USER MOD reduce.3.24.130724 H: found=0, std=0, add=637, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 640 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 454 THR OG1 : rot 180:sc= 1.03 USER MOD Set 1.2: A 476 THR OG1 : rot -67:sc= 1.24 USER MOD Set 2.1: A 422 SER OG : rot -121:sc= 0.775 USER MOD Set 2.2: A 424 HIS : no HE2:sc= 0.273 K(o=0.091,f=-0.81) USER MOD Set 2.3: A 434 GLN : amide:sc= -0.957 K(o=0.091,f=1) USER MOD Set 3.1: A 416 THR OG1 : rot 143:sc= 1.75 USER MOD Set 3.2: A 419 TYR OH : rot 180:sc= 0.728 USER MOD Set 4.1: A 407 THR OG1 : rot 180:sc= 1.17 USER MOD Set 4.2: A 445 THR OG1 : rot -76:sc= 1.29 USER MOD Set 5.1: A 404 SER OG : rot 96:sc= 0.885 USER MOD Set 5.2: A 479 ASN : amide:sc= 0.784 K(o=1.7,f=-1) USER MOD Single : A 395 ASN : amide:sc= -2.75! K(o=-2.8!,f=0) USER MOD Single : A 397 SER OG : rot 176:sc= 0.112 USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 400 GLN : amide:sc= -2.48! C(o=-2.5!,f=-1.6!) USER MOD Single : A 405 GLN : amide:sc= -0.445 K(o=-0.45,f=-5.7!) USER MOD Single : A 406 THR OG1 : rot 180:sc= -0.0895 USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 414 GLN : amide:sc=-0.00276 K(o=-0.0028,f=-0.85) USER MOD Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 423 CYS SG : rot 130:sc= -3.68 USER MOD Single : A 428 THR OG1 : rot 180:sc= 0.0294 USER MOD Single : A 440 THR OG1 : rot 180:sc= 0.00173 USER MOD Single : A 441 SER OG : rot 180:sc= -0.337 USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 SER OG : rot -19:sc= 0.829 USER MOD Single : A 447 THR OG1 : rot 180:sc= 0.0685 USER MOD Single : A 450 THR OG1 : rot 180:sc= 0 USER MOD Single : A 455 TYR OH : rot 66:sc= 0.845 USER MOD Single : A 456 ASN : amide:sc= -1.76 K(o=-1.8,f=-4.2!) USER MOD Single : A 463 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0628) USER MOD Single : A 465 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 466 GLN : amide:sc= -1.47! K(o=-1.5!,f=-0.093) USER MOD Single : A 468 HIS : no HD1:sc= -0.0222 X(o=-0.022,f=0) USER MOD Single : A 469 LYS NZ :NH3+ 137:sc= 0.231 (180deg=-0.414) USER MOD Single : A 480 SER OG : rot 32:sc= 0.908 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 395 20.631 16.039 -1.141 1.00 7.64 N ATOM 2 CA ASN A 395 21.059 15.217 0.011 1.00 7.05 C ATOM 3 C ASN A 395 21.407 16.109 1.201 1.00 6.89 C ATOM 4 O ASN A 395 22.546 16.554 1.340 1.00 7.24 O ATOM 5 CB ASN A 395 22.262 14.360 -0.376 1.00 7.73 C ATOM 6 CG ASN A 395 22.729 13.441 0.740 1.00 8.25 C ATOM 7 OD1 ASN A 395 23.919 13.151 0.857 1.00 8.44 O ATOM 8 ND2 ASN A 395 21.803 12.955 1.557 1.00 8.76 N ATOM 0 HA ASN A 395 20.237 14.562 0.298 1.00 7.05 H new ATOM 0 HB2 ASN A 395 22.006 13.759 -1.249 1.00 7.73 H new ATOM 0 HB3 ASN A 395 23.085 15.012 -0.669 1.00 7.73 H new ATOM 0 HD21 ASN A 395 22.069 12.321 2.310 1.00 8.76 H new ATOM 0 HD22 ASN A 395 20.825 13.216 1.432 1.00 8.76 H new ATOM 17 N ALA A 396 20.420 16.379 2.049 1.00 6.67 N ATOM 18 CA ALA A 396 20.635 17.194 3.248 1.00 6.81 C ATOM 19 C ALA A 396 19.807 16.613 4.392 1.00 6.05 C ATOM 20 O ALA A 396 19.126 17.344 5.114 1.00 6.42 O ATOM 21 CB ALA A 396 20.265 18.663 3.006 1.00 7.55 C ATOM 0 H ALA A 396 19.463 16.047 1.932 1.00 6.67 H new ATOM 0 HA ALA A 396 21.694 17.170 3.506 1.00 6.81 H new ATOM 0 HB1 ALA A 396 20.437 19.236 3.917 1.00 7.55 H new ATOM 0 HB2 ALA A 396 20.881 19.066 2.202 1.00 7.55 H new ATOM 0 HB3 ALA A 396 19.214 18.732 2.727 1.00 7.55 H new ATOM 27 N SER A 397 19.861 15.289 4.553 1.00 5.23 N ATOM 28 CA SER A 397 18.954 14.597 5.454 1.00 4.72 C ATOM 29 C SER A 397 19.608 14.489 6.842 1.00 4.61 C ATOM 30 O SER A 397 20.829 14.637 6.946 1.00 4.53 O ATOM 31 CB SER A 397 18.629 13.207 4.875 1.00 4.27 C ATOM 32 OG SER A 397 17.693 12.515 5.685 1.00 4.45 O ATOM 0 H SER A 397 20.523 14.681 4.070 1.00 5.23 H new ATOM 0 HA SER A 397 18.020 15.150 5.558 1.00 4.72 H new ATOM 0 HB2 SER A 397 18.230 13.316 3.867 1.00 4.27 H new ATOM 0 HB3 SER A 397 19.545 12.622 4.794 1.00 4.27 H new ATOM 0 HG SER A 397 17.452 11.668 5.255 1.00 4.45 H new ATOM 38 N THR A 398 18.838 14.234 7.909 1.00 5.02 N ATOM 39 CA THR A 398 19.463 14.107 9.248 1.00 5.32 C ATOM 40 C THR A 398 19.123 12.751 9.846 1.00 5.50 C ATOM 41 O THR A 398 19.112 12.574 11.067 1.00 6.31 O ATOM 42 CB THR A 398 19.060 15.238 10.239 1.00 6.23 C ATOM 43 OG1 THR A 398 17.697 15.627 10.023 1.00 6.75 O ATOM 44 CG2 THR A 398 19.982 16.461 10.132 1.00 6.37 C ATOM 0 H THR A 398 17.825 14.115 7.885 1.00 5.02 H new ATOM 0 HA THR A 398 20.538 14.202 9.097 1.00 5.32 H new ATOM 0 HB THR A 398 19.167 14.837 11.247 1.00 6.23 H new ATOM 0 HG1 THR A 398 17.456 16.337 10.653 1.00 6.75 H new ATOM 0 HG21 THR A 398 19.660 17.222 10.843 1.00 6.37 H new ATOM 0 HG22 THR A 398 21.007 16.165 10.356 1.00 6.37 H new ATOM 0 HG23 THR A 398 19.934 16.865 9.121 1.00 6.37 H new ATOM 52 N GLY A 399 18.851 11.784 8.971 1.00 4.93 N ATOM 53 CA GLY A 399 18.557 10.441 9.435 1.00 5.31 C ATOM 54 C GLY A 399 18.567 9.431 8.310 1.00 4.62 C ATOM 55 O GLY A 399 19.581 8.781 8.065 1.00 4.48 O ATOM 0 H GLY A 399 18.829 11.906 7.959 1.00 4.93 H new ATOM 0 HA2 GLY A 399 19.290 10.150 10.188 1.00 5.31 H new ATOM 0 HA3 GLY A 399 17.581 10.432 9.920 1.00 5.31 H new ATOM 59 N GLN A 400 17.447 9.308 7.618 1.00 4.32 N ATOM 60 CA GLN A 400 17.294 8.326 6.571 1.00 3.59 C ATOM 61 C GLN A 400 17.440 8.968 5.209 1.00 2.81 C ATOM 62 O GLN A 400 16.577 9.691 4.755 1.00 2.93 O ATOM 63 CB GLN A 400 15.975 7.563 6.767 1.00 3.81 C ATOM 64 CG GLN A 400 14.703 8.333 6.465 1.00 4.51 C ATOM 65 CD GLN A 400 14.571 9.655 7.238 1.00 4.68 C ATOM 66 OE1 GLN A 400 13.930 9.682 8.289 1.00 5.27 O ATOM 67 NE2 GLN A 400 15.219 10.750 6.798 1.00 4.54 N ATOM 0 H GLN A 400 16.622 9.888 7.770 1.00 4.32 H new ATOM 0 HA GLN A 400 18.092 7.586 6.629 1.00 3.59 H new ATOM 0 HB2 GLN A 400 15.996 6.675 6.135 1.00 3.81 H new ATOM 0 HB3 GLN A 400 15.929 7.218 7.800 1.00 3.81 H new ATOM 0 HG2 GLN A 400 14.664 8.544 5.396 1.00 4.51 H new ATOM 0 HG3 GLN A 400 13.845 7.702 6.697 1.00 4.51 H new ATOM 0 HE21 GLN A 400 15.746 10.714 5.926 1.00 4.54 H new ATOM 0 HE22 GLN A 400 15.182 11.615 7.337 1.00 4.54 H new ATOM 76 N GLU A 401 18.627 8.841 4.651 1.00 2.28 N ATOM 77 CA GLU A 401 18.847 9.107 3.244 1.00 1.62 C ATOM 78 C GLU A 401 19.025 7.849 2.414 1.00 1.37 C ATOM 79 O GLU A 401 19.400 7.910 1.242 1.00 1.38 O ATOM 80 CB GLU A 401 19.997 10.062 3.042 1.00 1.30 C ATOM 81 CG GLU A 401 21.165 9.768 3.946 1.00 1.92 C ATOM 82 CD GLU A 401 22.357 10.647 3.657 1.00 2.22 C ATOM 83 OE1 GLU A 401 22.423 11.771 4.197 1.00 2.91 O ATOM 84 OE2 GLU A 401 23.232 10.224 2.875 1.00 2.28 O ATOM 0 H GLU A 401 19.463 8.552 5.158 1.00 2.28 H new ATOM 0 HA GLU A 401 17.936 9.582 2.880 1.00 1.62 H new ATOM 0 HB2 GLU A 401 20.326 10.013 2.004 1.00 1.30 H new ATOM 0 HB3 GLU A 401 19.653 11.081 3.220 1.00 1.30 H new ATOM 0 HG2 GLU A 401 20.860 9.905 4.984 1.00 1.92 H new ATOM 0 HG3 GLU A 401 21.453 8.723 3.833 1.00 1.92 H new ATOM 91 N ALA A 402 18.736 6.720 3.009 1.00 1.24 N ATOM 92 CA ALA A 402 18.907 5.443 2.351 1.00 1.04 C ATOM 93 C ALA A 402 17.615 5.064 1.676 1.00 0.82 C ATOM 94 O ALA A 402 17.202 3.904 1.635 1.00 0.79 O ATOM 95 CB ALA A 402 19.314 4.411 3.370 1.00 1.18 C ATOM 0 H ALA A 402 18.376 6.656 3.961 1.00 1.24 H new ATOM 0 HA ALA A 402 19.689 5.503 1.594 1.00 1.04 H new ATOM 0 HB1 ALA A 402 19.444 3.447 2.879 1.00 1.18 H new ATOM 0 HB2 ALA A 402 20.253 4.710 3.836 1.00 1.18 H new ATOM 0 HB3 ALA A 402 18.540 4.328 4.133 1.00 1.18 H new ATOM 101 N LEU A 403 16.990 6.089 1.169 1.00 0.75 N ATOM 102 CA LEU A 403 15.616 6.043 0.787 1.00 0.58 C ATOM 103 C LEU A 403 15.431 5.693 -0.674 1.00 0.57 C ATOM 104 O LEU A 403 15.972 6.360 -1.556 1.00 0.90 O ATOM 105 CB LEU A 403 15.029 7.402 1.101 1.00 0.59 C ATOM 106 CG LEU A 403 15.412 7.908 2.491 1.00 0.79 C ATOM 107 CD1 LEU A 403 14.780 9.255 2.752 1.00 1.70 C ATOM 108 CD2 LEU A 403 14.987 6.914 3.554 1.00 1.52 C ATOM 0 H LEU A 403 17.433 6.994 1.009 1.00 0.75 H new ATOM 0 HA LEU A 403 15.105 5.254 1.340 1.00 0.58 H new ATOM 0 HB2 LEU A 403 15.366 8.120 0.353 1.00 0.59 H new ATOM 0 HB3 LEU A 403 13.943 7.349 1.025 1.00 0.59 H new ATOM 0 HG LEU A 403 16.496 8.017 2.532 1.00 0.79 H new ATOM 0 HD11 LEU A 403 15.062 9.603 3.746 1.00 1.70 H new ATOM 0 HD12 LEU A 403 15.126 9.970 2.006 1.00 1.70 H new ATOM 0 HD13 LEU A 403 13.695 9.166 2.693 1.00 1.70 H new ATOM 0 HD21 LEU A 403 15.268 7.291 4.538 1.00 1.52 H new ATOM 0 HD22 LEU A 403 13.906 6.777 3.513 1.00 1.52 H new ATOM 0 HD23 LEU A 403 15.481 5.959 3.377 1.00 1.52 H new ATOM 120 N SER A 404 14.687 4.638 -0.922 1.00 0.30 N ATOM 121 CA SER A 404 14.257 4.317 -2.262 1.00 0.27 C ATOM 122 C SER A 404 12.753 4.535 -2.357 1.00 0.28 C ATOM 123 O SER A 404 12.056 4.542 -1.335 1.00 0.43 O ATOM 124 CB SER A 404 14.634 2.880 -2.604 1.00 0.28 C ATOM 125 OG SER A 404 14.327 2.568 -3.955 1.00 1.04 O ATOM 0 H SER A 404 14.366 3.985 -0.207 1.00 0.30 H new ATOM 0 HA SER A 404 14.754 4.966 -2.983 1.00 0.27 H new ATOM 0 HB2 SER A 404 15.699 2.731 -2.428 1.00 0.28 H new ATOM 0 HB3 SER A 404 14.103 2.196 -1.942 1.00 0.28 H new ATOM 0 HG SER A 404 15.126 2.691 -4.509 1.00 1.04 H new ATOM 131 N GLN A 405 12.258 4.735 -3.568 1.00 0.26 N ATOM 132 CA GLN A 405 10.862 5.073 -3.766 1.00 0.26 C ATOM 133 C GLN A 405 10.174 4.066 -4.671 1.00 0.27 C ATOM 134 O GLN A 405 10.601 3.840 -5.802 1.00 0.43 O ATOM 135 CB GLN A 405 10.696 6.476 -4.371 1.00 0.30 C ATOM 136 CG GLN A 405 11.919 7.386 -4.264 1.00 0.33 C ATOM 137 CD GLN A 405 13.008 7.077 -5.292 1.00 0.58 C ATOM 138 OE1 GLN A 405 13.921 6.293 -5.032 1.00 0.99 O ATOM 139 NE2 GLN A 405 12.922 7.685 -6.471 1.00 0.91 N ATOM 0 H GLN A 405 12.804 4.669 -4.427 1.00 0.26 H new ATOM 0 HA GLN A 405 10.398 5.054 -2.780 1.00 0.26 H new ATOM 0 HB2 GLN A 405 10.434 6.370 -5.424 1.00 0.30 H new ATOM 0 HB3 GLN A 405 9.855 6.967 -3.881 1.00 0.30 H new ATOM 0 HG2 GLN A 405 11.602 8.422 -4.385 1.00 0.33 H new ATOM 0 HG3 GLN A 405 12.341 7.296 -3.263 1.00 0.33 H new ATOM 0 HE21 GLN A 405 12.154 8.330 -6.658 1.00 0.91 H new ATOM 0 HE22 GLN A 405 13.624 7.507 -7.189 1.00 0.91 H new ATOM 148 N THR A 406 9.110 3.470 -4.166 1.00 0.18 N ATOM 149 CA THR A 406 8.280 2.591 -4.956 1.00 0.19 C ATOM 150 C THR A 406 6.951 3.239 -5.234 1.00 0.17 C ATOM 151 O THR A 406 6.102 3.372 -4.355 1.00 0.16 O ATOM 152 CB THR A 406 8.048 1.240 -4.256 1.00 0.21 C ATOM 153 OG1 THR A 406 9.280 0.515 -4.151 1.00 0.27 O ATOM 154 CG2 THR A 406 7.024 0.410 -4.999 1.00 0.29 C ATOM 0 H THR A 406 8.801 3.583 -3.201 1.00 0.18 H new ATOM 0 HA THR A 406 8.806 2.406 -5.892 1.00 0.19 H new ATOM 0 HB THR A 406 7.666 1.442 -3.256 1.00 0.21 H new ATOM 0 HG1 THR A 406 9.118 -0.341 -3.702 1.00 0.27 H new ATOM 0 HG21 THR A 406 6.880 -0.539 -4.482 1.00 0.29 H new ATOM 0 HG22 THR A 406 6.077 0.949 -5.038 1.00 0.29 H new ATOM 0 HG23 THR A 406 7.376 0.221 -6.013 1.00 0.29 H new ATOM 162 N THR A 407 6.800 3.679 -6.451 1.00 0.19 N ATOM 163 CA THR A 407 5.535 4.147 -6.927 1.00 0.19 C ATOM 164 C THR A 407 4.641 2.954 -7.226 1.00 0.19 C ATOM 165 O THR A 407 4.889 2.185 -8.156 1.00 0.26 O ATOM 166 CB THR A 407 5.736 5.002 -8.173 1.00 0.24 C ATOM 167 OG1 THR A 407 6.407 6.217 -7.821 1.00 0.26 O ATOM 168 CG2 THR A 407 4.410 5.313 -8.864 1.00 0.24 C ATOM 0 H THR A 407 7.552 3.722 -7.139 1.00 0.19 H new ATOM 0 HA THR A 407 5.056 4.763 -6.166 1.00 0.19 H new ATOM 0 HB THR A 407 6.348 4.437 -8.876 1.00 0.24 H new ATOM 0 HG1 THR A 407 6.536 6.764 -8.624 1.00 0.26 H new ATOM 0 HG21 THR A 407 4.595 5.924 -9.748 1.00 0.24 H new ATOM 0 HG22 THR A 407 3.927 4.382 -9.161 1.00 0.24 H new ATOM 0 HG23 THR A 407 3.760 5.855 -8.177 1.00 0.24 H new ATOM 176 N ILE A 408 3.614 2.797 -6.421 1.00 0.21 N ATOM 177 CA ILE A 408 2.727 1.652 -6.535 1.00 0.21 C ATOM 178 C ILE A 408 1.321 2.126 -6.802 1.00 0.18 C ATOM 179 O ILE A 408 0.842 3.079 -6.189 1.00 0.16 O ATOM 180 CB ILE A 408 2.782 0.690 -5.296 1.00 0.23 C ATOM 181 CG1 ILE A 408 1.503 -0.144 -5.151 1.00 0.21 C ATOM 182 CG2 ILE A 408 3.023 1.438 -3.998 1.00 0.25 C ATOM 183 CD1 ILE A 408 1.715 -1.477 -4.471 1.00 0.27 C ATOM 0 H ILE A 408 3.368 3.449 -5.676 1.00 0.21 H new ATOM 0 HA ILE A 408 3.077 1.055 -7.377 1.00 0.21 H new ATOM 0 HB ILE A 408 3.624 0.024 -5.486 1.00 0.23 H new ATOM 0 HG12 ILE A 408 0.769 0.429 -4.584 1.00 0.21 H new ATOM 0 HG13 ILE A 408 1.078 -0.315 -6.140 1.00 0.21 H new ATOM 0 HG21 ILE A 408 3.053 0.730 -3.170 1.00 0.25 H new ATOM 0 HG22 ILE A 408 3.973 1.970 -4.055 1.00 0.25 H new ATOM 0 HG23 ILE A 408 2.217 2.153 -3.835 1.00 0.25 H new ATOM 0 HD11 ILE A 408 0.765 -2.007 -4.406 1.00 0.27 H new ATOM 0 HD12 ILE A 408 2.424 -2.071 -5.048 1.00 0.27 H new ATOM 0 HD13 ILE A 408 2.110 -1.315 -3.468 1.00 0.27 H new ATOM 195 N SER A 409 0.693 1.486 -7.762 1.00 0.18 N ATOM 196 CA SER A 409 -0.623 1.875 -8.196 1.00 0.16 C ATOM 197 C SER A 409 -1.616 0.759 -7.947 1.00 0.13 C ATOM 198 O SER A 409 -1.259 -0.420 -7.909 1.00 0.15 O ATOM 199 CB SER A 409 -0.595 2.245 -9.674 1.00 0.21 C ATOM 200 OG SER A 409 0.074 1.254 -10.436 1.00 0.71 O ATOM 0 H SER A 409 1.081 0.685 -8.260 1.00 0.18 H new ATOM 0 HA SER A 409 -0.939 2.746 -7.622 1.00 0.16 H new ATOM 0 HB2 SER A 409 -1.614 2.364 -10.042 1.00 0.21 H new ATOM 0 HB3 SER A 409 -0.096 3.205 -9.802 1.00 0.21 H new ATOM 0 HG SER A 409 0.077 1.514 -11.381 1.00 0.71 H new ATOM 206 N TRP A 410 -2.855 1.141 -7.766 1.00 0.16 N ATOM 207 CA TRP A 410 -3.917 0.190 -7.524 1.00 0.17 C ATOM 208 C TRP A 410 -5.189 0.680 -8.127 1.00 0.18 C ATOM 209 O TRP A 410 -5.299 1.834 -8.541 1.00 0.19 O ATOM 210 CB TRP A 410 -4.105 -0.060 -6.027 1.00 0.16 C ATOM 211 CG TRP A 410 -4.401 1.174 -5.219 1.00 0.14 C ATOM 212 CD1 TRP A 410 -5.623 1.699 -4.865 1.00 0.14 C ATOM 213 CD2 TRP A 410 -3.420 2.039 -4.657 1.00 0.13 C ATOM 214 NE1 TRP A 410 -5.436 2.823 -4.098 1.00 0.13 N ATOM 215 CE2 TRP A 410 -4.093 3.055 -3.962 1.00 0.12 C ATOM 216 CE3 TRP A 410 -2.027 2.042 -4.676 1.00 0.14 C ATOM 217 CZ2 TRP A 410 -3.414 4.067 -3.290 1.00 0.14 C ATOM 218 CZ3 TRP A 410 -1.353 3.041 -4.017 1.00 0.15 C ATOM 219 CH2 TRP A 410 -2.046 4.045 -3.329 1.00 0.14 C ATOM 0 H TRP A 410 -3.158 2.115 -7.782 1.00 0.16 H new ATOM 0 HA TRP A 410 -3.639 -0.755 -7.991 1.00 0.17 H new ATOM 0 HB2 TRP A 410 -4.919 -0.772 -5.890 1.00 0.16 H new ATOM 0 HB3 TRP A 410 -3.203 -0.528 -5.634 1.00 0.16 H new ATOM 0 HD1 TRP A 410 -6.582 1.290 -5.147 1.00 0.14 H new ATOM 0 HE1 TRP A 410 -6.179 3.394 -3.694 1.00 0.13 H new ATOM 0 HE3 TRP A 410 -1.485 1.270 -5.201 1.00 0.14 H new ATOM 0 HZ2 TRP A 410 -3.947 4.841 -2.757 1.00 0.14 H new ATOM 0 HZ3 TRP A 410 -0.273 3.052 -4.030 1.00 0.15 H new ATOM 0 HH2 TRP A 410 -1.490 4.817 -2.819 1.00 0.14 H new ATOM 230 N ALA A 411 -6.142 -0.204 -8.188 1.00 0.19 N ATOM 231 CA ALA A 411 -7.358 0.096 -8.830 1.00 0.22 C ATOM 232 C ALA A 411 -8.342 0.650 -7.842 1.00 0.19 C ATOM 233 O ALA A 411 -8.476 0.152 -6.720 1.00 0.19 O ATOM 234 CB ALA A 411 -7.895 -1.118 -9.525 1.00 0.26 C ATOM 0 H ALA A 411 -6.085 -1.143 -7.793 1.00 0.19 H new ATOM 0 HA ALA A 411 -7.183 0.859 -9.589 1.00 0.22 H new ATOM 0 HB1 ALA A 411 -8.836 -0.870 -10.017 1.00 0.26 H new ATOM 0 HB2 ALA A 411 -7.176 -1.459 -10.269 1.00 0.26 H new ATOM 0 HB3 ALA A 411 -8.065 -1.910 -8.795 1.00 0.26 H new ATOM 240 N PRO A 412 -9.016 1.703 -8.269 1.00 0.20 N ATOM 241 CA PRO A 412 -9.949 2.441 -7.452 1.00 0.19 C ATOM 242 C PRO A 412 -10.944 1.539 -6.770 1.00 0.20 C ATOM 243 O PRO A 412 -11.685 0.798 -7.421 1.00 0.23 O ATOM 244 CB PRO A 412 -10.700 3.326 -8.427 1.00 0.24 C ATOM 245 CG PRO A 412 -9.967 3.276 -9.731 1.00 0.26 C ATOM 246 CD PRO A 412 -8.894 2.234 -9.620 1.00 0.23 C ATOM 0 HA PRO A 412 -9.422 2.986 -6.669 1.00 0.19 H new ATOM 0 HB2 PRO A 412 -11.726 2.978 -8.549 1.00 0.24 H new ATOM 0 HB3 PRO A 412 -10.752 4.349 -8.055 1.00 0.24 H new ATOM 0 HG2 PRO A 412 -10.651 3.033 -10.544 1.00 0.26 H new ATOM 0 HG3 PRO A 412 -9.532 4.248 -9.961 1.00 0.26 H new ATOM 0 HD2 PRO A 412 -9.028 1.450 -10.365 1.00 0.23 H new ATOM 0 HD3 PRO A 412 -7.907 2.666 -9.786 1.00 0.23 H new ATOM 254 N PHE A 413 -10.955 1.604 -5.464 1.00 0.21 N ATOM 255 CA PHE A 413 -11.881 0.829 -4.693 1.00 0.30 C ATOM 256 C PHE A 413 -13.227 1.553 -4.628 1.00 0.51 C ATOM 257 O PHE A 413 -14.104 1.258 -5.439 1.00 1.35 O ATOM 258 CB PHE A 413 -11.283 0.538 -3.310 1.00 0.30 C ATOM 259 CG PHE A 413 -12.198 -0.175 -2.367 1.00 0.37 C ATOM 260 CD1 PHE A 413 -12.612 0.443 -1.205 1.00 0.36 C ATOM 261 CD2 PHE A 413 -12.642 -1.454 -2.644 1.00 0.51 C ATOM 262 CE1 PHE A 413 -13.458 -0.204 -0.326 1.00 0.45 C ATOM 263 CE2 PHE A 413 -13.486 -2.110 -1.773 1.00 0.61 C ATOM 264 CZ PHE A 413 -13.898 -1.484 -0.611 1.00 0.57 C ATOM 0 H PHE A 413 -10.328 2.190 -4.913 1.00 0.21 H new ATOM 0 HA PHE A 413 -12.064 -0.135 -5.167 1.00 0.30 H new ATOM 0 HB2 PHE A 413 -10.380 -0.059 -3.439 1.00 0.30 H new ATOM 0 HB3 PHE A 413 -10.979 1.481 -2.856 1.00 0.30 H new ATOM 0 HD1 PHE A 413 -12.271 1.443 -0.981 1.00 0.36 H new ATOM 0 HD2 PHE A 413 -12.325 -1.945 -3.552 1.00 0.51 H new ATOM 0 HE1 PHE A 413 -13.775 0.288 0.582 1.00 0.45 H new ATOM 0 HE2 PHE A 413 -13.825 -3.111 -1.998 1.00 0.61 H new ATOM 0 HZ PHE A 413 -14.562 -1.993 0.072 1.00 0.57 H new ATOM 274 N GLN A 414 -13.362 2.514 -3.705 1.00 0.54 N ATOM 275 CA GLN A 414 -14.559 3.439 -3.678 1.00 0.53 C ATOM 276 C GLN A 414 -14.727 4.084 -2.343 1.00 0.44 C ATOM 277 O GLN A 414 -14.747 3.459 -1.281 1.00 0.48 O ATOM 278 CB GLN A 414 -15.928 2.830 -4.121 1.00 0.71 C ATOM 279 CG GLN A 414 -16.483 1.932 -3.077 1.00 1.28 C ATOM 280 CD GLN A 414 -17.736 1.200 -3.520 1.00 1.51 C ATOM 281 OE1 GLN A 414 -17.918 0.920 -4.704 1.00 2.11 O ATOM 282 NE2 GLN A 414 -18.606 0.869 -2.577 1.00 1.89 N ATOM 0 H GLN A 414 -12.681 2.690 -2.966 1.00 0.54 H new ATOM 0 HA GLN A 414 -14.304 4.172 -4.443 1.00 0.53 H new ATOM 0 HB2 GLN A 414 -16.636 3.633 -4.327 1.00 0.71 H new ATOM 0 HB3 GLN A 414 -15.798 2.274 -5.050 1.00 0.71 H new ATOM 0 HG2 GLN A 414 -15.724 1.202 -2.795 1.00 1.28 H new ATOM 0 HG3 GLN A 414 -16.709 2.518 -2.186 1.00 1.28 H new ATOM 0 HE21 GLN A 414 -18.423 1.117 -1.605 1.00 1.89 H new ATOM 0 HE22 GLN A 414 -19.458 0.366 -2.823 1.00 1.89 H new ATOM 291 N ASP A 415 -14.832 5.373 -2.482 1.00 0.39 N ATOM 292 CA ASP A 415 -15.002 6.331 -1.425 1.00 0.34 C ATOM 293 C ASP A 415 -14.207 6.019 -0.178 1.00 0.31 C ATOM 294 O ASP A 415 -14.692 6.212 0.937 1.00 0.35 O ATOM 295 CB ASP A 415 -16.463 6.483 -1.031 1.00 0.40 C ATOM 296 CG ASP A 415 -17.338 7.032 -2.132 1.00 0.45 C ATOM 297 OD1 ASP A 415 -18.057 6.240 -2.774 1.00 0.58 O ATOM 298 OD2 ASP A 415 -17.296 8.257 -2.374 1.00 0.59 O ATOM 0 H ASP A 415 -14.799 5.815 -3.401 1.00 0.39 H new ATOM 0 HA ASP A 415 -14.621 7.262 -1.844 1.00 0.34 H new ATOM 0 HB2 ASP A 415 -16.849 5.511 -0.723 1.00 0.40 H new ATOM 0 HB3 ASP A 415 -16.529 7.141 -0.165 1.00 0.40 H new ATOM 303 N THR A 416 -13.002 5.572 -0.351 1.00 0.27 N ATOM 304 CA THR A 416 -12.197 5.176 0.761 1.00 0.23 C ATOM 305 C THR A 416 -11.764 6.399 1.559 1.00 0.24 C ATOM 306 O THR A 416 -11.582 7.480 1.012 1.00 0.25 O ATOM 307 CB THR A 416 -10.990 4.392 0.259 1.00 0.19 C ATOM 308 OG1 THR A 416 -11.410 3.474 -0.758 1.00 0.22 O ATOM 309 CG2 THR A 416 -10.360 3.628 1.395 1.00 0.22 C ATOM 0 H THR A 416 -12.552 5.472 -1.261 1.00 0.27 H new ATOM 0 HA THR A 416 -12.778 4.534 1.423 1.00 0.23 H new ATOM 0 HB THR A 416 -10.258 5.087 -0.151 1.00 0.19 H new ATOM 0 HG1 THR A 416 -10.722 3.419 -1.453 1.00 0.22 H new ATOM 0 HG21 THR A 416 -9.499 3.071 1.026 1.00 0.22 H new ATOM 0 HG22 THR A 416 -10.037 4.326 2.168 1.00 0.22 H new ATOM 0 HG23 THR A 416 -11.088 2.934 1.814 1.00 0.22 H new ATOM 317 N SER A 417 -11.726 6.249 2.870 1.00 0.25 N ATOM 318 CA SER A 417 -11.251 7.302 3.746 1.00 0.28 C ATOM 319 C SER A 417 -9.728 7.397 3.673 1.00 0.27 C ATOM 320 O SER A 417 -9.155 8.484 3.707 1.00 0.33 O ATOM 321 CB SER A 417 -11.705 7.013 5.175 1.00 0.32 C ATOM 322 OG SER A 417 -13.114 6.882 5.232 1.00 1.14 O ATOM 0 H SER A 417 -12.021 5.401 3.354 1.00 0.25 H new ATOM 0 HA SER A 417 -11.668 8.258 3.428 1.00 0.28 H new ATOM 0 HB2 SER A 417 -11.234 6.098 5.534 1.00 0.32 H new ATOM 0 HB3 SER A 417 -11.382 7.818 5.835 1.00 0.32 H new ATOM 0 HG SER A 417 -13.388 6.695 6.154 1.00 1.14 H new ATOM 328 N GLU A 418 -9.093 6.239 3.552 1.00 0.23 N ATOM 329 CA GLU A 418 -7.642 6.136 3.487 1.00 0.25 C ATOM 330 C GLU A 418 -7.218 4.853 2.803 1.00 0.19 C ATOM 331 O GLU A 418 -7.942 3.876 2.797 1.00 0.28 O ATOM 332 CB GLU A 418 -7.076 6.113 4.894 1.00 0.36 C ATOM 333 CG GLU A 418 -6.717 7.454 5.450 1.00 0.84 C ATOM 334 CD GLU A 418 -6.379 7.417 6.929 1.00 0.86 C ATOM 335 OE1 GLU A 418 -5.201 7.167 7.273 1.00 1.31 O ATOM 336 OE2 GLU A 418 -7.285 7.629 7.761 1.00 1.37 O ATOM 0 H GLU A 418 -9.573 5.341 3.496 1.00 0.23 H new ATOM 0 HA GLU A 418 -7.271 6.992 2.924 1.00 0.25 H new ATOM 0 HB2 GLU A 418 -7.805 5.645 5.556 1.00 0.36 H new ATOM 0 HB3 GLU A 418 -6.187 5.483 4.902 1.00 0.36 H new ATOM 0 HG2 GLU A 418 -5.865 7.852 4.899 1.00 0.84 H new ATOM 0 HG3 GLU A 418 -7.549 8.141 5.291 1.00 0.84 H new ATOM 343 N TYR A 419 -6.032 4.851 2.271 1.00 0.17 N ATOM 344 CA TYR A 419 -5.421 3.618 1.793 1.00 0.16 C ATOM 345 C TYR A 419 -4.103 3.457 2.494 1.00 0.19 C ATOM 346 O TYR A 419 -3.204 4.289 2.351 1.00 0.29 O ATOM 347 CB TYR A 419 -5.192 3.577 0.267 1.00 0.16 C ATOM 348 CG TYR A 419 -6.466 3.648 -0.598 1.00 0.14 C ATOM 349 CD1 TYR A 419 -7.207 2.499 -0.878 1.00 0.12 C ATOM 350 CD2 TYR A 419 -6.943 4.865 -1.131 1.00 0.17 C ATOM 351 CE1 TYR A 419 -8.352 2.561 -1.643 1.00 0.12 C ATOM 352 CE2 TYR A 419 -8.096 4.909 -1.902 1.00 0.18 C ATOM 353 CZ TYR A 419 -8.761 3.797 -2.185 1.00 0.14 C ATOM 354 OH TYR A 419 -9.930 3.791 -2.917 1.00 0.19 O ATOM 0 H TYR A 419 -5.457 5.685 2.151 1.00 0.17 H new ATOM 0 HA TYR A 419 -6.113 2.805 2.014 1.00 0.16 H new ATOM 0 HB2 TYR A 419 -4.541 4.407 -0.007 1.00 0.16 H new ATOM 0 HB3 TYR A 419 -4.658 2.659 0.022 1.00 0.16 H new ATOM 0 HD1 TYR A 419 -6.878 1.547 -0.489 1.00 0.12 H new ATOM 0 HD2 TYR A 419 -6.401 5.778 -0.935 1.00 0.17 H new ATOM 0 HE1 TYR A 419 -8.932 1.669 -1.826 1.00 0.12 H new ATOM 0 HE2 TYR A 419 -8.455 5.857 -2.275 1.00 0.18 H new ATOM 0 HH TYR A 419 -10.117 4.696 -3.242 1.00 0.19 H new ATOM 364 N ILE A 420 -3.998 2.408 3.274 1.00 0.18 N ATOM 365 CA ILE A 420 -2.814 2.181 4.054 1.00 0.18 C ATOM 366 C ILE A 420 -1.981 1.107 3.409 1.00 0.17 C ATOM 367 O ILE A 420 -2.427 -0.029 3.229 1.00 0.21 O ATOM 368 CB ILE A 420 -3.154 1.804 5.501 1.00 0.22 C ATOM 369 CG1 ILE A 420 -3.989 2.934 6.098 1.00 0.32 C ATOM 370 CG2 ILE A 420 -1.876 1.567 6.318 1.00 0.26 C ATOM 371 CD1 ILE A 420 -4.533 2.641 7.460 1.00 0.32 C ATOM 0 H ILE A 420 -4.723 1.698 3.383 1.00 0.18 H new ATOM 0 HA ILE A 420 -2.244 3.109 4.087 1.00 0.18 H new ATOM 0 HB ILE A 420 -3.721 0.874 5.524 1.00 0.22 H new ATOM 0 HG12 ILE A 420 -3.377 3.835 6.149 1.00 0.32 H new ATOM 0 HG13 ILE A 420 -4.820 3.151 5.426 1.00 0.32 H new ATOM 0 HG21 ILE A 420 -2.142 1.301 7.341 1.00 0.26 H new ATOM 0 HG22 ILE A 420 -1.303 0.756 5.870 1.00 0.26 H new ATOM 0 HG23 ILE A 420 -1.274 2.476 6.324 1.00 0.26 H new ATOM 0 HD11 ILE A 420 -5.113 3.494 7.811 1.00 0.32 H new ATOM 0 HD12 ILE A 420 -5.174 1.760 7.414 1.00 0.32 H new ATOM 0 HD13 ILE A 420 -3.709 2.455 8.149 1.00 0.32 H new ATOM 383 N ILE A 421 -0.783 1.481 3.045 1.00 0.15 N ATOM 384 CA ILE A 421 0.101 0.584 2.342 1.00 0.18 C ATOM 385 C ILE A 421 1.130 0.060 3.315 1.00 0.19 C ATOM 386 O ILE A 421 1.986 0.802 3.804 1.00 0.30 O ATOM 387 CB ILE A 421 0.788 1.273 1.153 1.00 0.19 C ATOM 388 CG1 ILE A 421 -0.269 1.779 0.166 1.00 0.20 C ATOM 389 CG2 ILE A 421 1.724 0.281 0.478 1.00 0.24 C ATOM 390 CD1 ILE A 421 0.189 2.930 -0.688 1.00 0.32 C ATOM 0 H ILE A 421 -0.393 2.406 3.224 1.00 0.15 H new ATOM 0 HA ILE A 421 -0.486 -0.239 1.935 1.00 0.18 H new ATOM 0 HB ILE A 421 1.367 2.128 1.501 1.00 0.19 H new ATOM 0 HG12 ILE A 421 -0.568 0.956 -0.483 1.00 0.20 H new ATOM 0 HG13 ILE A 421 -1.155 2.084 0.723 1.00 0.20 H new ATOM 0 HG21 ILE A 421 2.216 0.762 -0.367 1.00 0.24 H new ATOM 0 HG22 ILE A 421 2.476 -0.054 1.193 1.00 0.24 H new ATOM 0 HG23 ILE A 421 1.152 -0.577 0.125 1.00 0.24 H new ATOM 0 HD11 ILE A 421 -0.617 3.229 -1.359 1.00 0.32 H new ATOM 0 HD12 ILE A 421 0.460 3.771 -0.050 1.00 0.32 H new ATOM 0 HD13 ILE A 421 1.056 2.625 -1.275 1.00 0.32 H new ATOM 402 N SER A 422 1.020 -1.212 3.600 1.00 0.14 N ATOM 403 CA SER A 422 1.828 -1.842 4.615 1.00 0.14 C ATOM 404 C SER A 422 2.955 -2.618 3.968 1.00 0.16 C ATOM 405 O SER A 422 2.775 -3.735 3.482 1.00 0.36 O ATOM 406 CB SER A 422 0.988 -2.781 5.466 1.00 0.18 C ATOM 407 OG SER A 422 1.477 -2.854 6.792 1.00 0.88 O ATOM 0 H SER A 422 0.367 -1.842 3.135 1.00 0.14 H new ATOM 0 HA SER A 422 2.241 -1.064 5.256 1.00 0.14 H new ATOM 0 HB2 SER A 422 -0.046 -2.437 5.477 1.00 0.18 H new ATOM 0 HB3 SER A 422 0.989 -3.776 5.021 1.00 0.18 H new ATOM 0 HG SER A 422 1.704 -3.783 7.006 1.00 0.88 H new ATOM 413 N CYS A 423 4.101 -1.999 3.948 1.00 0.14 N ATOM 414 CA CYS A 423 5.305 -2.608 3.428 1.00 0.12 C ATOM 415 C CYS A 423 5.975 -3.463 4.492 1.00 0.12 C ATOM 416 O CYS A 423 6.664 -2.948 5.369 1.00 0.13 O ATOM 417 CB CYS A 423 6.264 -1.536 2.941 1.00 0.14 C ATOM 418 SG CYS A 423 5.635 -0.546 1.568 1.00 0.95 S ATOM 0 H CYS A 423 4.233 -1.049 4.294 1.00 0.14 H new ATOM 0 HA CYS A 423 5.033 -3.249 2.589 1.00 0.12 H new ATOM 0 HB2 CYS A 423 6.502 -0.873 3.773 1.00 0.14 H new ATOM 0 HB3 CYS A 423 7.196 -2.011 2.635 1.00 0.14 H new ATOM 0 HG CYS A 423 5.779 0.717 1.842 1.00 0.95 H new ATOM 424 N HIS A 424 5.764 -4.769 4.411 1.00 0.13 N ATOM 425 CA HIS A 424 6.308 -5.700 5.396 1.00 0.15 C ATOM 426 C HIS A 424 7.648 -6.261 4.931 1.00 0.15 C ATOM 427 O HIS A 424 7.711 -7.070 4.005 1.00 0.16 O ATOM 428 CB HIS A 424 5.341 -6.849 5.642 1.00 0.18 C ATOM 429 CG HIS A 424 4.100 -6.486 6.403 1.00 0.19 C ATOM 430 ND1 HIS A 424 3.921 -6.778 7.738 1.00 0.24 N ATOM 431 CD2 HIS A 424 2.957 -5.876 6.000 1.00 0.24 C ATOM 432 CE1 HIS A 424 2.725 -6.371 8.120 1.00 0.25 C ATOM 433 NE2 HIS A 424 2.123 -5.820 7.087 1.00 0.25 N ATOM 0 H HIS A 424 5.218 -5.211 3.672 1.00 0.13 H new ATOM 0 HA HIS A 424 6.455 -5.149 6.325 1.00 0.15 H new ATOM 0 HB2 HIS A 424 5.048 -7.269 4.680 1.00 0.18 H new ATOM 0 HB3 HIS A 424 5.865 -7.634 6.186 1.00 0.18 H new ATOM 0 HD1 HIS A 424 4.606 -7.237 8.338 1.00 0.24 H new ATOM 0 HD2 HIS A 424 2.744 -5.504 5.009 1.00 0.24 H new ATOM 0 HE1 HIS A 424 2.310 -6.473 9.112 1.00 0.25 H new ATOM 442 N PRO A 425 8.724 -5.819 5.571 1.00 0.17 N ATOM 443 CA PRO A 425 10.085 -6.221 5.232 1.00 0.17 C ATOM 444 C PRO A 425 10.358 -7.692 5.455 1.00 0.18 C ATOM 445 O PRO A 425 10.025 -8.275 6.487 1.00 0.24 O ATOM 446 CB PRO A 425 10.986 -5.376 6.133 1.00 0.21 C ATOM 447 CG PRO A 425 10.097 -4.515 6.970 1.00 0.32 C ATOM 448 CD PRO A 425 8.669 -4.850 6.660 1.00 0.22 C ATOM 0 HA PRO A 425 10.264 -6.063 4.169 1.00 0.17 H new ATOM 0 HB2 PRO A 425 11.606 -6.014 6.763 1.00 0.21 H new ATOM 0 HB3 PRO A 425 11.662 -4.764 5.535 1.00 0.21 H new ATOM 0 HG2 PRO A 425 10.302 -4.678 8.028 1.00 0.32 H new ATOM 0 HG3 PRO A 425 10.290 -3.462 6.766 1.00 0.32 H new ATOM 0 HD2 PRO A 425 8.166 -5.268 7.532 1.00 0.22 H new ATOM 0 HD3 PRO A 425 8.112 -3.960 6.366 1.00 0.22 H new ATOM 456 N VAL A 426 10.958 -8.265 4.441 1.00 0.15 N ATOM 457 CA VAL A 426 11.386 -9.645 4.441 1.00 0.19 C ATOM 458 C VAL A 426 12.916 -9.696 4.519 1.00 0.20 C ATOM 459 O VAL A 426 13.600 -8.887 3.886 1.00 0.20 O ATOM 460 CB VAL A 426 10.944 -10.326 3.140 1.00 0.20 C ATOM 461 CG1 VAL A 426 11.123 -11.833 3.191 1.00 0.27 C ATOM 462 CG2 VAL A 426 9.522 -9.957 2.768 1.00 0.21 C ATOM 0 H VAL A 426 11.168 -7.775 3.572 1.00 0.15 H new ATOM 0 HA VAL A 426 10.943 -10.157 5.295 1.00 0.19 H new ATOM 0 HB VAL A 426 11.600 -9.950 2.355 1.00 0.20 H new ATOM 0 HG11 VAL A 426 10.796 -12.270 2.247 1.00 0.27 H new ATOM 0 HG12 VAL A 426 12.174 -12.069 3.356 1.00 0.27 H new ATOM 0 HG13 VAL A 426 10.527 -12.243 4.006 1.00 0.27 H new ATOM 0 HG21 VAL A 426 9.246 -10.459 1.841 1.00 0.21 H new ATOM 0 HG22 VAL A 426 8.845 -10.268 3.564 1.00 0.21 H new ATOM 0 HG23 VAL A 426 9.450 -8.878 2.631 1.00 0.21 H new ATOM 472 N GLY A 427 13.447 -10.619 5.303 1.00 0.26 N ATOM 473 CA GLY A 427 14.896 -10.770 5.411 1.00 0.29 C ATOM 474 C GLY A 427 15.459 -9.972 6.568 1.00 0.32 C ATOM 475 O GLY A 427 16.338 -10.439 7.291 1.00 0.38 O ATOM 0 H GLY A 427 12.906 -11.271 5.871 1.00 0.26 H new ATOM 0 HA2 GLY A 427 15.143 -11.824 5.542 1.00 0.29 H new ATOM 0 HA3 GLY A 427 15.366 -10.445 4.483 1.00 0.29 H new ATOM 479 N THR A 428 14.950 -8.768 6.735 1.00 0.31 N ATOM 480 CA THR A 428 15.307 -7.929 7.854 1.00 0.37 C ATOM 481 C THR A 428 14.344 -8.118 9.001 1.00 0.41 C ATOM 482 O THR A 428 13.354 -8.847 8.897 1.00 0.41 O ATOM 483 CB THR A 428 15.275 -6.451 7.475 1.00 0.37 C ATOM 484 OG1 THR A 428 14.202 -6.200 6.556 1.00 0.30 O ATOM 485 CG2 THR A 428 16.597 -6.004 6.875 1.00 0.42 C ATOM 0 H THR A 428 14.276 -8.346 6.096 1.00 0.31 H new ATOM 0 HA THR A 428 16.315 -8.221 8.147 1.00 0.37 H new ATOM 0 HB THR A 428 15.109 -5.874 8.385 1.00 0.37 H new ATOM 0 HG1 THR A 428 14.189 -5.249 6.320 1.00 0.30 H new ATOM 0 HG21 THR A 428 16.540 -4.947 6.616 1.00 0.42 H new ATOM 0 HG22 THR A 428 17.396 -6.158 7.600 1.00 0.42 H new ATOM 0 HG23 THR A 428 16.805 -6.587 5.977 1.00 0.42 H new ATOM 493 N ASP A 429 14.640 -7.457 10.102 1.00 0.48 N ATOM 494 CA ASP A 429 13.736 -7.434 11.222 1.00 0.54 C ATOM 495 C ASP A 429 13.039 -6.084 11.322 1.00 0.49 C ATOM 496 O ASP A 429 12.536 -5.710 12.379 1.00 0.59 O ATOM 497 CB ASP A 429 14.476 -7.737 12.515 1.00 0.69 C ATOM 498 CG ASP A 429 13.557 -8.227 13.613 1.00 1.09 C ATOM 499 OD1 ASP A 429 12.983 -9.329 13.465 1.00 1.06 O ATOM 500 OD2 ASP A 429 13.417 -7.527 14.636 1.00 1.78 O ATOM 0 H ASP A 429 15.502 -6.930 10.240 1.00 0.48 H new ATOM 0 HA ASP A 429 12.982 -8.205 11.063 1.00 0.54 H new ATOM 0 HB2 ASP A 429 15.240 -8.490 12.323 1.00 0.69 H new ATOM 0 HB3 ASP A 429 14.992 -6.838 12.853 1.00 0.69 H new ATOM 505 N GLU A 430 13.009 -5.357 10.213 1.00 0.40 N ATOM 506 CA GLU A 430 12.372 -4.053 10.183 1.00 0.38 C ATOM 507 C GLU A 430 10.882 -4.171 10.345 1.00 0.31 C ATOM 508 O GLU A 430 10.287 -5.228 10.120 1.00 0.33 O ATOM 509 CB GLU A 430 12.687 -3.308 8.882 1.00 0.38 C ATOM 510 CG GLU A 430 14.139 -2.894 8.710 1.00 0.48 C ATOM 511 CD GLU A 430 14.327 -1.955 7.538 1.00 1.58 C ATOM 512 OE1 GLU A 430 14.440 -2.443 6.393 1.00 2.50 O ATOM 513 OE2 GLU A 430 14.365 -0.728 7.752 1.00 1.64 O ATOM 0 H GLU A 430 13.418 -5.650 9.326 1.00 0.40 H new ATOM 0 HA GLU A 430 12.775 -3.483 11.020 1.00 0.38 H new ATOM 0 HB2 GLU A 430 12.404 -3.942 8.041 1.00 0.38 H new ATOM 0 HB3 GLU A 430 12.063 -2.416 8.833 1.00 0.38 H new ATOM 0 HG2 GLU A 430 14.488 -2.410 9.622 1.00 0.48 H new ATOM 0 HG3 GLU A 430 14.754 -3.782 8.565 1.00 0.48 H new ATOM 520 N GLU A 431 10.298 -3.072 10.757 1.00 0.29 N ATOM 521 CA GLU A 431 8.895 -2.998 10.956 1.00 0.26 C ATOM 522 C GLU A 431 8.234 -2.652 9.634 1.00 0.24 C ATOM 523 O GLU A 431 8.863 -2.082 8.741 1.00 0.26 O ATOM 524 CB GLU A 431 8.574 -1.940 12.012 1.00 0.29 C ATOM 525 CG GLU A 431 8.439 -0.554 11.422 1.00 0.63 C ATOM 526 CD GLU A 431 7.969 0.479 12.421 1.00 0.87 C ATOM 527 OE1 GLU A 431 8.742 1.410 12.731 1.00 1.11 O ATOM 528 OE2 GLU A 431 6.819 0.373 12.894 1.00 1.05 O ATOM 0 H GLU A 431 10.797 -2.206 10.961 1.00 0.29 H new ATOM 0 HA GLU A 431 8.516 -3.957 11.310 1.00 0.26 H new ATOM 0 HB2 GLU A 431 7.647 -2.207 12.519 1.00 0.29 H new ATOM 0 HB3 GLU A 431 9.360 -1.935 12.767 1.00 0.29 H new ATOM 0 HG2 GLU A 431 9.402 -0.244 11.016 1.00 0.63 H new ATOM 0 HG3 GLU A 431 7.738 -0.588 10.588 1.00 0.63 H new ATOM 535 N PRO A 432 6.972 -3.010 9.496 1.00 0.23 N ATOM 536 CA PRO A 432 6.207 -2.709 8.305 1.00 0.21 C ATOM 537 C PRO A 432 5.980 -1.217 8.160 1.00 0.20 C ATOM 538 O PRO A 432 5.336 -0.586 9.000 1.00 0.24 O ATOM 539 CB PRO A 432 4.877 -3.439 8.509 1.00 0.24 C ATOM 540 CG PRO A 432 4.820 -3.801 9.963 1.00 0.23 C ATOM 541 CD PRO A 432 6.217 -3.726 10.511 1.00 0.24 C ATOM 0 HA PRO A 432 6.723 -3.024 7.398 1.00 0.21 H new ATOM 0 HB2 PRO A 432 4.037 -2.802 8.233 1.00 0.24 H new ATOM 0 HB3 PRO A 432 4.821 -4.330 7.883 1.00 0.24 H new ATOM 0 HG2 PRO A 432 4.162 -3.119 10.501 1.00 0.23 H new ATOM 0 HG3 PRO A 432 4.413 -4.804 10.091 1.00 0.23 H new ATOM 0 HD2 PRO A 432 6.240 -3.201 11.466 1.00 0.24 H new ATOM 0 HD3 PRO A 432 6.629 -4.720 10.684 1.00 0.24 H new ATOM 549 N LEU A 433 6.517 -0.665 7.091 1.00 0.20 N ATOM 550 CA LEU A 433 6.326 0.726 6.781 1.00 0.20 C ATOM 551 C LEU A 433 4.914 0.940 6.312 1.00 0.20 C ATOM 552 O LEU A 433 4.470 0.330 5.339 1.00 0.30 O ATOM 553 CB LEU A 433 7.287 1.169 5.693 1.00 0.22 C ATOM 554 CG LEU A 433 8.680 1.571 6.164 1.00 0.24 C ATOM 555 CD1 LEU A 433 9.491 0.361 6.581 1.00 0.65 C ATOM 556 CD2 LEU A 433 9.395 2.358 5.078 1.00 0.73 C ATOM 0 H LEU A 433 7.095 -1.170 6.419 1.00 0.20 H new ATOM 0 HA LEU A 433 6.517 1.314 7.678 1.00 0.20 H new ATOM 0 HB2 LEU A 433 7.388 0.359 4.971 1.00 0.22 H new ATOM 0 HB3 LEU A 433 6.844 2.014 5.165 1.00 0.22 H new ATOM 0 HG LEU A 433 8.572 2.209 7.041 1.00 0.24 H new ATOM 0 HD11 LEU A 433 10.479 0.682 6.912 1.00 0.65 H new ATOM 0 HD12 LEU A 433 8.984 -0.153 7.398 1.00 0.65 H new ATOM 0 HD13 LEU A 433 9.594 -0.317 5.734 1.00 0.65 H new ATOM 0 HD21 LEU A 433 10.389 2.639 5.427 1.00 0.73 H new ATOM 0 HD22 LEU A 433 9.485 1.743 4.183 1.00 0.73 H new ATOM 0 HD23 LEU A 433 8.825 3.257 4.845 1.00 0.73 H new ATOM 568 N GLN A 434 4.212 1.791 7.004 1.00 0.17 N ATOM 569 CA GLN A 434 2.832 2.039 6.685 1.00 0.17 C ATOM 570 C GLN A 434 2.645 3.434 6.159 1.00 0.20 C ATOM 571 O GLN A 434 2.933 4.428 6.826 1.00 0.27 O ATOM 572 CB GLN A 434 1.935 1.755 7.878 1.00 0.18 C ATOM 573 CG GLN A 434 1.561 0.289 7.950 1.00 0.21 C ATOM 574 CD GLN A 434 0.764 -0.095 9.181 1.00 0.38 C ATOM 575 OE1 GLN A 434 -0.040 -1.028 9.143 1.00 1.26 O ATOM 576 NE2 GLN A 434 0.969 0.610 10.278 1.00 0.74 N ATOM 0 H GLN A 434 4.572 2.326 7.794 1.00 0.17 H new ATOM 0 HA GLN A 434 2.536 1.352 5.892 1.00 0.17 H new ATOM 0 HB2 GLN A 434 2.444 2.048 8.796 1.00 0.18 H new ATOM 0 HB3 GLN A 434 1.031 2.360 7.808 1.00 0.18 H new ATOM 0 HG2 GLN A 434 0.983 0.030 7.063 1.00 0.21 H new ATOM 0 HG3 GLN A 434 2.473 -0.308 7.922 1.00 0.21 H new ATOM 0 HE21 GLN A 434 1.643 1.376 10.274 1.00 0.74 H new ATOM 0 HE22 GLN A 434 0.454 0.389 11.130 1.00 0.74 H new ATOM 585 N PHE A 435 2.194 3.473 4.934 1.00 0.20 N ATOM 586 CA PHE A 435 1.966 4.723 4.225 1.00 0.23 C ATOM 587 C PHE A 435 0.478 4.981 4.085 1.00 0.21 C ATOM 588 O PHE A 435 -0.286 4.086 3.728 1.00 0.24 O ATOM 589 CB PHE A 435 2.632 4.704 2.843 1.00 0.25 C ATOM 590 CG PHE A 435 4.133 4.682 2.884 1.00 0.31 C ATOM 591 CD1 PHE A 435 4.819 3.479 2.946 1.00 0.36 C ATOM 592 CD2 PHE A 435 4.858 5.862 2.871 1.00 0.38 C ATOM 593 CE1 PHE A 435 6.198 3.458 2.997 1.00 0.43 C ATOM 594 CE2 PHE A 435 6.238 5.846 2.920 1.00 0.46 C ATOM 595 CZ PHE A 435 6.911 4.639 2.933 1.00 0.47 C ATOM 0 H PHE A 435 1.971 2.640 4.389 1.00 0.20 H new ATOM 0 HA PHE A 435 2.414 5.529 4.806 1.00 0.23 H new ATOM 0 HB2 PHE A 435 2.282 3.829 2.295 1.00 0.25 H new ATOM 0 HB3 PHE A 435 2.308 5.581 2.284 1.00 0.25 H new ATOM 0 HD1 PHE A 435 4.269 2.549 2.954 1.00 0.36 H new ATOM 0 HD2 PHE A 435 4.337 6.807 2.822 1.00 0.38 H new ATOM 0 HE1 PHE A 435 6.720 2.517 3.087 1.00 0.43 H new ATOM 0 HE2 PHE A 435 6.790 6.774 2.948 1.00 0.46 H new ATOM 0 HZ PHE A 435 7.990 4.619 2.893 1.00 0.47 H new ATOM 605 N ARG A 436 0.076 6.205 4.377 1.00 0.22 N ATOM 606 CA ARG A 436 -1.328 6.576 4.347 1.00 0.21 C ATOM 607 C ARG A 436 -1.581 7.614 3.262 1.00 0.19 C ATOM 608 O ARG A 436 -1.071 8.734 3.336 1.00 0.27 O ATOM 609 CB ARG A 436 -1.757 7.142 5.695 1.00 0.27 C ATOM 610 CG ARG A 436 -1.546 6.186 6.847 1.00 0.72 C ATOM 611 CD ARG A 436 -2.311 6.638 8.074 1.00 0.74 C ATOM 612 NE ARG A 436 -2.263 5.657 9.151 1.00 1.52 N ATOM 613 CZ ARG A 436 -3.331 5.265 9.843 1.00 2.15 C ATOM 614 NH1 ARG A 436 -4.543 5.701 9.511 1.00 2.32 N ATOM 615 NH2 ARG A 436 -3.195 4.413 10.849 1.00 3.14 N ATOM 0 H ARG A 436 0.706 6.963 4.639 1.00 0.22 H new ATOM 0 HA ARG A 436 -1.910 5.680 4.131 1.00 0.21 H new ATOM 0 HB2 ARG A 436 -1.201 8.059 5.888 1.00 0.27 H new ATOM 0 HB3 ARG A 436 -2.812 7.413 5.647 1.00 0.27 H new ATOM 0 HG2 ARG A 436 -1.871 5.186 6.559 1.00 0.72 H new ATOM 0 HG3 ARG A 436 -0.483 6.121 7.080 1.00 0.72 H new ATOM 0 HD2 ARG A 436 -1.899 7.583 8.428 1.00 0.74 H new ATOM 0 HD3 ARG A 436 -3.350 6.825 7.803 1.00 0.74 H new ATOM 0 HE ARG A 436 -1.360 5.247 9.388 1.00 1.52 H new ATOM 0 HH11 ARG A 436 -4.658 6.339 8.723 1.00 2.32 H new ATOM 0 HH12 ARG A 436 -5.358 5.398 10.044 1.00 2.32 H new ATOM 0 HH21 ARG A 436 -2.271 4.057 11.094 1.00 3.14 H new ATOM 0 HH22 ARG A 436 -4.014 4.114 11.378 1.00 3.14 H new ATOM 629 N VAL A 437 -2.354 7.246 2.260 1.00 0.17 N ATOM 630 CA VAL A 437 -2.692 8.163 1.187 1.00 0.16 C ATOM 631 C VAL A 437 -4.186 8.402 1.150 1.00 0.16 C ATOM 632 O VAL A 437 -4.977 7.604 1.665 1.00 0.17 O ATOM 633 CB VAL A 437 -2.197 7.666 -0.189 1.00 0.16 C ATOM 634 CG1 VAL A 437 -0.701 7.411 -0.149 1.00 0.20 C ATOM 635 CG2 VAL A 437 -2.950 6.425 -0.640 1.00 0.14 C ATOM 0 H VAL A 437 -2.762 6.316 2.165 1.00 0.17 H new ATOM 0 HA VAL A 437 -2.180 9.102 1.395 1.00 0.16 H new ATOM 0 HB VAL A 437 -2.397 8.448 -0.921 1.00 0.16 H new ATOM 0 HG11 VAL A 437 -0.365 7.061 -1.125 1.00 0.20 H new ATOM 0 HG12 VAL A 437 -0.181 8.335 0.104 1.00 0.20 H new ATOM 0 HG13 VAL A 437 -0.481 6.653 0.603 1.00 0.20 H new ATOM 0 HG21 VAL A 437 -2.574 6.105 -1.612 1.00 0.14 H new ATOM 0 HG22 VAL A 437 -2.803 5.626 0.087 1.00 0.14 H new ATOM 0 HG23 VAL A 437 -4.013 6.653 -0.719 1.00 0.14 H new ATOM 645 N PRO A 438 -4.560 9.539 0.570 1.00 0.17 N ATOM 646 CA PRO A 438 -5.946 9.996 0.468 1.00 0.18 C ATOM 647 C PRO A 438 -6.867 8.908 -0.091 1.00 0.16 C ATOM 648 O PRO A 438 -6.487 8.166 -0.998 1.00 0.14 O ATOM 649 CB PRO A 438 -5.826 11.188 -0.511 1.00 0.19 C ATOM 650 CG PRO A 438 -4.451 11.701 -0.256 1.00 0.21 C ATOM 651 CD PRO A 438 -3.617 10.491 -0.022 1.00 0.19 C ATOM 0 HA PRO A 438 -6.385 10.258 1.431 1.00 0.18 H new ATOM 0 HB2 PRO A 438 -5.952 10.873 -1.547 1.00 0.19 H new ATOM 0 HB3 PRO A 438 -6.582 11.948 -0.315 1.00 0.19 H new ATOM 0 HG2 PRO A 438 -4.082 12.275 -1.106 1.00 0.21 H new ATOM 0 HG3 PRO A 438 -4.433 12.364 0.609 1.00 0.21 H new ATOM 0 HD2 PRO A 438 -3.191 10.110 -0.951 1.00 0.19 H new ATOM 0 HD3 PRO A 438 -2.783 10.701 0.648 1.00 0.19 H new ATOM 659 N GLY A 439 -8.077 8.835 0.446 1.00 0.19 N ATOM 660 CA GLY A 439 -8.976 7.739 0.162 1.00 0.20 C ATOM 661 C GLY A 439 -9.506 7.698 -1.256 1.00 0.18 C ATOM 662 O GLY A 439 -10.201 6.752 -1.629 1.00 0.20 O ATOM 0 H GLY A 439 -8.456 9.532 1.086 1.00 0.19 H new ATOM 0 HA2 GLY A 439 -8.459 6.802 0.368 1.00 0.20 H new ATOM 0 HA3 GLY A 439 -9.821 7.794 0.848 1.00 0.20 H new ATOM 666 N THR A 440 -9.241 8.717 -2.044 1.00 0.16 N ATOM 667 CA THR A 440 -9.655 8.686 -3.429 1.00 0.18 C ATOM 668 C THR A 440 -8.469 8.345 -4.352 1.00 0.16 C ATOM 669 O THR A 440 -8.666 7.918 -5.494 1.00 0.19 O ATOM 670 CB THR A 440 -10.270 10.030 -3.851 1.00 0.24 C ATOM 671 OG1 THR A 440 -9.420 11.110 -3.441 1.00 0.27 O ATOM 672 CG2 THR A 440 -11.655 10.202 -3.246 1.00 0.29 C ATOM 0 H THR A 440 -8.750 9.563 -1.756 1.00 0.16 H new ATOM 0 HA THR A 440 -10.412 7.908 -3.526 1.00 0.18 H new ATOM 0 HB THR A 440 -10.363 10.039 -4.937 1.00 0.24 H new ATOM 0 HG1 THR A 440 -9.819 11.962 -3.715 1.00 0.27 H new ATOM 0 HG21 THR A 440 -12.072 11.160 -3.558 1.00 0.29 H new ATOM 0 HG22 THR A 440 -12.304 9.396 -3.588 1.00 0.29 H new ATOM 0 HG23 THR A 440 -11.583 10.174 -2.159 1.00 0.29 H new ATOM 680 N SER A 441 -7.238 8.531 -3.844 1.00 0.13 N ATOM 681 CA SER A 441 -6.016 8.256 -4.595 1.00 0.12 C ATOM 682 C SER A 441 -5.894 6.781 -4.970 1.00 0.11 C ATOM 683 O SER A 441 -6.336 5.901 -4.229 1.00 0.12 O ATOM 684 CB SER A 441 -4.807 8.670 -3.758 1.00 0.13 C ATOM 685 OG SER A 441 -4.831 10.060 -3.476 1.00 0.16 O ATOM 0 H SER A 441 -7.070 8.877 -2.899 1.00 0.13 H new ATOM 0 HA SER A 441 -6.055 8.830 -5.521 1.00 0.12 H new ATOM 0 HB2 SER A 441 -4.797 8.107 -2.825 1.00 0.13 H new ATOM 0 HB3 SER A 441 -3.890 8.420 -4.291 1.00 0.13 H new ATOM 0 HG SER A 441 -4.047 10.298 -2.938 1.00 0.16 H new ATOM 691 N THR A 442 -5.293 6.516 -6.122 1.00 0.10 N ATOM 692 CA THR A 442 -5.137 5.155 -6.600 1.00 0.12 C ATOM 693 C THR A 442 -3.677 4.834 -6.928 1.00 0.13 C ATOM 694 O THR A 442 -3.382 3.824 -7.570 1.00 0.16 O ATOM 695 CB THR A 442 -6.034 4.903 -7.828 1.00 0.13 C ATOM 696 OG1 THR A 442 -5.786 5.896 -8.834 1.00 0.14 O ATOM 697 CG2 THR A 442 -7.502 4.939 -7.422 1.00 0.17 C ATOM 0 H THR A 442 -4.906 7.228 -6.741 1.00 0.10 H new ATOM 0 HA THR A 442 -5.449 4.489 -5.796 1.00 0.12 H new ATOM 0 HB THR A 442 -5.800 3.919 -8.234 1.00 0.13 H new ATOM 0 HG1 THR A 442 -6.360 5.726 -9.610 1.00 0.14 H new ATOM 0 HG21 THR A 442 -8.126 4.760 -8.297 1.00 0.17 H new ATOM 0 HG22 THR A 442 -7.692 4.167 -6.676 1.00 0.17 H new ATOM 0 HG23 THR A 442 -7.739 5.916 -7.001 1.00 0.17 H new ATOM 705 N SER A 443 -2.761 5.689 -6.481 1.00 0.12 N ATOM 706 CA SER A 443 -1.331 5.484 -6.703 1.00 0.15 C ATOM 707 C SER A 443 -0.520 6.303 -5.702 1.00 0.15 C ATOM 708 O SER A 443 -0.945 7.381 -5.282 1.00 0.19 O ATOM 709 CB SER A 443 -0.926 5.871 -8.131 1.00 0.17 C ATOM 710 OG SER A 443 -1.677 5.156 -9.097 1.00 1.08 O ATOM 0 H SER A 443 -2.985 6.536 -5.959 1.00 0.12 H new ATOM 0 HA SER A 443 -1.122 4.424 -6.562 1.00 0.15 H new ATOM 0 HB2 SER A 443 -1.073 6.942 -8.274 1.00 0.17 H new ATOM 0 HB3 SER A 443 0.136 5.673 -8.275 1.00 0.17 H new ATOM 0 HG SER A 443 -2.069 4.359 -8.683 1.00 1.08 H new ATOM 716 N ALA A 444 0.635 5.779 -5.313 1.00 0.14 N ATOM 717 CA ALA A 444 1.500 6.457 -4.354 1.00 0.15 C ATOM 718 C ALA A 444 2.943 6.101 -4.544 1.00 0.16 C ATOM 719 O ALA A 444 3.310 4.941 -4.725 1.00 0.15 O ATOM 720 CB ALA A 444 1.082 6.137 -2.935 1.00 0.16 C ATOM 0 H ALA A 444 0.996 4.885 -5.647 1.00 0.14 H new ATOM 0 HA ALA A 444 1.390 7.527 -4.533 1.00 0.15 H new ATOM 0 HB1 ALA A 444 1.741 6.653 -2.237 1.00 0.16 H new ATOM 0 HB2 ALA A 444 0.055 6.465 -2.775 1.00 0.16 H new ATOM 0 HB3 ALA A 444 1.149 5.062 -2.770 1.00 0.16 H new ATOM 726 N THR A 445 3.744 7.136 -4.520 1.00 0.24 N ATOM 727 CA THR A 445 5.165 7.004 -4.499 1.00 0.25 C ATOM 728 C THR A 445 5.649 6.825 -3.080 1.00 0.26 C ATOM 729 O THR A 445 5.561 7.723 -2.242 1.00 0.33 O ATOM 730 CB THR A 445 5.807 8.235 -5.123 1.00 0.31 C ATOM 731 OG1 THR A 445 5.476 8.303 -6.518 1.00 0.34 O ATOM 732 CG2 THR A 445 7.322 8.207 -4.936 1.00 0.34 C ATOM 0 H THR A 445 3.416 8.102 -4.515 1.00 0.24 H new ATOM 0 HA THR A 445 5.449 6.125 -5.077 1.00 0.25 H new ATOM 0 HB THR A 445 5.420 9.123 -4.623 1.00 0.31 H new ATOM 0 HG1 THR A 445 6.013 7.650 -7.014 1.00 0.34 H new ATOM 0 HG21 THR A 445 7.761 9.096 -5.389 1.00 0.34 H new ATOM 0 HG22 THR A 445 7.557 8.189 -3.872 1.00 0.34 H new ATOM 0 HG23 THR A 445 7.731 7.317 -5.413 1.00 0.34 H new ATOM 740 N LEU A 446 6.143 5.644 -2.828 1.00 0.22 N ATOM 741 CA LEU A 446 6.553 5.256 -1.493 1.00 0.25 C ATOM 742 C LEU A 446 8.024 5.538 -1.234 1.00 0.24 C ATOM 743 O LEU A 446 8.897 4.756 -1.606 1.00 0.23 O ATOM 744 CB LEU A 446 6.222 3.767 -1.252 1.00 0.25 C ATOM 745 CG LEU A 446 4.863 3.484 -0.573 1.00 0.32 C ATOM 746 CD1 LEU A 446 3.751 4.287 -1.225 1.00 0.65 C ATOM 747 CD2 LEU A 446 4.547 1.997 -0.651 1.00 0.59 C ATOM 0 H LEU A 446 6.275 4.921 -3.535 1.00 0.22 H new ATOM 0 HA LEU A 446 5.992 5.865 -0.784 1.00 0.25 H new ATOM 0 HB2 LEU A 446 6.243 3.249 -2.211 1.00 0.25 H new ATOM 0 HB3 LEU A 446 7.011 3.333 -0.638 1.00 0.25 H new ATOM 0 HG LEU A 446 4.932 3.785 0.472 1.00 0.32 H new ATOM 0 HD11 LEU A 446 2.806 4.069 -0.728 1.00 0.65 H new ATOM 0 HD12 LEU A 446 3.971 5.351 -1.137 1.00 0.65 H new ATOM 0 HD13 LEU A 446 3.678 4.018 -2.279 1.00 0.65 H new ATOM 0 HD21 LEU A 446 3.588 1.803 -0.171 1.00 0.59 H new ATOM 0 HD22 LEU A 446 4.498 1.690 -1.696 1.00 0.59 H new ATOM 0 HD23 LEU A 446 5.328 1.432 -0.142 1.00 0.59 H new ATOM 759 N THR A 447 8.276 6.665 -0.582 1.00 0.30 N ATOM 760 CA THR A 447 9.619 7.045 -0.172 1.00 0.30 C ATOM 761 C THR A 447 9.967 6.452 1.183 1.00 0.29 C ATOM 762 O THR A 447 9.246 6.653 2.161 1.00 0.36 O ATOM 763 CB THR A 447 9.747 8.572 -0.058 1.00 0.39 C ATOM 764 OG1 THR A 447 8.488 9.138 0.329 1.00 0.86 O ATOM 765 CG2 THR A 447 10.229 9.190 -1.355 1.00 0.60 C ATOM 0 H THR A 447 7.556 7.340 -0.323 1.00 0.30 H new ATOM 0 HA THR A 447 10.299 6.664 -0.934 1.00 0.30 H new ATOM 0 HB THR A 447 10.492 8.793 0.706 1.00 0.39 H new ATOM 0 HG1 THR A 447 8.576 10.111 0.402 1.00 0.86 H new ATOM 0 HG21 THR A 447 10.307 10.271 -1.236 1.00 0.60 H new ATOM 0 HG22 THR A 447 11.206 8.781 -1.612 1.00 0.60 H new ATOM 0 HG23 THR A 447 9.520 8.963 -2.152 1.00 0.60 H new ATOM 773 N GLY A 448 11.064 5.726 1.246 1.00 0.30 N ATOM 774 CA GLY A 448 11.561 5.280 2.532 1.00 0.38 C ATOM 775 C GLY A 448 12.052 3.851 2.550 1.00 0.30 C ATOM 776 O GLY A 448 12.847 3.487 3.415 1.00 0.38 O ATOM 0 H GLY A 448 11.619 5.437 0.441 1.00 0.30 H new ATOM 0 HA2 GLY A 448 12.376 5.935 2.840 1.00 0.38 H new ATOM 0 HA3 GLY A 448 10.768 5.388 3.272 1.00 0.38 H new ATOM 780 N LEU A 449 11.585 3.043 1.611 1.00 0.28 N ATOM 781 CA LEU A 449 11.987 1.650 1.535 1.00 0.25 C ATOM 782 C LEU A 449 13.498 1.514 1.419 1.00 0.25 C ATOM 783 O LEU A 449 14.121 2.076 0.516 1.00 0.34 O ATOM 784 CB LEU A 449 11.304 0.964 0.359 1.00 0.24 C ATOM 785 CG LEU A 449 9.780 1.008 0.373 1.00 0.21 C ATOM 786 CD1 LEU A 449 9.222 0.446 -0.917 1.00 0.27 C ATOM 787 CD2 LEU A 449 9.241 0.221 1.542 1.00 0.23 C ATOM 0 H LEU A 449 10.925 3.331 0.889 1.00 0.28 H new ATOM 0 HA LEU A 449 11.676 1.163 2.459 1.00 0.25 H new ATOM 0 HB2 LEU A 449 11.656 1.426 -0.564 1.00 0.24 H new ATOM 0 HB3 LEU A 449 11.621 -0.079 0.334 1.00 0.24 H new ATOM 0 HG LEU A 449 9.471 2.049 0.471 1.00 0.21 H new ATOM 0 HD11 LEU A 449 8.133 0.485 -0.890 1.00 0.27 H new ATOM 0 HD12 LEU A 449 9.585 1.036 -1.758 1.00 0.27 H new ATOM 0 HD13 LEU A 449 9.545 -0.589 -1.033 1.00 0.27 H new ATOM 0 HD21 LEU A 449 8.152 0.263 1.537 1.00 0.23 H new ATOM 0 HD22 LEU A 449 9.565 -0.817 1.462 1.00 0.23 H new ATOM 0 HD23 LEU A 449 9.616 0.648 2.472 1.00 0.23 H new ATOM 799 N THR A 450 14.077 0.786 2.361 1.00 0.22 N ATOM 800 CA THR A 450 15.503 0.538 2.369 1.00 0.23 C ATOM 801 C THR A 450 15.885 -0.410 1.264 1.00 0.22 C ATOM 802 O THR A 450 15.551 -1.595 1.268 1.00 0.38 O ATOM 803 CB THR A 450 15.965 -0.025 3.724 1.00 0.27 C ATOM 804 OG1 THR A 450 15.453 0.791 4.786 1.00 0.32 O ATOM 805 CG2 THR A 450 17.483 -0.079 3.812 1.00 0.34 C ATOM 0 H THR A 450 13.572 0.355 3.135 1.00 0.22 H new ATOM 0 HA THR A 450 16.002 1.493 2.205 1.00 0.23 H new ATOM 0 HB THR A 450 15.581 -1.041 3.817 1.00 0.27 H new ATOM 0 HG1 THR A 450 15.747 0.429 5.648 1.00 0.32 H new ATOM 0 HG21 THR A 450 17.777 -0.481 4.781 1.00 0.34 H new ATOM 0 HG22 THR A 450 17.871 -0.720 3.020 1.00 0.34 H new ATOM 0 HG23 THR A 450 17.890 0.926 3.697 1.00 0.34 H new ATOM 813 N ARG A 451 16.550 0.168 0.302 1.00 0.29 N ATOM 814 CA ARG A 451 17.088 -0.547 -0.825 1.00 0.26 C ATOM 815 C ARG A 451 17.912 -1.745 -0.407 1.00 0.26 C ATOM 816 O ARG A 451 18.800 -1.669 0.444 1.00 0.30 O ATOM 817 CB ARG A 451 17.889 0.415 -1.670 1.00 0.31 C ATOM 818 CG ARG A 451 19.029 1.021 -0.906 1.00 0.32 C ATOM 819 CD ARG A 451 19.535 2.282 -1.563 1.00 0.43 C ATOM 820 NE ARG A 451 20.722 2.810 -0.895 1.00 1.32 N ATOM 821 CZ ARG A 451 21.420 3.859 -1.331 1.00 1.75 C ATOM 822 NH1 ARG A 451 21.035 4.514 -2.422 1.00 1.39 N ATOM 823 NH2 ARG A 451 22.498 4.261 -0.666 1.00 2.70 N ATOM 0 H ARG A 451 16.738 1.170 0.278 1.00 0.29 H new ATOM 0 HA ARG A 451 16.263 -0.949 -1.413 1.00 0.26 H new ATOM 0 HB2 ARG A 451 18.276 -0.107 -2.545 1.00 0.31 H new ATOM 0 HB3 ARG A 451 17.236 1.207 -2.035 1.00 0.31 H new ATOM 0 HG2 ARG A 451 18.707 1.245 0.111 1.00 0.32 H new ATOM 0 HG3 ARG A 451 19.842 0.298 -0.831 1.00 0.32 H new ATOM 0 HD2 ARG A 451 19.768 2.078 -2.608 1.00 0.43 H new ATOM 0 HD3 ARG A 451 18.748 3.036 -1.554 1.00 0.43 H new ATOM 0 HE ARG A 451 21.036 2.347 -0.042 1.00 1.32 H new ATOM 0 HH11 ARG A 451 20.202 4.215 -2.929 1.00 1.39 H new ATOM 0 HH12 ARG A 451 21.572 5.316 -2.752 1.00 1.39 H new ATOM 0 HH21 ARG A 451 22.791 3.767 0.177 1.00 2.70 H new ATOM 0 HH22 ARG A 451 23.033 5.063 -0.999 1.00 2.70 H new ATOM 837 N GLY A 452 17.562 -2.857 -1.011 1.00 0.28 N ATOM 838 CA GLY A 452 18.198 -4.106 -0.727 1.00 0.34 C ATOM 839 C GLY A 452 17.335 -4.985 0.148 1.00 0.32 C ATOM 840 O GLY A 452 17.541 -6.196 0.228 1.00 0.41 O ATOM 0 H GLY A 452 16.825 -2.913 -1.714 1.00 0.28 H new ATOM 0 HA2 GLY A 452 18.416 -4.624 -1.661 1.00 0.34 H new ATOM 0 HA3 GLY A 452 19.152 -3.925 -0.232 1.00 0.34 H new ATOM 844 N ALA A 453 16.362 -4.368 0.799 1.00 0.32 N ATOM 845 CA ALA A 453 15.422 -5.086 1.637 1.00 0.31 C ATOM 846 C ALA A 453 14.149 -5.343 0.881 1.00 0.27 C ATOM 847 O ALA A 453 13.629 -4.486 0.166 1.00 0.35 O ATOM 848 CB ALA A 453 15.145 -4.314 2.919 1.00 0.32 C ATOM 0 H ALA A 453 16.204 -3.361 0.760 1.00 0.32 H new ATOM 0 HA ALA A 453 15.861 -6.045 1.912 1.00 0.31 H new ATOM 0 HB1 ALA A 453 14.437 -4.871 3.533 1.00 0.32 H new ATOM 0 HB2 ALA A 453 16.075 -4.178 3.470 1.00 0.32 H new ATOM 0 HB3 ALA A 453 14.724 -3.339 2.673 1.00 0.32 H new ATOM 854 N THR A 454 13.699 -6.558 1.015 1.00 0.23 N ATOM 855 CA THR A 454 12.478 -7.005 0.422 1.00 0.21 C ATOM 856 C THR A 454 11.287 -6.513 1.229 1.00 0.17 C ATOM 857 O THR A 454 11.301 -6.557 2.456 1.00 0.19 O ATOM 858 CB THR A 454 12.494 -8.529 0.386 1.00 0.22 C ATOM 859 OG1 THR A 454 13.508 -8.993 -0.501 1.00 0.29 O ATOM 860 CG2 THR A 454 11.153 -9.097 -0.054 1.00 0.24 C ATOM 0 H THR A 454 14.183 -7.278 1.551 1.00 0.23 H new ATOM 0 HA THR A 454 12.389 -6.607 -0.589 1.00 0.21 H new ATOM 0 HB THR A 454 12.700 -8.872 1.400 1.00 0.22 H new ATOM 0 HG1 THR A 454 13.508 -9.973 -0.514 1.00 0.29 H new ATOM 0 HG21 THR A 454 11.206 -10.186 -0.067 1.00 0.24 H new ATOM 0 HG22 THR A 454 10.377 -8.779 0.643 1.00 0.24 H new ATOM 0 HG23 THR A 454 10.914 -8.734 -1.054 1.00 0.24 H new ATOM 868 N TYR A 455 10.271 -6.029 0.544 1.00 0.16 N ATOM 869 CA TYR A 455 9.074 -5.551 1.202 1.00 0.16 C ATOM 870 C TYR A 455 7.832 -6.178 0.590 1.00 0.13 C ATOM 871 O TYR A 455 7.590 -6.056 -0.610 1.00 0.15 O ATOM 872 CB TYR A 455 8.991 -4.024 1.115 1.00 0.23 C ATOM 873 CG TYR A 455 10.021 -3.314 1.964 1.00 0.22 C ATOM 874 CD1 TYR A 455 9.829 -3.175 3.331 1.00 0.20 C ATOM 875 CD2 TYR A 455 11.181 -2.786 1.406 1.00 0.28 C ATOM 876 CE1 TYR A 455 10.759 -2.531 4.124 1.00 0.22 C ATOM 877 CE2 TYR A 455 12.118 -2.142 2.191 1.00 0.30 C ATOM 878 CZ TYR A 455 11.905 -2.017 3.550 1.00 0.26 C ATOM 879 OH TYR A 455 12.838 -1.367 4.328 1.00 0.29 O ATOM 0 H TYR A 455 10.252 -5.957 -0.473 1.00 0.16 H new ATOM 0 HA TYR A 455 9.125 -5.843 2.251 1.00 0.16 H new ATOM 0 HB2 TYR A 455 9.117 -3.720 0.076 1.00 0.23 H new ATOM 0 HB3 TYR A 455 7.995 -3.704 1.423 1.00 0.23 H new ATOM 0 HD1 TYR A 455 8.935 -3.578 3.784 1.00 0.20 H new ATOM 0 HD2 TYR A 455 11.351 -2.881 0.344 1.00 0.28 H new ATOM 0 HE1 TYR A 455 10.591 -2.430 5.186 1.00 0.22 H new ATOM 0 HE2 TYR A 455 13.014 -1.738 1.744 1.00 0.30 H new ATOM 0 HH TYR A 455 13.245 -2.004 4.951 1.00 0.29 H new ATOM 889 N ASN A 456 7.066 -6.880 1.411 1.00 0.12 N ATOM 890 CA ASN A 456 5.765 -7.367 0.987 1.00 0.12 C ATOM 891 C ASN A 456 4.781 -6.233 1.118 1.00 0.13 C ATOM 892 O ASN A 456 4.315 -5.910 2.214 1.00 0.15 O ATOM 893 CB ASN A 456 5.310 -8.578 1.811 1.00 0.14 C ATOM 894 CG ASN A 456 4.107 -9.287 1.178 1.00 0.17 C ATOM 895 OD1 ASN A 456 3.840 -9.119 -0.013 1.00 0.17 O ATOM 896 ND2 ASN A 456 3.386 -10.117 1.938 1.00 0.20 N ATOM 0 H ASN A 456 7.321 -7.123 2.368 1.00 0.12 H new ATOM 0 HA ASN A 456 5.826 -7.704 -0.048 1.00 0.12 H new ATOM 0 HB2 ASN A 456 6.136 -9.282 1.906 1.00 0.14 H new ATOM 0 HB3 ASN A 456 5.050 -8.253 2.819 1.00 0.14 H new ATOM 0 HD21 ASN A 456 2.599 -10.625 1.534 1.00 0.20 H new ATOM 0 HD22 ASN A 456 3.623 -10.243 2.922 1.00 0.20 H new ATOM 903 N ILE A 457 4.513 -5.613 -0.006 1.00 0.13 N ATOM 904 CA ILE A 457 3.728 -4.408 -0.053 1.00 0.14 C ATOM 905 C ILE A 457 2.251 -4.741 -0.151 1.00 0.14 C ATOM 906 O ILE A 457 1.799 -5.387 -1.096 1.00 0.18 O ATOM 907 CB ILE A 457 4.165 -3.531 -1.237 1.00 0.16 C ATOM 908 CG1 ILE A 457 5.591 -3.015 -1.012 1.00 0.19 C ATOM 909 CG2 ILE A 457 3.196 -2.367 -1.440 1.00 0.18 C ATOM 910 CD1 ILE A 457 6.048 -1.996 -2.038 1.00 0.22 C ATOM 0 H ILE A 457 4.837 -5.934 -0.918 1.00 0.13 H new ATOM 0 HA ILE A 457 3.893 -3.850 0.868 1.00 0.14 H new ATOM 0 HB ILE A 457 4.152 -4.139 -2.141 1.00 0.16 H new ATOM 0 HG12 ILE A 457 5.652 -2.569 -0.020 1.00 0.19 H new ATOM 0 HG13 ILE A 457 6.278 -3.861 -1.024 1.00 0.19 H new ATOM 0 HG21 ILE A 457 3.527 -1.761 -2.284 1.00 0.18 H new ATOM 0 HG22 ILE A 457 2.198 -2.756 -1.642 1.00 0.18 H new ATOM 0 HG23 ILE A 457 3.171 -1.753 -0.540 1.00 0.18 H new ATOM 0 HD11 ILE A 457 7.066 -1.681 -1.809 1.00 0.22 H new ATOM 0 HD12 ILE A 457 6.021 -2.443 -3.032 1.00 0.22 H new ATOM 0 HD13 ILE A 457 5.386 -1.131 -2.012 1.00 0.22 H new ATOM 922 N ILE A 458 1.515 -4.306 0.845 1.00 0.16 N ATOM 923 CA ILE A 458 0.101 -4.598 0.947 1.00 0.18 C ATOM 924 C ILE A 458 -0.682 -3.303 1.047 1.00 0.20 C ATOM 925 O ILE A 458 -0.268 -2.385 1.731 1.00 0.29 O ATOM 926 CB ILE A 458 -0.186 -5.474 2.174 1.00 0.22 C ATOM 927 CG1 ILE A 458 0.501 -6.822 2.017 1.00 0.21 C ATOM 928 CG2 ILE A 458 -1.677 -5.664 2.375 1.00 0.29 C ATOM 929 CD1 ILE A 458 0.411 -7.669 3.251 1.00 0.27 C ATOM 0 H ILE A 458 1.879 -3.738 1.610 1.00 0.16 H new ATOM 0 HA ILE A 458 -0.206 -5.143 0.054 1.00 0.18 H new ATOM 0 HB ILE A 458 0.209 -4.969 3.056 1.00 0.22 H new ATOM 0 HG12 ILE A 458 0.052 -7.358 1.181 1.00 0.21 H new ATOM 0 HG13 ILE A 458 1.550 -6.663 1.767 1.00 0.21 H new ATOM 0 HG21 ILE A 458 -1.849 -6.289 3.251 1.00 0.29 H new ATOM 0 HG22 ILE A 458 -2.151 -4.694 2.522 1.00 0.29 H new ATOM 0 HG23 ILE A 458 -2.104 -6.147 1.496 1.00 0.29 H new ATOM 0 HD11 ILE A 458 0.919 -8.618 3.079 1.00 0.27 H new ATOM 0 HD12 ILE A 458 0.885 -7.150 4.084 1.00 0.27 H new ATOM 0 HD13 ILE A 458 -0.636 -7.856 3.489 1.00 0.27 H new ATOM 941 N VAL A 459 -1.797 -3.224 0.359 1.00 0.17 N ATOM 942 CA VAL A 459 -2.596 -2.018 0.366 1.00 0.18 C ATOM 943 C VAL A 459 -3.976 -2.328 0.913 1.00 0.18 C ATOM 944 O VAL A 459 -4.720 -3.113 0.322 1.00 0.23 O ATOM 945 CB VAL A 459 -2.731 -1.420 -1.048 1.00 0.19 C ATOM 946 CG1 VAL A 459 -3.353 -0.038 -0.987 1.00 0.20 C ATOM 947 CG2 VAL A 459 -1.384 -1.379 -1.767 1.00 0.20 C ATOM 0 H VAL A 459 -2.173 -3.980 -0.213 1.00 0.17 H new ATOM 0 HA VAL A 459 -2.094 -1.286 0.999 1.00 0.18 H new ATOM 0 HB VAL A 459 -3.391 -2.069 -1.623 1.00 0.19 H new ATOM 0 HG11 VAL A 459 -3.440 0.367 -1.995 1.00 0.20 H new ATOM 0 HG12 VAL A 459 -4.343 -0.104 -0.536 1.00 0.20 H new ATOM 0 HG13 VAL A 459 -2.724 0.618 -0.385 1.00 0.20 H new ATOM 0 HG21 VAL A 459 -1.515 -0.952 -2.761 1.00 0.20 H new ATOM 0 HG22 VAL A 459 -0.686 -0.765 -1.197 1.00 0.20 H new ATOM 0 HG23 VAL A 459 -0.988 -2.391 -1.856 1.00 0.20 H new ATOM 957 N GLU A 460 -4.305 -1.747 2.053 1.00 0.18 N ATOM 958 CA GLU A 460 -5.618 -1.938 2.644 1.00 0.22 C ATOM 959 C GLU A 460 -6.408 -0.641 2.624 1.00 0.21 C ATOM 960 O GLU A 460 -5.878 0.435 2.901 1.00 0.30 O ATOM 961 CB GLU A 460 -5.516 -2.463 4.072 1.00 0.30 C ATOM 962 CG GLU A 460 -4.922 -3.857 4.176 1.00 0.36 C ATOM 963 CD GLU A 460 -4.929 -4.389 5.592 1.00 0.60 C ATOM 964 OE1 GLU A 460 -3.843 -4.491 6.192 1.00 0.79 O ATOM 965 OE2 GLU A 460 -6.022 -4.686 6.121 1.00 0.82 O ATOM 0 H GLU A 460 -3.683 -1.140 2.587 1.00 0.18 H new ATOM 0 HA GLU A 460 -6.141 -2.683 2.044 1.00 0.22 H new ATOM 0 HB2 GLU A 460 -4.907 -1.775 4.659 1.00 0.30 H new ATOM 0 HB3 GLU A 460 -6.510 -2.469 4.518 1.00 0.30 H new ATOM 0 HG2 GLU A 460 -5.484 -4.536 3.534 1.00 0.36 H new ATOM 0 HG3 GLU A 460 -3.898 -3.840 3.803 1.00 0.36 H new ATOM 972 N ALA A 461 -7.679 -0.759 2.299 1.00 0.16 N ATOM 973 CA ALA A 461 -8.560 0.386 2.193 1.00 0.15 C ATOM 974 C ALA A 461 -9.226 0.681 3.512 1.00 0.14 C ATOM 975 O ALA A 461 -9.995 -0.130 4.031 1.00 0.17 O ATOM 976 CB ALA A 461 -9.601 0.141 1.112 1.00 0.16 C ATOM 0 H ALA A 461 -8.131 -1.652 2.101 1.00 0.16 H new ATOM 0 HA ALA A 461 -7.963 1.256 1.919 1.00 0.15 H new ATOM 0 HB1 ALA A 461 -10.260 1.006 1.038 1.00 0.16 H new ATOM 0 HB2 ALA A 461 -9.102 -0.018 0.156 1.00 0.16 H new ATOM 0 HB3 ALA A 461 -10.188 -0.741 1.366 1.00 0.16 H new ATOM 982 N LEU A 462 -8.926 1.849 4.045 1.00 0.16 N ATOM 983 CA LEU A 462 -9.531 2.303 5.268 1.00 0.20 C ATOM 984 C LEU A 462 -10.897 2.892 4.929 1.00 0.22 C ATOM 985 O LEU A 462 -11.006 4.028 4.472 1.00 0.24 O ATOM 986 CB LEU A 462 -8.652 3.341 5.973 1.00 0.25 C ATOM 987 CG LEU A 462 -8.732 3.278 7.504 1.00 0.34 C ATOM 988 CD1 LEU A 462 -7.711 4.165 8.174 1.00 0.85 C ATOM 989 CD2 LEU A 462 -10.111 3.657 7.973 1.00 0.78 C ATOM 0 H LEU A 462 -8.257 2.504 3.639 1.00 0.16 H new ATOM 0 HA LEU A 462 -9.642 1.464 5.955 1.00 0.20 H new ATOM 0 HB2 LEU A 462 -7.616 3.196 5.666 1.00 0.25 H new ATOM 0 HB3 LEU A 462 -8.946 4.337 5.643 1.00 0.25 H new ATOM 0 HG LEU A 462 -8.513 2.249 7.787 1.00 0.34 H new ATOM 0 HD11 LEU A 462 -7.812 4.082 9.256 1.00 0.85 H new ATOM 0 HD12 LEU A 462 -6.709 3.854 7.878 1.00 0.85 H new ATOM 0 HD13 LEU A 462 -7.874 5.200 7.872 1.00 0.85 H new ATOM 0 HD21 LEU A 462 -10.152 3.607 9.061 1.00 0.78 H new ATOM 0 HD22 LEU A 462 -10.340 4.672 7.647 1.00 0.78 H new ATOM 0 HD23 LEU A 462 -10.841 2.967 7.551 1.00 0.78 H new ATOM 1001 N LYS A 463 -11.924 2.100 5.145 1.00 0.23 N ATOM 1002 CA LYS A 463 -13.278 2.445 4.772 1.00 0.30 C ATOM 1003 C LYS A 463 -14.188 2.079 5.931 1.00 0.40 C ATOM 1004 O LYS A 463 -14.484 0.895 6.125 1.00 0.50 O ATOM 1005 CB LYS A 463 -13.662 1.670 3.495 1.00 0.31 C ATOM 1006 CG LYS A 463 -15.026 2.016 2.897 1.00 0.38 C ATOM 1007 CD LYS A 463 -14.973 3.193 1.928 1.00 0.42 C ATOM 1008 CE LYS A 463 -16.372 3.659 1.547 1.00 0.95 C ATOM 1009 NZ LYS A 463 -17.171 2.578 0.912 1.00 1.62 N ATOM 0 H LYS A 463 -11.841 1.186 5.591 1.00 0.23 H new ATOM 0 HA LYS A 463 -13.373 3.510 4.562 1.00 0.30 H new ATOM 0 HB2 LYS A 463 -12.898 1.850 2.739 1.00 0.31 H new ATOM 0 HB3 LYS A 463 -13.644 0.604 3.720 1.00 0.31 H new ATOM 0 HG2 LYS A 463 -15.420 1.143 2.377 1.00 0.38 H new ATOM 0 HG3 LYS A 463 -15.721 2.248 3.704 1.00 0.38 H new ATOM 0 HD2 LYS A 463 -14.424 4.017 2.383 1.00 0.42 H new ATOM 0 HD3 LYS A 463 -14.427 2.904 1.030 1.00 0.42 H new ATOM 0 HE2 LYS A 463 -16.889 4.015 2.438 1.00 0.95 H new ATOM 0 HE3 LYS A 463 -16.298 4.504 0.862 1.00 0.95 H new ATOM 0 HZ1 LYS A 463 -18.054 2.976 0.533 1.00 1.62 H new ATOM 0 HZ2 LYS A 463 -16.624 2.151 0.138 1.00 1.62 H new ATOM 0 HZ3 LYS A 463 -17.395 1.850 1.620 1.00 1.62 H new ATOM 1023 N ASP A 464 -14.556 3.081 6.744 1.00 0.58 N ATOM 1024 CA ASP A 464 -15.541 2.861 7.837 1.00 0.61 C ATOM 1025 C ASP A 464 -14.923 2.061 8.965 1.00 0.51 C ATOM 1026 O ASP A 464 -15.332 0.937 9.258 1.00 0.53 O ATOM 1027 CB ASP A 464 -16.750 2.106 7.306 1.00 0.72 C ATOM 1028 CG ASP A 464 -18.049 2.573 7.920 1.00 1.08 C ATOM 1029 OD1 ASP A 464 -18.540 1.901 8.853 1.00 1.85 O ATOM 1030 OD2 ASP A 464 -18.578 3.619 7.481 1.00 1.15 O ATOM 0 H ASP A 464 -14.201 4.035 6.676 1.00 0.58 H new ATOM 0 HA ASP A 464 -15.847 3.837 8.214 1.00 0.61 H new ATOM 0 HB2 ASP A 464 -16.801 2.226 6.224 1.00 0.72 H new ATOM 0 HB3 ASP A 464 -16.623 1.041 7.503 1.00 0.72 H new ATOM 1035 N GLN A 465 -13.948 2.682 9.597 1.00 0.52 N ATOM 1036 CA GLN A 465 -13.151 2.093 10.666 1.00 0.49 C ATOM 1037 C GLN A 465 -12.527 0.738 10.290 1.00 0.44 C ATOM 1038 O GLN A 465 -11.947 0.061 11.143 1.00 0.66 O ATOM 1039 CB GLN A 465 -14.001 1.947 11.925 1.00 0.56 C ATOM 1040 CG GLN A 465 -14.714 3.229 12.315 1.00 0.67 C ATOM 1041 CD GLN A 465 -15.577 3.066 13.548 1.00 0.78 C ATOM 1042 OE1 GLN A 465 -16.757 2.730 13.454 1.00 1.32 O ATOM 1043 NE2 GLN A 465 -14.998 3.301 14.712 1.00 1.39 N ATOM 0 H GLN A 465 -13.676 3.640 9.378 1.00 0.52 H new ATOM 0 HA GLN A 465 -12.320 2.774 10.848 1.00 0.49 H new ATOM 0 HB2 GLN A 465 -14.740 1.161 11.768 1.00 0.56 H new ATOM 0 HB3 GLN A 465 -13.365 1.627 12.750 1.00 0.56 H new ATOM 0 HG2 GLN A 465 -13.976 4.010 12.494 1.00 0.67 H new ATOM 0 HG3 GLN A 465 -15.335 3.562 11.483 1.00 0.67 H new ATOM 0 HE21 GLN A 465 -14.017 3.578 14.747 1.00 1.39 H new ATOM 0 HE22 GLN A 465 -15.532 3.206 15.576 1.00 1.39 H new ATOM 1052 N GLN A 466 -12.651 0.335 9.032 1.00 0.36 N ATOM 1053 CA GLN A 466 -12.136 -0.954 8.598 1.00 0.36 C ATOM 1054 C GLN A 466 -11.104 -0.816 7.508 1.00 0.28 C ATOM 1055 O GLN A 466 -11.062 0.176 6.791 1.00 0.29 O ATOM 1056 CB GLN A 466 -13.283 -1.824 8.112 1.00 0.54 C ATOM 1057 CG GLN A 466 -14.248 -2.159 9.211 1.00 1.20 C ATOM 1058 CD GLN A 466 -15.589 -2.650 8.712 1.00 1.42 C ATOM 1059 OE1 GLN A 466 -16.225 -3.488 9.350 1.00 1.60 O ATOM 1060 NE2 GLN A 466 -16.051 -2.109 7.594 1.00 2.13 N ATOM 0 H GLN A 466 -13.102 0.881 8.298 1.00 0.36 H new ATOM 0 HA GLN A 466 -11.648 -1.420 9.454 1.00 0.36 H new ATOM 0 HB2 GLN A 466 -13.813 -1.309 7.311 1.00 0.54 H new ATOM 0 HB3 GLN A 466 -12.883 -2.746 7.689 1.00 0.54 H new ATOM 0 HG2 GLN A 466 -13.806 -2.923 9.851 1.00 1.20 H new ATOM 0 HG3 GLN A 466 -14.402 -1.275 9.830 1.00 1.20 H new ATOM 0 HE21 GLN A 466 -15.493 -1.417 7.094 1.00 2.13 H new ATOM 0 HE22 GLN A 466 -16.965 -2.385 7.234 1.00 2.13 H new ATOM 1069 N ARG A 467 -10.284 -1.837 7.395 1.00 0.33 N ATOM 1070 CA ARG A 467 -9.222 -1.879 6.404 1.00 0.30 C ATOM 1071 C ARG A 467 -9.372 -3.126 5.547 1.00 0.33 C ATOM 1072 O ARG A 467 -9.312 -4.246 6.049 1.00 0.51 O ATOM 1073 CB ARG A 467 -7.863 -1.860 7.095 1.00 0.36 C ATOM 1074 CG ARG A 467 -7.655 -0.633 7.964 1.00 0.34 C ATOM 1075 CD ARG A 467 -6.516 -0.839 8.941 1.00 0.43 C ATOM 1076 NE ARG A 467 -6.326 0.308 9.828 1.00 1.24 N ATOM 1077 CZ ARG A 467 -5.232 0.510 10.563 1.00 1.67 C ATOM 1078 NH1 ARG A 467 -4.215 -0.341 10.497 1.00 1.51 N ATOM 1079 NH2 ARG A 467 -5.155 1.559 11.369 1.00 2.58 N ATOM 0 H ARG A 467 -10.332 -2.666 7.988 1.00 0.33 H new ATOM 0 HA ARG A 467 -9.292 -1.002 5.760 1.00 0.30 H new ATOM 0 HB2 ARG A 467 -7.762 -2.755 7.709 1.00 0.36 H new ATOM 0 HB3 ARG A 467 -7.078 -1.901 6.340 1.00 0.36 H new ATOM 0 HG2 ARG A 467 -7.445 0.231 7.333 1.00 0.34 H new ATOM 0 HG3 ARG A 467 -8.571 -0.412 8.511 1.00 0.34 H new ATOM 0 HD2 ARG A 467 -6.711 -1.729 9.539 1.00 0.43 H new ATOM 0 HD3 ARG A 467 -5.595 -1.023 8.387 1.00 0.43 H new ATOM 0 HE ARG A 467 -7.077 0.996 9.888 1.00 1.24 H new ATOM 0 HH11 ARG A 467 -4.269 -1.153 9.882 1.00 1.51 H new ATOM 0 HH12 ARG A 467 -3.380 -0.183 11.061 1.00 1.51 H new ATOM 0 HH21 ARG A 467 -5.934 2.215 11.428 1.00 2.58 H new ATOM 0 HH22 ARG A 467 -4.317 1.711 11.930 1.00 2.58 H new ATOM 1093 N HIS A 468 -9.593 -2.921 4.259 1.00 0.28 N ATOM 1094 CA HIS A 468 -9.867 -4.023 3.340 1.00 0.32 C ATOM 1095 C HIS A 468 -8.680 -4.256 2.387 1.00 0.24 C ATOM 1096 O HIS A 468 -8.308 -3.342 1.657 1.00 0.27 O ATOM 1097 CB HIS A 468 -11.118 -3.715 2.502 1.00 0.44 C ATOM 1098 CG HIS A 468 -12.314 -3.285 3.301 1.00 0.75 C ATOM 1099 ND1 HIS A 468 -13.279 -4.159 3.746 1.00 1.02 N ATOM 1100 CD2 HIS A 468 -12.699 -2.058 3.725 1.00 1.01 C ATOM 1101 CE1 HIS A 468 -14.205 -3.490 4.408 1.00 1.26 C ATOM 1102 NE2 HIS A 468 -13.878 -2.211 4.411 1.00 1.25 N ATOM 0 H HIS A 468 -9.589 -2.000 3.821 1.00 0.28 H new ATOM 0 HA HIS A 468 -10.028 -4.920 3.937 1.00 0.32 H new ATOM 0 HB2 HIS A 468 -10.875 -2.931 1.785 1.00 0.44 H new ATOM 0 HB3 HIS A 468 -11.382 -4.602 1.927 1.00 0.44 H new ATOM 0 HD2 HIS A 468 -12.175 -1.129 3.555 1.00 1.01 H new ATOM 0 HE1 HIS A 468 -15.083 -3.917 4.870 1.00 1.26 H new ATOM 0 HE2 HIS A 468 -14.412 -1.461 4.850 1.00 1.25 H new ATOM 1111 N LYS A 469 -8.061 -5.448 2.436 1.00 0.27 N ATOM 1112 CA LYS A 469 -7.066 -5.870 1.393 1.00 0.40 C ATOM 1113 C LYS A 469 -7.527 -5.455 -0.003 1.00 0.29 C ATOM 1114 O LYS A 469 -8.602 -5.851 -0.459 1.00 0.37 O ATOM 1115 CB LYS A 469 -6.816 -7.397 1.352 1.00 0.80 C ATOM 1116 CG LYS A 469 -5.944 -7.840 0.183 1.00 0.70 C ATOM 1117 CD LYS A 469 -4.469 -7.481 0.349 1.00 0.70 C ATOM 1118 CE LYS A 469 -3.791 -8.294 1.446 1.00 0.41 C ATOM 1119 NZ LYS A 469 -3.966 -9.760 1.265 1.00 0.84 N ATOM 0 H LYS A 469 -8.218 -6.139 3.170 1.00 0.27 H new ATOM 0 HA LYS A 469 -6.140 -5.370 1.677 1.00 0.40 H new ATOM 0 HB2 LYS A 469 -6.343 -7.705 2.285 1.00 0.80 H new ATOM 0 HB3 LYS A 469 -7.775 -7.913 1.295 1.00 0.80 H new ATOM 0 HG2 LYS A 469 -6.035 -8.919 0.062 1.00 0.70 H new ATOM 0 HG3 LYS A 469 -6.319 -7.383 -0.733 1.00 0.70 H new ATOM 0 HD2 LYS A 469 -3.950 -7.646 -0.595 1.00 0.70 H new ATOM 0 HD3 LYS A 469 -4.380 -6.420 0.580 1.00 0.70 H new ATOM 0 HE2 LYS A 469 -2.727 -8.058 1.462 1.00 0.41 H new ATOM 0 HE3 LYS A 469 -4.197 -8.000 2.414 1.00 0.41 H new ATOM 0 HZ1 LYS A 469 -3.065 -10.243 1.455 1.00 0.84 H new ATOM 0 HZ2 LYS A 469 -4.691 -10.107 1.925 1.00 0.84 H new ATOM 0 HZ3 LYS A 469 -4.264 -9.956 0.288 1.00 0.84 H new ATOM 1133 N VAL A 470 -6.714 -4.649 -0.660 1.00 0.23 N ATOM 1134 CA VAL A 470 -6.956 -4.252 -2.042 1.00 0.18 C ATOM 1135 C VAL A 470 -5.927 -4.876 -2.952 1.00 0.18 C ATOM 1136 O VAL A 470 -6.236 -5.397 -4.026 1.00 0.29 O ATOM 1137 CB VAL A 470 -6.862 -2.728 -2.203 1.00 0.22 C ATOM 1138 CG1 VAL A 470 -7.265 -2.295 -3.608 1.00 0.61 C ATOM 1139 CG2 VAL A 470 -7.692 -2.041 -1.142 1.00 0.59 C ATOM 0 H VAL A 470 -5.867 -4.249 -0.255 1.00 0.23 H new ATOM 0 HA VAL A 470 -7.958 -4.590 -2.306 1.00 0.18 H new ATOM 0 HB VAL A 470 -5.824 -2.426 -2.066 1.00 0.22 H new ATOM 0 HG11 VAL A 470 -7.188 -1.211 -3.691 1.00 0.61 H new ATOM 0 HG12 VAL A 470 -6.603 -2.762 -4.337 1.00 0.61 H new ATOM 0 HG13 VAL A 470 -8.293 -2.602 -3.803 1.00 0.61 H new ATOM 0 HG21 VAL A 470 -7.618 -0.961 -1.265 1.00 0.59 H new ATOM 0 HG22 VAL A 470 -8.734 -2.347 -1.240 1.00 0.59 H new ATOM 0 HG23 VAL A 470 -7.323 -2.319 -0.155 1.00 0.59 H new ATOM 1149 N ARG A 471 -4.704 -4.839 -2.492 1.00 0.17 N ATOM 1150 CA ARG A 471 -3.571 -5.134 -3.320 1.00 0.19 C ATOM 1151 C ARG A 471 -2.442 -5.675 -2.456 1.00 0.18 C ATOM 1152 O ARG A 471 -2.253 -5.217 -1.332 1.00 0.22 O ATOM 1153 CB ARG A 471 -3.172 -3.846 -4.002 1.00 0.28 C ATOM 1154 CG ARG A 471 -2.286 -4.056 -5.200 1.00 0.77 C ATOM 1155 CD ARG A 471 -3.091 -3.964 -6.486 1.00 0.52 C ATOM 1156 NE ARG A 471 -4.299 -4.791 -6.480 1.00 1.18 N ATOM 1157 CZ ARG A 471 -5.212 -4.780 -7.453 1.00 1.45 C ATOM 1158 NH1 ARG A 471 -5.038 -4.017 -8.528 1.00 1.39 N ATOM 1159 NH2 ARG A 471 -6.290 -5.545 -7.363 1.00 2.13 N ATOM 0 H ARG A 471 -4.468 -4.602 -1.528 1.00 0.17 H new ATOM 0 HA ARG A 471 -3.804 -5.891 -4.068 1.00 0.19 H new ATOM 0 HB2 ARG A 471 -4.071 -3.314 -4.313 1.00 0.28 H new ATOM 0 HB3 ARG A 471 -2.656 -3.208 -3.285 1.00 0.28 H new ATOM 0 HG2 ARG A 471 -1.493 -3.309 -5.207 1.00 0.77 H new ATOM 0 HG3 ARG A 471 -1.804 -5.032 -5.136 1.00 0.77 H new ATOM 0 HD2 ARG A 471 -3.373 -2.925 -6.655 1.00 0.52 H new ATOM 0 HD3 ARG A 471 -2.460 -4.263 -7.323 1.00 0.52 H new ATOM 0 HE ARG A 471 -4.452 -5.412 -5.685 1.00 1.18 H new ATOM 0 HH11 ARG A 471 -4.204 -3.436 -8.612 1.00 1.39 H new ATOM 0 HH12 ARG A 471 -5.739 -4.012 -9.269 1.00 1.39 H new ATOM 0 HH21 ARG A 471 -6.424 -6.144 -6.548 1.00 2.13 H new ATOM 0 HH22 ARG A 471 -6.986 -5.535 -8.108 1.00 2.13 H new ATOM 1173 N GLU A 472 -1.724 -6.662 -2.955 1.00 0.20 N ATOM 1174 CA GLU A 472 -0.615 -7.247 -2.218 1.00 0.18 C ATOM 1175 C GLU A 472 0.436 -7.780 -3.173 1.00 0.18 C ATOM 1176 O GLU A 472 0.110 -8.488 -4.127 1.00 0.21 O ATOM 1177 CB GLU A 472 -1.105 -8.365 -1.294 1.00 0.21 C ATOM 1178 CG GLU A 472 -0.012 -9.350 -0.918 1.00 0.21 C ATOM 1179 CD GLU A 472 -0.399 -10.272 0.218 1.00 0.29 C ATOM 1180 OE1 GLU A 472 -0.055 -11.472 0.149 1.00 0.62 O ATOM 1181 OE2 GLU A 472 -1.054 -9.819 1.173 1.00 0.65 O ATOM 0 H GLU A 472 -1.888 -7.079 -3.871 1.00 0.20 H new ATOM 0 HA GLU A 472 -0.167 -6.465 -1.605 1.00 0.18 H new ATOM 0 HB2 GLU A 472 -1.516 -7.924 -0.386 1.00 0.21 H new ATOM 0 HB3 GLU A 472 -1.917 -8.902 -1.783 1.00 0.21 H new ATOM 0 HG2 GLU A 472 0.243 -9.949 -1.792 1.00 0.21 H new ATOM 0 HG3 GLU A 472 0.885 -8.797 -0.638 1.00 0.21 H new ATOM 1188 N GLU A 473 1.688 -7.431 -2.927 1.00 0.16 N ATOM 1189 CA GLU A 473 2.771 -7.894 -3.774 1.00 0.17 C ATOM 1190 C GLU A 473 4.113 -7.759 -3.101 1.00 0.20 C ATOM 1191 O GLU A 473 4.402 -6.756 -2.451 1.00 0.26 O ATOM 1192 CB GLU A 473 2.750 -7.140 -5.106 1.00 0.23 C ATOM 1193 CG GLU A 473 3.889 -7.490 -6.044 1.00 0.27 C ATOM 1194 CD GLU A 473 3.756 -6.797 -7.380 1.00 1.24 C ATOM 1195 OE1 GLU A 473 4.386 -5.734 -7.563 1.00 2.26 O ATOM 1196 OE2 GLU A 473 3.026 -7.308 -8.257 1.00 1.25 O ATOM 0 H GLU A 473 1.977 -6.833 -2.153 1.00 0.16 H new ATOM 0 HA GLU A 473 2.618 -8.957 -3.963 1.00 0.17 H new ATOM 0 HB2 GLU A 473 1.805 -7.344 -5.610 1.00 0.23 H new ATOM 0 HB3 GLU A 473 2.779 -6.069 -4.904 1.00 0.23 H new ATOM 0 HG2 GLU A 473 4.837 -7.211 -5.584 1.00 0.27 H new ATOM 0 HG3 GLU A 473 3.915 -8.569 -6.196 1.00 0.27 H new ATOM 1203 N VAL A 474 4.938 -8.777 -3.271 1.00 0.24 N ATOM 1204 CA VAL A 474 6.247 -8.762 -2.685 1.00 0.28 C ATOM 1205 C VAL A 474 7.241 -8.137 -3.647 1.00 0.21 C ATOM 1206 O VAL A 474 7.340 -8.544 -4.806 1.00 0.28 O ATOM 1207 CB VAL A 474 6.758 -10.163 -2.302 1.00 0.49 C ATOM 1208 CG1 VAL A 474 7.935 -10.060 -1.345 1.00 0.80 C ATOM 1209 CG2 VAL A 474 5.652 -11.019 -1.710 1.00 1.22 C ATOM 0 H VAL A 474 4.718 -9.615 -3.808 1.00 0.24 H new ATOM 0 HA VAL A 474 6.162 -8.176 -1.770 1.00 0.28 H new ATOM 0 HB VAL A 474 7.097 -10.653 -3.215 1.00 0.49 H new ATOM 0 HG11 VAL A 474 8.282 -11.060 -1.086 1.00 0.80 H new ATOM 0 HG12 VAL A 474 8.744 -9.507 -1.822 1.00 0.80 H new ATOM 0 HG13 VAL A 474 7.624 -9.538 -0.440 1.00 0.80 H new ATOM 0 HG21 VAL A 474 6.050 -12.000 -1.452 1.00 1.22 H new ATOM 0 HG22 VAL A 474 5.261 -10.539 -0.813 1.00 1.22 H new ATOM 0 HG23 VAL A 474 4.850 -11.133 -2.440 1.00 1.22 H new ATOM 1219 N VAL A 475 7.969 -7.151 -3.171 1.00 0.19 N ATOM 1220 CA VAL A 475 8.957 -6.469 -3.989 1.00 0.19 C ATOM 1221 C VAL A 475 10.234 -6.236 -3.240 1.00 0.19 C ATOM 1222 O VAL A 475 10.255 -5.744 -2.115 1.00 0.26 O ATOM 1223 CB VAL A 475 8.464 -5.112 -4.527 1.00 0.22 C ATOM 1224 CG1 VAL A 475 8.402 -5.138 -6.041 1.00 0.41 C ATOM 1225 CG2 VAL A 475 7.110 -4.740 -3.946 1.00 0.32 C ATOM 0 H VAL A 475 7.897 -6.799 -2.216 1.00 0.19 H new ATOM 0 HA VAL A 475 9.132 -7.138 -4.832 1.00 0.19 H new ATOM 0 HB VAL A 475 9.178 -4.350 -4.215 1.00 0.22 H new ATOM 0 HG11 VAL A 475 8.052 -4.173 -6.407 1.00 0.41 H new ATOM 0 HG12 VAL A 475 9.395 -5.340 -6.442 1.00 0.41 H new ATOM 0 HG13 VAL A 475 7.714 -5.920 -6.364 1.00 0.41 H new ATOM 0 HG21 VAL A 475 6.794 -3.777 -4.348 1.00 0.32 H new ATOM 0 HG22 VAL A 475 6.378 -5.502 -4.212 1.00 0.32 H new ATOM 0 HG23 VAL A 475 7.186 -4.673 -2.861 1.00 0.32 H new ATOM 1235 N THR A 476 11.289 -6.623 -3.891 1.00 0.24 N ATOM 1236 CA THR A 476 12.616 -6.357 -3.447 1.00 0.24 C ATOM 1237 C THR A 476 13.090 -5.052 -4.051 1.00 0.26 C ATOM 1238 O THR A 476 12.921 -4.802 -5.246 1.00 0.33 O ATOM 1239 CB THR A 476 13.514 -7.507 -3.877 1.00 0.31 C ATOM 1240 OG1 THR A 476 13.164 -8.691 -3.147 1.00 0.32 O ATOM 1241 CG2 THR A 476 14.993 -7.182 -3.677 1.00 0.38 C ATOM 0 H THR A 476 11.246 -7.145 -4.766 1.00 0.24 H new ATOM 0 HA THR A 476 12.647 -6.269 -2.361 1.00 0.24 H new ATOM 0 HB THR A 476 13.359 -7.673 -4.943 1.00 0.31 H new ATOM 0 HG1 THR A 476 13.382 -8.568 -2.200 1.00 0.32 H new ATOM 0 HG21 THR A 476 15.598 -8.030 -3.997 1.00 0.38 H new ATOM 0 HG22 THR A 476 15.256 -6.305 -4.268 1.00 0.38 H new ATOM 0 HG23 THR A 476 15.182 -6.979 -2.623 1.00 0.38 H new ATOM 1249 N VAL A 477 13.647 -4.220 -3.213 1.00 0.25 N ATOM 1250 CA VAL A 477 14.056 -2.897 -3.609 1.00 0.29 C ATOM 1251 C VAL A 477 15.534 -2.878 -3.975 1.00 0.33 C ATOM 1252 O VAL A 477 16.341 -3.563 -3.348 1.00 0.37 O ATOM 1253 CB VAL A 477 13.764 -1.929 -2.455 1.00 0.28 C ATOM 1254 CG1 VAL A 477 14.283 -0.531 -2.738 1.00 0.35 C ATOM 1255 CG2 VAL A 477 12.270 -1.899 -2.188 1.00 0.31 C ATOM 0 H VAL A 477 13.831 -4.440 -2.234 1.00 0.25 H new ATOM 0 HA VAL A 477 13.498 -2.588 -4.493 1.00 0.29 H new ATOM 0 HB VAL A 477 14.289 -2.289 -1.570 1.00 0.28 H new ATOM 0 HG11 VAL A 477 14.054 0.120 -1.894 1.00 0.35 H new ATOM 0 HG12 VAL A 477 15.362 -0.567 -2.886 1.00 0.35 H new ATOM 0 HG13 VAL A 477 13.806 -0.141 -3.637 1.00 0.35 H new ATOM 0 HG21 VAL A 477 12.061 -1.212 -1.368 1.00 0.31 H new ATOM 0 HG22 VAL A 477 11.747 -1.565 -3.084 1.00 0.31 H new ATOM 0 HG23 VAL A 477 11.928 -2.899 -1.920 1.00 0.31 H new ATOM 1265 N GLY A 478 15.880 -2.106 -4.994 1.00 0.43 N ATOM 1266 CA GLY A 478 17.252 -2.017 -5.428 1.00 0.53 C ATOM 1267 C GLY A 478 17.618 -0.575 -5.731 1.00 1.15 C ATOM 1268 O GLY A 478 16.720 0.249 -5.882 1.00 1.69 O ATOM 0 H GLY A 478 15.226 -1.536 -5.530 1.00 0.43 H new ATOM 0 HA2 GLY A 478 17.911 -2.412 -4.655 1.00 0.53 H new ATOM 0 HA3 GLY A 478 17.400 -2.631 -6.316 1.00 0.53 H new ATOM 1272 N ASN A 479 18.909 -0.259 -5.836 1.00 1.80 N ATOM 1273 CA ASN A 479 19.345 1.116 -6.103 1.00 2.82 C ATOM 1274 C ASN A 479 20.858 1.149 -6.215 1.00 3.58 C ATOM 1275 O ASN A 479 21.481 2.196 -6.033 1.00 4.40 O ATOM 1276 CB ASN A 479 18.911 2.131 -5.008 1.00 3.20 C ATOM 1277 CG ASN A 479 17.939 3.176 -5.528 1.00 3.99 C ATOM 1278 OD1 ASN A 479 16.719 3.009 -5.453 1.00 4.47 O ATOM 1279 ND2 ASN A 479 18.473 4.269 -6.050 1.00 4.61 N ATOM 0 H ASN A 479 19.670 -0.932 -5.741 1.00 1.80 H new ATOM 0 HA ASN A 479 18.863 1.417 -7.033 1.00 2.82 H new ATOM 0 HB2 ASN A 479 18.450 1.591 -4.181 1.00 3.20 H new ATOM 0 HB3 ASN A 479 19.795 2.629 -4.610 1.00 3.20 H new ATOM 0 HD21 ASN A 479 17.870 5.010 -6.408 1.00 4.61 H new ATOM 0 HD22 ASN A 479 19.487 4.370 -6.094 1.00 4.61 H new ATOM 1286 N SER A 480 21.453 0.005 -6.523 1.00 3.56 N ATOM 1287 CA SER A 480 22.897 -0.125 -6.447 1.00 4.40 C ATOM 1288 C SER A 480 23.370 -1.269 -7.337 1.00 4.81 C ATOM 1289 O SER A 480 22.993 -2.430 -7.065 1.00 4.88 O ATOM 1290 CB SER A 480 23.296 -0.356 -4.985 1.00 4.37 C ATOM 1291 OG SER A 480 22.805 -1.600 -4.509 1.00 4.36 O ATOM 1292 OXT SER A 480 24.102 -1.006 -8.310 1.00 5.40 O ATOM 0 H SER A 480 20.962 -0.837 -6.825 1.00 3.56 H new ATOM 0 HA SER A 480 23.374 0.788 -6.804 1.00 4.40 H new ATOM 0 HB2 SER A 480 24.382 -0.332 -4.894 1.00 4.37 H new ATOM 0 HB3 SER A 480 22.906 0.452 -4.367 1.00 4.37 H new ATOM 0 HG SER A 480 22.777 -2.245 -5.247 1.00 4.36 H new TER 1298 SER A 480