 O GLY A 35 6.644 -12.760 4.156 1.00 0.00 O ATOM 0 H GLY A 35 3.593 -13.024 1.391 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.220 -13.921 3.436 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.612 -14.698 2.709 1.00 0.00 H new ATOM 483 N CYS A 36 5.832 -11.511 2.469 1.00 0.00 N ATOM 484 CA CYS A 36 6.630 -10.338 2.808 1.00 0.00 C ATOM 485 C CYS A 36 5.740 -9.119 3.028 1.00 0.00 C ATOM 486 O CYS A 36 5.065 -8.659 2.108 1.00 0.00 O ATOM 487 CB CYS A 36 7.646 -10.050 1.701 1.00 0.00 C ATOM 488 SG CYS A 36 9.245 -10.860 1.938 1.00 0.00 S ATOM 0 H CYS A 36 5.227 -11.390 1.657 1.00 0.00 H new ATOM 0 HA CYS A 36 7.163 -10.547 3.735 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.227 -10.369 0.746 1.00 0.00 H new ATOM 0 HB3 CYS A 36 7.802 -8.973 1.637 1.00 0.00 H new ATOM 0 HG CYS A 36 9.859 -10.950 0.796 1.00 0.00 H new ATOM 494 N GLU A 37 5.742 -8.604 4.253 1.00 0.00 N ATOM 495 CA GLU A 37 4.932 -7.440 4.594 1.00 0.00 C ATOM 496 C GLU A 37 5.323 -6.237 3.740 1.00 0.00 C ATOM 497 O GLU A 37 6.504 -5.930 3.583 1.00 0.00 O ATOM 498 CB GLU A 37 5.088 -7.099 6.077 1.00 0.00 C ATOM 499 CG GLU A 37 3.802 -6.621 6.730 1.00 0.00 C ATOM 500 CD GLU A 37 4.053 -5.701 7.908 1.00 0.00 C ATOM 501 OE1 GLU A 37 5.077 -4.987 7.896 1.00 0.00 O ATOM 502 OE2 GLU A 37 3.224 -5.694 8.842 1.00 0.00 O ATOM 0 H GLU A 37 6.295 -8.974 5.026 1.00 0.00 H new ATOM 0 HA GLU A 37 3.889 -7.683 4.393 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.449 -7.980 6.608 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.850 -6.327 6.185 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.195 -6.100 5.990 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.226 -7.484 7.064 1.00 0.00 H new ATOM 509 N VAL A 38 4.320 -5.559 3.189 1.00 0.00 N ATOM 510 CA VAL A 38 4.557 -4.390 2.352 1.00 0.00 C ATOM 511 C VAL A 38 3.911 -3.145 2.951 1.00 0.00 C ATOM 512 O VAL A 38 2.701 -2.943 2.835 1.00 0.00 O ATOM 513 CB VAL A 38 4.015 -4.601 0.926 1.00 0.00 C ATOM 514 CG1 VAL A 38 4.346 -3.405 0.046 1.00 0.00 C ATOM 515 CG2 VAL A 38 4.574 -5.884 0.329 1.00 0.00 C ATOM 0 H VAL A 38 3.336 -5.800 3.308 1.00 0.00 H new ATOM 0 HA VAL A 38 5.637 -4.248 2.305 1.00 0.00 H new ATOM 0 HB VAL A 38 2.930 -4.694 0.978 1.00 0.00 H new ATOM 0 HG11 VAL A 38 3.955 -3.572 -0.958 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.893 -2.507 0.467 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.427 -3.277 -0.003 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.181 -6.018 -0.679 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.662 -5.823 0.289 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.281 -6.732 0.948 1.00 0.00 H new ATOM 525 N THR A 39 4.725 -2.312 3.591 1.00 0.00 N ATOM 526 CA THR A 39 4.233 -1.087 4.209 1.00 0.00 C ATOM 527 C THR A 39 4.541 0.128 3.342 1.00 0.00 C ATOM 528 O THR A 39 5.679 0.328 2.916 1.00 0.00 O ATOM 529 CB THR A 39 4.847 -0.876 5.605 1.00 0.00 C ATOM 530 OG1 THR A 39 6.259 -0.661 5.492 1.00 0.00 O ATOM 531 CG2 THR A 39 4.582 -2.077 6.500 1.00 0.00 C ATOM 0 H THR A 39 5.728 -2.463 3.695 1.00 0.00 H new ATOM 0 HA THR A 39 3.153 -1.195 4.308 1.00 0.00 H new ATOM 0 HB THR A 39 4.381 0.001 6.054 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.670 -0.717 6.380 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.025 -1.905 7.481 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.507 -2.220 6.608 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.024 -2.968 6.054 1.00 0.00 H new ATOM 539 N VAL A 40 3.520 0.939 3.083 1.00 0.00 N ATOM 540 CA VAL A 40 3.683 2.137 2.267 1.00 0.00 C ATOM 541 C VAL A 40 3.392 3.396 3.076 1.00 0.00 C ATOM 542 O VAL A 40 2.588 3.376 4.007 1.00 0.00 O ATOM 543 CB VAL A 40 2.759 2.106 1.035 1.00 0.00 C ATOM 544 CG1 VAL A 40 3.087 3.255 0.093 1.00 0.00 C ATOM 545 CG2 VAL A 40 2.871 0.769 0.318 1.00 0.00 C ATOM 0 H VAL A 40 2.571 0.788 3.426 1.00 0.00 H new ATOM 0 HA VAL A 40 4.721 2.155 1.933 1.00 0.00 H new ATOM 0 HB VAL A 40 1.729 2.226 1.372 1.00 0.00 H new ATOM 0 HG11 VAL A 40 2.424 3.217 -0.772 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.950 4.203 0.614 1.00 0.00 H new ATOM 0 HG13 VAL A 40 4.122 3.169 -0.239 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.211 0.765 -0.550 1.00 0.00 H new ATOM 0 HG22 VAL A 40 3.900 0.616 -0.008 1.00 0.00 H new ATOM 0 HG23 VAL A 40 2.582 -0.033 0.997 1.00 0.00 H new ATOM 555 N GLY A 41 4.051 4.492 2.712 1.00 0.00 N ATOM 556 CA GLY A 41 3.849 5.746 3.414 1.00 0.00 C ATOM 557 C GLY A 41 4.792 6.834 2.939 1.00 0.00 C ATOM 558 O GLY A 41 5.253 6.810 1.798 1.00 0.00 O ATOM 0 H GLY A 41 4.721 4.534 1.944 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.819 6.075 3.274 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.991 5.588 4.483 1.00 0.00 H new ATOM 562 N ARG A 42 5.077 7.792 3.816 1.00 0.00 N ATOM 563 CA ARG A 42 5.968 8.895 3.478 1.00 0.00 C ATOM 564 C ARG A 42 7.168 8.933 4.421 1.00 0.00 C ATOM 565 O ARG A 42 7.760 9.987 4.647 1.00 0.00 O ATOM 566 CB ARG A 42 5.214 10.225 3.542 1.00 0.00 C ATOM 567 CG ARG A 42 4.703 10.570 4.931 1.00 0.00 C ATOM 568 CD ARG A 42 4.586 12.073 5.124 1.00 0.00 C ATOM 569 NE ARG A 42 4.434 12.434 6.531 1.00 0.00 N ATOM 570 CZ ARG A 42 4.085 13.647 6.946 1.00 0.00 C ATOM 571 NH1 ARG A 42 3.851 14.610 6.065 1.00 0.00 N ATOM 572 NH2 ARG A 42 3.968 13.898 8.243 1.00 0.00 N ATOM 0 H ARG A 42 4.704 7.826 4.765 1.00 0.00 H new ATOM 0 HA ARG A 42 6.330 8.738 2.462 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.872 11.023 3.198 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.370 10.188 2.853 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.730 10.105 5.088 1.00 0.00 H new ATOM 0 HG3 ARG A 42 5.378 10.157 5.681 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.472 12.561 4.718 1.00 0.00 H new ATOM 0 HD3 ARG A 42 3.731 12.445 4.560 1.00 0.00 H new ATOM 0 HE ARG A 42 4.605 11.715 7.234 1.00 0.00 H new ATOM 0 HH11 ARG A 42 3.939 14.420 5.067 1.00 0.00 H new ATOM 0 HH12 ARG A 42 3.583 15.541 6.386 1.00 0.00 H new ATOM 0 HH21 ARG A 42 4.146 13.159 8.923 1.00 0.00 H new ATOM 0 HH22 ARG A 42 3.700 14.830 8.560 1.00 0.00 H new ATOM 586 N GLY A 43 7.520 7.773 4.968 1.00 0.00 N ATOM 587 CA GLY A 43 8.647 7.696 5.880 1.00 0.00 C ATOM 588 C GLY A 43 9.866 7.058 5.243 1.00 0.00 C ATOM 589 O GLY A 43 9.980 7.008 4.018 1.00 0.00 O ATOM 0 H GLY A 43 7.046 6.886 4.796 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.903 8.699 6.222 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.359 7.122 6.761 1.00 0.00 H new ATOM 593 N PHE A 44 10.780 6.572 6.075 1.00 0.00 N ATOM 594 CA PHE A 44 11.998 5.937 5.586 1.00 0.00 C ATOM 595 C PHE A 44 12.021 4.454 5.944 1.00 0.00 C ATOM 596 O PHE A 44 12.613 3.641 5.235 1.00 0.00 O ATOM 597 CB PHE A 44 13.231 6.632 6.168 1.00 0.00 C ATOM 598 CG PHE A 44 13.431 6.369 7.633 1.00 0.00 C ATOM 599 CD1 PHE A 44 12.862 7.200 8.584 1.00 0.00 C ATOM 600 CD2 PHE A 44 14.189 5.290 8.059 1.00 0.00 C ATOM 601 CE1 PHE A 44 13.046 6.960 9.933 1.00 0.00 C ATOM 602 CE2 PHE A 44 14.376 5.044 9.406 1.00 0.00 C ATOM 603 CZ PHE A 44 13.803 5.881 10.344 1.00 0.00 C ATOM 0 H PHE A 44 10.701 6.606 7.091 1.00 0.00 H new ATOM 0 HA PHE A 44 12.015 6.031 4.500 1.00 0.00 H new ATOM 0 HB2 PHE A 44 14.116 6.301 5.624 1.00 0.00 H new ATOM 0 HB3 PHE A 44 13.142 7.707 6.009 1.00 0.00 H new ATOM 0 HD1 PHE A 44 12.268 8.045 8.268 1.00 0.00 H new ATOM 0 HD2 PHE A 44 14.639 4.633 7.329 1.00 0.00 H new ATOM 0 HE1 PHE A 44 12.598 7.616 10.665 1.00 0.00 H new ATOM 0 HE2 PHE A 44 14.969 4.199 9.725 1.00 0.00 H new ATOM 0 HZ PHE A 44 13.947 5.691 11.397 1.00 0.00 H new ATOM 613 N GLY A 45 11.370 4.109 7.051 1.00 0.00 N ATOM 614 CA GLY A 45 11.328 2.725 7.486 1.00 0.00 C ATOM 615 C GLY A 45 10.425 1.872 6.618 1.00 0.00 C ATOM 616 O GLY A 45 10.714 0.701 6.370 1.00 0.00 O ATOM 0 H GLY A 45 10.871 4.763 7.654 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.337 2.312 7.472 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.981 2.682 8.518 1.00 0.00 H new ATOM 620 N VAL A 46 9.325 2.458 6.155 1.00 0.00 N ATOM 621 CA VAL A 46 8.376 1.744 5.309 1.00 0.00 C ATOM 622 C VAL A 46 9.059 1.188 4.065 1.00 0.00 C ATOM 623 O VAL A 46 9.905 1.847 3.460 1.00 0.00 O ATOM 624 CB VAL A 46 7.211 2.656 4.879 1.00 0.00 C ATOM 625 CG1 VAL A 46 6.266 2.900 6.045 1.00 0.00 C ATOM 626 CG2 VAL A 46 7.741 3.971 4.326 1.00 0.00 C ATOM 0 H VAL A 46 9.069 3.426 6.352 1.00 0.00 H new ATOM 0 HA VAL A 46 7.981 0.919 5.902 1.00 0.00 H new ATOM 0 HB VAL A 46 6.652 2.155 4.089 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.450 3.546 5.723 1.00 0.00 H new ATOM 0 HG12 VAL A 46 5.861 1.949 6.390 1.00 0.00 H new ATOM 0 HG13 VAL A 46 6.809 3.380 6.859 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.905 4.603 4.027 1.00 0.00 H new ATOM 0 HG22 VAL A 46 8.324 4.480 5.093 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.374 3.773 3.461 1.00 0.00 H new ATOM 636 N THR A 47 8.685 -0.030 3.685 1.00 0.00 N ATOM 637 CA THR A 47 9.261 -0.676 2.513 1.00 0.00 C ATOM 638 C THR A 47 9.086 0.187 1.268 1.00 0.00 C ATOM 639 O THR A 47 9.860 0.085 0.316 1.00 0.00 O ATOM 640 CB THR A 47 8.623 -2.055 2.261 1.00 0.00 C ATOM 641 OG1 THR A 47 8.740 -2.870 3.433 1.00 0.00 O ATOM 642 CG2 THR A 47 9.289 -2.753 1.085 1.00 0.00 C ATOM 0 H THR A 47 7.985 -0.589 4.173 1.00 0.00 H new ATOM 0 HA THR A 47 10.324 -0.807 2.715 1.00 0.00 H new ATOM 0 HB THR A 47 7.569 -1.905 2.025 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.331 -3.744 3.266 1.00 0.00 H new ATOM 0 HG21 THR A 47 8.821 -3.725 0.926 1.00 0.00 H new ATOM 0 HG22 THR A 47 9.174 -2.144 0.188 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.349 -2.891 1.297 1.00 0.00 H new ATOM 650 N TYR A 48 8.065 1.037 1.282 1.00 0.00 N ATOM 651 CA TYR A 48 7.787 1.916 0.153 1.00 0.00 C ATOM 652 C TYR A 48 7.481 3.333 0.629 1.00 0.00 C ATOM 653 O TYR A 48 6.621 3.539 1.484 1.00 0.00 O ATOM 654 CB TYR A 48 6.613 1.376 -0.665 1.00 0.00 C ATOM 655 CG TYR A 48 6.944 0.124 -1.445 1.00 0.00 C ATOM 656 CD1 TYR A 48 7.608 0.196 -2.664 1.00 0.00 C ATOM 657 CD2 TYR A 48 6.593 -1.131 -0.963 1.00 0.00 C ATOM 658 CE1 TYR A 48 7.911 -0.945 -3.380 1.00 0.00 C ATOM 659 CE2 TYR A 48 6.894 -2.278 -1.672 1.00 0.00 C ATOM 660 CZ TYR A 48 7.553 -2.180 -2.881 1.00 0.00 C ATOM 661 OH TYR A 48 7.854 -3.319 -3.591 1.00 0.00 O ATOM 0 H TYR A 48 7.416 1.136 2.063 1.00 0.00 H new ATOM 0 HA TYR A 48 8.676 1.947 -0.478 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.780 1.167 0.006 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.278 2.148 -1.358 1.00 0.00 H new ATOM 0 HD1 TYR A 48 7.892 1.161 -3.058 1.00 0.00 H new ATOM 0 HD2 TYR A 48 6.076 -1.211 -0.018 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.426 -0.871 -4.326 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.615 -3.246 -1.282 1.00 0.00 H new ATOM 0 HH TYR A 48 7.155 -3.990 -3.445 1.00 0.00 H new ATOM 671 N GLN A 49 8.192 4.306 0.067 1.00 0.00 N ATOM 672 CA GLN A 49 7.997 5.703 0.433 1.00 0.00 C ATOM 673 C GLN A 49 7.520 6.519 -0.765 1.00 0.00 C ATOM 674 O GLN A 49 8.300 6.833 -1.665 1.00 0.00 O ATOM 675 CB GLN A 49 9.296 6.295 0.983 1.00 0.00 C ATOM 676 CG GLN A 49 9.202 7.778 1.303 1.00 0.00 C ATOM 677 CD GLN A 49 10.547 8.387 1.645 1.00 0.00 C ATOM 678 OE1 GLN A 49 11.575 8.007 1.084 1.00 0.00 O ATOM 679 NE2 GLN A 49 10.547 9.339 2.571 1.00 0.00 N ATOM 0 H GLN A 49 8.908 4.152 -0.643 1.00 0.00 H new ATOM 0 HA GLN A 49 7.230 5.745 1.207 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.578 5.754 1.886 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.093 6.139 0.256 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.776 8.304 0.449 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.518 7.923 2.140 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.671 9.623 3.010 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.423 9.786 2.843 1.00 0.00 H new ATOM 688 N LEU A 50 6.236 6.858 -0.770 1.00 0.00 N ATOM 689 CA LEU A 50 5.655 7.637 -1.858 1.00 0.00 C ATOM 690 C LEU A 50 5.778 9.132 -1.583 1.00 0.00 C ATOM 691 O LEU A 50 5.228 9.643 -0.607 1.00 0.00 O ATOM 692 CB LEU A 50 4.184 7.262 -2.050 1.00 0.00 C ATOM 693 CG LEU A 50 3.880 5.767 -2.153 1.00 0.00 C ATOM 694 CD1 LEU A 50 2.383 5.519 -2.054 1.00 0.00 C ATOM 695 CD2 LEU A 50 4.432 5.199 -3.453 1.00 0.00 C ATOM 0 H LEU A 50 5.577 6.606 -0.033 1.00 0.00 H new ATOM 0 HA LEU A 50 6.205 7.408 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.614 7.672 -1.216 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.821 7.749 -2.955 1.00 0.00 H new ATOM 0 HG LEU A 50 4.368 5.258 -1.321 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.186 4.450 -2.129 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.015 5.889 -1.097 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.874 6.040 -2.865 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.207 4.134 -3.509 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.973 5.712 -4.298 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.512 5.343 -3.484 1.00 0.00 H new ATOM 707 N VAL A 51 6.503 9.830 -2.452 1.00 0.00 N ATOM 708 CA VAL A 51 6.697 11.268 -2.306 1.00 0.00 C ATOM 709 C VAL A 51 6.312 12.007 -3.582 1.00 0.00 C ATOM 710 O VAL A 51 6.632 11.568 -4.687 1.00 0.00 O ATOM 711 CB VAL A 51 8.157 11.604 -1.951 1.00 0.00 C ATOM 712 CG1 VAL A 51 8.324 13.101 -1.738 1.00 0.00 C ATOM 713 CG2 VAL A 51 8.598 10.830 -0.718 1.00 0.00 C ATOM 0 H VAL A 51 6.966 9.423 -3.265 1.00 0.00 H new ATOM 0 HA VAL A 51 6.049 11.594 -1.492 1.00 0.00 H new ATOM 0 HB VAL A 51 8.792 11.306 -2.785 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.362 13.319 -1.488 1.00 0.00 H new ATOM 0 HG12 VAL A 51 8.051 13.631 -2.651 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.678 13.427 -0.923 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.632 11.080 -0.482 1.00 0.00 H new ATOM 0 HG22 VAL A 51 7.959 11.094 0.125 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.519 9.760 -0.912 1.00 0.00 H new ATOM 723 N SER A 52 5.623 13.133 -3.423 1.00 0.00 N ATOM 724 CA SER A 52 5.191 13.932 -4.564 1.00 0.00 C ATOM 725 C SER A 52 5.551 15.402 -4.364 1.00 0.00 C ATOM 726 O SER A 52 6.049 15.794 -3.309 1.00 0.00 O ATOM 727 CB SER A 52 3.683 13.788 -4.772 1.00 0.00 C ATOM 728 OG SER A 52 3.307 14.197 -6.076 1.00 0.00 O ATOM 0 H SER A 52 5.352 13.512 -2.516 1.00 0.00 H new ATOM 0 HA SER A 52 5.709 13.566 -5.451 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.388 12.751 -4.614 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.152 14.387 -4.032 1.00 0.00 H new ATOM 0 HG SER A 52 2.359 13.995 -6.222 1.00 0.00 H new ATOM 734 N LYS A 53 5.295 16.211 -5.386 1.00 0.00 N ATOM 735 CA LYS A 53 5.589 17.637 -5.326 1.00 0.00 C ATOM 736 C LYS A 53 4.303 18.456 -5.261 1.00 0.00 C ATOM 737 O LYS A 53 4.295 19.577 -4.753 1.00 0.00 O ATOM 738 CB LYS A 53 6.415 18.061 -6.543 1.00 0.00 C ATOM 739 CG LYS A 53 7.780 17.399 -6.611 1.00 0.00 C ATOM 740 CD LYS A 53 7.730 16.097 -7.393 1.00 0.00 C ATOM 741 CE LYS A 53 8.766 15.103 -6.889 1.00 0.00 C ATOM 742 NZ LYS A 53 8.691 13.807 -7.617 1.00 0.00 N ATOM 0 H LYS A 53 4.884 15.903 -6.267 1.00 0.00 H new ATOM 0 HA LYS A 53 6.165 17.825 -4.420 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.859 17.823 -7.450 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.546 19.143 -6.524 1.00 0.00 H new ATOM 0 HG2 LYS A 53 8.492 18.079 -7.079 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.142 17.204 -5.601 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.735 15.660 -7.311 1.00 0.00 H new ATOM 0 HD3 LYS A 53 7.903 16.299 -8.450 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.763 15.528 -7.005 1.00 0.00 H new ATOM 0 HE3 LYS A 53 8.615 14.930 -5.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 9.413 13.157 -7.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 7.748 13.389 -7.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 8.860 13.968 -8.630 1.00 0.00 H new ATOM 756 N ILE A 54 3.219 17.888 -5.778 1.00 0.00 N ATOM 757 CA ILE A 54 1.928 18.564 -5.776 1.00 0.00 C ATOM 758 C ILE A 54 1.289 18.525 -4.393 1.00 0.00 C ATOM 759 O ILE A 54 1.004 19.566 -3.799 1.00 0.00 O ATOM 760 CB ILE A 54 0.960 17.933 -6.795 1.00 0.00 C ATOM 761 CG1 ILE A 54 1.560 17.986 -8.202 1.00 0.00 C ATOM 762 CG2 ILE A 54 -0.384 18.645 -6.759 1.00 0.00 C ATOM 763 CD1 ILE A 54 2.366 16.758 -8.562 1.00 0.00 C ATOM 0 H ILE A 54 3.209 16.961 -6.204 1.00 0.00 H new ATOM 0 HA ILE A 54 2.114 19.600 -6.058 1.00 0.00 H new ATOM 0 HB ILE A 54 0.803 16.888 -6.527 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.755 18.108 -8.927 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.198 18.866 -8.283 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.057 18.188 -7.484 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.814 18.560 -5.761 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -0.245 19.698 -7.006 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.761 16.865 -9.572 1.00 0.00 H new ATOM 0 HD12 ILE A 54 3.192 16.646 -7.860 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.727 15.876 -8.514 1.00 0.00 H new ATOM 775 N CYS A 55 1.067 17.318 -3.884 1.00 0.00 N ATOM 776 CA CYS A 55 0.462 17.142 -2.568 1.00 0.00 C ATOM 777 C CYS A 55 1.010 15.896 -1.880 1.00 0.00 C ATOM 778 O CYS A 55 0.335 14.873 -1.765 1.00 0.00 O ATOM 779 CB CYS A 55 -1.059 17.043 -2.693 1.00 0.00 C ATOM 780 SG CYS A 55 -1.910 18.637 -2.630 1.00 0.00 S ATOM 0 H CYS A 55 1.297 16.447 -4.362 1.00 0.00 H new ATOM 0 HA CYS A 55 0.714 18.011 -1.960 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -1.304 16.549 -3.633 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -1.438 16.409 -1.892 1.00 0.00 H new ATOM 0 HG CYS A 55 -1.125 19.566 -3.089 1.00 0.00 H new ATOM 786 N PRO A 56 2.264 15.982 -1.412 1.00 0.00 N ATOM 787 CA PRO A 56 2.932 14.870 -0.728 1.00 0.00 C ATOM 788 C PRO A 56 2.333 14.593 0.647 1.00 0.00 C ATOM 789 O PRO A 56 2.554 13.530 1.228 1.00 0.00 O ATOM 790 CB PRO A 56 4.378 15.353 -0.594 1.00 0.00 C ATOM 791 CG PRO A 56 4.284 16.840 -0.613 1.00 0.00 C ATOM 792 CD PRO A 56 3.127 17.171 -1.514 1.00 0.00 C ATOM 0 HA PRO A 56 2.831 13.934 -1.277 1.00 0.00 H new ATOM 0 HB2 PRO A 56 4.830 14.997 0.332 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.996 14.985 -1.413 1.00 0.00 H new ATOM 0 HG2 PRO A 56 4.122 17.233 0.391 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.207 17.285 -0.984 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.609 18.073 -1.188 1.00 0.00 H new ATOM 0 HD3 PRO A 56 3.453 17.344 -2.540 1.00 0.00 H new ATOM 800 N LEU A 57 1.575 15.554 1.162 1.00 0.00 N ATOM 801 CA LEU A 57 0.944 15.413 2.469 1.00 0.00 C ATOM 802 C LEU A 57 -0.272 14.495 2.391 1.00 0.00 C ATOM 803 O LEU A 57 -0.770 14.019 3.411 1.00 0.00 O ATOM 804 CB LEU A 57 0.528 16.783 3.008 1.00 0.00 C ATOM 805 CG LEU A 57 1.668 17.741 3.356 1.00 0.00 C ATOM 806 CD1 LEU A 57 1.159 19.172 3.431 1.00 0.00 C ATOM 807 CD2 LEU A 57 2.323 17.336 4.669 1.00 0.00 C ATOM 0 H LEU A 57 1.382 16.440 0.694 1.00 0.00 H new ATOM 0 HA LEU A 57 1.670 14.967 3.148 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.111 17.264 2.267 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.078 16.631 3.901 1.00 0.00 H new ATOM 0 HG LEU A 57 2.418 17.685 2.567 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.984 19.839 3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.738 19.459 2.468 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.390 19.245 4.200 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.132 18.029 4.901 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.582 17.362 5.468 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.724 16.327 4.579 1.00 0.00 H new ATOM 819 N MET A 58 -0.744 14.249 1.173 1.00 0.00 N ATOM 820 CA MET A 58 -1.899 13.385 0.961 1.00 0.00 C ATOM 821 C MET A 58 -1.716 12.048 1.672 1.00 0.00 C ATOM 822 O MET A 58 -2.652 11.520 2.273 1.00 0.00 O ATOM 823 CB MET A 58 -2.124 13.155 -0.535 1.00 0.00 C ATOM 824 CG MET A 58 -3.420 12.425 -0.849 1.00 0.00 C ATOM 825 SD MET A 58 -4.881 13.377 -0.391 1.00 0.00 S ATOM 826 CE MET A 58 -4.920 14.592 -1.707 1.00 0.00 C ATOM 0 H MET A 58 -0.344 14.636 0.318 1.00 0.00 H new ATOM 0 HA MET A 58 -2.774 13.882 1.380 1.00 0.00 H new ATOM 0 HB2 MET A 58 -2.126 14.118 -1.046 1.00 0.00 H new ATOM 0 HB3 MET A 58 -1.288 12.583 -0.936 1.00 0.00 H new ATOM 0 HG2 MET A 58 -3.457 12.200 -1.915 1.00 0.00 H new ATOM 0 HG3 MET A 58 -3.432 11.471 -0.321 1.00 0.00 H new ATOM 0 HE1 MET A 58 -5.828 15.189 -1.624 1.00 0.00 H new ATOM 0 HE2 MET A 58 -4.049 15.243 -1.627 1.00 0.00 H new ATOM 0 HE3 MET A 58 -4.906 14.084 -2.671 1.00 0.00 H new ATOM 836 N ILE A 59 -0.505 11.506 1.598 1.00 0.00 N ATOM 837 CA ILE A 59 -0.200 10.231 2.235 1.00 0.00 C ATOM 838 C ILE A 59 0.455 10.439 3.597 1.00 0.00 C ATOM 839 O ILE A 59 1.207 11.392 3.796 1.00 0.00 O ATOM 840 CB ILE A 59 0.729 9.371 1.358 1.00 0.00 C ATOM 841 CG1 ILE A 59 0.121 9.181 -0.033 1.00 0.00 C ATOM 842 CG2 ILE A 59 0.986 8.025 2.018 1.00 0.00 C ATOM 843 CD1 ILE A 59 -1.176 8.403 -0.024 1.00 0.00 C ATOM 0 H ILE A 59 0.280 11.930 1.104 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.148 9.710 2.366 1.00 0.00 H new ATOM 0 HB ILE A 59 1.683 9.888 1.250 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.055 10.159 -0.481 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.841 8.664 -0.668 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.644 7.429 1.385 1.00 0.00 H new ATOM 0 HG22 ILE A 59 1.458 8.180 2.988 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.041 7.500 2.154 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.550 8.307 -1.043 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.003 7.411 0.394 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.912 8.929 0.584 1.00 0.00 H new ATOM 855 N SER A 60 0.164 9.539 4.531 1.00 0.00 N ATOM 856 CA SER A 60 0.722 9.625 5.875 1.00 0.00 C ATOM 857 C SER A 60 1.599 8.414 6.178 1.00 0.00 C ATOM 858 O SER A 60 1.477 7.370 5.536 1.00 0.00 O ATOM 859 CB SER A 60 -0.399 9.729 6.911 1.00 0.00 C ATOM 860 OG SER A 60 -1.592 9.133 6.431 1.00 0.00 O ATOM 0 H SER A 60 -0.455 8.742 4.381 1.00 0.00 H new ATOM 0 HA SER A 60 1.340 10.522 5.928 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.091 9.241 7.835 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.582 10.777 7.150 1.00 0.00 H new ATOM 0 HG SER A 60 -2.293 9.211 7.111 1.00 0.00 H new ATOM 866 N ARG A 61 2.483 8.561 7.159 1.00 0.00 N ATOM 867 CA ARG A 61 3.382 7.481 7.546 1.00 0.00 C ATOM 868 C ARG A 61 2.604 6.195 7.811 1.00 0.00 C ATOM 869 O ARG A 61 1.751 6.145 8.695 1.00 0.00 O ATOM 870 CB ARG A 61 4.178 7.873 8.792 1.00 0.00 C ATOM 871 CG ARG A 61 5.567 8.407 8.484 1.00 0.00 C ATOM 872 CD ARG A 61 6.076 9.310 9.597 1.00 0.00 C ATOM 873 NE ARG A 61 7.448 8.988 9.979 1.00 0.00 N ATOM 874 CZ ARG A 61 7.793 7.871 10.609 1.00 0.00 C ATOM 875 NH1 ARG A 61 6.870 6.973 10.926 1.00 0.00 N ATOM 876 NH2 ARG A 61 9.063 7.649 10.923 1.00 0.00 N ATOM 0 H ARG A 61 2.596 9.418 7.701 1.00 0.00 H new ATOM 0 HA ARG A 61 4.073 7.305 6.722 1.00 0.00 H new ATOM 0 HB2 ARG A 61 3.622 8.630 9.345 1.00 0.00 H new ATOM 0 HB3 ARG A 61 4.268 7.004 9.443 1.00 0.00 H new ATOM 0 HG2 ARG A 61 6.256 7.574 8.346 1.00 0.00 H new ATOM 0 HG3 ARG A 61 5.545 8.961 7.546 1.00 0.00 H new ATOM 0 HD2 ARG A 61 6.025 10.349 9.273 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.426 9.215 10.467 1.00 0.00 H new ATOM 0 HE ARG A 61 8.182 9.658 9.749 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.893 7.140 10.686 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.137 6.116 11.410 1.00 0.00 H new ATOM 0 HH21 ARG A 61 9.776 8.337 10.680 1.00 0.00 H new ATOM 0 HH22 ARG A 61 9.326 6.791 11.407 1.00 0.00 H new ATOM 890 N ASN A 62 2.905 5.158 7.036 1.00 0.00 N ATOM 891 CA ASN A 62 2.233 3.872 7.186 1.00 0.00 C ATOM 892 C ASN A 62 0.743 3.999 6.886 1.00 0.00 C ATOM 893 O ASN A 62 -0.089 3.368 7.539 1.00 0.00 O ATOM 894 CB ASN A 62 2.435 3.329 8.602 1.00 0.00 C ATOM 895 CG ASN A 62 3.807 3.660 9.157 1.00 0.00 C ATOM 896 OD1 ASN A 62 3.977 4.643 9.878 1.00 0.00 O ATOM 897 ND2 ASN A 62 4.794 2.837 8.823 1.00 0.00 N ATOM 0 H ASN A 62 3.609 5.183 6.298 1.00 0.00 H new ATOM 0 HA ASN A 62 2.672 3.176 6.471 1.00 0.00 H new ATOM 0 HB2 ASN A 62 1.670 3.743 9.260 1.00 0.00 H new ATOM 0 HB3 ASN A 62 2.299 2.247 8.596 1.00 0.00 H new ATOM 0 HD21 ASN A 62 5.739 3.008 9.167 1.00 0.00 H new ATOM 0 HD22 ASN A 62 4.607 2.034 8.223 1.00 0.00 H new ATOM 904 N HIS A 63 0.412 4.818 5.892 1.00 0.00 N ATOM 905 CA HIS A 63 -0.978 5.027 5.504 1.00 0.00 C ATOM 906 C HIS A 63 -1.685 3.694 5.277 1.00 0.00 C ATOM 907 O HIS A 63 -2.886 3.568 5.520 1.00 0.00 O ATOM 908 CB HIS A 63 -1.054 5.880 4.237 1.00 0.00 C ATOM 909 CG HIS A 63 -2.409 6.468 3.991 1.00 0.00 C ATOM 910 ND1 HIS A 63 -2.635 7.825 3.899 1.00 0.00 N ATOM 911 CD2 HIS A 63 -3.613 5.875 3.816 1.00 0.00 C ATOM 912 CE1 HIS A 63 -3.919 8.042 3.679 1.00 0.00 C ATOM 913 NE2 HIS A 63 -4.535 6.875 3.624 1.00 0.00 N ATOM 0 H HIS A 63 1.088 5.347 5.341 1.00 0.00 H new ATOM 0 HA HIS A 63 -1.481 5.552 6.316 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -0.324 6.687 4.308 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -0.771 5.269 3.380 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -3.812 4.813 3.826 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.386 9.009 3.564 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -5.533 6.738 3.465 1.00 0.00 H new ATOM 921 N CYS A 64 -0.934 2.703 4.810 1.00 0.00 N ATOM 922 CA CYS A 64 -1.489 1.380 4.549 1.00 0.00 C ATOM 923 C CYS A 64 -0.415 0.305 4.680 1.00 0.00 C ATOM 924 O CYS A 64 0.780 0.593 4.611 1.00 0.00 O ATOM 925 CB CYS A 64 -2.109 1.331 3.152 1.00 0.00 C ATOM 926 SG CYS A 64 -0.905 1.419 1.806 1.00 0.00 S ATOM 0 H CYS A 64 0.061 2.791 4.604 1.00 0.00 H new ATOM 0 HA CYS A 64 -2.265 1.185 5.290 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.682 0.409 3.053 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -2.813 2.157 3.050 1.00 0.00 H new ATOM 0 HG CYS A 64 -1.525 1.368 0.665 1.00 0.00 H new ATOM 932 N VAL A 65 -0.849 -0.937 4.870 1.00 0.00 N ATOM 933 CA VAL A 65 0.075 -2.057 5.011 1.00 0.00 C ATOM 934 C VAL A 65 -0.530 -3.341 4.456 1.00 0.00 C ATOM 935 O VAL A 65 -1.630 -3.740 4.840 1.00 0.00 O ATOM 936 CB VAL A 65 0.464 -2.281 6.485 1.00 0.00 C ATOM 937 CG1 VAL A 65 1.450 -3.432 6.607 1.00 0.00 C ATOM 938 CG2 VAL A 65 1.042 -1.007 7.082 1.00 0.00 C ATOM 0 H VAL A 65 -1.834 -1.193 4.930 1.00 0.00 H new ATOM 0 HA VAL A 65 0.969 -1.804 4.441 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.434 -2.542 7.045 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.714 -3.576 7.655 1.00 0.00 H new ATOM 0 HG12 VAL A 65 0.995 -4.343 6.219 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.349 -3.203 6.035 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.311 -1.183 8.123 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.930 -0.713 6.522 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.299 -0.211 7.029 1.00 0.00 H new ATOM 948 N LEU A 66 0.196 -3.986 3.549 1.00 0.00 N ATOM 949 CA LEU A 66 -0.268 -5.228 2.940 1.00 0.00 C ATOM 950 C LEU A 66 0.442 -6.432 3.550 1.00 0.00 C ATOM 951 O LEU A 66 1.594 -6.339 3.973 1.00 0.00 O ATOM 952 CB LEU A 66 -0.034 -5.196 1.428 1.00 0.00 C ATOM 953 CG LEU A 66 -0.999 -4.330 0.618 1.00 0.00 C ATOM 954 CD1 LEU A 66 -0.312 -3.054 0.157 1.00 0.00 C ATOM 955 CD2 LEU A 66 -1.542 -5.106 -0.572 1.00 0.00 C ATOM 0 H LEU A 66 1.108 -3.670 3.219 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.336 -5.322 3.135 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.981 -4.843 1.245 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.089 -6.217 1.050 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.837 -4.056 1.259 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.014 -2.450 -0.418 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.026 -2.489 1.025 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.545 -3.307 -0.467 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.227 -4.474 -1.137 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.716 -5.411 -1.215 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.072 -5.990 -0.218 1.00 0.00 H new ATOM 967 N LYS A 67 -0.253 -7.564 3.591 1.00 0.00 N ATOM 968 CA LYS A 67 0.310 -8.789 4.146 1.00 0.00 C ATOM 969 C LYS A 67 -0.651 -9.960 3.966 1.00 0.00 C ATOM 970 O LYS A 67 -1.863 -9.769 3.865 1.00 0.00 O ATOM 971 CB LYS A 67 0.630 -8.601 5.631 1.00 0.00 C ATOM 972 CG LYS A 67 -0.580 -8.233 6.472 1.00 0.00 C ATOM 973 CD LYS A 67 -0.297 -7.035 7.363 1.00 0.00 C ATOM 974 CE LYS A 67 0.161 -7.466 8.747 1.00 0.00 C ATOM 975 NZ LYS A 67 -0.838 -7.120 9.795 1.00 0.00 N ATOM 0 H LYS A 67 -1.208 -7.658 3.246 1.00 0.00 H new ATOM 0 HA LYS A 67 1.231 -9.012 3.608 1.00 0.00 H new ATOM 0 HB2 LYS A 67 1.066 -9.522 6.020 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.385 -7.822 5.736 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.424 -8.010 5.819 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.869 -9.085 7.087 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.469 -6.411 6.903 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -1.196 -6.424 7.450 1.00 0.00 H new ATOM 0 HE2 LYS A 67 0.336 -8.542 8.753 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.112 -6.987 8.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.488 -7.430 10.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.986 -6.091 9.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.739 -7.597 9.587 1.00 0.00 H new ATOM 989 N GLN A 68 -0.102 -11.170 3.930 1.00 0.00 N ATOM 990 CA GLN A 68 -0.912 -12.371 3.763 1.00 0.00 C ATOM 991 C GLN A 68 -1.363 -12.915 5.115 1.00 0.00 C ATOM 992 O GLN A 68 -0.543 -13.332 5.931 1.00 0.00 O ATOM 993 CB GLN A 68 -0.125 -13.441 3.006 1.00 0.00 C ATOM 994 CG GLN A 68 -0.265 -13.344 1.495 1.00 0.00 C ATOM 995 CD GLN A 68 -0.141 -14.690 0.810 1.00 0.00 C ATOM 996 OE1 GLN A 68 -0.278 -15.737 1.443 1.00 0.00 O ATOM 997 NE2 GLN A 68 0.121 -14.671 -0.492 1.00 0.00 N ATOM 0 H GLN A 68 0.899 -11.345 4.014 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.797 -12.105 3.185 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.929 -13.360 3.271 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.461 -14.426 3.331 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -1.232 -12.904 1.251 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.499 -12.671 1.106 1.00 0.00 H new ATOM 0 HE21 GLN A 68 0.227 -13.780 -0.978 1.00 0.00 H new ATOM 0 HE22 GLN A 68 0.216 -15.547 -1.006 1.00 0.00 H new ATOM 1006 N ASN A 69 -2.672 -12.906 5.344 1.00 0.00 N ATOM 1007 CA ASN A 69 -3.231 -13.398 6.598 1.00 0.00 C ATOM 1008 C ASN A 69 -2.709 -14.796 6.916 1.00 0.00 C ATOM 1009 O ASN A 69 -2.211 -15.512 6.046 1.00 0.00 O ATOM 1010 CB ASN A 69 -4.760 -13.418 6.526 1.00 0.00 C ATOM 1011 CG ASN A 69 -5.270 -14.083 5.262 1.00 0.00 C ATOM 1012 OD1 ASN A 69 -4.771 -15.132 4.854 1.00 0.00 O ATOM 1013 ND2 ASN A 69 -6.270 -13.474 4.636 1.00 0.00 N ATOM 0 H ASN A 69 -3.365 -12.564 4.678 1.00 0.00 H new ATOM 0 HA ASN A 69 -2.919 -12.723 7.395 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.155 -13.944 7.395 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -5.137 -12.396 6.573 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -6.655 -13.874 3.781 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -6.653 -12.606 5.010 1.00 0.00 H new ATOM 1020 N PRO A 70 -2.823 -15.195 8.191 1.00 0.00 N ATOM 1021 CA PRO A 70 -2.369 -16.510 8.653 1.00 0.00 C ATOM 1022 C PRO A 70 -2.871 -17.642 7.763 1.00 0.00 C ATOM 1023 O PRO A 70 -2.246 -18.698 7.676 1.00 0.00 O ATOM 1024 CB PRO A 70 -2.975 -16.622 10.054 1.00 0.00 C ATOM 1025 CG PRO A 70 -3.124 -15.214 10.517 1.00 0.00 C ATOM 1026 CD PRO A 70 -3.406 -14.394 9.280 1.00 0.00 C ATOM 0 HA PRO A 70 -1.283 -16.596 8.636 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -3.937 -17.134 10.029 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.328 -17.191 10.721 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.937 -15.125 11.238 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -2.218 -14.869 11.015 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -4.476 -14.241 9.136 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.948 -13.407 9.341 1.00 0.00 H new ATOM 1034 N GLU A 71 -4.003 -17.414 7.105 1.00 0.00 N ATOM 1035 CA GLU A 71 -4.588 -18.416 6.222 1.00 0.00 C ATOM 1036 C GLU A 71 -3.714 -18.632 4.989 1.00 0.00 C ATOM 1037 O GLU A 71 -3.543 -19.759 4.526 1.00 0.00 O ATOM 1038 CB GLU A 71 -5.995 -17.994 5.795 1.00 0.00 C ATOM 1039 CG GLU A 71 -6.863 -17.517 6.948 1.00 0.00 C ATOM 1040 CD GLU A 71 -8.345 -17.622 6.644 1.00 0.00 C ATOM 1041 OE1 GLU A 71 -8.734 -17.351 5.489 1.00 0.00 O ATOM 1042 OE2 GLU A 71 -9.116 -17.974 7.562 1.00 0.00 O ATOM 0 H GLU A 71 -4.533 -16.545 7.167 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.650 -19.355 6.772 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.918 -17.197 5.055 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.485 -18.836 5.306 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.636 -18.105 7.837 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.616 -16.481 7.180 1.00 0.00 H new ATOM 1049 N GLY A 72 -3.165 -17.542 4.462 1.00 0.00 N ATOM 1050 CA GLY A 72 -2.317 -17.632 3.288 1.00 0.00 C ATOM 1051 C GLY A 72 -2.846 -16.816 2.126 1.00 0.00 C ATOM 1052 O GLY A 72 -2.504 -17.073 0.973 1.00 0.00 O ATOM 0 H GLY A 72 -3.292 -16.598 4.827 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.314 -17.289 3.541 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.231 -18.676 2.985 1.00 0.00 H new ATOM 1056 N GLN A 73 -3.684 -15.830 2.431 1.00 0.00 N ATOM 1057 CA GLN A 73 -4.264 -14.975 1.401 1.00 0.00 C ATOM 1058 C GLN A 73 -3.932 -13.510 1.661 1.00 0.00 C ATOM 1059 O GLN A 73 -3.986 -13.043 2.799 1.00 0.00 O ATOM 1060 CB GLN A 73 -5.781 -15.165 1.346 1.00 0.00 C ATOM 1061 CG GLN A 73 -6.489 -14.147 0.466 1.00 0.00 C ATOM 1062 CD GLN A 73 -6.009 -14.183 -0.971 1.00 0.00 C ATOM 1063 OE1 GLN A 73 -5.363 -15.141 -1.398 1.00 0.00 O ATOM 1064 NE2 GLN A 73 -6.323 -13.138 -1.727 1.00 0.00 N ATOM 0 H GLN A 73 -3.976 -15.604 3.382 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.834 -15.261 0.441 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -6.000 -16.167 0.977 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -6.184 -15.102 2.357 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.562 -14.335 0.491 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.331 -13.148 0.873 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.860 -12.366 -1.332 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -6.027 -13.107 -2.703 1.00 0.00 H new ATOM 1073 N TRP A 74 -3.587 -12.790 0.599 1.00 0.00 N ATOM 1074 CA TRP A 74 -3.246 -11.376 0.713 1.00 0.00 C ATOM 1075 C TRP A 74 -4.398 -10.585 1.323 1.00 0.00 C ATOM 1076 O TRP A 74 -5.568 -10.895 1.095 1.00 0.00 O ATOM 1077 CB TRP A 74 -2.890 -10.805 -0.661 1.00 0.00 C ATOM 1078 CG TRP A 74 -1.477 -11.089 -1.074 1.00 0.00 C ATOM 1079 CD1 TRP A 74 -1.069 -11.922 -2.076 1.00 0.00 C ATOM 1080 CD2 TRP A 74 -0.288 -10.542 -0.494 1.00 0.00 C ATOM 1081 NE1 TRP A 74 0.303 -11.925 -2.155 1.00 0.00 N ATOM 1082 CE2 TRP A 74 0.806 -11.086 -1.196 1.00 0.00 C ATOM 1083 CE3 TRP A 74 -0.041 -9.643 0.547 1.00 0.00 C ATOM 1084 CZ2 TRP A 74 2.124 -10.761 -0.886 1.00 0.00 C ATOM 1085 CZ3 TRP A 74 1.268 -9.322 0.853 1.00 0.00 C ATOM 1086 CH2 TRP A 74 2.337 -9.879 0.138 1.00 0.00 C ATOM 0 H TRP A 74 -3.536 -13.161 -0.350 1.00 0.00 H new ATOM 0 HA TRP A 74 -2.382 -11.288 1.371 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.569 -11.220 -1.406 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.048 -9.727 -0.651 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -1.727 -12.494 -2.713 1.00 0.00 H new ATOM 0 HE1 TRP A 74 0.857 -12.465 -2.820 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -0.858 -9.207 1.102 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 2.949 -11.190 -1.435 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 1.471 -8.630 1.657 1.00 0.00 H new ATOM 0 HH2 TRP A 74 3.349 -9.607 0.400 1.00 0.00 H new ATOM 1097 N THR A 75 -4.060 -9.561 2.100 1.00 0.00 N ATOM 1098 CA THR A 75 -5.067 -8.726 2.744 1.00 0.00 C ATOM 1099 C THR A 75 -4.535 -7.320 2.997 1.00 0.00 C ATOM 1100 O THR A 75 -3.512 -7.144 3.660 1.00 0.00 O ATOM 1101 CB THR A 75 -5.531 -9.336 4.081 1.00 0.00 C ATOM 1102 OG1 THR A 75 -4.421 -9.937 4.756 1.00 0.00 O ATOM 1103 CG2 THR A 75 -6.617 -10.376 3.853 1.00 0.00 C ATOM 0 H THR A 75 -3.097 -9.290 2.299 1.00 0.00 H new ATOM 0 HA THR A 75 -5.917 -8.673 2.063 1.00 0.00 H new ATOM 0 HB THR A 75 -5.941 -8.536 4.698 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.584 -9.622 4.354 1.00 0.00 H new ATOM 0 HG21 THR A 75 -6.929 -10.793 4.811 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.472 -9.908 3.365 1.00 0.00 H new ATOM 0 HG23 THR A 75 -6.230 -11.174 3.219 1.00 0.00 H new ATOM 1111 N ILE A 76 -5.235 -6.323 2.467 1.00 0.00 N ATOM 1112 CA ILE A 76 -4.833 -4.933 2.637 1.00 0.00 C ATOM 1113 C ILE A 76 -5.455 -4.331 3.893 1.00 0.00 C ATOM 1114 O ILE A 76 -6.670 -4.383 4.081 1.00 0.00 O ATOM 1115 CB ILE A 76 -5.231 -4.078 1.420 1.00 0.00 C ATOM 1116 CG1 ILE A 76 -4.777 -2.630 1.615 1.00 0.00 C ATOM 1117 CG2 ILE A 76 -6.735 -4.142 1.197 1.00 0.00 C ATOM 1118 CD1 ILE A 76 -4.487 -1.908 0.318 1.00 0.00 C ATOM 0 H ILE A 76 -6.084 -6.452 1.916 1.00 0.00 H new ATOM 0 HA ILE A 76 -3.747 -4.928 2.733 1.00 0.00 H new ATOM 0 HB ILE A 76 -4.735 -4.478 0.536 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.549 -2.086 2.160 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.881 -2.619 2.236 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.001 -3.533 0.333 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.033 -5.175 1.018 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.250 -3.764 2.080 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.171 -0.887 0.533 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -3.694 -2.429 -0.219 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.387 -1.887 -0.296 1.00 0.00 H new ATOM 1130 N MET A 77 -4.614 -3.757 4.747 1.00 0.00 N ATOM 1131 CA MET A 77 -5.083 -3.142 5.983 1.00 0.00 C ATOM 1132 C MET A 77 -4.569 -1.711 6.107 1.00 0.00 C ATOM 1133 O MET A 77 -3.393 -1.440 5.863 1.00 0.00 O ATOM 1134 CB MET A 77 -4.630 -3.965 7.191 1.00 0.00 C ATOM 1135 CG MET A 77 -5.090 -3.393 8.522 1.00 0.00 C ATOM 1136 SD MET A 77 -3.811 -3.472 9.791 1.00 0.00 S ATOM 1137 CE MET A 77 -2.752 -2.119 9.288 1.00 0.00 C ATOM 0 H MET A 77 -3.605 -3.705 4.606 1.00 0.00 H new ATOM 0 HA MET A 77 -6.172 -3.117 5.957 1.00 0.00 H new ATOM 0 HB2 MET A 77 -5.010 -4.982 7.091 1.00 0.00 H new ATOM 0 HB3 MET A 77 -3.542 -4.030 7.189 1.00 0.00 H new ATOM 0 HG2 MET A 77 -5.394 -2.356 8.382 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.969 -3.939 8.863 1.00 0.00 H new ATOM 0 HE1 MET A 77 -1.875 -2.084 9.934 1.00 0.00 H new ATOM 0 HE2 MET A 77 -2.436 -2.269 8.256 1.00 0.00 H new ATOM 0 HE3 MET A 77 -3.299 -1.180 9.367 1.00 0.00 H new ATOM 1147 N ASP A 78 -5.457 -0.799 6.486 1.00 0.00 N ATOM 1148 CA ASP A 78 -5.093 0.605 6.642 1.00 0.00 C ATOM 1149 C ASP A 78 -4.753 0.919 8.096 1.00 0.00 C ATOM 1150 O ASP A 78 -5.590 0.772 8.985 1.00 0.00 O ATOM 1151 CB ASP A 78 -6.234 1.506 6.166 1.00 0.00 C ATOM 1152 CG ASP A 78 -6.843 1.029 4.862 1.00 0.00 C ATOM 1153 OD1 ASP A 78 -6.104 0.943 3.860 1.00 0.00 O ATOM 1154 OD2 ASP A 78 -8.058 0.743 4.844 1.00 0.00 O ATOM 0 H ASP A 78 -6.434 -1.006 6.691 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.211 0.797 6.031 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.008 1.543 6.933 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -5.862 2.523 6.039 1.00 0.00 H new ATOM 1159 N ASN A 79 -3.517 1.350 8.329 1.00 0.00 N ATOM 1160 CA ASN A 79 -3.066 1.683 9.675 1.00 0.00 C ATOM 1161 C ASN A 79 -3.642 3.022 10.126 1.00 0.00 C ATOM 1162 O ASN A 79 -2.925 4.018 10.226 1.00 0.00 O ATOM 1163 CB ASN A 79 -1.537 1.731 9.725 1.00 0.00 C ATOM 1164 CG ASN A 79 -0.994 1.417 11.106 1.00 0.00 C ATOM 1165 OD1 ASN A 79 -1.585 1.793 12.118 1.00 0.00 O ATOM 1166 ND2 ASN A 79 0.138 0.724 11.152 1.00 0.00 N ATOM 0 H ASN A 79 -2.811 1.477 7.604 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.422 0.907 10.353 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -1.130 1.019 9.007 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -1.197 2.721 9.420 1.00 0.00 H new ATOM 0 HD21 ASN A 79 0.552 0.483 12.052 1.00 0.00 H new ATOM 0 HD22 ASN A 79 0.593 0.433 10.287 1.00 0.00 H new ATOM 1173 N LYS A 80 -4.942 3.038 10.400 1.00 0.00 N ATOM 1174 CA LYS A 80 -5.617 4.252 10.843 1.00 0.00 C ATOM 1175 C LYS A 80 -5.327 5.412 9.896 1.00 0.00 C ATOM 1176 O LYS A 80 -4.664 6.379 10.269 1.00 0.00 O ATOM 1177 CB LYS A 80 -5.175 4.616 12.262 1.00 0.00 C ATOM 1178 CG LYS A 80 -6.013 3.961 13.347 1.00 0.00 C ATOM 1179 CD LYS A 80 -5.981 4.764 14.637 1.00 0.00 C ATOM 1180 CE LYS A 80 -4.595 4.756 15.264 1.00 0.00 C ATOM 1181 NZ LYS A 80 -4.559 5.527 16.538 1.00 0.00 N ATOM 0 H LYS A 80 -5.550 2.223 10.323 1.00 0.00 H new ATOM 0 HA LYS A 80 -6.691 4.063 10.840 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -4.133 4.326 12.395 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -5.222 5.698 12.382 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -7.043 3.863 13.004 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -5.643 2.953 13.535 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -6.284 5.791 14.435 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.703 4.351 15.342 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -4.288 3.727 15.453 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -3.876 5.180 14.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.598 5.498 16.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -4.828 6.515 16.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -5.226 5.107 17.217 1.00 0.00 H new ATOM 1195 N SER A 81 -5.830 5.309 8.670 1.00 0.00 N ATOM 1196 CA SER A 81 -5.623 6.348 7.669 1.00 0.00 C ATOM 1197 C SER A 81 -6.407 7.608 8.023 1.00 0.00 C ATOM 1198 O SER A 81 -7.570 7.537 8.423 1.00 0.00 O ATOM 1199 CB SER A 81 -6.042 5.845 6.286 1.00 0.00 C ATOM 1200 OG SER A 81 -7.163 4.983 6.375 1.00 0.00 O ATOM 0 H SER A 81 -6.384 4.516 8.346 1.00 0.00 H new ATOM 0 HA SER A 81 -4.561 6.594 7.652 1.00 0.00 H new ATOM 0 HB2 SER A 81 -6.281 6.693 5.644 1.00 0.00 H new ATOM 0 HB3 SER A 81 -5.210 5.318 5.820 1.00 0.00 H new ATOM 0 HG SER A 81 -7.956 5.502 6.624 1.00 0.00 H new ATOM 1206 N LEU A 82 -5.763 8.760 7.874 1.00 0.00 N ATOM 1207 CA LEU A 82 -6.399 10.037 8.178 1.00 0.00 C ATOM 1208 C LEU A 82 -7.454 10.383 7.132 1.00 0.00 C ATOM 1209 O LEU A 82 -8.649 10.408 7.425 1.00 0.00 O ATOM 1210 CB LEU A 82 -5.350 11.148 8.247 1.00 0.00 C ATOM 1211 CG LEU A 82 -5.884 12.563 8.469 1.00 0.00 C ATOM 1212 CD1 LEU A 82 -5.947 12.884 9.954 1.00 0.00 C ATOM 1213 CD2 LEU A 82 -5.020 13.581 7.737 1.00 0.00 C ATOM 0 H LEU A 82 -4.801 8.836 7.544 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.890 9.948 9.147 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.654 10.913 9.052 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.778 11.138 7.319 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.895 12.616 8.064 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.329 13.895 10.092 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -6.608 12.175 10.452 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.948 12.812 10.384 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.415 14.583 7.906 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -3.998 13.526 8.111 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.028 13.364 6.669 1.00 0.00 H new ATOM 1225 N ASN A 83 -7.004 10.647 5.909 1.00 0.00 N ATOM 1226 CA ASN A 83 -7.910 10.989 4.819 1.00 0.00 C ATOM 1227 C ASN A 83 -8.840 9.823 4.498 1.00 0.00 C ATOM 1228 O ASN A 83 -9.995 10.022 4.124 1.00 0.00 O ATOM 1229 CB ASN A 83 -7.114 11.380 3.572 1.00 0.00 C ATOM 1230 CG ASN A 83 -6.577 12.796 3.649 1.00 0.00 C ATOM 1231 OD1 ASN A 83 -7.337 13.764 3.599 1.00 0.00 O ATOM 1232 ND2 ASN A 83 -5.261 12.924 3.771 1.00 0.00 N ATOM 0 H ASN A 83 -6.018 10.631 5.649 1.00 0.00 H new ATOM 0 HA ASN A 83 -8.517 11.837 5.136 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.284 10.686 3.442 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -7.751 11.283 2.693 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.842 13.852 3.827 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.669 12.094 3.808 1.00 0.00 H new ATOM 1239 N GLY A 84 -8.327 8.605 4.647 1.00 0.00 N ATOM 1240 CA GLY A 84 -9.125 7.425 4.369 1.00 0.00 C ATOM 1241 C GLY A 84 -8.630 6.664 3.155 1.00 0.00 C ATOM 1242 O GLY A 84 -8.062 7.250 2.234 1.00 0.00 O ATOM 0 H GLY A 84 -7.373 8.415 4.955 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.110 6.767 5.238 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -10.162 7.720 4.211 1.00 0.00 H new ATOM 1246 N VAL A 85 -8.845 5.352 3.154 1.00 0.00 N ATOM 1247 CA VAL A 85 -8.417 4.508 2.044 1.00 0.00 C ATOM 1248 C VAL A 85 -9.614 3.978 1.263 1.00 0.00 C ATOM 1249 O VAL A 85 -10.642 3.630 1.845 1.00 0.00 O ATOM 1250 CB VAL A 85 -7.571 3.319 2.537 1.00 0.00 C ATOM 1251 CG1 VAL A 85 -6.971 2.566 1.360 1.00 0.00 C ATOM 1252 CG2 VAL A 85 -6.482 3.797 3.486 1.00 0.00 C ATOM 0 H VAL A 85 -9.313 4.851 3.909 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.807 5.131 1.389 1.00 0.00 H new ATOM 0 HB VAL A 85 -8.221 2.634 3.082 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -6.377 1.730 1.728 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.771 2.190 0.723 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.334 3.238 0.785 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -5.894 2.944 3.824 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -5.832 4.503 2.968 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -6.938 4.287 4.346 1.00 0.00 H new ATOM 1262 N TRP A 86 -9.472 3.918 -0.056 1.00 0.00 N ATOM 1263 CA TRP A 86 -10.543 3.428 -0.917 1.00 0.00 C ATOM 1264 C TRP A 86 -10.143 2.122 -1.593 1.00 0.00 C ATOM 1265 O TRP A 86 -8.981 1.927 -1.951 1.00 0.00 O ATOM 1266 CB TRP A 86 -10.895 4.477 -1.973 1.00 0.00 C ATOM 1267 CG TRP A 86 -11.181 5.830 -1.395 1.00 0.00 C ATOM 1268 CD1 TRP A 86 -10.271 6.807 -1.107 1.00 0.00 C ATOM 1269 CD2 TRP A 86 -12.463 6.354 -1.033 1.00 0.00 C ATOM 1270 NE1 TRP A 86 -10.910 7.907 -0.588 1.00 0.00 N ATOM 1271 CE2 TRP A 86 -12.256 7.654 -0.533 1.00 0.00 C ATOM 1272 CE3 TRP A 86 -13.766 5.852 -1.084 1.00 0.00 C ATOM 1273 CZ2 TRP A 86 -13.303 8.456 -0.087 1.00 0.00 C ATOM 1274 CZ3 TRP A 86 -14.805 6.648 -0.641 1.00 0.00 C ATOM 1275 CH2 TRP A 86 -14.569 7.939 -0.149 1.00 0.00 C ATOM 0 H TRP A 86 -8.627 4.202 -0.552 1.00 0.00 H new ATOM 0 HA TRP A 86 -11.419 3.240 -0.296 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -10.071 4.559 -2.682 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -11.766 4.139 -2.535 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -9.206 6.727 -1.264 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -10.457 8.771 -0.292 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -13.958 4.859 -1.463 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -13.123 9.450 0.294 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -15.816 6.269 -0.674 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -15.402 8.538 0.188 1.00 0.00 H new ATOM 1286 N LEU A 87 -11.112 1.230 -1.767 1.00 0.00 N ATOM 1287 CA LEU A 87 -10.860 -0.060 -2.401 1.00 0.00 C ATOM 1288 C LEU A 87 -12.045 -0.482 -3.264 1.00 0.00 C ATOM 1289 O LEU A 87 -13.108 -0.828 -2.749 1.00 0.00 O ATOM 1290 CB LEU A 87 -10.580 -1.126 -1.341 1.00 0.00 C ATOM 1291 CG LEU A 87 -10.463 -2.563 -1.850 1.00 0.00 C ATOM 1292 CD1 LEU A 87 -9.233 -2.719 -2.731 1.00 0.00 C ATOM 1293 CD2 LEU A 87 -10.412 -3.539 -0.683 1.00 0.00 C ATOM 0 H LEU A 87 -12.079 1.376 -1.478 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.985 0.042 -3.043 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.653 -0.866 -0.829 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.376 -1.089 -0.597 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.345 -2.789 -2.449 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.166 -3.748 -3.084 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.310 -2.047 -3.585 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.340 -2.474 -2.156 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.329 -4.557 -1.063 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.548 -3.314 -0.058 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.323 -3.446 -0.091 1.00 0.00 H new ATOM 1305 N ASN A 88 -11.854 -0.455 -4.579 1.00 0.00 N ATOM 1306 CA ASN A 88 -12.906 -0.837 -5.513 1.00 0.00 C ATOM 1307 C ASN A 88 -14.144 0.034 -5.324 1.00 0.00 C ATOM 1308 O ASN A 88 -15.265 -0.470 -5.245 1.00 0.00 O ATOM 1309 CB ASN A 88 -13.273 -2.311 -5.326 1.00 0.00 C ATOM 1310 CG ASN A 88 -12.304 -3.241 -6.029 1.00 0.00 C ATOM 1311 OD1 ASN A 88 -11.563 -2.826 -6.921 1.00 0.00 O ATOM 1312 ND2 ASN A 88 -12.305 -4.508 -5.631 1.00 0.00 N ATOM 0 H ASN A 88 -10.980 -0.172 -5.022 1.00 0.00 H new ATOM 0 HA ASN A 88 -12.530 -0.689 -6.525 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -13.291 -2.546 -4.262 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -14.279 -2.483 -5.707 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.675 -5.180 -6.068 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -12.936 -4.809 -4.888 1.00 0.00 H new ATOM 1319 N ARG A 89 -13.933 1.345 -5.252 1.00 0.00 N ATOM 1320 CA ARG A 89 -15.032 2.286 -5.072 1.00 0.00 C ATOM 1321 C ARG A 89 -15.770 2.016 -3.764 1.00 0.00 C ATOM 1322 O ARG A 89 -16.999 1.953 -3.735 1.00 0.00 O ATOM 1323 CB ARG A 89 -16.006 2.198 -6.248 1.00 0.00 C ATOM 1324 CG ARG A 89 -15.351 2.428 -7.600 1.00 0.00 C ATOM 1325 CD ARG A 89 -15.394 3.894 -7.998 1.00 0.00 C ATOM 1326 NE ARG A 89 -16.372 4.146 -9.054 1.00 0.00 N ATOM 1327 CZ ARG A 89 -16.414 5.268 -9.764 1.00 0.00 C ATOM 1328 NH1 ARG A 89 -15.539 6.237 -9.532 1.00 0.00 N ATOM 1329 NH2 ARG A 89 -17.334 5.423 -10.708 1.00 0.00 N ATOM 0 H ARG A 89 -13.012 1.779 -5.316 1.00 0.00 H new ATOM 0 HA ARG A 89 -14.613 3.291 -5.032 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.478 1.216 -6.245 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.799 2.933 -6.108 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -14.315 2.089 -7.566 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -15.857 1.829 -8.357 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -15.639 4.500 -7.125 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -14.406 4.207 -8.336 1.00 0.00 H new ATOM 0 HE ARG A 89 -17.060 3.421 -9.257 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -14.831 6.122 -8.807 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -15.574 7.097 -10.079 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -18.009 4.680 -10.889 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -17.366 6.285 -11.253 1.00 0.00 H new ATOM 1343 N ALA A 90 -15.012 1.857 -2.684 1.00 0.00 N ATOM 1344 CA ALA A 90 -15.594 1.595 -1.374 1.00 0.00 C ATOM 1345 C ALA A 90 -14.795 2.281 -0.271 1.00 0.00 C ATOM 1346 O ALA A 90 -13.697 2.783 -0.508 1.00 0.00 O ATOM 1347 CB ALA A 90 -15.670 0.097 -1.120 1.00 0.00 C ATOM 0 H ALA A 90 -13.993 1.905 -2.691 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.604 2.005 -1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -16.107 -0.084 -0.138 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.290 -0.371 -1.885 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -14.667 -0.329 -1.155 1.00 0.00 H new ATOM 1353 N ARG A 91 -15.354 2.299 0.935 1.00 0.00 N ATOM 1354 CA ARG A 91 -14.694 2.925 2.074 1.00 0.00 C ATOM 1355 C ARG A 91 -14.109 1.872 3.010 1.00 0.00 C ATOM 1356 O ARG A 91 -14.801 0.942 3.425 1.00 0.00 O ATOM 1357 CB ARG A 91 -15.680 3.811 2.838 1.00 0.00 C ATOM 1358 CG ARG A 91 -15.036 4.616 3.955 1.00 0.00 C ATOM 1359 CD ARG A 91 -14.512 5.951 3.449 1.00 0.00 C ATOM 1360 NE ARG A 91 -14.022 6.794 4.537 1.00 0.00 N ATOM 1361 CZ ARG A 91 -13.196 7.819 4.357 1.00 0.00 C ATOM 1362 NH1 ARG A 91 -12.771 8.126 3.139 1.00 0.00 N ATOM 1363 NH2 ARG A 91 -12.794 8.539 5.396 1.00 0.00 N ATOM 0 H ARG A 91 -16.262 1.887 1.148 1.00 0.00 H new ATOM 0 HA ARG A 91 -13.879 3.542 1.696 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -16.158 4.496 2.138 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -16.467 3.185 3.260 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -15.764 4.787 4.748 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -14.217 4.044 4.391 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -13.708 5.777 2.734 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -15.306 6.473 2.915 1.00 0.00 H new ATOM 0 HE ARG A 91 -14.331 6.584 5.486 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -13.078 7.575 2.338 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -12.137 8.913 3.003 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -13.119 8.306 6.334 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -12.160 9.326 5.257 1.00 0.00 H new ATOM 1377 N LEU A 92 -12.830 2.024 3.337 1.00 0.00 N ATOM 1378 CA LEU A 92 -12.151 1.086 4.224 1.00 0.00 C ATOM 1379 C LEU A 92 -12.108 1.620 5.652 1.00 0.00 C ATOM 1380 O LEU A 92 -12.171 2.828 5.874 1.00 0.00 O ATOM 1381 CB LEU A 92 -10.730 0.819 3.724 1.00 0.00 C ATOM 1382 CG LEU A 92 -10.613 0.228 2.318 1.00 0.00 C ATOM 1383 CD1 LEU A 92 -9.175 0.296 1.829 1.00 0.00 C ATOM 1384 CD2 LEU A 92 -11.118 -1.207 2.299 1.00 0.00 C ATOM 0 H LEU A 92 -12.243 2.788 3.001 1.00 0.00 H new ATOM 0 HA LEU A 92 -12.712 0.151 4.222 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.175 1.757 3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.242 0.140 4.423 1.00 0.00 H new ATOM 0 HG LEU A 92 -11.233 0.819 1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.111 -0.129 0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.848 1.335 1.804 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -8.534 -0.270 2.505 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.027 -1.611 1.291 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.525 -1.810 2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -12.164 -1.229 2.606 1.00 0.00 H new ATOM 1396 N GLU A 93 -11.998 0.711 6.615 1.00 0.00 N ATOM 1397 CA GLU A 93 -11.945 1.092 8.022 1.00 0.00 C ATOM 1398 C GLU A 93 -10.528 0.950 8.571 1.00 0.00 C ATOM 1399 O GLU A 93 -9.687 0.246 8.013 1.00 0.00 O ATOM 1400 CB GLU A 93 -12.910 0.233 8.843 1.00 0.00 C ATOM 1401 CG GLU A 93 -14.307 0.819 8.948 1.00 0.00 C ATOM 1402 CD GLU A 93 -15.240 0.302 7.870 1.00 0.00 C ATOM 1403 OE1 GLU A 93 -15.125 0.763 6.715 1.00 0.00 O ATOM 1404 OE2 GLU A 93 -16.085 -0.564 8.181 1.00 0.00 O ATOM 0 H GLU A 93 -11.944 -0.294 6.447 1.00 0.00 H new ATOM 0 HA GLU A 93 -12.244 2.137 8.100 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -12.974 -0.758 8.393 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -12.504 0.102 9.846 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.723 0.583 9.927 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.247 1.905 8.881 1.00 0.00 H new ATOM 1411 N PRO A 94 -10.257 1.636 9.691 1.00 0.00 N ATOM 1412 CA PRO A 94 -8.943 1.604 10.340 1.00 0.00 C ATOM 1413 C PRO A 94 -8.645 0.252 10.980 1.00 0.00 C ATOM 1414 O PRO A 94 -9.495 -0.326 11.659 1.00 0.00 O ATOM 1415 CB PRO A 94 -9.051 2.691 11.413 1.00 0.00 C ATOM 1416 CG PRO A 94 -10.509 2.791 11.706 1.00 0.00 C ATOM 1417 CD PRO A 94 -11.212 2.496 10.410 1.00 0.00 C ATOM 0 HA PRO A 94 -8.133 1.766 9.629 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -8.485 2.424 12.306 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -8.653 3.641 11.056 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -10.801 2.081 12.479 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -10.766 3.785 12.072 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -12.163 1.990 10.575 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -11.429 3.408 9.854 1.00 0.00 H new ATOM 1425 N LEU A 95 -7.435 -0.247 10.759 1.00 0.00 N ATOM 1426 CA LEU A 95 -7.024 -1.532 11.315 1.00 0.00 C ATOM 1427 C LEU A 95 -8.042 -2.619 10.984 1.00 0.00 C ATOM 1428 O LEU A 95 -8.556 -3.294 11.876 1.00 0.00 O ATOM 1429 CB LEU A 95 -6.852 -1.423 12.831 1.00 0.00 C ATOM 1430 CG LEU A 95 -6.232 -0.123 13.344 1.00 0.00 C ATOM 1431 CD1 LEU A 95 -6.045 -0.180 14.853 1.00 0.00 C ATOM 1432 CD2 LEU A 95 -4.905 0.145 12.650 1.00 0.00 C ATOM 0 H LEU A 95 -6.721 0.218 10.199 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.069 -1.805 10.866 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -7.830 -1.545 13.297 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.233 -2.255 13.167 1.00 0.00 H new ATOM 0 HG LEU A 95 -6.912 0.697 13.113 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.603 0.754 15.200 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.012 -0.324 15.334 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.386 -1.010 15.107 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.478 1.074 13.027 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.218 -0.677 12.849 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -5.067 0.230 11.576 1.00 0.00 H new ATOM 1444 N ARG A 96 -8.328 -2.782 9.696 1.00 0.00 N ATOM 1445 CA ARG A 96 -9.284 -3.788 9.247 1.00 0.00 C ATOM 1446 C ARG A 96 -8.666 -4.686 8.179 1.00 0.00 C ATOM 1447 O ARG A 96 -7.749 -4.280 7.465 1.00 0.00 O ATOM 1448 CB ARG A 96 -10.543 -3.115 8.698 1.00 0.00 C ATOM 1449 CG ARG A 96 -11.781 -3.995 8.762 1.00 0.00 C ATOM 1450 CD ARG A 96 -12.661 -3.633 9.948 1.00 0.00 C ATOM 1451 NE ARG A 96 -13.654 -4.666 10.228 1.00 0.00 N ATOM 1452 CZ ARG A 96 -14.469 -4.638 11.277 1.00 0.00 C ATOM 1453 NH1 ARG A 96 -14.409 -3.633 12.140 1.00 0.00 N ATOM 1454 NH2 ARG A 96 -15.346 -5.615 11.464 1.00 0.00 N ATOM 0 H ARG A 96 -7.912 -2.231 8.945 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.555 -4.405 10.104 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.729 -2.199 9.259 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.367 -2.824 7.662 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -12.351 -3.890 7.839 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.482 -5.041 8.835 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -12.037 -3.481 10.829 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -13.167 -2.688 9.749 1.00 0.00 H new ATOM 0 HE ARG A 96 -13.726 -5.453 9.583 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -13.736 -2.879 11.999 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -15.036 -3.614 12.945 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -15.396 -6.389 10.802 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -15.971 -5.592 12.270 1.00 0.00 H new ATOM 1468 N VAL A 97 -9.176 -5.910 8.076 1.00 0.00 N ATOM 1469 CA VAL A 97 -8.675 -6.866 7.096 1.00 0.00 C ATOM 1470 C VAL A 97 -9.560 -6.894 5.855 1.00 0.00 C ATOM 1471 O VAL A 97 -10.781 -7.022 5.952 1.00 0.00 O ATOM 1472 CB VAL A 97 -8.594 -8.285 7.687 1.00 0.00 C ATOM 1473 CG1 VAL A 97 -7.947 -9.241 6.696 1.00 0.00 C ATOM 1474 CG2 VAL A 97 -7.831 -8.271 9.003 1.00 0.00 C ATOM 0 H VAL A 97 -9.935 -6.262 8.659 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.673 -6.539 6.818 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.607 -8.636 7.884 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.899 -10.239 7.132 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.539 -9.273 5.781 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.939 -8.897 6.464 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.783 -9.282 9.407 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.820 -7.900 8.834 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.342 -7.621 9.713 1.00 0.00 H new ATOM 1484 N TYR A 98 -8.937 -6.773 4.688 1.00 0.00 N ATOM 1485 CA TYR A 98 -9.668 -6.783 3.426 1.00 0.00 C ATOM 1486 C TYR A 98 -8.980 -7.683 2.405 1.00 0.00 C ATOM 1487 O TYR A 98 -7.904 -7.360 1.901 1.00 0.00 O ATOM 1488 CB TYR A 98 -9.788 -5.362 2.871 1.00 0.00 C ATOM 1489 CG TYR A 98 -10.752 -4.490 3.644 1.00 0.00 C ATOM 1490 CD1 TYR A 98 -12.125 -4.665 3.526 1.00 0.00 C ATOM 1491 CD2 TYR A 98 -10.289 -3.492 4.492 1.00 0.00 C ATOM 1492 CE1 TYR A 98 -13.009 -3.870 4.229 1.00 0.00 C ATOM 1493 CE2 TYR A 98 -11.166 -2.693 5.200 1.00 0.00 C ATOM 1494 CZ TYR A 98 -12.525 -2.885 5.065 1.00 0.00 C ATOM 1495 OH TYR A 98 -13.403 -2.092 5.768 1.00 0.00 O ATOM 0 H TYR A 98 -7.927 -6.667 4.590 1.00 0.00 H new ATOM 0 HA TYR A 98 -10.666 -7.177 3.617 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -8.803 -4.894 2.877 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.111 -5.413 1.831 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.508 -5.436 2.873 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.225 -3.338 4.600 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -14.074 -4.019 4.125 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -10.789 -1.922 5.856 1.00 0.00 H new ATOM 0 HH TYR A 98 -13.242 -2.198 6.729 1.00 0.00 H new ATOM 1505 N SER A 99 -9.609 -8.814 2.104 1.00 0.00 N ATOM 1506 CA SER A 99 -9.058 -9.764 1.145 1.00 0.00 C ATOM 1507 C SER A 99 -9.148 -9.216 -0.276 1.00 0.00 C ATOM 1508 O SER A 99 -10.239 -8.964 -0.787 1.00 0.00 O ATOM 1509 CB SER A 99 -9.797 -11.101 1.236 1.00 0.00 C ATOM 1510 OG SER A 99 -10.547 -11.188 2.435 1.00 0.00 O ATOM 0 H SER A 99 -10.501 -9.095 2.511 1.00 0.00 H new ATOM 0 HA SER A 99 -8.007 -9.921 1.390 1.00 0.00 H new ATOM 0 HB2 SER A 99 -10.461 -11.212 0.379 1.00 0.00 H new ATOM 0 HB3 SER A 99 -9.080 -11.920 1.192 1.00 0.00 H new ATOM 0 HG SER A 99 -11.011 -12.050 2.469 1.00 0.00 H new ATOM 1516 N ILE A 100 -7.993 -9.035 -0.908 1.00 0.00 N ATOM 1517 CA ILE A 100 -7.940 -8.518 -2.270 1.00 0.00 C ATOM 1518 C ILE A 100 -7.788 -9.649 -3.281 1.00 0.00 C ATOM 1519 O ILE A 100 -7.381 -10.758 -2.932 1.00 0.00 O ATOM 1520 CB ILE A 100 -6.779 -7.523 -2.450 1.00 0.00 C ATOM 1521 CG1 ILE A 100 -5.438 -8.225 -2.226 1.00 0.00 C ATOM 1522 CG2 ILE A 100 -6.935 -6.349 -1.495 1.00 0.00 C ATOM 1523 CD1 ILE A 100 -4.243 -7.315 -2.404 1.00 0.00 C ATOM 0 H ILE A 100 -7.081 -9.239 -0.498 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.882 -7.999 -2.448 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.802 -7.141 -3.471 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.420 -8.643 -1.220 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.354 -9.061 -2.920 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.107 -5.654 -1.634 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.876 -5.837 -1.698 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.934 -6.713 -0.468 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.327 -7.879 -2.230 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.237 -6.917 -3.419 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.303 -6.492 -1.692 1.00 0.00 H new ATOM 1535 N HIS A 101 -8.115 -9.361 -4.537 1.00 0.00 N ATOM 1536 CA HIS A 101 -8.012 -10.353 -5.601 1.00 0.00 C ATOM 1537 C HIS A 101 -7.575 -9.702 -6.910 1.00 0.00 C ATOM 1538 O HIS A 101 -7.411 -8.485 -6.984 1.00 0.00 O ATOM 1539 CB HIS A 101 -9.351 -11.065 -5.794 1.00 0.00 C ATOM 1540 CG HIS A 101 -9.880 -11.696 -4.543 1.00 0.00 C ATOM 1541 ND1 HIS A 101 -9.389 -12.879 -4.031 1.00 0.00 N ATOM 1542 CD2 HIS A 101 -10.862 -11.302 -3.699 1.00 0.00 C ATOM 1543 CE1 HIS A 101 -10.047 -13.185 -2.928 1.00 0.00 C ATOM 1544 NE2 HIS A 101 -10.947 -12.244 -2.704 1.00 0.00 N ATOM 0 H HIS A 101 -8.454 -8.449 -4.843 1.00 0.00 H new ATOM 0 HA HIS A 101 -7.258 -11.085 -5.310 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -10.083 -10.349 -6.168 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -9.238 -11.833 -6.559 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -11.466 -10.412 -3.791 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -9.878 -14.057 -2.313 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -11.599 -12.221 -1.920 1.00 0.00 H new ATOM 1552 N GLN A 102 -7.387 -10.523 -7.939 1.00 0.00 N ATOM 1553 CA GLN A 102 -6.967 -10.026 -9.244 1.00 0.00 C ATOM 1554 C GLN A 102 -8.048 -9.147 -9.865 1.00 0.00 C ATOM 1555 O GLN A 102 -9.001 -9.646 -10.462 1.00 0.00 O ATOM 1556 CB GLN A 102 -6.644 -11.194 -10.177 1.00 0.00 C ATOM 1557 CG GLN A 102 -5.566 -10.874 -11.201 1.00 0.00 C ATOM 1558 CD GLN A 102 -5.992 -9.795 -12.178 1.00 0.00 C ATOM 1559 OE1 GLN A 102 -7.175 -9.652 -12.485 1.00 0.00 O ATOM 1560 NE2 GLN A 102 -5.026 -9.030 -12.672 1.00 0.00 N ATOM 0 H GLN A 102 -7.519 -11.533 -7.894 1.00 0.00 H new ATOM 0 HA GLN A 102 -6.070 -9.423 -9.104 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -6.324 -12.048 -9.580 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -7.553 -11.493 -10.699 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -4.662 -10.554 -10.683 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -5.314 -11.780 -11.753 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -4.058 -9.184 -12.389 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -5.252 -8.288 -13.334 1.00 0.00 H new ATOM 1569 N GLY A 103 -7.892 -7.835 -9.721 1.00 0.00 N ATOM 1570 CA GLY A 103 -8.862 -6.907 -10.273 1.00 0.00 C ATOM 1571 C GLY A 103 -9.354 -5.905 -9.249 1.00 0.00 C ATOM 1572 O GLY A 103 -10.518 -5.505 -9.270 1.00 0.00 O ATOM 0 H GLY A 103 -7.111 -7.398 -9.232 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.414 -6.374 -11.112 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -9.711 -7.466 -10.667 1.00 0.00 H new ATOM 1576 N ASP A 104 -8.466 -5.498 -8.347 1.00 0.00 N ATOM 1577 CA ASP A 104 -8.817 -4.536 -7.309 1.00 0.00 C ATOM 1578 C ASP A 104 -8.164 -3.184 -7.578 1.00 0.00 C ATOM 1579 O ASP A 104 -7.167 -3.097 -8.295 1.00 0.00 O ATOM 1580 CB ASP A 104 -8.391 -5.058 -5.936 1.00 0.00 C ATOM 1581 CG ASP A 104 -9.486 -5.857 -5.255 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -9.926 -6.873 -5.832 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -9.901 -5.466 -4.145 1.00 0.00 O ATOM 0 H ASP A 104 -7.499 -5.820 -8.314 1.00 0.00 H new ATOM 0 HA ASP A 104 -9.899 -4.405 -7.320 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.505 -5.683 -6.047 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.111 -4.217 -5.302 1.00 0.00 H new ATOM 1588 N TYR A 105 -8.733 -2.133 -6.999 1.00 0.00 N ATOM 1589 CA TYR A 105 -8.208 -0.784 -7.178 1.00 0.00 C ATOM 1590 C TYR A 105 -7.993 -0.099 -5.832 1.00 0.00 C ATOM 1591 O TYR A 105 -8.947 0.331 -5.183 1.00 0.00 O ATOM 1592 CB TYR A 105 -9.161 0.046 -8.040 1.00 0.00 C ATOM 1593 CG TYR A 105 -8.719 0.175 -9.480 1.00 0.00 C ATOM 1594 CD1 TYR A 105 -8.664 -0.936 -10.313 1.00 0.00 C ATOM 1595 CD2 TYR A 105 -8.356 1.408 -10.008 1.00 0.00 C ATOM 1596 CE1 TYR A 105 -8.260 -0.823 -11.629 1.00 0.00 C ATOM 1597 CE2 TYR A 105 -7.952 1.531 -11.323 1.00 0.00 C ATOM 1598 CZ TYR A 105 -7.906 0.413 -12.129 1.00 0.00 C ATOM 1599 OH TYR A 105 -7.503 0.531 -13.440 1.00 0.00 O ATOM 0 H TYR A 105 -9.558 -2.189 -6.402 1.00 0.00 H new ATOM 0 HA TYR A 105 -7.245 -0.860 -7.683 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -10.151 -0.408 -8.012 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -9.255 1.042 -7.607 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -8.942 -1.905 -9.925 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -8.390 2.285 -9.379 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -8.221 -1.697 -12.263 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -7.674 2.497 -11.718 1.00 0.00 H new ATOM 0 HH TYR A 105 -7.519 1.475 -13.704 1.00 0.00 H new ATOM 1609 N ILE A 106 -6.734 -0.001 -5.420 1.00 0.00 N ATOM 1610 CA ILE A 106 -6.393 0.633 -4.153 1.00 0.00 C ATOM 1611 C ILE A 106 -6.088 2.115 -4.344 1.00 0.00 C ATOM 1612 O ILE A 106 -5.310 2.490 -5.221 1.00 0.00 O ATOM 1613 CB ILE A 106 -5.180 -0.048 -3.491 1.00 0.00 C ATOM 1614 CG1 ILE A 106 -5.463 -1.534 -3.264 1.00 0.00 C ATOM 1615 CG2 ILE A 106 -4.839 0.639 -2.177 1.00 0.00 C ATOM 1616 CD1 ILE A 106 -5.114 -2.404 -4.452 1.00 0.00 C ATOM 0 H ILE A 106 -5.933 -0.352 -5.945 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.261 0.524 -3.502 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.323 0.041 -4.158 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -4.898 -1.875 -2.396 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.519 -1.662 -3.028 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -3.980 0.147 -1.721 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.600 1.686 -2.365 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.693 0.578 -1.502 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.341 -3.445 -4.220 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.698 -2.090 -5.317 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -4.052 -2.305 -4.676 1.00 0.00 H new ATOM 1628 N GLN A 107 -6.705 2.952 -3.516 1.00 0.00 N ATOM 1629 CA GLN A 107 -6.499 4.393 -3.594 1.00 0.00 C ATOM 1630 C GLN A 107 -6.240 4.981 -2.211 1.00 0.00 C ATOM 1631 O GLN A 107 -7.059 4.839 -1.301 1.00 0.00 O ATOM 1632 CB GLN A 107 -7.714 5.070 -4.230 1.00 0.00 C ATOM 1633 CG GLN A 107 -7.367 6.315 -5.031 1.00 0.00 C ATOM 1634 CD GLN A 107 -8.580 6.941 -5.691 1.00 0.00 C ATOM 1635 OE1 GLN A 107 -8.883 6.662 -6.851 1.00 0.00 O ATOM 1636 NE2 GLN A 107 -9.282 7.793 -4.953 1.00 0.00 N ATOM 0 H GLN A 107 -7.351 2.657 -2.784 1.00 0.00 H new ATOM 0 HA GLN A 107 -5.623 4.576 -4.217 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.217 4.356 -4.883 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.422 5.338 -3.446 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -6.898 7.047 -4.373 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -6.634 6.058 -5.796 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -8.995 7.995 -3.995 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -10.109 8.245 -5.344 1.00 0.00 H new ATOM 1645 N LEU A 108 -5.098 5.642 -2.058 1.00 0.00 N ATOM 1646 CA LEU A 108 -4.731 6.253 -0.785 1.00 0.00 C ATOM 1647 C LEU A 108 -5.022 7.750 -0.795 1.00 0.00 C ATOM 1648 O LEU A 108 -4.252 8.539 -1.339 1.00 0.00 O ATOM 1649 CB LEU A 108 -3.250 6.012 -0.490 1.00 0.00 C ATOM 1650 CG LEU A 108 -2.810 4.549 -0.415 1.00 0.00 C ATOM 1651 CD1 LEU A 108 -1.294 4.451 -0.345 1.00 0.00 C ATOM 1652 CD2 LEU A 108 -3.446 3.861 0.783 1.00 0.00 C ATOM 0 H LEU A 108 -4.410 5.769 -2.800 1.00 0.00 H new ATOM 0 HA LEU A 108 -5.332 5.790 -0.002 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.661 6.509 -1.261 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.006 6.493 0.457 1.00 0.00 H new ATOM 0 HG LEU A 108 -3.146 4.042 -1.320 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.999 3.403 -0.292 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.859 4.906 -1.235 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.936 4.974 0.542 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.121 2.821 0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -3.142 4.369 1.698 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.531 3.899 0.691 1.00 0.00 H new ATOM 1664 N GLY A 109 -6.141 8.134 -0.187 1.00 0.00 N ATOM 1665 CA GLY A 109 -6.513 9.536 -0.135 1.00 0.00 C ATOM 1666 C GLY A 109 -7.679 9.860 -1.048 1.00 0.00 C ATOM 1667 O GLY A 109 -8.372 8.962 -1.525 1.00 0.00 O ATOM 0 H GLY A 109 -6.796 7.499 0.270 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -6.773 9.802 0.890 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -5.655 10.147 -0.415 1.00 0.00 H new ATOM 1671 N VAL A 110 -7.898 11.149 -1.290 1.00 0.00 N ATOM 1672 CA VAL A 110 -8.989 11.590 -2.151 1.00 0.00 C ATOM 1673 C VAL A 110 -8.492 12.565 -3.212 1.00 0.00 C ATOM 1674 O VAL A 110 -7.467 13.227 -3.051 1.00 0.00 O ATOM 1675 CB VAL A 110 -10.110 12.262 -1.336 1.00 0.00 C ATOM 1676 CG1 VAL A 110 -10.967 11.215 -0.641 1.00 0.00 C ATOM 1677 CG2 VAL A 110 -9.523 13.238 -0.328 1.00 0.00 C ATOM 0 H VAL A 110 -7.335 11.906 -0.902 1.00 0.00 H new ATOM 0 HA VAL A 110 -9.388 10.700 -2.638 1.00 0.00 H new ATOM 0 HB VAL A 110 -10.748 12.822 -2.020 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.753 11.709 -0.070 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -11.417 10.560 -1.387 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.346 10.625 0.033 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -10.329 13.704 0.239 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -8.862 12.703 0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.957 14.007 -0.853 1.00 0.00 H new ATOM 1687 N PRO A 111 -9.235 12.657 -4.325 1.00 0.00 N ATOM 1688 CA PRO A 111 -8.890 13.550 -5.435 1.00 0.00 C ATOM 1689 C PRO A 111 -9.071 15.021 -5.075 1.00 0.00 C ATOM 1690 O PRO A 111 -10.154 15.441 -4.664 1.00 0.00 O ATOM 1691 CB PRO A 111 -9.873 13.144 -6.536 1.00 0.00 C ATOM 1692 CG PRO A 111 -11.036 12.563 -5.809 1.00 0.00 C ATOM 1693 CD PRO A 111 -10.469 11.898 -4.585 1.00 0.00 C ATOM 0 HA PRO A 111 -7.843 13.455 -5.723 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -10.171 14.003 -7.137 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -9.428 12.418 -7.216 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -11.752 13.338 -5.536 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -11.567 11.844 -6.433 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -11.159 11.952 -3.743 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -10.262 10.842 -4.761 1.00 0.00 H new ATOM 1701 N LEU A 112 -8.006 15.799 -5.230 1.00 0.00 N ATOM 1702 CA LEU A 112 -8.048 17.224 -4.921 1.00 0.00 C ATOM 1703 C LEU A 112 -9.027 17.951 -5.837 1.00 0.00 C ATOM 1704 O LEU A 112 -9.604 17.352 -6.744 1.00 0.00 O ATOM 1705 CB LEU A 112 -6.653 17.837 -5.058 1.00 0.00 C ATOM 1706 CG LEU A 112 -5.548 17.182 -4.228 1.00 0.00 C ATOM 1707 CD1 LEU A 112 -4.191 17.398 -4.881 1.00 0.00 C ATOM 1708 CD2 LEU A 112 -5.551 17.731 -2.808 1.00 0.00 C ATOM 0 H LEU A 112 -7.103 15.467 -5.568 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.389 17.338 -3.892 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.363 17.799 -6.108 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.712 18.890 -4.782 1.00 0.00 H new ATOM 0 HG LEU A 112 -5.741 16.110 -4.183 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -3.417 16.925 -4.277 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -4.193 16.957 -5.878 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -3.990 18.467 -4.957 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -4.758 17.254 -2.232 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.383 18.808 -2.834 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -6.514 17.525 -2.340 1.00 0.00 H new ATOM 1800 N ALA A 118 -7.597 10.573 -8.132 1.00 0.00 N ATOM 1801 CA ALA A 118 -6.477 10.476 -7.203 1.00 0.00 C ATOM 1802 C ALA A 118 -5.172 10.204 -7.944 1.00 0.00 C ATOM 1803 O ALA A 118 -5.058 9.225 -8.680 1.00 0.00 O ATOM 1804 CB ALA A 118 -6.738 9.387 -6.173 1.00 0.00 C ATOM 0 HA ALA A 118 -6.380 11.432 -6.688 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.894 9.326 -5.486 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -7.644 9.624 -5.615 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.864 8.430 -6.679 1.00 0.00 H new ATOM 1810 N GLU A 119 -4.190 11.078 -7.743 1.00 0.00 N ATOM 1811 CA GLU A 119 -2.894 10.932 -8.394 1.00 0.00 C ATOM 1812 C GLU A 119 -2.290 9.561 -8.102 1.00 0.00 C ATOM 1813 O GLU A 119 -1.570 8.999 -8.928 1.00 0.00 O ATOM 1814 CB GLU A 119 -1.938 12.032 -7.928 1.00 0.00 C ATOM 1815 CG GLU A 119 -1.488 11.877 -6.485 1.00 0.00 C ATOM 1816 CD GLU A 119 -0.832 13.131 -5.941 1.00 0.00 C ATOM 1817 OE1 GLU A 119 0.306 13.435 -6.358 1.00 0.00 O ATOM 1818 OE2 GLU A 119 -1.456 13.809 -5.098 1.00 0.00 O ATOM 0 H GLU A 119 -4.268 11.893 -7.135 1.00 0.00 H new ATOM 0 HA GLU A 119 -3.044 11.022 -9.470 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.061 12.037 -8.575 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.426 13.000 -8.046 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.348 11.623 -5.865 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.787 11.045 -6.414 1.00 0.00 H new ATOM 1825 N TYR A 120 -2.588 9.030 -6.921 1.00 0.00 N ATOM 1826 CA TYR A 120 -2.072 7.727 -6.518 1.00 0.00 C ATOM 1827 C TYR A 120 -3.128 6.641 -6.706 1.00 0.00 C ATOM 1828 O TYR A 120 -4.129 6.604 -5.991 1.00 0.00 O ATOM 1829 CB TYR A 120 -1.618 7.764 -5.058 1.00 0.00 C ATOM 1830 CG TYR A 120 -0.298 8.472 -4.853 1.00 0.00 C ATOM 1831 CD1 TYR A 120 0.894 7.897 -5.274 1.00 0.00 C ATOM 1832 CD2 TYR A 120 -0.243 9.716 -4.237 1.00 0.00 C ATOM 1833 CE1 TYR A 120 2.103 8.540 -5.088 1.00 0.00 C ATOM 1834 CE2 TYR A 120 0.961 10.367 -4.048 1.00 0.00 C ATOM 1835 CZ TYR A 120 2.131 9.775 -4.475 1.00 0.00 C ATOM 1836 OH TYR A 120 3.332 10.419 -4.288 1.00 0.00 O ATOM 0 H TYR A 120 -3.184 9.481 -6.227 1.00 0.00 H new ATOM 0 HA TYR A 120 -1.217 7.492 -7.152 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.383 8.260 -4.461 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -1.535 6.743 -4.686 1.00 0.00 H new ATOM 0 HD1 TYR A 120 0.876 6.930 -5.755 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -1.157 10.182 -3.900 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.021 8.078 -5.421 1.00 0.00 H new ATOM 0 HE2 TYR A 120 0.986 11.334 -3.568 1.00 0.00 H new ATOM 0 HH TYR A 120 3.954 10.165 -5.002 1.00 0.00 H new ATOM 1846 N GLU A 121 -2.896 5.760 -7.674 1.00 0.00 N ATOM 1847 CA GLU A 121 -3.827 4.674 -7.957 1.00 0.00 C ATOM 1848 C GLU A 121 -3.089 3.451 -8.495 1.00 0.00 C ATOM 1849 O GLU A 121 -2.213 3.569 -9.353 1.00 0.00 O ATOM 1850 CB GLU A 121 -4.885 5.129 -8.964 1.00 0.00 C ATOM 1851 CG GLU A 121 -6.074 5.825 -8.325 1.00 0.00 C ATOM 1852 CD GLU A 121 -6.993 6.467 -9.346 1.00 0.00 C ATOM 1853 OE1 GLU A 121 -6.540 7.394 -10.050 1.00 0.00 O ATOM 1854 OE2 GLU A 121 -8.164 6.044 -9.442 1.00 0.00 O ATOM 0 H GLU A 121 -2.072 5.777 -8.275 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.319 4.399 -7.024 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.423 5.805 -9.683 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.239 4.263 -9.523 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -6.640 5.103 -7.736 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.715 6.588 -7.634 1.00 0.00 H new ATOM 1861 N TYR A 122 -3.449 2.279 -7.985 1.00 0.00 N ATOM 1862 CA TYR A 122 -2.820 1.035 -8.412 1.00 0.00 C ATOM 1863 C TYR A 122 -3.868 0.018 -8.855 1.00 0.00 C ATOM 1864 O TYR A 122 -5.067 0.293 -8.823 1.00 0.00 O ATOM 1865 CB TYR A 122 -1.975 0.451 -7.278 1.00 0.00 C ATOM 1866 CG TYR A 122 -1.117 1.477 -6.572 1.00 0.00 C ATOM 1867 CD1 TYR A 122 -1.632 2.250 -5.539 1.00 0.00 C ATOM 1868 CD2 TYR A 122 0.208 1.674 -6.940 1.00 0.00 C ATOM 1869 CE1 TYR A 122 -0.852 3.189 -4.892 1.00 0.00 C ATOM 1870 CE2 TYR A 122 0.996 2.610 -6.298 1.00 0.00 C ATOM 1871 CZ TYR A 122 0.461 3.365 -5.274 1.00 0.00 C ATOM 1872 OH TYR A 122 1.242 4.299 -4.633 1.00 0.00 O ATOM 0 H TYR A 122 -4.173 2.164 -7.276 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.174 1.257 -9.261 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.635 -0.021 -6.550 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -1.333 -0.332 -7.681 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -2.660 2.115 -5.236 1.00 0.00 H new ATOM 0 HD2 TYR A 122 0.629 1.086 -7.742 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -1.269 3.782 -4.091 1.00 0.00 H new ATOM 0 HE2 TYR A 122 2.025 2.750 -6.596 1.00 0.00 H new ATOM 0 HH TYR A 122 2.141 4.296 -5.022 1.00 0.00 H new ATOM 1882 N GLU A 123 -3.405 -1.157 -9.268 1.00 0.00 N ATOM 1883 CA GLU A 123 -4.302 -2.215 -9.718 1.00 0.00 C ATOM 1884 C GLU A 123 -3.717 -3.591 -9.412 1.00 0.00 C ATOM 1885 O GLU A 123 -2.757 -4.026 -10.047 1.00 0.00 O ATOM 1886 CB GLU A 123 -4.567 -2.085 -11.220 1.00 0.00 C ATOM 1887 CG GLU A 123 -5.510 -3.144 -11.765 1.00 0.00 C ATOM 1888 CD GLU A 123 -5.449 -3.257 -13.276 1.00 0.00 C ATOM 1889 OE1 GLU A 123 -4.353 -3.530 -13.808 1.00 0.00 O ATOM 1890 OE2 GLU A 123 -6.499 -3.071 -13.927 1.00 0.00 O ATOM 0 H GLU A 123 -2.415 -1.400 -9.300 1.00 0.00 H new ATOM 0 HA GLU A 123 -5.244 -2.111 -9.179 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -4.985 -1.099 -11.423 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -3.619 -2.145 -11.754 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.262 -4.109 -11.322 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -6.530 -2.907 -11.463 1.00 0.00 H new ATOM 1897 N VAL A 124 -4.304 -4.272 -8.432 1.00 0.00 N ATOM 1898 CA VAL A 124 -3.843 -5.599 -8.040 1.00 0.00 C ATOM 1899 C VAL A 124 -3.733 -6.521 -9.249 1.00 0.00 C ATOM 1900 O VAL A 124 -4.713 -6.757 -9.957 1.00 0.00 O ATOM 1901 CB VAL A 124 -4.787 -6.238 -7.005 1.00 0.00 C ATOM 1902 CG1 VAL A 124 -4.266 -7.601 -6.576 1.00 0.00 C ATOM 1903 CG2 VAL A 124 -4.958 -5.321 -5.803 1.00 0.00 C ATOM 0 H VAL A 124 -5.100 -3.926 -7.895 1.00 0.00 H new ATOM 0 HA VAL A 124 -2.857 -5.473 -7.592 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.764 -6.379 -7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -4.946 -8.037 -5.844 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.200 -8.255 -7.445 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.278 -7.489 -6.130 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -5.628 -5.788 -5.081 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -3.988 -5.147 -5.337 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.380 -4.370 -6.128 1.00 0.00 H new ATOM 1913 N THR A 125 -2.532 -7.043 -9.481 1.00 0.00 N ATOM 1914 CA THR A 125 -2.292 -7.939 -10.605 1.00 0.00 C ATOM 1915 C THR A 125 -1.167 -8.920 -10.295 1.00 0.00 C ATOM 1916 O THR A 125 -0.287 -8.632 -9.484 1.00 0.00 O ATOM 1917 CB THR A 125 -1.939 -7.156 -11.883 1.00 0.00 C ATOM 1918 OG1 THR A 125 -1.911 -8.042 -13.008 1.00 0.00 O ATOM 1919 CG2 THR A 125 -0.590 -6.468 -11.740 1.00 0.00 C ATOM 0 H THR A 125 -1.710 -6.860 -8.905 1.00 0.00 H new ATOM 0 HA THR A 125 -3.217 -8.492 -10.772 1.00 0.00 H new ATOM 0 HB THR A 125 -2.703 -6.395 -12.039 1.00 0.00 H new ATOM 0 HG1 THR A 125 -1.688 -7.536 -13.817 1.00 0.00 H new ATOM 0 HG21 THR A 125 -0.362 -5.921 -12.655 1.00 0.00 H new ATOM 0 HG22 THR A 125 -0.623 -5.773 -10.901 1.00 0.00 H new ATOM 0 HG23 THR A 125 0.183 -7.216 -11.562 1.00 0.00 H new ATOM 1927 N GLU A 126 -1.201 -10.078 -10.947 1.00 0.00 N ATOM 1928 CA GLU A 126 -0.183 -11.101 -10.740 1.00 0.00 C ATOM 1929 C GLU A 126 0.767 -11.172 -11.932 1.00 0.00 C ATOM 1930 O GLU A 126 0.376 -11.575 -13.027 1.00 0.00 O ATOM 1931 CB GLU A 126 -0.837 -12.465 -10.513 1.00 0.00 C ATOM 1932 CG GLU A 126 0.070 -13.467 -9.820 1.00 0.00 C ATOM 1933 CD GLU A 126 -0.676 -14.700 -9.347 1.00 0.00 C ATOM 1934 OE1 GLU A 126 -1.860 -14.854 -9.711 1.00 0.00 O ATOM 1935 OE2 GLU A 126 -0.074 -15.512 -8.612 1.00 0.00 O ATOM 0 H GLU A 126 -1.922 -10.331 -11.623 1.00 0.00 H new ATOM 0 HA GLU A 126 0.392 -10.831 -9.854 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.739 -12.331 -9.916 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -1.148 -12.874 -11.474 1.00 0.00 H new ATOM 0 HG2 GLU A 126 0.863 -13.767 -10.505 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.550 -12.988 -8.967 1.00 0.00 H new ATOM 1942 N GLU A 127 2.017 -10.776 -11.710 1.00 0.00 N ATOM 1943 CA GLU A 127 3.022 -10.794 -12.767 1.00 0.00 C ATOM 1944 C GLU A 127 4.337 -11.376 -12.257 1.00 0.00 C ATOM 1945 O GLU A 127 4.628 -11.327 -11.062 1.00 0.00 O ATOM 1946 CB GLU A 127 3.252 -9.380 -13.306 1.00 0.00 C ATOM 1947 CG GLU A 127 1.967 -8.621 -13.592 1.00 0.00 C ATOM 1948 CD GLU A 127 2.023 -7.853 -14.899 1.00 0.00 C ATOM 1949 OE1 GLU A 127 2.100 -8.501 -15.964 1.00 0.00 O ATOM 1950 OE2 GLU A 127 1.988 -6.606 -14.856 1.00 0.00 O ATOM 0 H GLU A 127 2.357 -10.439 -10.809 1.00 0.00 H new ATOM 0 HA GLU A 127 2.653 -11.427 -13.574 1.00 0.00 H new ATOM 0 HB2 GLU A 127 3.844 -8.817 -12.584 1.00 0.00 H new ATOM 0 HB3 GLU A 127 3.840 -9.441 -14.222 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.134 -9.323 -13.623 1.00 0.00 H new ATOM 0 HG3 GLU A 127 1.769 -7.927 -12.775 1.00 0.00 H new ATOM 1957 N ASP A 128 5.127 -11.927 -13.171 1.00 0.00 N ATOM 1958 CA ASP A 128 6.411 -12.519 -12.816 1.00 0.00 C ATOM 1959 C ASP A 128 7.419 -11.440 -12.431 1.00 0.00 C ATOM 1960 O ASP A 128 7.307 -10.291 -12.859 1.00 0.00 O ATOM 1961 CB ASP A 128 6.955 -13.349 -13.980 1.00 0.00 C ATOM 1962 CG ASP A 128 6.104 -14.571 -14.266 1.00 0.00 C ATOM 1963 OD1 ASP A 128 5.033 -14.416 -14.890 1.00 0.00 O ATOM 1964 OD2 ASP A 128 6.510 -15.682 -13.867 1.00 0.00 O ATOM 0 H ASP A 128 4.901 -11.976 -14.164 1.00 0.00 H new ATOM 0 HA ASP A 128 6.256 -13.171 -11.956 1.00 0.00 H new ATOM 0 HB2 ASP A 128 7.005 -12.727 -14.874 1.00 0.00 H new ATOM 0 HB3 ASP A 128 7.974 -13.664 -13.753 1.00 0.00 H new ATOM 1969 N TRP A 129 8.400 -11.817 -11.620 1.00 0.00 N ATOM 1970 CA TRP A 129 9.427 -10.881 -11.176 1.00 0.00 C ATOM 1971 C TRP A 129 10.157 -10.269 -12.366 1.00 0.00 C ATOM 1972 O TRP A 129 10.571 -9.111 -12.322 1.00 0.00 O ATOM 1973 CB TRP A 129 10.426 -11.586 -10.256 1.00 0.00 C ATOM 1974 CG TRP A 129 11.686 -10.805 -10.039 1.00 0.00 C ATOM 1975 CD1 TRP A 129 12.909 -11.052 -10.593 1.00 0.00 C ATOM 1976 CD2 TRP A 129 11.847 -9.652 -9.205 1.00 0.00 C ATOM 1977 NE1 TRP A 129 13.821 -10.122 -10.155 1.00 0.00 N ATOM 1978 CE2 TRP A 129 13.194 -9.251 -9.303 1.00 0.00 C ATOM 1979 CE3 TRP A 129 10.984 -8.917 -8.388 1.00 0.00 C ATOM 1980 CZ2 TRP A 129 13.695 -8.151 -8.613 1.00 0.00 C ATOM 1981 CZ3 TRP A 129 11.483 -7.826 -7.703 1.00 0.00 C ATOM 1982 CH2 TRP A 129 12.828 -7.450 -7.820 1.00 0.00 C ATOM 0 H TRP A 129 8.507 -12.764 -11.256 1.00 0.00 H new ATOM 0 HA TRP A 129 8.938 -10.079 -10.623 1.00 0.00 H new ATOM 0 HB2 TRP A 129 9.952 -11.773 -9.292 1.00 0.00 H new ATOM 0 HB3 TRP A 129 10.678 -12.558 -10.681 1.00 0.00 H new ATOM 0 HD1 TRP A 129 13.128 -11.860 -11.276 1.00 0.00 H new ATOM 0 HE1 TRP A 129 14.805 -10.086 -10.421 1.00 0.00 H new ATOM 0 HE3 TRP A 129 9.945 -9.197 -8.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 14.732 -7.861 -8.700 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 10.825 -7.253 -7.066 1.00 0.00 H new ATOM 0 HH2 TRP A 129 13.187 -6.590 -7.274 1.00 0.00 H new ATOM 1993 N GLU A 130 10.311 -11.054 -13.428 1.00 0.00 N ATOM 1994 CA GLU A 130 10.992 -10.587 -14.629 1.00 0.00 C ATOM 1995 C GLU A 130 10.117 -9.608 -15.406 1.00 0.00 C ATOM 1996 O GLU A 130 10.557 -9.004 -16.385 1.00 0.00 O ATOM 1997 CB GLU A 130 11.368 -11.772 -15.522 1.00 0.00 C ATOM 1998 CG GLU A 130 12.004 -12.927 -14.767 1.00 0.00 C ATOM 1999 CD GLU A 130 13.240 -13.466 -15.459 1.00 0.00 C ATOM 2000 OE1 GLU A 130 14.233 -12.716 -15.567 1.00 0.00 O ATOM 2001 OE2 GLU A 130 13.216 -14.637 -15.891 1.00 0.00 O ATOM 0 H GLU A 130 9.974 -12.015 -13.481 1.00 0.00 H new ATOM 0 HA GLU A 130 11.901 -10.069 -14.322 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.473 -12.131 -16.031 1.00 0.00 H new ATOM 0 HB3 GLU A 130 12.058 -11.430 -16.294 1.00 0.00 H new ATOM 0 HG2 GLU A 130 12.269 -12.597 -13.763 1.00 0.00 H new ATOM 0 HG3 GLU A 130 11.275 -13.730 -14.657 1.00 0.00 H new ATOM 2008 N THR A 131 8.872 -9.456 -14.963 1.00 0.00 N ATOM 2009 CA THR A 131 7.934 -8.553 -15.616 1.00 0.00 C ATOM 2010 C THR A 131 7.827 -7.232 -14.863 1.00 0.00 C ATOM 2011 O THR A 131 7.624 -6.178 -15.465 1.00 0.00 O ATOM 2012 CB THR A 131 6.532 -9.182 -15.725 1.00 0.00 C ATOM 2013 OG1 THR A 131 6.596 -10.390 -16.493 1.00 0.00 O ATOM 2014 CG2 THR A 131 5.553 -8.215 -16.373 1.00 0.00 C ATOM 0 H THR A 131 8.491 -9.947 -14.154 1.00 0.00 H new ATOM 0 HA THR A 131 8.321 -8.367 -16.618 1.00 0.00 H new ATOM 0 HB THR A 131 6.181 -9.409 -14.718 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.701 -10.785 -16.557 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.570 -8.682 -16.439 1.00 0.00 H new ATOM 0 HG22 THR A 131 5.485 -7.309 -15.771 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.902 -7.961 -17.374 1.00 0.00 H new ATOM 2022 N ILE A 132 7.967 -7.296 -13.543 1.00 0.00 N ATOM 2023 CA ILE A 132 7.889 -6.103 -12.708 1.00 0.00 C ATOM 2024 C ILE A 132 9.278 -5.558 -12.396 1.00 0.00 C ATOM 2025 O ILE A 132 9.427 -4.406 -11.990 1.00 0.00 O ATOM 2026 CB ILE A 132 7.153 -6.389 -11.386 1.00 0.00 C ATOM 2027 CG1 ILE A 132 5.817 -7.083 -11.659 1.00 0.00 C ATOM 2028 CG2 ILE A 132 6.937 -5.099 -10.610 1.00 0.00 C ATOM 2029 CD1 ILE A 132 5.301 -7.885 -10.485 1.00 0.00 C ATOM 0 H ILE A 132 8.135 -8.161 -13.029 1.00 0.00 H new ATOM 0 HA ILE A 132 7.328 -5.358 -13.273 1.00 0.00 H new ATOM 0 HB ILE A 132 7.769 -7.055 -10.782 1.00 0.00 H new ATOM 0 HG12 ILE A 132 5.075 -6.332 -11.929 1.00 0.00 H new ATOM 0 HG13 ILE A 132 5.929 -7.744 -12.519 1.00 0.00 H new ATOM 0 HG21 ILE A 132 6.416 -5.318 -9.678 1.00 0.00 H new ATOM 0 HG22 ILE A 132 7.901 -4.642 -10.388 1.00 0.00 H new ATOM 0 HG23 ILE A 132 6.339 -4.411 -11.207 1.00 0.00 H new ATOM 0 HD11 ILE A 132 4.351 -8.349 -10.751 1.00 0.00 H new ATOM 0 HD12 ILE A 132 6.023 -8.660 -10.228 1.00 0.00 H new ATOM 0 HD13 ILE A 132 5.156 -7.225 -9.629 1.00 0.00 H new ATOM 2041 N TYR A 133 10.293 -6.393 -12.591 1.00 0.00 N ATOM 2042 CA TYR A 133 11.671 -5.996 -12.330 1.00 0.00 C ATOM 2043 C TYR A 133 12.020 -4.715 -13.082 1.00 0.00 C ATOM 2044 O TYR A 133 12.442 -3.717 -12.498 1.00 0.00 O ATOM 2045 CB TYR A 133 12.632 -7.115 -12.734 1.00 0.00 C ATOM 2046 CG TYR A 133 13.994 -6.618 -13.162 1.00 0.00 C ATOM 2047 CD1 TYR A 133 14.709 -5.724 -12.375 1.00 0.00 C ATOM 2048 CD2 TYR A 133 14.567 -7.042 -14.355 1.00 0.00 C ATOM 2049 CE1 TYR A 133 15.953 -5.267 -12.762 1.00 0.00 C ATOM 2050 CE2 TYR A 133 15.811 -6.592 -14.750 1.00 0.00 C ATOM 2051 CZ TYR A 133 16.501 -5.704 -13.951 1.00 0.00 C ATOM 2052 OH TYR A 133 17.740 -5.252 -14.341 1.00 0.00 O ATOM 0 H TYR A 133 10.187 -7.349 -12.929 1.00 0.00 H new ATOM 0 HA TYR A 133 11.772 -5.808 -11.261 1.00 0.00 H new ATOM 0 HB2 TYR A 133 12.752 -7.800 -11.895 1.00 0.00 H new ATOM 0 HB3 TYR A 133 12.189 -7.685 -13.551 1.00 0.00 H new ATOM 0 HD1 TYR A 133 14.284 -5.380 -11.444 1.00 0.00 H new ATOM 0 HD2 TYR A 133 14.030 -7.736 -14.984 1.00 0.00 H new ATOM 0 HE1 TYR A 133 16.494 -4.571 -12.138 1.00 0.00 H new ATOM 0 HE2 TYR A 133 16.242 -6.933 -15.680 1.00 0.00 H new ATOM 0 HH TYR A 133 17.980 -5.657 -15.200 1.00 0.00 H new ATOM 2062 N PRO A 134 11.839 -4.742 -14.411 1.00 0.00 N ATOM 2063 CA PRO A 134 12.127 -3.592 -15.273 1.00 0.00 C ATOM 2064 C PRO A 134 11.439 -2.319 -14.791 1.00 0.00 C ATOM 2065 O PRO A 134 12.061 -1.259 -14.708 1.00 0.00 O ATOM 2066 CB PRO A 134 11.569 -4.019 -16.633 1.00 0.00 C ATOM 2067 CG PRO A 134 11.622 -5.508 -16.613 1.00 0.00 C ATOM 2068 CD PRO A 134 11.339 -5.898 -15.174 1.00 0.00 C ATOM 0 HA PRO A 134 13.190 -3.352 -15.289 1.00 0.00 H new ATOM 0 HB2 PRO A 134 10.549 -3.661 -16.773 1.00 0.00 H new ATOM 0 HB3 PRO A 134 12.164 -3.612 -17.451 1.00 0.00 H new ATOM 0 HG2 PRO A 134 10.883 -5.937 -17.290 1.00 0.00 H new ATOM 0 HG3 PRO A 134 12.598 -5.871 -16.935 1.00 0.00 H new ATOM 0 HD2 PRO A 134 10.275 -6.064 -15.003 1.00 0.00 H new ATOM 0 HD3 PRO A 134 11.854 -6.818 -14.897 1.00 0.00 H new ATOM 2076 N CYS A 135 10.154 -2.431 -14.473 1.00 0.00 N ATOM 2077 CA CYS A 135 9.381 -1.289 -13.999 1.00 0.00 C ATOM 2078 C CYS A 135 9.003 -1.460 -12.531 1.00 0.00 C ATOM 2079 O CYS A 135 7.822 -1.499 -12.184 1.00 0.00 O ATOM 2080 CB CYS A 135 8.120 -1.112 -14.846 1.00 0.00 C ATOM 2081 SG CYS A 135 8.426 -1.087 -16.628 1.00 0.00 S ATOM 0 H CYS A 135 9.626 -3.301 -14.535 1.00 0.00 H new ATOM 0 HA CYS A 135 10.001 -0.398 -14.094 1.00 0.00 H new ATOM 0 HB2 CYS A 135 7.426 -1.921 -14.619 1.00 0.00 H new ATOM 0 HB3 CYS A 135 7.630 -0.182 -14.559 1.00 0.00 H new ATOM 0 HG CYS A 135 7.300 -0.935 -17.260 1.00 0.00 H new ATOM 2087 N LEU A 136 10.012 -1.562 -11.674 1.00 0.00 N ATOM 2088 CA LEU A 136 9.786 -1.730 -10.243 1.00 0.00 C ATOM 2089 C LEU A 136 9.601 -0.380 -9.558 1.00 0.00 C ATOM 2090 O LEU A 136 9.915 0.665 -10.128 1.00 0.00 O ATOM 2091 CB LEU A 136 10.957 -2.482 -9.606 1.00 0.00 C ATOM 2092 CG LEU A 136 10.650 -3.887 -9.088 1.00 0.00 C ATOM 2093 CD1 LEU A 136 11.860 -4.468 -8.373 1.00 0.00 C ATOM 2094 CD2 LEU A 136 9.443 -3.862 -8.162 1.00 0.00 C ATOM 0 H LEU A 136 10.995 -1.531 -11.945 1.00 0.00 H new ATOM 0 HA LEU A 136 8.874 -2.311 -10.111 1.00 0.00 H new ATOM 0 HB2 LEU A 136 11.759 -2.555 -10.341 1.00 0.00 H new ATOM 0 HB3 LEU A 136 11.338 -1.886 -8.777 1.00 0.00 H new ATOM 0 HG LEU A 136 10.416 -4.525 -9.940 1.00 0.00 H new ATOM 0 HD11 LEU A 136 11.623 -5.468 -8.011 1.00 0.00 H new ATOM 0 HD12 LEU A 136 12.700 -4.522 -9.065 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.125 -3.830 -7.530 1.00 0.00 H new ATOM 0 HD21 LEU A 136 9.239 -4.871 -7.803 1.00 0.00 H new ATOM 0 HD22 LEU A 136 9.649 -3.209 -7.314 1.00 0.00 H new ATOM 0 HD23 LEU A 136 8.575 -3.488 -8.705 1.00 0.00 H new ATOM 2106 N SER A 137 9.091 -0.410 -8.330 1.00 0.00 N ATOM 2107 CA SER A 137 8.863 0.812 -7.568 1.00 0.00 C ATOM 2108 C SER A 137 10.056 1.123 -6.670 1.00 0.00 C ATOM 2109 O SER A 137 10.875 0.257 -6.360 1.00 0.00 O ATOM 2110 CB SER A 137 7.595 0.681 -6.723 1.00 0.00 C ATOM 2111 OG SER A 137 7.815 1.134 -5.398 1.00 0.00 O ATOM 0 H SER A 137 8.828 -1.267 -7.843 1.00 0.00 H new ATOM 0 HA SER A 137 8.738 1.633 -8.274 1.00 0.00 H new ATOM 0 HB2 SER A 137 6.790 1.257 -7.179 1.00 0.00 H new ATOM 0 HB3 SER A 137 7.272 -0.360 -6.706 1.00 0.00 H new ATOM 0 HG SER A 137 7.402 0.509 -4.766 1.00 0.00 H new ATOM 2117 N PRO A 138 10.159 2.390 -6.241 1.00 0.00 N ATOM 2118 CA PRO A 138 11.248 2.846 -5.372 1.00 0.00 C ATOM 2119 C PRO A 138 11.143 2.273 -3.962 1.00 0.00 C ATOM 2120 O PRO A 138 10.549 2.886 -3.075 1.00 0.00 O ATOM 2121 CB PRO A 138 11.069 4.366 -5.347 1.00 0.00 C ATOM 2122 CG PRO A 138 9.624 4.582 -5.637 1.00 0.00 C ATOM 2123 CD PRO A 138 9.219 3.474 -6.571 1.00 0.00 C ATOM 0 HA PRO A 138 12.223 2.524 -5.737 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.345 4.781 -4.378 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.699 4.851 -6.092 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.034 4.556 -4.721 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.459 5.558 -6.094 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.184 3.171 -6.411 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.305 3.777 -7.615 1.00 0.00 H new ATOM 2131 N LYS A 139 11.724 1.095 -3.762 1.00 0.00 N ATOM 2132 CA LYS A 139 11.698 0.440 -2.460 1.00 0.00 C ATOM 2133 C LYS A 139 12.553 1.201 -1.451 1.00 0.00 C ATOM 2134 O LYS A 139 13.779 1.226 -1.555 1.00 0.00 O ATOM 2135 CB LYS A 139 12.196 -1.002 -2.582 1.00 0.00 C ATOM 2136 CG LYS A 139 11.080 -2.020 -2.733 1.00 0.00 C ATOM 2137 CD LYS A 139 11.449 -3.351 -2.100 1.00 0.00 C ATOM 2138 CE LYS A 139 11.244 -4.505 -3.069 1.00 0.00 C ATOM 2139 NZ LYS A 139 12.202 -5.618 -2.817 1.00 0.00 N ATOM 0 H LYS A 139 12.219 0.574 -4.486 1.00 0.00 H new ATOM 0 HA LYS A 139 10.668 0.433 -2.105 1.00 0.00 H new ATOM 0 HB2 LYS A 139 12.862 -1.076 -3.441 1.00 0.00 H new ATOM 0 HB3 LYS A 139 12.785 -1.250 -1.699 1.00 0.00 H new ATOM 0 HG2 LYS A 139 10.171 -1.636 -2.270 1.00 0.00 H new ATOM 0 HG3 LYS A 139 10.862 -2.167 -3.791 1.00 0.00 H new ATOM 0 HD2 LYS A 139 12.490 -3.326 -1.778 1.00 0.00 H new ATOM 0 HD3 LYS A 139 10.843 -3.511 -1.208 1.00 0.00 H new ATOM 0 HE2 LYS A 139 10.223 -4.877 -2.980 1.00 0.00 H new ATOM 0 HE3 LYS A 139 11.364 -4.147 -4.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 12.030 -6.385 -3.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 13.176 -5.270 -2.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 12.070 -5.977 -1.850 1.00 0.00 H new ATOM 2153 N SER A 140 11.897 1.819 -0.474 1.00 0.00 N ATOM 2154 CA SER A 140 12.597 2.583 0.552 1.00 0.00 C ATOM 2155 C SER A 140 13.140 1.660 1.639 1.00 0.00 C ATOM 2156 O SER A 140 12.385 0.954 2.305 1.00 0.00 O ATOM 2157 CB SER A 140 11.661 3.623 1.171 1.00 0.00 C ATOM 2158 OG SER A 140 12.143 4.057 2.431 1.00 0.00 O ATOM 0 H SER A 140 10.882 1.806 -0.371 1.00 0.00 H new ATOM 0 HA SER A 140 13.436 3.095 0.081 1.00 0.00 H new ATOM 0 HB2 SER A 140 11.567 4.477 0.500 1.00 0.00 H new ATOM 0 HB3 SER A 140 10.664 3.197 1.286 1.00 0.00 H new ATOM 0 HG SER A 140 11.792 3.472 3.135 1.00 0.00 H new