USER MOD reduce.3.24.130724 H: found=0, std=0, add=637, rem=0, adj=25 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 -64:sc= 0.108 USER MOD Set 1.2: A 476 THR OG1 : rot 180:sc= 0.109 USER MOD Set 2.1: A 450 THR OG1 : rot 136:sc= 0.053 USER MOD Set 2.2: A 455 TYR OH : rot 60:sc= 1.45 USER MOD Set 3.1: A 416 THR OG1 : rot 135:sc= 1.95 USER MOD Set 3.2: A 419 TYR OH : rot 143:sc= 0.325 USER MOD Set 4.1: A 407 THR OG1 : rot -80:sc= 1.26 USER MOD Set 4.2: A 445 THR OG1 : rot 180:sc= 1.05 USER MOD Single : A 395 ASN : amide:sc= -0.0179 X(o=-0.018,f=0.39) USER MOD Single : A 397 SER OG : rot 144:sc= 0.769 USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 400 GLN : amide:sc= -3.52! K(o=-3.5!,f=-0.21) USER MOD Single : A 404 SER OG : rot -70:sc= -3.73! USER MOD Single : A 405 GLN : amide:sc= 0.378 K(o=0.38,f=-3.9!) USER MOD Single : A 406 THR OG1 : rot -170:sc= -0.966 USER MOD Single : A 409 SER OG : rot 180:sc= 0 USER MOD Single : A 414 GLN : amide:sc= 0.0359 X(o=0.036,f=-0.28) USER MOD Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 422 SER OG : rot 180:sc= 0 USER MOD Single : A 423 CYS SG : rot 140:sc= -2.69 USER MOD Single : A 424 HIS : no HD1:sc= -0.446 K(o=-0.45,f=-1.4) USER MOD Single : A 428 THR OG1 : rot 177:sc= 0.471 USER MOD Single : A 434 GLN : amide:sc= -0.253 K(o=-0.25,f=-1.8!) USER MOD Single : A 440 THR OG1 : rot 180:sc=0.000544 USER MOD Single : A 441 SER OG : rot -170:sc= -0.0604 USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 SER OG : rot -17:sc= 0.708 USER MOD Single : A 447 THR OG1 : rot 180:sc= 0.0862 USER MOD Single : A 456 ASN : amide:sc= -1.48 K(o=-1.5,f=-4!) USER MOD Single : A 463 LYS NZ :NH3+ -165:sc= -0.14 (180deg=-0.478) USER MOD Single : A 465 GLN : amide:sc= -0.624 K(o=-0.62,f=0) USER MOD Single : A 466 GLN : amide:sc= 0.00253 X(o=0.0025,f=0) USER MOD Single : A 468 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 469 LYS NZ :NH3+ 139:sc= 0.282 (180deg=-0.651) USER MOD Single : A 479 ASN : amide:sc= -0.0876 X(o=-0.088,f=-0.085) USER MOD Single : A 480 SER OG : rot 38:sc= 0.706 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 395 26.838 11.959 -5.711 1.00 7.64 N ATOM 2 CA ASN A 395 25.505 12.553 -5.461 1.00 7.05 C ATOM 3 C ASN A 395 24.675 12.545 -6.743 1.00 6.89 C ATOM 4 O ASN A 395 25.192 12.278 -7.831 1.00 7.24 O ATOM 5 CB ASN A 395 25.649 13.985 -4.926 1.00 7.73 C ATOM 6 CG ASN A 395 26.126 14.969 -5.978 1.00 8.25 C ATOM 7 OD1 ASN A 395 26.879 14.616 -6.884 1.00 8.44 O ATOM 8 ND2 ASN A 395 25.687 16.211 -5.863 1.00 8.76 N ATOM 0 HA ASN A 395 24.992 11.953 -4.709 1.00 7.05 H new ATOM 0 HB2 ASN A 395 24.688 14.318 -4.535 1.00 7.73 H new ATOM 0 HB3 ASN A 395 26.351 13.986 -4.092 1.00 7.73 H new ATOM 0 HD21 ASN A 395 25.972 16.918 -6.541 1.00 8.76 H new ATOM 0 HD22 ASN A 395 25.063 16.462 -5.096 1.00 8.76 H new ATOM 17 N ALA A 396 23.400 12.878 -6.587 1.00 6.67 N ATOM 18 CA ALA A 396 22.373 12.732 -7.636 1.00 6.81 C ATOM 19 C ALA A 396 21.034 12.838 -6.944 1.00 6.05 C ATOM 20 O ALA A 396 20.193 13.670 -7.278 1.00 6.42 O ATOM 21 CB ALA A 396 22.476 11.387 -8.350 1.00 7.55 C ATOM 0 H ALA A 396 23.034 13.265 -5.717 1.00 6.67 H new ATOM 0 HA ALA A 396 22.506 13.503 -8.395 1.00 6.81 H new ATOM 0 HB1 ALA A 396 21.702 11.321 -9.114 1.00 7.55 H new ATOM 0 HB2 ALA A 396 23.456 11.298 -8.818 1.00 7.55 H new ATOM 0 HB3 ALA A 396 22.343 10.581 -7.628 1.00 7.55 H new ATOM 27 N SER A 397 20.856 11.956 -5.973 1.00 5.23 N ATOM 28 CA SER A 397 19.866 12.149 -4.927 1.00 4.72 C ATOM 29 C SER A 397 20.181 13.489 -4.201 1.00 4.61 C ATOM 30 O SER A 397 21.363 13.767 -3.975 1.00 4.53 O ATOM 31 CB SER A 397 19.988 10.984 -3.928 1.00 4.27 C ATOM 32 OG SER A 397 19.122 11.167 -2.826 1.00 4.45 O ATOM 0 H SER A 397 21.391 11.091 -5.888 1.00 5.23 H new ATOM 0 HA SER A 397 18.858 12.179 -5.341 1.00 4.72 H new ATOM 0 HB2 SER A 397 19.751 10.045 -4.429 1.00 4.27 H new ATOM 0 HB3 SER A 397 21.017 10.908 -3.577 1.00 4.27 H new ATOM 0 HG SER A 397 18.766 10.299 -2.542 1.00 4.45 H new ATOM 38 N THR A 398 19.188 14.336 -3.835 1.00 5.02 N ATOM 39 CA THR A 398 19.528 15.591 -3.118 1.00 5.32 C ATOM 40 C THR A 398 18.466 15.911 -2.071 1.00 5.50 C ATOM 41 O THR A 398 18.175 17.077 -1.801 1.00 6.31 O ATOM 42 CB THR A 398 19.685 16.810 -4.072 1.00 6.23 C ATOM 43 OG1 THR A 398 18.691 16.762 -5.105 1.00 6.75 O ATOM 44 CG2 THR A 398 21.084 16.896 -4.696 1.00 6.37 C ATOM 0 H THR A 398 18.195 14.187 -4.012 1.00 5.02 H new ATOM 0 HA THR A 398 20.492 15.418 -2.639 1.00 5.32 H new ATOM 0 HB THR A 398 19.546 17.706 -3.467 1.00 6.23 H new ATOM 0 HG1 THR A 398 18.798 17.535 -5.698 1.00 6.75 H new ATOM 0 HG21 THR A 398 21.137 17.765 -5.352 1.00 6.37 H new ATOM 0 HG22 THR A 398 21.829 16.992 -3.906 1.00 6.37 H new ATOM 0 HG23 THR A 398 21.281 15.993 -5.273 1.00 6.37 H new ATOM 52 N GLY A 399 17.891 14.870 -1.477 1.00 4.93 N ATOM 53 CA GLY A 399 16.838 15.066 -0.502 1.00 5.31 C ATOM 54 C GLY A 399 16.490 13.778 0.191 1.00 4.62 C ATOM 55 O GLY A 399 16.390 13.724 1.416 1.00 4.48 O ATOM 0 H GLY A 399 18.136 13.896 -1.654 1.00 4.93 H new ATOM 0 HA2 GLY A 399 17.154 15.804 0.235 1.00 5.31 H new ATOM 0 HA3 GLY A 399 15.953 15.467 -0.995 1.00 5.31 H new ATOM 59 N GLN A 400 16.306 12.729 -0.595 1.00 4.32 N ATOM 60 CA GLN A 400 16.018 11.410 -0.039 1.00 3.59 C ATOM 61 C GLN A 400 17.284 10.562 -0.102 1.00 2.81 C ATOM 62 O GLN A 400 17.554 9.915 -1.111 1.00 2.93 O ATOM 63 CB GLN A 400 14.859 10.737 -0.796 1.00 3.81 C ATOM 64 CG GLN A 400 13.515 11.436 -0.611 1.00 4.51 C ATOM 65 CD GLN A 400 12.767 10.979 0.629 1.00 4.68 C ATOM 66 OE1 GLN A 400 12.010 11.745 1.222 1.00 5.27 O ATOM 67 NE2 GLN A 400 12.968 9.733 1.031 1.00 4.54 N ATOM 0 H GLN A 400 16.350 12.761 -1.614 1.00 4.32 H new ATOM 0 HA GLN A 400 15.706 11.512 1.000 1.00 3.59 H new ATOM 0 HB2 GLN A 400 15.100 10.708 -1.859 1.00 3.81 H new ATOM 0 HB3 GLN A 400 14.770 9.704 -0.461 1.00 3.81 H new ATOM 0 HG2 GLN A 400 13.678 12.512 -0.553 1.00 4.51 H new ATOM 0 HG3 GLN A 400 12.895 11.254 -1.489 1.00 4.51 H new ATOM 0 HE21 GLN A 400 13.604 9.126 0.513 1.00 4.54 H new ATOM 0 HE22 GLN A 400 12.487 9.380 1.858 1.00 4.54 H new ATOM 76 N GLU A 401 18.030 10.543 0.999 1.00 2.28 N ATOM 77 CA GLU A 401 19.437 10.098 0.961 1.00 1.62 C ATOM 78 C GLU A 401 19.673 8.693 0.425 1.00 1.37 C ATOM 79 O GLU A 401 20.244 8.538 -0.656 1.00 1.38 O ATOM 80 CB GLU A 401 20.125 10.311 2.323 1.00 1.30 C ATOM 81 CG GLU A 401 20.862 11.637 2.405 1.00 1.92 C ATOM 82 CD GLU A 401 21.445 11.904 3.777 1.00 2.22 C ATOM 83 OE1 GLU A 401 20.698 12.362 4.667 1.00 2.91 O ATOM 84 OE2 GLU A 401 22.652 11.653 3.972 1.00 2.28 O ATOM 0 H GLU A 401 17.698 10.825 1.921 1.00 2.28 H new ATOM 0 HA GLU A 401 19.906 10.743 0.217 1.00 1.62 H new ATOM 0 HB2 GLU A 401 19.377 10.266 3.115 1.00 1.30 H new ATOM 0 HB3 GLU A 401 20.828 9.497 2.502 1.00 1.30 H new ATOM 0 HG2 GLU A 401 21.664 11.647 1.667 1.00 1.92 H new ATOM 0 HG3 GLU A 401 20.178 12.444 2.143 1.00 1.92 H new ATOM 91 N ALA A 402 19.249 7.691 1.129 1.00 1.24 N ATOM 92 CA ALA A 402 19.461 6.326 0.672 1.00 1.04 C ATOM 93 C ALA A 402 18.149 5.629 0.426 1.00 0.82 C ATOM 94 O ALA A 402 18.031 4.404 0.421 1.00 0.79 O ATOM 95 CB ALA A 402 20.341 5.594 1.656 1.00 1.18 C ATOM 0 H ALA A 402 18.756 7.776 2.018 1.00 1.24 H new ATOM 0 HA ALA A 402 19.979 6.338 -0.287 1.00 1.04 H new ATOM 0 HB1 ALA A 402 20.499 4.572 1.312 1.00 1.18 H new ATOM 0 HB2 ALA A 402 21.302 6.103 1.734 1.00 1.18 H new ATOM 0 HB3 ALA A 402 19.859 5.578 2.633 1.00 1.18 H new ATOM 101 N LEU A 403 17.184 6.460 0.207 1.00 0.75 N ATOM 102 CA LEU A 403 15.802 6.099 0.273 1.00 0.58 C ATOM 103 C LEU A 403 15.245 5.811 -1.101 1.00 0.57 C ATOM 104 O LEU A 403 15.374 6.622 -2.016 1.00 0.90 O ATOM 105 CB LEU A 403 15.103 7.239 0.982 1.00 0.59 C ATOM 106 CG LEU A 403 15.784 7.592 2.309 1.00 0.79 C ATOM 107 CD1 LEU A 403 15.201 8.851 2.916 1.00 1.70 C ATOM 108 CD2 LEU A 403 15.661 6.434 3.288 1.00 1.52 C ATOM 0 H LEU A 403 17.338 7.440 -0.030 1.00 0.75 H new ATOM 0 HA LEU A 403 15.648 5.173 0.827 1.00 0.58 H new ATOM 0 HB2 LEU A 403 15.092 8.116 0.335 1.00 0.59 H new ATOM 0 HB3 LEU A 403 14.064 6.968 1.168 1.00 0.59 H new ATOM 0 HG LEU A 403 16.838 7.777 2.102 1.00 0.79 H new ATOM 0 HD11 LEU A 403 15.708 9.070 3.856 1.00 1.70 H new ATOM 0 HD12 LEU A 403 15.338 9.684 2.227 1.00 1.70 H new ATOM 0 HD13 LEU A 403 14.137 8.706 3.103 1.00 1.70 H new ATOM 0 HD21 LEU A 403 16.149 6.698 4.226 1.00 1.52 H new ATOM 0 HD22 LEU A 403 14.607 6.224 3.473 1.00 1.52 H new ATOM 0 HD23 LEU A 403 16.139 5.549 2.867 1.00 1.52 H new ATOM 120 N SER A 404 14.615 4.670 -1.240 1.00 0.30 N ATOM 121 CA SER A 404 14.122 4.234 -2.520 1.00 0.27 C ATOM 122 C SER A 404 12.612 4.390 -2.572 1.00 0.28 C ATOM 123 O SER A 404 11.899 3.932 -1.677 1.00 0.43 O ATOM 124 CB SER A 404 14.566 2.795 -2.773 1.00 0.28 C ATOM 125 OG SER A 404 15.936 2.761 -3.133 1.00 1.04 O ATOM 0 H SER A 404 14.431 4.023 -0.474 1.00 0.30 H new ATOM 0 HA SER A 404 14.538 4.853 -3.315 1.00 0.27 H new ATOM 0 HB2 SER A 404 14.403 2.194 -1.879 1.00 0.28 H new ATOM 0 HB3 SER A 404 13.963 2.355 -3.567 1.00 0.28 H new ATOM 0 HG SER A 404 16.049 3.146 -4.027 1.00 1.04 H new ATOM 131 N GLN A 405 12.137 5.081 -3.596 1.00 0.26 N ATOM 132 CA GLN A 405 10.729 5.412 -3.687 1.00 0.26 C ATOM 133 C GLN A 405 10.018 4.476 -4.644 1.00 0.27 C ATOM 134 O GLN A 405 10.308 4.450 -5.844 1.00 0.43 O ATOM 135 CB GLN A 405 10.514 6.857 -4.145 1.00 0.30 C ATOM 136 CG GLN A 405 11.687 7.794 -3.897 1.00 0.33 C ATOM 137 CD GLN A 405 12.669 7.809 -5.056 1.00 0.58 C ATOM 138 OE1 GLN A 405 12.832 6.810 -5.755 1.00 0.99 O ATOM 139 NE2 GLN A 405 13.326 8.938 -5.280 1.00 0.91 N ATOM 0 H GLN A 405 12.705 5.421 -4.372 1.00 0.26 H new ATOM 0 HA GLN A 405 10.312 5.299 -2.686 1.00 0.26 H new ATOM 0 HB2 GLN A 405 10.291 6.854 -5.212 1.00 0.30 H new ATOM 0 HB3 GLN A 405 9.636 7.256 -3.637 1.00 0.30 H new ATOM 0 HG2 GLN A 405 11.313 8.804 -3.728 1.00 0.33 H new ATOM 0 HG3 GLN A 405 12.206 7.490 -2.988 1.00 0.33 H new ATOM 0 HE21 GLN A 405 13.167 9.748 -4.681 1.00 0.91 H new ATOM 0 HE22 GLN A 405 13.991 8.997 -6.052 1.00 0.91 H new ATOM 148 N THR A 406 9.091 3.709 -4.110 1.00 0.18 N ATOM 149 CA THR A 406 8.293 2.809 -4.904 1.00 0.19 C ATOM 150 C THR A 406 6.948 3.422 -5.201 1.00 0.17 C ATOM 151 O THR A 406 6.058 3.468 -4.356 1.00 0.16 O ATOM 152 CB THR A 406 8.105 1.469 -4.178 1.00 0.21 C ATOM 153 OG1 THR A 406 9.382 0.872 -3.927 1.00 0.27 O ATOM 154 CG2 THR A 406 7.242 0.523 -4.979 1.00 0.29 C ATOM 0 H THR A 406 8.872 3.694 -3.114 1.00 0.18 H new ATOM 0 HA THR A 406 8.816 2.629 -5.843 1.00 0.19 H new ATOM 0 HB THR A 406 7.599 1.664 -3.232 1.00 0.21 H new ATOM 0 HG1 THR A 406 9.257 -0.047 -3.610 1.00 0.27 H new ATOM 0 HG21 THR A 406 7.130 -0.415 -4.436 1.00 0.29 H new ATOM 0 HG22 THR A 406 6.261 0.971 -5.137 1.00 0.29 H new ATOM 0 HG23 THR A 406 7.712 0.330 -5.943 1.00 0.29 H new ATOM 162 N THR A 407 6.833 3.933 -6.398 1.00 0.19 N ATOM 163 CA THR A 407 5.578 4.409 -6.895 1.00 0.19 C ATOM 164 C THR A 407 4.723 3.217 -7.304 1.00 0.19 C ATOM 165 O THR A 407 5.042 2.499 -8.251 1.00 0.26 O ATOM 166 CB THR A 407 5.815 5.345 -8.076 1.00 0.24 C ATOM 167 OG1 THR A 407 6.439 6.553 -7.615 1.00 0.26 O ATOM 168 CG2 THR A 407 4.522 5.669 -8.818 1.00 0.24 C ATOM 0 H THR A 407 7.609 4.029 -7.053 1.00 0.19 H new ATOM 0 HA THR A 407 5.053 4.968 -6.120 1.00 0.19 H new ATOM 0 HB THR A 407 6.473 4.836 -8.781 1.00 0.24 H new ATOM 0 HG1 THR A 407 5.761 7.144 -7.227 1.00 0.26 H new ATOM 0 HG21 THR A 407 4.738 6.338 -9.651 1.00 0.24 H new ATOM 0 HG22 THR A 407 4.080 4.748 -9.198 1.00 0.24 H new ATOM 0 HG23 THR A 407 3.823 6.153 -8.136 1.00 0.24 H new ATOM 176 N ILE A 408 3.653 3.009 -6.571 1.00 0.21 N ATOM 177 CA ILE A 408 2.823 1.827 -6.746 1.00 0.21 C ATOM 178 C ILE A 408 1.383 2.234 -6.946 1.00 0.18 C ATOM 179 O ILE A 408 0.869 3.112 -6.255 1.00 0.16 O ATOM 180 CB ILE A 408 2.971 0.798 -5.572 1.00 0.23 C ATOM 181 CG1 ILE A 408 1.736 -0.103 -5.428 1.00 0.21 C ATOM 182 CG2 ILE A 408 3.238 1.477 -4.242 1.00 0.25 C ATOM 183 CD1 ILE A 408 2.049 -1.482 -4.893 1.00 0.27 C ATOM 0 H ILE A 408 3.331 3.645 -5.841 1.00 0.21 H new ATOM 0 HA ILE A 408 3.174 1.310 -7.639 1.00 0.21 H new ATOM 0 HB ILE A 408 3.831 0.183 -5.836 1.00 0.23 H new ATOM 0 HG12 ILE A 408 1.020 0.381 -4.764 1.00 0.21 H new ATOM 0 HG13 ILE A 408 1.253 -0.201 -6.400 1.00 0.21 H new ATOM 0 HG21 ILE A 408 3.333 0.723 -3.461 1.00 0.25 H new ATOM 0 HG22 ILE A 408 4.162 2.051 -4.306 1.00 0.25 H new ATOM 0 HG23 ILE A 408 2.411 2.146 -4.002 1.00 0.25 H new ATOM 0 HD11 ILE A 408 1.128 -2.061 -4.819 1.00 0.27 H new ATOM 0 HD12 ILE A 408 2.741 -1.986 -5.568 1.00 0.27 H new ATOM 0 HD13 ILE A 408 2.504 -1.395 -3.906 1.00 0.27 H new ATOM 195 N SER A 409 0.760 1.622 -7.929 1.00 0.18 N ATOM 196 CA SER A 409 -0.596 1.953 -8.292 1.00 0.16 C ATOM 197 C SER A 409 -1.534 0.799 -7.997 1.00 0.13 C ATOM 198 O SER A 409 -1.120 -0.361 -7.923 1.00 0.15 O ATOM 199 CB SER A 409 -0.663 2.327 -9.770 1.00 0.21 C ATOM 200 OG SER A 409 -0.073 1.326 -10.580 1.00 0.71 O ATOM 0 H SER A 409 1.179 0.884 -8.496 1.00 0.18 H new ATOM 0 HA SER A 409 -0.914 2.807 -7.694 1.00 0.16 H new ATOM 0 HB2 SER A 409 -1.703 2.471 -10.065 1.00 0.21 H new ATOM 0 HB3 SER A 409 -0.152 3.276 -9.931 1.00 0.21 H new ATOM 0 HG SER A 409 -0.131 1.591 -11.522 1.00 0.71 H new ATOM 206 N TRP A 410 -2.791 1.129 -7.810 1.00 0.16 N ATOM 207 CA TRP A 410 -3.815 0.136 -7.560 1.00 0.17 C ATOM 208 C TRP A 410 -5.127 0.615 -8.085 1.00 0.18 C ATOM 209 O TRP A 410 -5.290 1.788 -8.433 1.00 0.19 O ATOM 210 CB TRP A 410 -3.926 -0.178 -6.065 1.00 0.16 C ATOM 211 CG TRP A 410 -4.231 1.036 -5.223 1.00 0.14 C ATOM 212 CD1 TRP A 410 -5.458 1.546 -4.860 1.00 0.14 C ATOM 213 CD2 TRP A 410 -3.257 1.910 -4.654 1.00 0.13 C ATOM 214 NE1 TRP A 410 -5.285 2.669 -4.084 1.00 0.13 N ATOM 215 CE2 TRP A 410 -3.944 2.913 -3.946 1.00 0.12 C ATOM 216 CE3 TRP A 410 -1.864 1.931 -4.673 1.00 0.14 C ATOM 217 CZ2 TRP A 410 -3.276 3.927 -3.262 1.00 0.14 C ATOM 218 CZ3 TRP A 410 -1.203 2.931 -4.002 1.00 0.15 C ATOM 219 CH2 TRP A 410 -1.906 3.920 -3.303 1.00 0.14 C ATOM 0 H TRP A 410 -3.134 2.090 -7.826 1.00 0.16 H new ATOM 0 HA TRP A 410 -3.535 -0.782 -8.077 1.00 0.17 H new ATOM 0 HB2 TRP A 410 -4.708 -0.922 -5.914 1.00 0.16 H new ATOM 0 HB3 TRP A 410 -2.991 -0.623 -5.724 1.00 0.16 H new ATOM 0 HD1 TRP A 410 -6.413 1.127 -5.142 1.00 0.14 H new ATOM 0 HE1 TRP A 410 -6.034 3.229 -3.677 1.00 0.13 H new ATOM 0 HE3 TRP A 410 -1.312 1.172 -5.207 1.00 0.14 H new ATOM 0 HZ2 TRP A 410 -3.817 4.689 -2.721 1.00 0.14 H new ATOM 0 HZ3 TRP A 410 -0.123 2.955 -4.014 1.00 0.15 H new ATOM 0 HH2 TRP A 410 -1.357 4.693 -2.786 1.00 0.14 H new ATOM 230 N ALA A 411 -6.053 -0.301 -8.151 1.00 0.19 N ATOM 231 CA ALA A 411 -7.318 -0.019 -8.712 1.00 0.22 C ATOM 232 C ALA A 411 -8.254 0.530 -7.670 1.00 0.19 C ATOM 233 O ALA A 411 -8.303 0.059 -6.533 1.00 0.19 O ATOM 234 CB ALA A 411 -7.885 -1.251 -9.348 1.00 0.26 C ATOM 0 H ALA A 411 -5.940 -1.257 -7.815 1.00 0.19 H new ATOM 0 HA ALA A 411 -7.196 0.742 -9.483 1.00 0.22 H new ATOM 0 HB1 ALA A 411 -8.860 -1.023 -9.778 1.00 0.26 H new ATOM 0 HB2 ALA A 411 -7.214 -1.596 -10.135 1.00 0.26 H new ATOM 0 HB3 ALA A 411 -7.994 -2.032 -8.595 1.00 0.26 H new ATOM 240 N PRO A 412 -8.994 1.547 -8.079 1.00 0.20 N ATOM 241 CA PRO A 412 -9.918 2.260 -7.226 1.00 0.19 C ATOM 242 C PRO A 412 -10.873 1.332 -6.503 1.00 0.20 C ATOM 243 O PRO A 412 -11.517 0.473 -7.113 1.00 0.23 O ATOM 244 CB PRO A 412 -10.707 3.152 -8.168 1.00 0.24 C ATOM 245 CG PRO A 412 -10.019 3.121 -9.495 1.00 0.26 C ATOM 246 CD PRO A 412 -8.958 2.061 -9.443 1.00 0.23 C ATOM 0 HA PRO A 412 -9.379 2.807 -6.452 1.00 0.19 H new ATOM 0 HB2 PRO A 412 -11.734 2.799 -8.260 1.00 0.24 H new ATOM 0 HB3 PRO A 412 -10.753 4.171 -7.783 1.00 0.24 H new ATOM 0 HG2 PRO A 412 -10.733 2.906 -10.290 1.00 0.26 H new ATOM 0 HG3 PRO A 412 -9.577 4.092 -9.718 1.00 0.26 H new ATOM 0 HD2 PRO A 412 -9.156 1.270 -10.167 1.00 0.23 H new ATOM 0 HD3 PRO A 412 -7.978 2.474 -9.682 1.00 0.23 H new ATOM 254 N PHE A 413 -10.956 1.516 -5.209 1.00 0.21 N ATOM 255 CA PHE A 413 -11.803 0.697 -4.375 1.00 0.30 C ATOM 256 C PHE A 413 -13.089 1.439 -3.998 1.00 0.51 C ATOM 257 O PHE A 413 -14.021 0.845 -3.452 1.00 1.35 O ATOM 258 CB PHE A 413 -11.019 0.264 -3.131 1.00 0.30 C ATOM 259 CG PHE A 413 -11.800 -0.561 -2.155 1.00 0.37 C ATOM 260 CD1 PHE A 413 -12.153 -0.030 -0.930 1.00 0.36 C ATOM 261 CD2 PHE A 413 -12.181 -1.857 -2.460 1.00 0.51 C ATOM 262 CE1 PHE A 413 -12.875 -0.775 -0.018 1.00 0.45 C ATOM 263 CE2 PHE A 413 -12.904 -2.611 -1.554 1.00 0.61 C ATOM 264 CZ PHE A 413 -13.251 -2.069 -0.330 1.00 0.57 C ATOM 0 H PHE A 413 -10.440 2.236 -4.704 1.00 0.21 H new ATOM 0 HA PHE A 413 -12.102 -0.192 -4.930 1.00 0.30 H new ATOM 0 HB2 PHE A 413 -10.145 -0.304 -3.449 1.00 0.30 H new ATOM 0 HB3 PHE A 413 -10.652 1.155 -2.621 1.00 0.30 H new ATOM 0 HD1 PHE A 413 -11.861 0.980 -0.682 1.00 0.36 H new ATOM 0 HD2 PHE A 413 -11.911 -2.283 -3.415 1.00 0.51 H new ATOM 0 HE1 PHE A 413 -13.145 -0.348 0.937 1.00 0.45 H new ATOM 0 HE2 PHE A 413 -13.197 -3.621 -1.802 1.00 0.61 H new ATOM 0 HZ PHE A 413 -13.815 -2.655 0.381 1.00 0.57 H new ATOM 274 N GLN A 414 -13.116 2.742 -4.294 1.00 0.54 N ATOM 275 CA GLN A 414 -14.329 3.586 -4.116 1.00 0.53 C ATOM 276 C GLN A 414 -14.451 4.134 -2.729 1.00 0.44 C ATOM 277 O GLN A 414 -14.618 3.425 -1.737 1.00 0.48 O ATOM 278 CB GLN A 414 -15.660 2.893 -4.500 1.00 0.71 C ATOM 279 CG GLN A 414 -16.838 3.855 -4.529 1.00 1.28 C ATOM 280 CD GLN A 414 -18.126 3.220 -4.031 1.00 1.51 C ATOM 281 OE1 GLN A 414 -18.339 2.014 -4.178 1.00 2.11 O ATOM 282 NE2 GLN A 414 -18.997 4.022 -3.430 1.00 1.89 N ATOM 0 H GLN A 414 -12.311 3.250 -4.661 1.00 0.54 H new ATOM 0 HA GLN A 414 -14.170 4.402 -4.821 1.00 0.53 H new ATOM 0 HB2 GLN A 414 -15.553 2.428 -5.480 1.00 0.71 H new ATOM 0 HB3 GLN A 414 -15.867 2.094 -3.788 1.00 0.71 H new ATOM 0 HG2 GLN A 414 -16.606 4.726 -3.916 1.00 1.28 H new ATOM 0 HG3 GLN A 414 -16.985 4.213 -5.548 1.00 1.28 H new ATOM 0 HE21 GLN A 414 -18.788 5.015 -3.326 1.00 1.89 H new ATOM 0 HE22 GLN A 414 -19.875 3.645 -3.073 1.00 1.89 H new ATOM 291 N ASP A 415 -14.365 5.436 -2.741 1.00 0.39 N ATOM 292 CA ASP A 415 -14.614 6.306 -1.622 1.00 0.34 C ATOM 293 C ASP A 415 -13.931 5.882 -0.339 1.00 0.31 C ATOM 294 O ASP A 415 -14.512 5.970 0.743 1.00 0.35 O ATOM 295 CB ASP A 415 -16.105 6.468 -1.360 1.00 0.40 C ATOM 296 CG ASP A 415 -16.785 7.385 -2.353 1.00 0.45 C ATOM 297 OD1 ASP A 415 -17.445 6.881 -3.284 1.00 0.58 O ATOM 298 OD2 ASP A 415 -16.659 8.621 -2.210 1.00 0.59 O ATOM 0 H ASP A 415 -14.104 5.950 -3.583 1.00 0.39 H new ATOM 0 HA ASP A 415 -14.178 7.260 -1.919 1.00 0.34 H new ATOM 0 HB2 ASP A 415 -16.582 5.489 -1.393 1.00 0.40 H new ATOM 0 HB3 ASP A 415 -16.251 6.860 -0.353 1.00 0.40 H new ATOM 303 N THR A 416 -12.703 5.469 -0.451 1.00 0.27 N ATOM 304 CA THR A 416 -11.928 5.082 0.697 1.00 0.23 C ATOM 305 C THR A 416 -11.586 6.301 1.544 1.00 0.24 C ATOM 306 O THR A 416 -11.398 7.398 1.028 1.00 0.25 O ATOM 307 CB THR A 416 -10.660 4.375 0.223 1.00 0.19 C ATOM 308 OG1 THR A 416 -11.023 3.299 -0.649 1.00 0.22 O ATOM 309 CG2 THR A 416 -9.874 3.838 1.399 1.00 0.22 C ATOM 0 H THR A 416 -12.208 5.390 -1.339 1.00 0.27 H new ATOM 0 HA THR A 416 -12.508 4.400 1.318 1.00 0.23 H new ATOM 0 HB THR A 416 -10.033 5.090 -0.309 1.00 0.19 H new ATOM 0 HG1 THR A 416 -10.439 3.304 -1.436 1.00 0.22 H new ATOM 0 HG21 THR A 416 -8.975 3.338 1.038 1.00 0.22 H new ATOM 0 HG22 THR A 416 -9.593 4.662 2.055 1.00 0.22 H new ATOM 0 HG23 THR A 416 -10.487 3.127 1.952 1.00 0.22 H new ATOM 317 N SER A 417 -11.614 6.120 2.855 1.00 0.25 N ATOM 318 CA SER A 417 -11.241 7.170 3.781 1.00 0.28 C ATOM 319 C SER A 417 -9.721 7.335 3.787 1.00 0.27 C ATOM 320 O SER A 417 -9.208 8.452 3.845 1.00 0.33 O ATOM 321 CB SER A 417 -11.748 6.822 5.184 1.00 0.32 C ATOM 322 OG SER A 417 -13.112 6.432 5.145 1.00 1.14 O ATOM 0 H SER A 417 -11.894 5.247 3.302 1.00 0.25 H new ATOM 0 HA SER A 417 -11.693 8.111 3.468 1.00 0.28 H new ATOM 0 HB2 SER A 417 -11.146 6.015 5.603 1.00 0.32 H new ATOM 0 HB3 SER A 417 -11.630 7.683 5.842 1.00 0.32 H new ATOM 0 HG SER A 417 -13.415 6.212 6.051 1.00 1.14 H new ATOM 328 N GLU A 418 -9.012 6.212 3.731 1.00 0.23 N ATOM 329 CA GLU A 418 -7.575 6.199 3.683 1.00 0.25 C ATOM 330 C GLU A 418 -7.087 4.910 3.032 1.00 0.19 C ATOM 331 O GLU A 418 -7.644 3.849 3.287 1.00 0.28 O ATOM 332 CB GLU A 418 -7.051 6.203 5.092 1.00 0.36 C ATOM 333 CG GLU A 418 -5.723 6.847 5.229 1.00 0.84 C ATOM 334 CD GLU A 418 -5.800 8.359 5.286 1.00 0.86 C ATOM 335 OE1 GLU A 418 -5.478 9.005 4.266 1.00 1.31 O ATOM 336 OE2 GLU A 418 -6.185 8.909 6.337 1.00 1.37 O ATOM 0 H GLU A 418 -9.433 5.283 3.718 1.00 0.23 H new ATOM 0 HA GLU A 418 -7.231 7.066 3.118 1.00 0.25 H new ATOM 0 HB2 GLU A 418 -7.764 6.719 5.735 1.00 0.36 H new ATOM 0 HB3 GLU A 418 -6.986 5.175 5.450 1.00 0.36 H new ATOM 0 HG2 GLU A 418 -5.239 6.479 6.134 1.00 0.84 H new ATOM 0 HG3 GLU A 418 -5.094 6.552 4.389 1.00 0.84 H new ATOM 343 N TYR A 419 -6.045 4.970 2.229 1.00 0.17 N ATOM 344 CA TYR A 419 -5.404 3.737 1.788 1.00 0.16 C ATOM 345 C TYR A 419 -4.129 3.574 2.563 1.00 0.19 C ATOM 346 O TYR A 419 -3.218 4.397 2.463 1.00 0.29 O ATOM 347 CB TYR A 419 -5.090 3.686 0.284 1.00 0.16 C ATOM 348 CG TYR A 419 -6.319 3.743 -0.633 1.00 0.14 C ATOM 349 CD1 TYR A 419 -7.120 2.619 -0.850 1.00 0.12 C ATOM 350 CD2 TYR A 419 -6.690 4.929 -1.288 1.00 0.17 C ATOM 351 CE1 TYR A 419 -8.220 2.679 -1.675 1.00 0.12 C ATOM 352 CE2 TYR A 419 -7.799 4.976 -2.114 1.00 0.18 C ATOM 353 CZ TYR A 419 -8.555 3.844 -2.300 1.00 0.14 C ATOM 354 OH TYR A 419 -9.653 3.883 -3.126 1.00 0.19 O ATOM 0 H TYR A 419 -5.629 5.831 1.873 1.00 0.17 H new ATOM 0 HA TYR A 419 -6.110 2.927 1.971 1.00 0.16 H new ATOM 0 HB2 TYR A 419 -4.431 4.518 0.037 1.00 0.16 H new ATOM 0 HB3 TYR A 419 -4.539 2.769 0.073 1.00 0.16 H new ATOM 0 HD1 TYR A 419 -6.872 1.688 -0.362 1.00 0.12 H new ATOM 0 HD2 TYR A 419 -6.098 5.821 -1.144 1.00 0.17 H new ATOM 0 HE1 TYR A 419 -8.823 1.796 -1.829 1.00 0.12 H new ATOM 0 HE2 TYR A 419 -8.069 5.897 -2.610 1.00 0.18 H new ATOM 0 HH TYR A 419 -10.106 4.747 -3.028 1.00 0.19 H new ATOM 364 N ILE A 420 -4.072 2.527 3.350 1.00 0.18 N ATOM 365 CA ILE A 420 -2.933 2.306 4.192 1.00 0.18 C ATOM 366 C ILE A 420 -2.109 1.176 3.637 1.00 0.17 C ATOM 367 O ILE A 420 -2.556 0.030 3.560 1.00 0.21 O ATOM 368 CB ILE A 420 -3.344 2.022 5.640 1.00 0.22 C ATOM 369 CG1 ILE A 420 -4.243 3.165 6.114 1.00 0.32 C ATOM 370 CG2 ILE A 420 -2.103 1.883 6.530 1.00 0.26 C ATOM 371 CD1 ILE A 420 -4.847 2.949 7.466 1.00 0.32 C ATOM 0 H ILE A 420 -4.802 1.818 3.421 1.00 0.18 H new ATOM 0 HA ILE A 420 -2.334 3.216 4.205 1.00 0.18 H new ATOM 0 HB ILE A 420 -3.891 1.081 5.701 1.00 0.22 H new ATOM 0 HG12 ILE A 420 -3.661 4.087 6.131 1.00 0.32 H new ATOM 0 HG13 ILE A 420 -5.044 3.307 5.389 1.00 0.32 H new ATOM 0 HG21 ILE A 420 -2.412 1.681 7.556 1.00 0.26 H new ATOM 0 HG22 ILE A 420 -1.486 1.060 6.168 1.00 0.26 H new ATOM 0 HG23 ILE A 420 -1.528 2.808 6.499 1.00 0.26 H new ATOM 0 HD11 ILE A 420 -5.470 3.805 7.727 1.00 0.32 H new ATOM 0 HD12 ILE A 420 -5.458 2.046 7.452 1.00 0.32 H new ATOM 0 HD13 ILE A 420 -4.054 2.838 8.205 1.00 0.32 H new ATOM 383 N ILE A 421 -0.915 1.516 3.225 1.00 0.15 N ATOM 384 CA ILE A 421 -0.044 0.563 2.579 1.00 0.18 C ATOM 385 C ILE A 421 0.952 0.041 3.579 1.00 0.19 C ATOM 386 O ILE A 421 1.710 0.801 4.175 1.00 0.30 O ATOM 387 CB ILE A 421 0.714 1.171 1.389 1.00 0.19 C ATOM 388 CG1 ILE A 421 -0.271 1.648 0.312 1.00 0.20 C ATOM 389 CG2 ILE A 421 1.664 0.119 0.832 1.00 0.24 C ATOM 390 CD1 ILE A 421 0.300 2.675 -0.631 1.00 0.32 C ATOM 0 H ILE A 421 -0.520 2.451 3.325 1.00 0.15 H new ATOM 0 HA ILE A 421 -0.671 -0.242 2.196 1.00 0.18 H new ATOM 0 HB ILE A 421 1.286 2.039 1.716 1.00 0.19 H new ATOM 0 HG12 ILE A 421 -0.607 0.787 -0.266 1.00 0.20 H new ATOM 0 HG13 ILE A 421 -1.151 2.067 0.800 1.00 0.20 H new ATOM 0 HG21 ILE A 421 2.211 0.534 -0.015 1.00 0.24 H new ATOM 0 HG22 ILE A 421 2.369 -0.182 1.607 1.00 0.24 H new ATOM 0 HG23 ILE A 421 1.093 -0.750 0.504 1.00 0.24 H new ATOM 0 HD11 ILE A 421 -0.458 2.960 -1.361 1.00 0.32 H new ATOM 0 HD12 ILE A 421 0.609 3.555 -0.067 1.00 0.32 H new ATOM 0 HD13 ILE A 421 1.162 2.254 -1.148 1.00 0.32 H new ATOM 402 N SER A 422 0.939 -1.252 3.753 1.00 0.14 N ATOM 403 CA SER A 422 1.814 -1.897 4.699 1.00 0.14 C ATOM 404 C SER A 422 2.940 -2.625 3.992 1.00 0.16 C ATOM 405 O SER A 422 2.759 -3.720 3.462 1.00 0.36 O ATOM 406 CB SER A 422 1.050 -2.878 5.575 1.00 0.18 C ATOM 407 OG SER A 422 0.194 -2.211 6.493 1.00 0.88 O ATOM 0 H SER A 422 0.324 -1.889 3.246 1.00 0.14 H new ATOM 0 HA SER A 422 2.237 -1.115 5.330 1.00 0.14 H new ATOM 0 HB2 SER A 422 0.459 -3.544 4.945 1.00 0.18 H new ATOM 0 HB3 SER A 422 1.756 -3.501 6.124 1.00 0.18 H new ATOM 0 HG SER A 422 -0.281 -2.873 7.037 1.00 0.88 H new ATOM 413 N CYS A 423 4.092 -1.996 3.978 1.00 0.14 N ATOM 414 CA CYS A 423 5.295 -2.616 3.462 1.00 0.12 C ATOM 415 C CYS A 423 5.952 -3.471 4.538 1.00 0.12 C ATOM 416 O CYS A 423 6.644 -2.957 5.416 1.00 0.13 O ATOM 417 CB CYS A 423 6.268 -1.556 2.974 1.00 0.14 C ATOM 418 SG CYS A 423 5.667 -0.582 1.576 1.00 0.95 S ATOM 0 H CYS A 423 4.224 -1.045 4.322 1.00 0.14 H new ATOM 0 HA CYS A 423 5.022 -3.255 2.622 1.00 0.12 H new ATOM 0 HB2 CYS A 423 6.497 -0.882 3.800 1.00 0.14 H new ATOM 0 HB3 CYS A 423 7.202 -2.040 2.689 1.00 0.14 H new ATOM 0 HG CYS A 423 6.004 0.663 1.738 1.00 0.95 H new ATOM 424 N HIS A 424 5.720 -4.772 4.473 1.00 0.13 N ATOM 425 CA HIS A 424 6.290 -5.705 5.439 1.00 0.15 C ATOM 426 C HIS A 424 7.639 -6.214 4.950 1.00 0.15 C ATOM 427 O HIS A 424 7.729 -6.870 3.917 1.00 0.16 O ATOM 428 CB HIS A 424 5.349 -6.886 5.674 1.00 0.18 C ATOM 429 CG HIS A 424 4.103 -6.548 6.435 1.00 0.19 C ATOM 430 ND1 HIS A 424 4.021 -6.592 7.808 1.00 0.24 N ATOM 431 CD2 HIS A 424 2.877 -6.168 6.001 1.00 0.24 C ATOM 432 CE1 HIS A 424 2.800 -6.257 8.185 1.00 0.25 C ATOM 433 NE2 HIS A 424 2.086 -5.994 7.108 1.00 0.25 N ATOM 0 H HIS A 424 5.138 -5.210 3.759 1.00 0.13 H new ATOM 0 HA HIS A 424 6.427 -5.174 6.381 1.00 0.15 H new ATOM 0 HB2 HIS A 424 5.067 -7.307 4.709 1.00 0.18 H new ATOM 0 HB3 HIS A 424 5.890 -7.663 6.214 1.00 0.18 H new ATOM 0 HD2 HIS A 424 2.578 -6.028 4.973 1.00 0.24 H new ATOM 0 HE1 HIS A 424 2.446 -6.207 9.204 1.00 0.25 H new ATOM 0 HE2 HIS A 424 1.107 -5.708 7.100 1.00 0.25 H new ATOM 442 N PRO A 425 8.701 -5.909 5.692 1.00 0.17 N ATOM 443 CA PRO A 425 10.058 -6.268 5.312 1.00 0.17 C ATOM 444 C PRO A 425 10.380 -7.722 5.543 1.00 0.18 C ATOM 445 O PRO A 425 10.090 -8.309 6.589 1.00 0.24 O ATOM 446 CB PRO A 425 10.949 -5.389 6.182 1.00 0.21 C ATOM 447 CG PRO A 425 10.075 -4.814 7.250 1.00 0.32 C ATOM 448 CD PRO A 425 8.651 -5.194 6.966 1.00 0.22 C ATOM 0 HA PRO A 425 10.204 -6.115 4.243 1.00 0.17 H new ATOM 0 HB2 PRO A 425 11.760 -5.972 6.618 1.00 0.21 H new ATOM 0 HB3 PRO A 425 11.408 -4.597 5.590 1.00 0.21 H new ATOM 0 HG2 PRO A 425 10.378 -5.189 8.228 1.00 0.32 H new ATOM 0 HG3 PRO A 425 10.178 -3.729 7.278 1.00 0.32 H new ATOM 0 HD2 PRO A 425 8.245 -5.824 7.757 1.00 0.22 H new ATOM 0 HD3 PRO A 425 8.012 -4.313 6.900 1.00 0.22 H new ATOM 456 N VAL A 426 10.982 -8.277 4.526 1.00 0.15 N ATOM 457 CA VAL A 426 11.475 -9.627 4.542 1.00 0.19 C ATOM 458 C VAL A 426 13.002 -9.586 4.551 1.00 0.20 C ATOM 459 O VAL A 426 13.606 -8.874 3.748 1.00 0.20 O ATOM 460 CB VAL A 426 11.031 -10.373 3.283 1.00 0.20 C ATOM 461 CG1 VAL A 426 11.285 -11.866 3.404 1.00 0.27 C ATOM 462 CG2 VAL A 426 9.583 -10.083 2.928 1.00 0.21 C ATOM 0 H VAL A 426 11.147 -7.792 3.644 1.00 0.15 H new ATOM 0 HA VAL A 426 11.085 -10.136 5.424 1.00 0.19 H new ATOM 0 HB VAL A 426 11.641 -9.999 2.460 1.00 0.20 H new ATOM 0 HG11 VAL A 426 10.958 -12.366 2.492 1.00 0.27 H new ATOM 0 HG12 VAL A 426 12.350 -12.043 3.553 1.00 0.27 H new ATOM 0 HG13 VAL A 426 10.729 -12.262 4.254 1.00 0.27 H new ATOM 0 HG21 VAL A 426 9.312 -10.634 2.028 1.00 0.21 H new ATOM 0 HG22 VAL A 426 8.938 -10.392 3.751 1.00 0.21 H new ATOM 0 HG23 VAL A 426 9.459 -9.015 2.751 1.00 0.21 H new ATOM 472 N GLY A 427 13.619 -10.324 5.450 1.00 0.26 N ATOM 473 CA GLY A 427 15.081 -10.339 5.529 1.00 0.29 C ATOM 474 C GLY A 427 15.606 -9.526 6.694 1.00 0.32 C ATOM 475 O GLY A 427 16.555 -9.930 7.368 1.00 0.38 O ATOM 0 H GLY A 427 13.147 -10.917 6.132 1.00 0.26 H new ATOM 0 HA2 GLY A 427 15.426 -11.369 5.623 1.00 0.29 H new ATOM 0 HA3 GLY A 427 15.496 -9.948 4.600 1.00 0.29 H new ATOM 479 N THR A 428 14.994 -8.381 6.931 1.00 0.31 N ATOM 480 CA THR A 428 15.373 -7.524 8.038 1.00 0.37 C ATOM 481 C THR A 428 14.440 -7.689 9.216 1.00 0.41 C ATOM 482 O THR A 428 13.410 -8.363 9.129 1.00 0.41 O ATOM 483 CB THR A 428 15.338 -6.050 7.647 1.00 0.37 C ATOM 484 OG1 THR A 428 14.226 -5.793 6.778 1.00 0.30 O ATOM 485 CG2 THR A 428 16.634 -5.614 6.984 1.00 0.42 C ATOM 0 H THR A 428 14.225 -8.021 6.366 1.00 0.31 H new ATOM 0 HA THR A 428 16.386 -7.823 8.308 1.00 0.37 H new ATOM 0 HB THR A 428 15.221 -5.468 8.561 1.00 0.37 H new ATOM 0 HG1 THR A 428 14.182 -4.835 6.578 1.00 0.30 H new ATOM 0 HG21 THR A 428 16.570 -4.558 6.720 1.00 0.42 H new ATOM 0 HG22 THR A 428 17.465 -5.766 7.673 1.00 0.42 H new ATOM 0 HG23 THR A 428 16.798 -6.204 6.082 1.00 0.42 H new ATOM 493 N ASP A 429 14.808 -7.061 10.318 1.00 0.48 N ATOM 494 CA ASP A 429 13.929 -6.963 11.465 1.00 0.54 C ATOM 495 C ASP A 429 13.266 -5.595 11.497 1.00 0.49 C ATOM 496 O ASP A 429 13.082 -4.998 12.558 1.00 0.59 O ATOM 497 CB ASP A 429 14.697 -7.183 12.758 1.00 0.69 C ATOM 498 CG ASP A 429 13.805 -7.583 13.922 1.00 1.09 C ATOM 499 OD1 ASP A 429 13.327 -8.738 13.946 1.00 1.06 O ATOM 500 OD2 ASP A 429 13.568 -6.742 14.815 1.00 1.78 O ATOM 0 H ASP A 429 15.714 -6.610 10.441 1.00 0.48 H new ATOM 0 HA ASP A 429 13.167 -7.737 11.375 1.00 0.54 H new ATOM 0 HB2 ASP A 429 15.447 -7.958 12.600 1.00 0.69 H new ATOM 0 HB3 ASP A 429 15.232 -6.269 13.016 1.00 0.69 H new ATOM 505 N GLU A 430 12.937 -5.082 10.324 1.00 0.40 N ATOM 506 CA GLU A 430 12.273 -3.803 10.223 1.00 0.38 C ATOM 507 C GLU A 430 10.801 -3.954 10.458 1.00 0.31 C ATOM 508 O GLU A 430 10.244 -5.054 10.412 1.00 0.33 O ATOM 509 CB GLU A 430 12.512 -3.162 8.849 1.00 0.38 C ATOM 510 CG GLU A 430 13.945 -2.739 8.573 1.00 0.48 C ATOM 511 CD GLU A 430 14.100 -2.121 7.198 1.00 1.58 C ATOM 512 OE1 GLU A 430 14.060 -2.873 6.200 1.00 2.50 O ATOM 513 OE2 GLU A 430 14.266 -0.889 7.110 1.00 1.64 O ATOM 0 H GLU A 430 13.121 -5.536 9.429 1.00 0.40 H new ATOM 0 HA GLU A 430 12.694 -3.152 10.989 1.00 0.38 H new ATOM 0 HB2 GLU A 430 12.204 -3.868 8.078 1.00 0.38 H new ATOM 0 HB3 GLU A 430 11.868 -2.288 8.757 1.00 0.38 H new ATOM 0 HG2 GLU A 430 14.264 -2.023 9.330 1.00 0.48 H new ATOM 0 HG3 GLU A 430 14.601 -3.605 8.657 1.00 0.48 H new ATOM 520 N GLU A 431 10.183 -2.835 10.729 1.00 0.29 N ATOM 521 CA GLU A 431 8.790 -2.798 10.972 1.00 0.26 C ATOM 522 C GLU A 431 8.083 -2.474 9.669 1.00 0.24 C ATOM 523 O GLU A 431 8.672 -1.898 8.755 1.00 0.26 O ATOM 524 CB GLU A 431 8.491 -1.760 12.044 1.00 0.29 C ATOM 525 CG GLU A 431 8.288 -0.370 11.482 1.00 0.63 C ATOM 526 CD GLU A 431 7.863 0.636 12.528 1.00 0.87 C ATOM 527 OE1 GLU A 431 8.703 1.464 12.942 1.00 1.11 O ATOM 528 OE2 GLU A 431 6.681 0.616 12.933 1.00 1.05 O ATOM 0 H GLU A 431 10.645 -1.927 10.785 1.00 0.29 H new ATOM 0 HA GLU A 431 8.432 -3.762 11.334 1.00 0.26 H new ATOM 0 HB2 GLU A 431 7.597 -2.059 12.591 1.00 0.29 H new ATOM 0 HB3 GLU A 431 9.312 -1.740 12.761 1.00 0.29 H new ATOM 0 HG2 GLU A 431 9.215 -0.033 11.018 1.00 0.63 H new ATOM 0 HG3 GLU A 431 7.534 -0.409 10.696 1.00 0.63 H new ATOM 535 N PRO A 432 6.827 -2.876 9.562 1.00 0.23 N ATOM 536 CA PRO A 432 6.028 -2.600 8.389 1.00 0.21 C ATOM 537 C PRO A 432 5.830 -1.112 8.217 1.00 0.20 C ATOM 538 O PRO A 432 5.204 -0.451 9.052 1.00 0.24 O ATOM 539 CB PRO A 432 4.683 -3.291 8.655 1.00 0.24 C ATOM 540 CG PRO A 432 4.719 -3.763 10.080 1.00 0.23 C ATOM 541 CD PRO A 432 6.126 -3.613 10.595 1.00 0.24 C ATOM 0 HA PRO A 432 6.504 -2.960 7.477 1.00 0.21 H new ATOM 0 HB2 PRO A 432 3.854 -2.601 8.496 1.00 0.24 H new ATOM 0 HB3 PRO A 432 4.536 -4.128 7.973 1.00 0.24 H new ATOM 0 HG2 PRO A 432 4.028 -3.181 10.690 1.00 0.23 H new ATOM 0 HG3 PRO A 432 4.401 -4.804 10.143 1.00 0.23 H new ATOM 0 HD2 PRO A 432 6.144 -3.077 11.544 1.00 0.24 H new ATOM 0 HD3 PRO A 432 6.588 -4.585 10.769 1.00 0.24 H new ATOM 549 N LEU A 433 6.369 -0.587 7.134 1.00 0.20 N ATOM 550 CA LEU A 433 6.178 0.793 6.794 1.00 0.20 C ATOM 551 C LEU A 433 4.762 0.993 6.336 1.00 0.20 C ATOM 552 O LEU A 433 4.337 0.447 5.317 1.00 0.30 O ATOM 553 CB LEU A 433 7.133 1.217 5.700 1.00 0.22 C ATOM 554 CG LEU A 433 8.508 1.677 6.170 1.00 0.24 C ATOM 555 CD1 LEU A 433 9.362 0.502 6.608 1.00 0.65 C ATOM 556 CD2 LEU A 433 9.201 2.478 5.082 1.00 0.73 C ATOM 0 H LEU A 433 6.947 -1.108 6.474 1.00 0.20 H new ATOM 0 HA LEU A 433 6.377 1.404 7.675 1.00 0.20 H new ATOM 0 HB2 LEU A 433 7.264 0.381 5.013 1.00 0.22 H new ATOM 0 HB3 LEU A 433 6.673 2.026 5.134 1.00 0.22 H new ATOM 0 HG LEU A 433 8.370 2.323 7.037 1.00 0.24 H new ATOM 0 HD11 LEU A 433 10.336 0.863 6.937 1.00 0.65 H new ATOM 0 HD12 LEU A 433 8.871 -0.018 7.430 1.00 0.65 H new ATOM 0 HD13 LEU A 433 9.493 -0.184 5.771 1.00 0.65 H new ATOM 0 HD21 LEU A 433 10.181 2.798 5.435 1.00 0.73 H new ATOM 0 HD22 LEU A 433 9.320 1.858 4.193 1.00 0.73 H new ATOM 0 HD23 LEU A 433 8.600 3.353 4.836 1.00 0.73 H new ATOM 568 N GLN A 434 4.043 1.757 7.102 1.00 0.17 N ATOM 569 CA GLN A 434 2.645 1.975 6.848 1.00 0.17 C ATOM 570 C GLN A 434 2.415 3.373 6.325 1.00 0.20 C ATOM 571 O GLN A 434 2.584 4.367 7.034 1.00 0.27 O ATOM 572 CB GLN A 434 1.831 1.701 8.109 1.00 0.18 C ATOM 573 CG GLN A 434 1.498 0.230 8.287 1.00 0.21 C ATOM 574 CD GLN A 434 1.482 -0.200 9.759 1.00 0.38 C ATOM 575 OE1 GLN A 434 2.189 0.386 10.577 1.00 1.26 O ATOM 576 NE2 GLN A 434 0.708 -1.230 10.129 1.00 0.74 N ATOM 0 H GLN A 434 4.405 2.247 7.920 1.00 0.17 H new ATOM 0 HA GLN A 434 2.309 1.279 6.079 1.00 0.17 H new ATOM 0 HB2 GLN A 434 2.388 2.050 8.978 1.00 0.18 H new ATOM 0 HB3 GLN A 434 0.906 2.276 8.071 1.00 0.18 H new ATOM 0 HG2 GLN A 434 0.524 0.026 7.843 1.00 0.21 H new ATOM 0 HG3 GLN A 434 2.228 -0.372 7.745 1.00 0.21 H new ATOM 0 HE21 GLN A 434 0.127 -1.705 9.438 1.00 0.74 H new ATOM 0 HE22 GLN A 434 0.700 -1.538 11.101 1.00 0.74 H new ATOM 585 N PHE A 435 2.020 3.427 5.074 1.00 0.20 N ATOM 586 CA PHE A 435 1.835 4.690 4.377 1.00 0.23 C ATOM 587 C PHE A 435 0.360 4.995 4.214 1.00 0.21 C ATOM 588 O PHE A 435 -0.421 4.146 3.789 1.00 0.24 O ATOM 589 CB PHE A 435 2.516 4.673 3.000 1.00 0.25 C ATOM 590 CG PHE A 435 4.015 4.621 3.049 1.00 0.31 C ATOM 591 CD1 PHE A 435 4.685 3.413 2.962 1.00 0.36 C ATOM 592 CD2 PHE A 435 4.755 5.784 3.200 1.00 0.38 C ATOM 593 CE1 PHE A 435 6.064 3.364 3.023 1.00 0.43 C ATOM 594 CE2 PHE A 435 6.135 5.741 3.261 1.00 0.46 C ATOM 595 CZ PHE A 435 6.791 4.523 3.110 1.00 0.47 C ATOM 0 H PHE A 435 1.817 2.603 4.508 1.00 0.20 H new ATOM 0 HA PHE A 435 2.299 5.470 4.981 1.00 0.23 H new ATOM 0 HB2 PHE A 435 2.153 3.811 2.440 1.00 0.25 H new ATOM 0 HB3 PHE A 435 2.214 5.563 2.448 1.00 0.25 H new ATOM 0 HD1 PHE A 435 4.123 2.498 2.845 1.00 0.36 H new ATOM 0 HD2 PHE A 435 4.247 6.734 3.271 1.00 0.38 H new ATOM 0 HE1 PHE A 435 6.571 2.410 3.002 1.00 0.43 H new ATOM 0 HE2 PHE A 435 6.700 6.646 3.425 1.00 0.46 H new ATOM 0 HZ PHE A 435 7.869 4.491 3.062 1.00 0.47 H new ATOM 605 N ARG A 436 -0.002 6.212 4.571 1.00 0.22 N ATOM 606 CA ARG A 436 -1.373 6.678 4.481 1.00 0.21 C ATOM 607 C ARG A 436 -1.517 7.653 3.321 1.00 0.19 C ATOM 608 O ARG A 436 -0.902 8.720 3.326 1.00 0.27 O ATOM 609 CB ARG A 436 -1.785 7.378 5.778 1.00 0.27 C ATOM 610 CG ARG A 436 -2.008 6.435 6.948 1.00 0.72 C ATOM 611 CD ARG A 436 -2.072 7.184 8.271 1.00 0.74 C ATOM 612 NE ARG A 436 -0.859 7.963 8.525 1.00 1.52 N ATOM 613 CZ ARG A 436 -0.255 8.047 9.710 1.00 2.15 C ATOM 614 NH1 ARG A 436 -0.731 7.380 10.756 1.00 2.32 N ATOM 615 NH2 ARG A 436 0.830 8.799 9.847 1.00 3.14 N ATOM 0 H ARG A 436 0.649 6.909 4.933 1.00 0.22 H new ATOM 0 HA ARG A 436 -2.019 5.815 4.317 1.00 0.21 H new ATOM 0 HB2 ARG A 436 -1.015 8.100 6.049 1.00 0.27 H new ATOM 0 HB3 ARG A 436 -2.701 7.941 5.599 1.00 0.27 H new ATOM 0 HG2 ARG A 436 -2.935 5.882 6.798 1.00 0.72 H new ATOM 0 HG3 ARG A 436 -1.202 5.702 6.983 1.00 0.72 H new ATOM 0 HD2 ARG A 436 -2.935 7.850 8.268 1.00 0.74 H new ATOM 0 HD3 ARG A 436 -2.221 6.472 9.083 1.00 0.74 H new ATOM 0 HE ARG A 436 -0.449 8.475 7.744 1.00 1.52 H new ATOM 0 HH11 ARG A 436 -1.563 6.799 10.655 1.00 2.32 H new ATOM 0 HH12 ARG A 436 -0.264 7.449 11.660 1.00 2.32 H new ATOM 0 HH21 ARG A 436 1.200 9.311 9.046 1.00 3.14 H new ATOM 0 HH22 ARG A 436 1.294 8.865 10.753 1.00 3.14 H new ATOM 629 N VAL A 437 -2.300 7.283 2.327 1.00 0.17 N ATOM 630 CA VAL A 437 -2.606 8.180 1.232 1.00 0.16 C ATOM 631 C VAL A 437 -4.097 8.407 1.153 1.00 0.16 C ATOM 632 O VAL A 437 -4.898 7.566 1.577 1.00 0.17 O ATOM 633 CB VAL A 437 -2.085 7.681 -0.135 1.00 0.16 C ATOM 634 CG1 VAL A 437 -0.573 7.549 -0.121 1.00 0.20 C ATOM 635 CG2 VAL A 437 -2.740 6.370 -0.535 1.00 0.14 C ATOM 0 H VAL A 437 -2.737 6.364 2.256 1.00 0.17 H new ATOM 0 HA VAL A 437 -2.088 9.115 1.445 1.00 0.16 H new ATOM 0 HB VAL A 437 -2.356 8.426 -0.883 1.00 0.16 H new ATOM 0 HG11 VAL A 437 -0.230 7.196 -1.094 1.00 0.20 H new ATOM 0 HG12 VAL A 437 -0.125 8.520 0.092 1.00 0.20 H new ATOM 0 HG13 VAL A 437 -0.277 6.836 0.649 1.00 0.20 H new ATOM 0 HG21 VAL A 437 -2.350 6.048 -1.501 1.00 0.14 H new ATOM 0 HG22 VAL A 437 -2.522 5.610 0.216 1.00 0.14 H new ATOM 0 HG23 VAL A 437 -3.819 6.509 -0.607 1.00 0.14 H new ATOM 645 N PRO A 438 -4.460 9.567 0.620 1.00 0.17 N ATOM 646 CA PRO A 438 -5.845 10.012 0.498 1.00 0.18 C ATOM 647 C PRO A 438 -6.737 8.930 -0.115 1.00 0.16 C ATOM 648 O PRO A 438 -6.329 8.225 -1.039 1.00 0.14 O ATOM 649 CB PRO A 438 -5.715 11.231 -0.440 1.00 0.19 C ATOM 650 CG PRO A 438 -4.352 11.754 -0.145 1.00 0.21 C ATOM 651 CD PRO A 438 -3.508 10.553 0.100 1.00 0.19 C ATOM 0 HA PRO A 438 -6.311 10.242 1.456 1.00 0.18 H new ATOM 0 HB2 PRO A 438 -5.817 10.944 -1.487 1.00 0.19 H new ATOM 0 HB3 PRO A 438 -6.484 11.977 -0.237 1.00 0.19 H new ATOM 0 HG2 PRO A 438 -3.968 12.340 -0.980 1.00 0.21 H new ATOM 0 HG3 PRO A 438 -4.363 12.410 0.726 1.00 0.21 H new ATOM 0 HD2 PRO A 438 -3.029 10.205 -0.815 1.00 0.19 H new ATOM 0 HD3 PRO A 438 -2.713 10.760 0.816 1.00 0.19 H new ATOM 659 N GLY A 439 -7.958 8.824 0.391 1.00 0.19 N ATOM 660 CA GLY A 439 -8.833 7.726 0.047 1.00 0.20 C ATOM 661 C GLY A 439 -9.321 7.727 -1.388 1.00 0.18 C ATOM 662 O GLY A 439 -9.989 6.785 -1.812 1.00 0.20 O ATOM 0 H GLY A 439 -8.362 9.494 1.046 1.00 0.19 H new ATOM 0 HA2 GLY A 439 -8.309 6.789 0.237 1.00 0.20 H new ATOM 0 HA3 GLY A 439 -9.698 7.748 0.710 1.00 0.20 H new ATOM 666 N THR A 440 -9.043 8.781 -2.132 1.00 0.16 N ATOM 667 CA THR A 440 -9.411 8.797 -3.530 1.00 0.18 C ATOM 668 C THR A 440 -8.201 8.483 -4.429 1.00 0.16 C ATOM 669 O THR A 440 -8.360 8.132 -5.601 1.00 0.19 O ATOM 670 CB THR A 440 -10.018 10.152 -3.928 1.00 0.24 C ATOM 671 OG1 THR A 440 -9.188 11.225 -3.454 1.00 0.27 O ATOM 672 CG2 THR A 440 -11.423 10.298 -3.363 1.00 0.29 C ATOM 0 H THR A 440 -8.572 9.622 -1.797 1.00 0.16 H new ATOM 0 HA THR A 440 -10.163 8.021 -3.675 1.00 0.18 H new ATOM 0 HB THR A 440 -10.073 10.196 -5.016 1.00 0.24 H new ATOM 0 HG1 THR A 440 -9.583 12.083 -3.714 1.00 0.27 H new ATOM 0 HG21 THR A 440 -11.835 11.264 -3.656 1.00 0.29 H new ATOM 0 HG22 THR A 440 -12.056 9.501 -3.752 1.00 0.29 H new ATOM 0 HG23 THR A 440 -11.386 10.234 -2.275 1.00 0.29 H new ATOM 680 N SER A 441 -6.992 8.634 -3.874 1.00 0.13 N ATOM 681 CA SER A 441 -5.755 8.308 -4.576 1.00 0.12 C ATOM 682 C SER A 441 -5.698 6.831 -4.952 1.00 0.11 C ATOM 683 O SER A 441 -6.135 5.971 -4.197 1.00 0.12 O ATOM 684 CB SER A 441 -4.560 8.648 -3.684 1.00 0.13 C ATOM 685 OG SER A 441 -4.510 10.037 -3.399 1.00 0.16 O ATOM 0 H SER A 441 -6.849 8.985 -2.927 1.00 0.13 H new ATOM 0 HA SER A 441 -5.722 8.895 -5.494 1.00 0.12 H new ATOM 0 HB2 SER A 441 -4.626 8.085 -2.753 1.00 0.13 H new ATOM 0 HB3 SER A 441 -3.637 8.342 -4.176 1.00 0.13 H new ATOM 0 HG SER A 441 -3.658 10.251 -2.964 1.00 0.16 H new ATOM 691 N THR A 442 -5.156 6.537 -6.121 1.00 0.10 N ATOM 692 CA THR A 442 -5.037 5.162 -6.569 1.00 0.12 C ATOM 693 C THR A 442 -3.593 4.824 -6.927 1.00 0.13 C ATOM 694 O THR A 442 -3.320 3.826 -7.592 1.00 0.16 O ATOM 695 CB THR A 442 -5.980 4.871 -7.756 1.00 0.13 C ATOM 696 OG1 THR A 442 -5.913 5.936 -8.713 1.00 0.14 O ATOM 697 CG2 THR A 442 -7.415 4.709 -7.269 1.00 0.17 C ATOM 0 H THR A 442 -4.793 7.230 -6.775 1.00 0.10 H new ATOM 0 HA THR A 442 -5.339 4.521 -5.741 1.00 0.12 H new ATOM 0 HB THR A 442 -5.661 3.943 -8.229 1.00 0.13 H new ATOM 0 HG1 THR A 442 -6.513 5.741 -9.462 1.00 0.14 H new ATOM 0 HG21 THR A 442 -8.067 4.504 -8.118 1.00 0.17 H new ATOM 0 HG22 THR A 442 -7.468 3.880 -6.563 1.00 0.17 H new ATOM 0 HG23 THR A 442 -7.738 5.626 -6.777 1.00 0.17 H new ATOM 705 N SER A 443 -2.670 5.674 -6.487 1.00 0.12 N ATOM 706 CA SER A 443 -1.242 5.467 -6.708 1.00 0.15 C ATOM 707 C SER A 443 -0.453 6.273 -5.683 1.00 0.15 C ATOM 708 O SER A 443 -0.875 7.360 -5.286 1.00 0.19 O ATOM 709 CB SER A 443 -0.826 5.885 -8.123 1.00 0.17 C ATOM 710 OG SER A 443 -1.633 5.270 -9.114 1.00 1.08 O ATOM 0 H SER A 443 -2.890 6.524 -5.968 1.00 0.12 H new ATOM 0 HA SER A 443 -1.029 4.404 -6.596 1.00 0.15 H new ATOM 0 HB2 SER A 443 -0.898 6.969 -8.217 1.00 0.17 H new ATOM 0 HB3 SER A 443 0.218 5.619 -8.288 1.00 0.17 H new ATOM 0 HG SER A 443 -2.100 4.501 -8.725 1.00 1.08 H new ATOM 716 N ALA A 444 0.672 5.734 -5.246 1.00 0.14 N ATOM 717 CA ALA A 444 1.497 6.395 -4.243 1.00 0.15 C ATOM 718 C ALA A 444 2.951 6.115 -4.437 1.00 0.16 C ATOM 719 O ALA A 444 3.368 4.991 -4.702 1.00 0.15 O ATOM 720 CB ALA A 444 1.082 5.980 -2.844 1.00 0.16 C ATOM 0 H ALA A 444 1.038 4.838 -5.569 1.00 0.14 H new ATOM 0 HA ALA A 444 1.340 7.467 -4.365 1.00 0.15 H new ATOM 0 HB1 ALA A 444 1.712 6.486 -2.112 1.00 0.16 H new ATOM 0 HB2 ALA A 444 0.040 6.254 -2.677 1.00 0.16 H new ATOM 0 HB3 ALA A 444 1.195 4.901 -2.736 1.00 0.16 H new ATOM 726 N THR A 445 3.708 7.174 -4.325 1.00 0.24 N ATOM 727 CA THR A 445 5.131 7.094 -4.295 1.00 0.25 C ATOM 728 C THR A 445 5.609 6.857 -2.882 1.00 0.26 C ATOM 729 O THR A 445 5.496 7.714 -2.003 1.00 0.33 O ATOM 730 CB THR A 445 5.728 8.378 -4.847 1.00 0.31 C ATOM 731 OG1 THR A 445 5.370 8.530 -6.231 1.00 0.34 O ATOM 732 CG2 THR A 445 7.244 8.381 -4.690 1.00 0.34 C ATOM 0 H THR A 445 3.343 8.124 -4.252 1.00 0.24 H new ATOM 0 HA THR A 445 5.456 6.258 -4.914 1.00 0.25 H new ATOM 0 HB THR A 445 5.326 9.218 -4.281 1.00 0.31 H new ATOM 0 HG1 THR A 445 5.757 9.360 -6.580 1.00 0.34 H new ATOM 0 HG21 THR A 445 7.650 9.309 -5.092 1.00 0.34 H new ATOM 0 HG22 THR A 445 7.501 8.300 -3.634 1.00 0.34 H new ATOM 0 HG23 THR A 445 7.668 7.535 -5.232 1.00 0.34 H new ATOM 740 N LEU A 446 6.121 5.673 -2.676 1.00 0.22 N ATOM 741 CA LEU A 446 6.517 5.237 -1.352 1.00 0.25 C ATOM 742 C LEU A 446 7.965 5.587 -1.033 1.00 0.24 C ATOM 743 O LEU A 446 8.895 4.889 -1.430 1.00 0.23 O ATOM 744 CB LEU A 446 6.243 3.723 -1.191 1.00 0.25 C ATOM 745 CG LEU A 446 4.879 3.362 -0.553 1.00 0.32 C ATOM 746 CD1 LEU A 446 3.758 4.177 -1.172 1.00 0.65 C ATOM 747 CD2 LEU A 446 4.587 1.876 -0.729 1.00 0.59 C ATOM 0 H LEU A 446 6.277 4.984 -3.411 1.00 0.22 H new ATOM 0 HA LEU A 446 5.912 5.779 -0.626 1.00 0.25 H new ATOM 0 HB2 LEU A 446 6.302 3.253 -2.173 1.00 0.25 H new ATOM 0 HB3 LEU A 446 7.036 3.290 -0.582 1.00 0.25 H new ATOM 0 HG LEU A 446 4.935 3.595 0.510 1.00 0.32 H new ATOM 0 HD11 LEU A 446 2.811 3.905 -0.707 1.00 0.65 H new ATOM 0 HD12 LEU A 446 3.949 5.238 -1.013 1.00 0.65 H new ATOM 0 HD13 LEU A 446 3.708 3.974 -2.242 1.00 0.65 H new ATOM 0 HD21 LEU A 446 3.625 1.638 -0.275 1.00 0.59 H new ATOM 0 HD22 LEU A 446 4.557 1.634 -1.791 1.00 0.59 H new ATOM 0 HD23 LEU A 446 5.370 1.292 -0.246 1.00 0.59 H new ATOM 759 N THR A 447 8.129 6.685 -0.302 1.00 0.30 N ATOM 760 CA THR A 447 9.439 7.157 0.131 1.00 0.30 C ATOM 761 C THR A 447 9.837 6.549 1.469 1.00 0.29 C ATOM 762 O THR A 447 9.155 6.731 2.477 1.00 0.36 O ATOM 763 CB THR A 447 9.439 8.686 0.291 1.00 0.39 C ATOM 764 OG1 THR A 447 8.146 9.135 0.719 1.00 0.86 O ATOM 765 CG2 THR A 447 9.830 9.386 -0.993 1.00 0.60 C ATOM 0 H THR A 447 7.355 7.274 0.007 1.00 0.30 H new ATOM 0 HA THR A 447 10.151 6.853 -0.636 1.00 0.30 H new ATOM 0 HB THR A 447 10.183 8.939 1.047 1.00 0.39 H new ATOM 0 HG1 THR A 447 8.155 10.110 0.820 1.00 0.86 H new ATOM 0 HG21 THR A 447 9.818 10.465 -0.838 1.00 0.60 H new ATOM 0 HG22 THR A 447 10.832 9.073 -1.287 1.00 0.60 H new ATOM 0 HG23 THR A 447 9.122 9.125 -1.780 1.00 0.60 H new ATOM 773 N GLY A 448 10.940 5.828 1.474 1.00 0.30 N ATOM 774 CA GLY A 448 11.490 5.342 2.725 1.00 0.38 C ATOM 775 C GLY A 448 12.098 3.961 2.613 1.00 0.30 C ATOM 776 O GLY A 448 13.051 3.646 3.326 1.00 0.38 O ATOM 0 H GLY A 448 11.467 5.568 0.640 1.00 0.30 H new ATOM 0 HA2 GLY A 448 12.251 6.040 3.075 1.00 0.38 H new ATOM 0 HA3 GLY A 448 10.702 5.325 3.478 1.00 0.38 H new ATOM 780 N LEU A 449 11.539 3.142 1.727 1.00 0.28 N ATOM 781 CA LEU A 449 11.993 1.772 1.525 1.00 0.25 C ATOM 782 C LEU A 449 13.503 1.672 1.370 1.00 0.25 C ATOM 783 O LEU A 449 14.118 2.391 0.578 1.00 0.34 O ATOM 784 CB LEU A 449 11.297 1.164 0.313 1.00 0.24 C ATOM 785 CG LEU A 449 9.771 1.088 0.414 1.00 0.21 C ATOM 786 CD1 LEU A 449 9.179 0.496 -0.848 1.00 0.27 C ATOM 787 CD2 LEU A 449 9.360 0.257 1.611 1.00 0.23 C ATOM 0 H LEU A 449 10.758 3.411 1.129 1.00 0.28 H new ATOM 0 HA LEU A 449 11.728 1.210 2.421 1.00 0.25 H new ATOM 0 HB2 LEU A 449 11.559 1.749 -0.569 1.00 0.24 H new ATOM 0 HB3 LEU A 449 11.686 0.158 0.156 1.00 0.24 H new ATOM 0 HG LEU A 449 9.390 2.102 0.538 1.00 0.21 H new ATOM 0 HD11 LEU A 449 8.094 0.451 -0.755 1.00 0.27 H new ATOM 0 HD12 LEU A 449 9.444 1.120 -1.702 1.00 0.27 H new ATOM 0 HD13 LEU A 449 9.572 -0.510 -0.997 1.00 0.27 H new ATOM 0 HD21 LEU A 449 8.272 0.214 1.668 1.00 0.23 H new ATOM 0 HD22 LEU A 449 9.759 -0.752 1.507 1.00 0.23 H new ATOM 0 HD23 LEU A 449 9.753 0.711 2.521 1.00 0.23 H new ATOM 799 N THR A 450 14.083 0.780 2.157 1.00 0.22 N ATOM 800 CA THR A 450 15.503 0.505 2.113 1.00 0.23 C ATOM 801 C THR A 450 15.809 -0.414 0.961 1.00 0.22 C ATOM 802 O THR A 450 15.504 -1.605 0.975 1.00 0.38 O ATOM 803 CB THR A 450 15.972 -0.140 3.430 1.00 0.27 C ATOM 804 OG1 THR A 450 15.512 0.634 4.548 1.00 0.32 O ATOM 805 CG2 THR A 450 17.484 -0.274 3.492 1.00 0.34 C ATOM 0 H THR A 450 13.576 0.225 2.847 1.00 0.22 H new ATOM 0 HA THR A 450 16.034 1.447 1.978 1.00 0.23 H new ATOM 0 HB THR A 450 15.545 -1.142 3.471 1.00 0.27 H new ATOM 0 HG1 THR A 450 15.163 0.034 5.240 1.00 0.32 H new ATOM 0 HG21 THR A 450 17.770 -0.734 4.438 1.00 0.34 H new ATOM 0 HG22 THR A 450 17.828 -0.897 2.667 1.00 0.34 H new ATOM 0 HG23 THR A 450 17.940 0.713 3.416 1.00 0.34 H new ATOM 813 N ARG A 451 16.368 0.192 -0.050 1.00 0.29 N ATOM 814 CA ARG A 451 16.819 -0.504 -1.224 1.00 0.26 C ATOM 815 C ARG A 451 17.707 -1.682 -0.882 1.00 0.26 C ATOM 816 O ARG A 451 18.649 -1.582 -0.099 1.00 0.30 O ATOM 817 CB ARG A 451 17.522 0.479 -2.133 1.00 0.31 C ATOM 818 CG ARG A 451 18.713 1.103 -1.470 1.00 0.32 C ATOM 819 CD ARG A 451 19.152 2.371 -2.164 1.00 0.43 C ATOM 820 NE ARG A 451 20.436 2.859 -1.655 1.00 1.32 N ATOM 821 CZ ARG A 451 20.932 4.071 -1.905 1.00 1.75 C ATOM 822 NH1 ARG A 451 20.248 4.937 -2.641 1.00 1.39 N ATOM 823 NH2 ARG A 451 22.112 4.419 -1.412 1.00 2.70 N ATOM 0 H ARG A 451 16.526 1.199 -0.082 1.00 0.29 H new ATOM 0 HA ARG A 451 15.955 -0.921 -1.741 1.00 0.26 H new ATOM 0 HB2 ARG A 451 17.839 -0.031 -3.043 1.00 0.31 H new ATOM 0 HB3 ARG A 451 16.823 1.260 -2.432 1.00 0.31 H new ATOM 0 HG2 ARG A 451 18.474 1.324 -0.430 1.00 0.32 H new ATOM 0 HG3 ARG A 451 19.538 0.390 -1.463 1.00 0.32 H new ATOM 0 HD2 ARG A 451 19.233 2.188 -3.236 1.00 0.43 H new ATOM 0 HD3 ARG A 451 18.392 3.140 -2.028 1.00 0.43 H new ATOM 0 HE ARG A 451 20.987 2.230 -1.071 1.00 1.32 H new ATOM 0 HH11 ARG A 451 19.337 4.677 -3.019 1.00 1.39 H new ATOM 0 HH12 ARG A 451 20.633 5.863 -2.829 1.00 1.39 H new ATOM 0 HH21 ARG A 451 22.641 3.759 -0.841 1.00 2.70 H new ATOM 0 HH22 ARG A 451 22.491 5.346 -1.603 1.00 2.70 H new ATOM 837 N GLY A 452 17.349 -2.802 -1.461 1.00 0.28 N ATOM 838 CA GLY A 452 18.042 -4.031 -1.227 1.00 0.34 C ATOM 839 C GLY A 452 17.230 -4.967 -0.359 1.00 0.32 C ATOM 840 O GLY A 452 17.477 -6.175 -0.317 1.00 0.41 O ATOM 0 H GLY A 452 16.565 -2.880 -2.109 1.00 0.28 H new ATOM 0 HA2 GLY A 452 18.261 -4.514 -2.179 1.00 0.34 H new ATOM 0 HA3 GLY A 452 18.999 -3.825 -0.747 1.00 0.34 H new ATOM 844 N ALA A 453 16.244 -4.398 0.317 1.00 0.32 N ATOM 845 CA ALA A 453 15.374 -5.153 1.197 1.00 0.31 C ATOM 846 C ALA A 453 14.076 -5.472 0.509 1.00 0.27 C ATOM 847 O ALA A 453 13.560 -4.707 -0.310 1.00 0.35 O ATOM 848 CB ALA A 453 15.131 -4.384 2.489 1.00 0.32 C ATOM 0 H ALA A 453 16.027 -3.402 0.270 1.00 0.32 H new ATOM 0 HA ALA A 453 15.863 -6.094 1.447 1.00 0.31 H new ATOM 0 HB1 ALA A 453 14.476 -4.963 3.140 1.00 0.32 H new ATOM 0 HB2 ALA A 453 16.082 -4.210 2.993 1.00 0.32 H new ATOM 0 HB3 ALA A 453 14.661 -3.427 2.260 1.00 0.32 H new ATOM 854 N THR A 454 13.599 -6.638 0.833 1.00 0.23 N ATOM 855 CA THR A 454 12.371 -7.156 0.315 1.00 0.21 C ATOM 856 C THR A 454 11.194 -6.649 1.138 1.00 0.17 C ATOM 857 O THR A 454 11.190 -6.768 2.361 1.00 0.19 O ATOM 858 CB THR A 454 12.442 -8.677 0.383 1.00 0.22 C ATOM 859 OG1 THR A 454 13.450 -9.160 -0.500 1.00 0.29 O ATOM 860 CG2 THR A 454 11.109 -9.315 0.020 1.00 0.24 C ATOM 0 H THR A 454 14.067 -7.270 1.482 1.00 0.23 H new ATOM 0 HA THR A 454 12.227 -6.827 -0.714 1.00 0.21 H new ATOM 0 HB THR A 454 12.686 -8.949 1.410 1.00 0.22 H new ATOM 0 HG1 THR A 454 13.206 -8.944 -1.424 1.00 0.29 H new ATOM 0 HG21 THR A 454 11.197 -10.400 0.079 1.00 0.24 H new ATOM 0 HG22 THR A 454 10.341 -8.975 0.715 1.00 0.24 H new ATOM 0 HG23 THR A 454 10.833 -9.028 -0.995 1.00 0.24 H new ATOM 868 N TYR A 455 10.211 -6.067 0.478 1.00 0.16 N ATOM 869 CA TYR A 455 9.032 -5.576 1.164 1.00 0.16 C ATOM 870 C TYR A 455 7.769 -6.175 0.561 1.00 0.13 C ATOM 871 O TYR A 455 7.499 -6.015 -0.630 1.00 0.15 O ATOM 872 CB TYR A 455 8.966 -4.046 1.114 1.00 0.23 C ATOM 873 CG TYR A 455 10.062 -3.356 1.898 1.00 0.22 C ATOM 874 CD1 TYR A 455 9.919 -3.105 3.257 1.00 0.20 C ATOM 875 CD2 TYR A 455 11.238 -2.954 1.279 1.00 0.28 C ATOM 876 CE1 TYR A 455 10.919 -2.474 3.976 1.00 0.22 C ATOM 877 CE2 TYR A 455 12.241 -2.324 1.990 1.00 0.30 C ATOM 878 CZ TYR A 455 12.077 -2.088 3.338 1.00 0.26 C ATOM 879 OH TYR A 455 13.077 -1.458 4.048 1.00 0.29 O ATOM 0 H TYR A 455 10.206 -5.923 -0.532 1.00 0.16 H new ATOM 0 HA TYR A 455 9.101 -5.884 2.207 1.00 0.16 H new ATOM 0 HB2 TYR A 455 9.020 -3.724 0.074 1.00 0.23 H new ATOM 0 HB3 TYR A 455 7.999 -3.722 1.499 1.00 0.23 H new ATOM 0 HD1 TYR A 455 9.013 -3.407 3.761 1.00 0.20 H new ATOM 0 HD2 TYR A 455 11.371 -3.137 0.223 1.00 0.28 H new ATOM 0 HE1 TYR A 455 10.792 -2.285 5.032 1.00 0.22 H new ATOM 0 HE2 TYR A 455 13.149 -2.018 1.492 1.00 0.30 H new ATOM 0 HH TYR A 455 13.384 -2.044 4.771 1.00 0.29 H new ATOM 889 N ASN A 456 7.024 -6.893 1.383 1.00 0.12 N ATOM 890 CA ASN A 456 5.723 -7.400 0.992 1.00 0.12 C ATOM 891 C ASN A 456 4.714 -6.292 1.168 1.00 0.13 C ATOM 892 O ASN A 456 4.319 -5.955 2.286 1.00 0.15 O ATOM 893 CB ASN A 456 5.333 -8.623 1.828 1.00 0.14 C ATOM 894 CG ASN A 456 4.144 -9.381 1.233 1.00 0.17 C ATOM 895 OD1 ASN A 456 3.845 -9.237 0.048 1.00 0.17 O ATOM 896 ND2 ASN A 456 3.475 -10.230 2.022 1.00 0.20 N ATOM 0 H ASN A 456 7.302 -7.139 2.333 1.00 0.12 H new ATOM 0 HA ASN A 456 5.752 -7.719 -0.050 1.00 0.12 H new ATOM 0 HB2 ASN A 456 6.188 -9.295 1.904 1.00 0.14 H new ATOM 0 HB3 ASN A 456 5.087 -8.304 2.841 1.00 0.14 H new ATOM 0 HD21 ASN A 456 2.700 -10.774 1.644 1.00 0.20 H new ATOM 0 HD22 ASN A 456 3.741 -10.333 3.001 1.00 0.20 H new ATOM 903 N ILE A 457 4.339 -5.710 0.054 1.00 0.13 N ATOM 904 CA ILE A 457 3.515 -4.528 0.042 1.00 0.14 C ATOM 905 C ILE A 457 2.044 -4.901 0.002 1.00 0.14 C ATOM 906 O ILE A 457 1.556 -5.467 -0.977 1.00 0.18 O ATOM 907 CB ILE A 457 3.876 -3.640 -1.162 1.00 0.16 C ATOM 908 CG1 ILE A 457 5.314 -3.123 -1.028 1.00 0.19 C ATOM 909 CG2 ILE A 457 2.890 -2.477 -1.296 1.00 0.18 C ATOM 910 CD1 ILE A 457 5.709 -2.113 -2.087 1.00 0.22 C ATOM 0 H ILE A 457 4.599 -6.046 -0.873 1.00 0.13 H new ATOM 0 HA ILE A 457 3.701 -3.968 0.958 1.00 0.14 H new ATOM 0 HB ILE A 457 3.808 -4.242 -2.068 1.00 0.16 H new ATOM 0 HG12 ILE A 457 5.435 -2.669 -0.045 1.00 0.19 H new ATOM 0 HG13 ILE A 457 5.999 -3.970 -1.075 1.00 0.19 H new ATOM 0 HG21 ILE A 457 3.166 -1.863 -2.154 1.00 0.18 H new ATOM 0 HG22 ILE A 457 1.883 -2.869 -1.438 1.00 0.18 H new ATOM 0 HG23 ILE A 457 2.919 -1.870 -0.391 1.00 0.18 H new ATOM 0 HD11 ILE A 457 6.739 -1.797 -1.922 1.00 0.22 H new ATOM 0 HD12 ILE A 457 5.622 -2.568 -3.074 1.00 0.22 H new ATOM 0 HD13 ILE A 457 5.050 -1.247 -2.028 1.00 0.22 H new ATOM 922 N ILE A 458 1.353 -4.595 1.080 1.00 0.16 N ATOM 923 CA ILE A 458 -0.056 -4.903 1.202 1.00 0.18 C ATOM 924 C ILE A 458 -0.843 -3.624 1.405 1.00 0.20 C ATOM 925 O ILE A 458 -0.526 -2.830 2.283 1.00 0.29 O ATOM 926 CB ILE A 458 -0.312 -5.869 2.369 1.00 0.22 C ATOM 927 CG1 ILE A 458 0.351 -7.211 2.080 1.00 0.21 C ATOM 928 CG2 ILE A 458 -1.800 -6.052 2.603 1.00 0.29 C ATOM 929 CD1 ILE A 458 0.095 -8.253 3.133 1.00 0.27 C ATOM 0 H ILE A 458 1.751 -4.127 1.894 1.00 0.16 H new ATOM 0 HA ILE A 458 -0.383 -5.389 0.283 1.00 0.18 H new ATOM 0 HB ILE A 458 0.120 -5.445 3.275 1.00 0.22 H new ATOM 0 HG12 ILE A 458 -0.006 -7.583 1.120 1.00 0.21 H new ATOM 0 HG13 ILE A 458 1.426 -7.061 1.984 1.00 0.21 H new ATOM 0 HG21 ILE A 458 -1.956 -6.740 3.434 1.00 0.29 H new ATOM 0 HG22 ILE A 458 -2.252 -5.089 2.840 1.00 0.29 H new ATOM 0 HG23 ILE A 458 -2.262 -6.459 1.704 1.00 0.29 H new ATOM 0 HD11 ILE A 458 0.598 -9.180 2.858 1.00 0.27 H new ATOM 0 HD12 ILE A 458 0.478 -7.903 4.092 1.00 0.27 H new ATOM 0 HD13 ILE A 458 -0.977 -8.433 3.214 1.00 0.27 H new ATOM 941 N VAL A 459 -1.856 -3.416 0.591 1.00 0.17 N ATOM 942 CA VAL A 459 -2.629 -2.194 0.650 1.00 0.18 C ATOM 943 C VAL A 459 -4.004 -2.484 1.219 1.00 0.18 C ATOM 944 O VAL A 459 -4.746 -3.302 0.674 1.00 0.23 O ATOM 945 CB VAL A 459 -2.776 -1.548 -0.743 1.00 0.19 C ATOM 946 CG1 VAL A 459 -3.398 -0.164 -0.640 1.00 0.20 C ATOM 947 CG2 VAL A 459 -1.435 -1.490 -1.463 1.00 0.20 C ATOM 0 H VAL A 459 -2.164 -4.079 -0.121 1.00 0.17 H new ATOM 0 HA VAL A 459 -2.098 -1.494 1.295 1.00 0.18 H new ATOM 0 HB VAL A 459 -3.446 -2.174 -1.332 1.00 0.19 H new ATOM 0 HG11 VAL A 459 -3.490 0.269 -1.636 1.00 0.20 H new ATOM 0 HG12 VAL A 459 -4.386 -0.242 -0.185 1.00 0.20 H new ATOM 0 HG13 VAL A 459 -2.765 0.475 -0.024 1.00 0.20 H new ATOM 0 HG21 VAL A 459 -1.567 -1.030 -2.442 1.00 0.20 H new ATOM 0 HG22 VAL A 459 -0.732 -0.898 -0.876 1.00 0.20 H new ATOM 0 HG23 VAL A 459 -1.044 -2.500 -1.586 1.00 0.20 H new ATOM 957 N GLU A 460 -4.328 -1.825 2.315 1.00 0.18 N ATOM 958 CA GLU A 460 -5.607 -2.023 2.971 1.00 0.22 C ATOM 959 C GLU A 460 -6.407 -0.730 2.931 1.00 0.21 C ATOM 960 O GLU A 460 -5.912 0.334 3.304 1.00 0.30 O ATOM 961 CB GLU A 460 -5.408 -2.480 4.419 1.00 0.30 C ATOM 962 CG GLU A 460 -4.669 -3.805 4.562 1.00 0.36 C ATOM 963 CD GLU A 460 -4.401 -4.165 6.010 1.00 0.60 C ATOM 964 OE1 GLU A 460 -3.295 -3.864 6.506 1.00 0.79 O ATOM 965 OE2 GLU A 460 -5.295 -4.753 6.659 1.00 0.82 O ATOM 0 H GLU A 460 -3.720 -1.145 2.772 1.00 0.18 H new ATOM 0 HA GLU A 460 -6.156 -2.802 2.442 1.00 0.22 H new ATOM 0 HB2 GLU A 460 -4.857 -1.710 4.958 1.00 0.30 H new ATOM 0 HB3 GLU A 460 -6.383 -2.568 4.897 1.00 0.30 H new ATOM 0 HG2 GLU A 460 -5.256 -4.597 4.096 1.00 0.36 H new ATOM 0 HG3 GLU A 460 -3.723 -3.750 4.023 1.00 0.36 H new ATOM 972 N ALA A 461 -7.635 -0.827 2.460 1.00 0.16 N ATOM 973 CA ALA A 461 -8.498 0.332 2.331 1.00 0.15 C ATOM 974 C ALA A 461 -9.250 0.602 3.614 1.00 0.14 C ATOM 975 O ALA A 461 -10.037 -0.224 4.075 1.00 0.17 O ATOM 976 CB ALA A 461 -9.475 0.144 1.187 1.00 0.16 C ATOM 0 H ALA A 461 -8.060 -1.704 2.158 1.00 0.16 H new ATOM 0 HA ALA A 461 -7.865 1.193 2.119 1.00 0.15 H new ATOM 0 HB1 ALA A 461 -10.114 1.023 1.106 1.00 0.16 H new ATOM 0 HB2 ALA A 461 -8.924 0.009 0.256 1.00 0.16 H new ATOM 0 HB3 ALA A 461 -10.091 -0.736 1.375 1.00 0.16 H new ATOM 982 N LEU A 462 -8.996 1.761 4.179 1.00 0.16 N ATOM 983 CA LEU A 462 -9.676 2.204 5.371 1.00 0.20 C ATOM 984 C LEU A 462 -10.992 2.860 4.958 1.00 0.22 C ATOM 985 O LEU A 462 -11.007 3.985 4.469 1.00 0.24 O ATOM 986 CB LEU A 462 -8.780 3.178 6.136 1.00 0.25 C ATOM 987 CG LEU A 462 -8.945 3.176 7.655 1.00 0.34 C ATOM 988 CD1 LEU A 462 -8.186 4.316 8.285 1.00 0.85 C ATOM 989 CD2 LEU A 462 -10.395 3.236 8.066 1.00 0.78 C ATOM 0 H LEU A 462 -8.309 2.424 3.821 1.00 0.16 H new ATOM 0 HA LEU A 462 -9.893 1.364 6.031 1.00 0.20 H new ATOM 0 HB2 LEU A 462 -7.741 2.948 5.901 1.00 0.25 H new ATOM 0 HB3 LEU A 462 -8.974 4.186 5.769 1.00 0.25 H new ATOM 0 HG LEU A 462 -8.531 2.234 8.014 1.00 0.34 H new ATOM 0 HD11 LEU A 462 -8.321 4.290 9.366 1.00 0.85 H new ATOM 0 HD12 LEU A 462 -7.126 4.221 8.050 1.00 0.85 H new ATOM 0 HD13 LEU A 462 -8.561 5.262 7.895 1.00 0.85 H new ATOM 0 HD21 LEU A 462 -10.465 3.232 9.154 1.00 0.78 H new ATOM 0 HD22 LEU A 462 -10.846 4.148 7.676 1.00 0.78 H new ATOM 0 HD23 LEU A 462 -10.923 2.370 7.666 1.00 0.78 H new ATOM 1001 N LYS A 463 -12.082 2.132 5.127 1.00 0.23 N ATOM 1002 CA LYS A 463 -13.400 2.578 4.710 1.00 0.30 C ATOM 1003 C LYS A 463 -14.370 2.366 5.856 1.00 0.40 C ATOM 1004 O LYS A 463 -14.865 1.251 6.044 1.00 0.50 O ATOM 1005 CB LYS A 463 -13.837 1.780 3.467 1.00 0.31 C ATOM 1006 CG LYS A 463 -15.174 2.198 2.847 1.00 0.38 C ATOM 1007 CD LYS A 463 -14.999 3.054 1.603 1.00 0.42 C ATOM 1008 CE LYS A 463 -16.343 3.483 1.043 1.00 0.95 C ATOM 1009 NZ LYS A 463 -17.238 2.321 0.805 1.00 1.62 N ATOM 0 H LYS A 463 -12.077 1.209 5.560 1.00 0.23 H new ATOM 0 HA LYS A 463 -13.382 3.637 4.451 1.00 0.30 H new ATOM 0 HB2 LYS A 463 -13.061 1.872 2.707 1.00 0.31 H new ATOM 0 HB3 LYS A 463 -13.896 0.726 3.737 1.00 0.31 H new ATOM 0 HG2 LYS A 463 -15.747 1.306 2.592 1.00 0.38 H new ATOM 0 HG3 LYS A 463 -15.756 2.751 3.585 1.00 0.38 H new ATOM 0 HD2 LYS A 463 -14.404 3.935 1.844 1.00 0.42 H new ATOM 0 HD3 LYS A 463 -14.448 2.494 0.847 1.00 0.42 H new ATOM 0 HE2 LYS A 463 -16.822 4.174 1.736 1.00 0.95 H new ATOM 0 HE3 LYS A 463 -16.192 4.023 0.108 1.00 0.95 H new ATOM 0 HZ1 LYS A 463 -18.031 2.612 0.198 1.00 1.62 H new ATOM 0 HZ2 LYS A 463 -16.704 1.562 0.337 1.00 1.62 H new ATOM 0 HZ3 LYS A 463 -17.607 1.975 1.714 1.00 1.62 H new ATOM 1023 N ASP A 464 -14.577 3.415 6.668 1.00 0.58 N ATOM 1024 CA ASP A 464 -15.634 3.370 7.715 1.00 0.61 C ATOM 1025 C ASP A 464 -15.241 2.437 8.847 1.00 0.51 C ATOM 1026 O ASP A 464 -15.820 1.362 9.025 1.00 0.53 O ATOM 1027 CB ASP A 464 -16.943 2.886 7.115 1.00 0.72 C ATOM 1028 CG ASP A 464 -18.136 3.718 7.544 1.00 1.08 C ATOM 1029 OD1 ASP A 464 -18.804 3.343 8.532 1.00 1.85 O ATOM 1030 OD2 ASP A 464 -18.407 4.757 6.907 1.00 1.15 O ATOM 0 H ASP A 464 -14.048 4.286 6.631 1.00 0.58 H new ATOM 0 HA ASP A 464 -15.754 4.379 8.110 1.00 0.61 H new ATOM 0 HB2 ASP A 464 -16.867 2.904 6.028 1.00 0.72 H new ATOM 0 HB3 ASP A 464 -17.108 1.848 7.405 1.00 0.72 H new ATOM 1035 N GLN A 465 -14.262 2.887 9.608 1.00 0.52 N ATOM 1036 CA GLN A 465 -13.645 2.137 10.691 1.00 0.49 C ATOM 1037 C GLN A 465 -13.139 0.741 10.288 1.00 0.44 C ATOM 1038 O GLN A 465 -12.694 -0.020 11.145 1.00 0.66 O ATOM 1039 CB GLN A 465 -14.609 2.030 11.869 1.00 0.56 C ATOM 1040 CG GLN A 465 -15.081 3.381 12.370 1.00 0.67 C ATOM 1041 CD GLN A 465 -15.899 3.287 13.645 1.00 0.78 C ATOM 1042 OE1 GLN A 465 -15.872 4.191 14.479 1.00 1.32 O ATOM 1043 NE2 GLN A 465 -16.635 2.198 13.804 1.00 1.39 N ATOM 0 H GLN A 465 -13.859 3.816 9.487 1.00 0.52 H new ATOM 0 HA GLN A 465 -12.757 2.701 10.977 1.00 0.49 H new ATOM 0 HB2 GLN A 465 -15.473 1.436 11.572 1.00 0.56 H new ATOM 0 HB3 GLN A 465 -14.121 1.496 12.684 1.00 0.56 H new ATOM 0 HG2 GLN A 465 -14.216 4.020 12.546 1.00 0.67 H new ATOM 0 HG3 GLN A 465 -15.679 3.861 11.595 1.00 0.67 H new ATOM 0 HE21 GLN A 465 -16.630 1.470 13.089 1.00 1.39 H new ATOM 0 HE22 GLN A 465 -17.207 2.087 14.641 1.00 1.39 H new ATOM 1052 N GLN A 466 -13.193 0.395 9.005 1.00 0.36 N ATOM 1053 CA GLN A 466 -12.753 -0.923 8.569 1.00 0.36 C ATOM 1054 C GLN A 466 -11.652 -0.838 7.537 1.00 0.28 C ATOM 1055 O GLN A 466 -11.406 0.214 6.953 1.00 0.29 O ATOM 1056 CB GLN A 466 -13.927 -1.707 8.004 1.00 0.54 C ATOM 1057 CG GLN A 466 -14.984 -1.984 9.034 1.00 1.20 C ATOM 1058 CD GLN A 466 -16.276 -2.485 8.429 1.00 1.42 C ATOM 1059 OE1 GLN A 466 -16.475 -3.689 8.262 1.00 1.60 O ATOM 1060 NE2 GLN A 466 -17.159 -1.564 8.086 1.00 2.13 N ATOM 0 H GLN A 466 -13.533 1.001 8.259 1.00 0.36 H new ATOM 0 HA GLN A 466 -12.353 -1.438 9.442 1.00 0.36 H new ATOM 0 HB2 GLN A 466 -14.367 -1.150 7.177 1.00 0.54 H new ATOM 0 HB3 GLN A 466 -13.566 -2.651 7.596 1.00 0.54 H new ATOM 0 HG2 GLN A 466 -14.609 -2.723 9.742 1.00 1.20 H new ATOM 0 HG3 GLN A 466 -15.182 -1.073 9.599 1.00 1.20 H new ATOM 0 HE21 GLN A 466 -16.953 -0.577 8.242 1.00 2.13 H new ATOM 0 HE22 GLN A 466 -18.046 -1.840 7.665 1.00 2.13 H new ATOM 1069 N ARG A 467 -11.006 -1.966 7.321 1.00 0.33 N ATOM 1070 CA ARG A 467 -9.898 -2.066 6.384 1.00 0.30 C ATOM 1071 C ARG A 467 -10.088 -3.265 5.465 1.00 0.33 C ATOM 1072 O ARG A 467 -10.449 -4.351 5.914 1.00 0.51 O ATOM 1073 CB ARG A 467 -8.574 -2.175 7.139 1.00 0.36 C ATOM 1074 CG ARG A 467 -8.152 -0.877 7.805 1.00 0.34 C ATOM 1075 CD ARG A 467 -7.096 -1.117 8.868 1.00 0.43 C ATOM 1076 NE ARG A 467 -6.575 0.132 9.422 1.00 1.24 N ATOM 1077 CZ ARG A 467 -7.125 0.792 10.440 1.00 1.67 C ATOM 1078 NH1 ARG A 467 -8.243 0.346 11.000 1.00 1.51 N ATOM 1079 NH2 ARG A 467 -6.556 1.902 10.897 1.00 2.58 N ATOM 0 H ARG A 467 -11.233 -2.843 7.790 1.00 0.33 H new ATOM 0 HA ARG A 467 -9.875 -1.164 5.773 1.00 0.30 H new ATOM 0 HB2 ARG A 467 -8.660 -2.953 7.898 1.00 0.36 H new ATOM 0 HB3 ARG A 467 -7.794 -2.490 6.446 1.00 0.36 H new ATOM 0 HG2 ARG A 467 -7.764 -0.190 7.053 1.00 0.34 H new ATOM 0 HG3 ARG A 467 -9.021 -0.398 8.255 1.00 0.34 H new ATOM 0 HD2 ARG A 467 -7.522 -1.719 9.671 1.00 0.43 H new ATOM 0 HD3 ARG A 467 -6.276 -1.692 8.439 1.00 0.43 H new ATOM 0 HE ARG A 467 -5.733 0.524 9.000 1.00 1.24 H new ATOM 0 HH11 ARG A 467 -8.684 -0.505 10.651 1.00 1.51 H new ATOM 0 HH12 ARG A 467 -8.661 0.854 11.779 1.00 1.51 H new ATOM 0 HH21 ARG A 467 -5.698 2.249 10.468 1.00 2.58 H new ATOM 0 HH22 ARG A 467 -6.977 2.407 11.676 1.00 2.58 H new ATOM 1093 N HIS A 468 -9.869 -3.052 4.178 1.00 0.28 N ATOM 1094 CA HIS A 468 -10.055 -4.107 3.180 1.00 0.32 C ATOM 1095 C HIS A 468 -8.813 -4.270 2.284 1.00 0.24 C ATOM 1096 O HIS A 468 -8.377 -3.297 1.671 1.00 0.27 O ATOM 1097 CB HIS A 468 -11.264 -3.786 2.292 1.00 0.44 C ATOM 1098 CG HIS A 468 -12.592 -4.013 2.949 1.00 0.75 C ATOM 1099 ND1 HIS A 468 -13.404 -5.083 2.646 1.00 1.02 N ATOM 1100 CD2 HIS A 468 -13.260 -3.292 3.880 1.00 1.01 C ATOM 1101 CE1 HIS A 468 -14.510 -5.010 3.357 1.00 1.26 C ATOM 1102 NE2 HIS A 468 -14.451 -3.932 4.117 1.00 1.25 N ATOM 0 H HIS A 468 -9.562 -2.159 3.794 1.00 0.28 H new ATOM 0 HA HIS A 468 -10.219 -5.039 3.722 1.00 0.32 H new ATOM 0 HB2 HIS A 468 -11.202 -2.744 1.977 1.00 0.44 H new ATOM 0 HB3 HIS A 468 -11.209 -4.396 1.390 1.00 0.44 H new ATOM 0 HD2 HIS A 468 -12.919 -2.381 4.350 1.00 1.01 H new ATOM 0 HE1 HIS A 468 -15.328 -5.714 3.324 1.00 1.26 H new ATOM 0 HE2 HIS A 468 -15.171 -3.626 4.772 1.00 1.25 H new ATOM 1111 N LYS A 469 -8.223 -5.479 2.254 1.00 0.27 N ATOM 1112 CA LYS A 469 -7.198 -5.835 1.218 1.00 0.40 C ATOM 1113 C LYS A 469 -7.593 -5.281 -0.148 1.00 0.29 C ATOM 1114 O LYS A 469 -8.684 -5.557 -0.652 1.00 0.37 O ATOM 1115 CB LYS A 469 -6.993 -7.357 1.030 1.00 0.80 C ATOM 1116 CG LYS A 469 -6.099 -7.703 -0.154 1.00 0.70 C ATOM 1117 CD LYS A 469 -4.619 -7.441 0.106 1.00 0.70 C ATOM 1118 CE LYS A 469 -4.032 -8.437 1.096 1.00 0.41 C ATOM 1119 NZ LYS A 469 -4.300 -9.848 0.703 1.00 0.84 N ATOM 0 H LYS A 469 -8.425 -6.226 2.919 1.00 0.27 H new ATOM 0 HA LYS A 469 -6.272 -5.397 1.591 1.00 0.40 H new ATOM 0 HB2 LYS A 469 -6.558 -7.773 1.939 1.00 0.80 H new ATOM 0 HB3 LYS A 469 -7.964 -7.833 0.895 1.00 0.80 H new ATOM 0 HG2 LYS A 469 -6.235 -8.754 -0.407 1.00 0.70 H new ATOM 0 HG3 LYS A 469 -6.416 -7.123 -1.021 1.00 0.70 H new ATOM 0 HD2 LYS A 469 -4.070 -7.497 -0.834 1.00 0.70 H new ATOM 0 HD3 LYS A 469 -4.491 -6.429 0.490 1.00 0.70 H new ATOM 0 HE2 LYS A 469 -2.956 -8.281 1.170 1.00 0.41 H new ATOM 0 HE3 LYS A 469 -4.450 -8.252 2.085 1.00 0.41 H new ATOM 0 HZ1 LYS A 469 -3.451 -10.424 0.876 1.00 0.84 H new ATOM 0 HZ2 LYS A 469 -5.091 -10.221 1.266 1.00 0.84 H new ATOM 0 HZ3 LYS A 469 -4.545 -9.887 -0.307 1.00 0.84 H new ATOM 1133 N VAL A 470 -6.705 -4.500 -0.733 1.00 0.23 N ATOM 1134 CA VAL A 470 -6.885 -4.019 -2.091 1.00 0.18 C ATOM 1135 C VAL A 470 -5.880 -4.676 -3.015 1.00 0.18 C ATOM 1136 O VAL A 470 -6.232 -5.215 -4.068 1.00 0.29 O ATOM 1137 CB VAL A 470 -6.709 -2.500 -2.158 1.00 0.22 C ATOM 1138 CG1 VAL A 470 -6.893 -1.983 -3.579 1.00 0.61 C ATOM 1139 CG2 VAL A 470 -7.676 -1.842 -1.203 1.00 0.59 C ATOM 0 H VAL A 470 -5.845 -4.183 -0.285 1.00 0.23 H new ATOM 0 HA VAL A 470 -7.897 -4.274 -2.407 1.00 0.18 H new ATOM 0 HB VAL A 470 -5.691 -2.248 -1.860 1.00 0.22 H new ATOM 0 HG11 VAL A 470 -6.762 -0.901 -3.592 1.00 0.61 H new ATOM 0 HG12 VAL A 470 -6.154 -2.446 -4.233 1.00 0.61 H new ATOM 0 HG13 VAL A 470 -7.895 -2.231 -3.930 1.00 0.61 H new ATOM 0 HG21 VAL A 470 -7.553 -0.760 -1.249 1.00 0.59 H new ATOM 0 HG22 VAL A 470 -8.697 -2.103 -1.482 1.00 0.59 H new ATOM 0 HG23 VAL A 470 -7.477 -2.187 -0.188 1.00 0.59 H new ATOM 1149 N ARG A 471 -4.625 -4.644 -2.606 1.00 0.17 N ATOM 1150 CA ARG A 471 -3.557 -5.212 -3.395 1.00 0.19 C ATOM 1151 C ARG A 471 -2.449 -5.730 -2.490 1.00 0.18 C ATOM 1152 O ARG A 471 -2.251 -5.216 -1.391 1.00 0.22 O ATOM 1153 CB ARG A 471 -3.002 -4.185 -4.373 1.00 0.28 C ATOM 1154 CG ARG A 471 -2.090 -4.840 -5.396 1.00 0.77 C ATOM 1155 CD ARG A 471 -2.125 -4.171 -6.745 1.00 0.52 C ATOM 1156 NE ARG A 471 -1.198 -4.819 -7.672 1.00 1.18 N ATOM 1157 CZ ARG A 471 -0.604 -4.221 -8.702 1.00 1.45 C ATOM 1158 NH1 ARG A 471 -0.786 -2.927 -8.932 1.00 1.39 N ATOM 1159 NH2 ARG A 471 0.190 -4.926 -9.497 1.00 2.13 N ATOM 0 H ARG A 471 -4.323 -4.227 -1.726 1.00 0.17 H new ATOM 0 HA ARG A 471 -3.962 -6.046 -3.967 1.00 0.19 H new ATOM 0 HB2 ARG A 471 -3.824 -3.683 -4.883 1.00 0.28 H new ATOM 0 HB3 ARG A 471 -2.451 -3.420 -3.827 1.00 0.28 H new ATOM 0 HG2 ARG A 471 -1.067 -4.829 -5.020 1.00 0.77 H new ATOM 0 HG3 ARG A 471 -2.376 -5.886 -5.510 1.00 0.77 H new ATOM 0 HD2 ARG A 471 -3.137 -4.210 -7.149 1.00 0.52 H new ATOM 0 HD3 ARG A 471 -1.864 -3.118 -6.640 1.00 0.52 H new ATOM 0 HE ARG A 471 -0.991 -5.806 -7.517 1.00 1.18 H new ATOM 0 HH11 ARG A 471 -1.387 -2.379 -8.316 1.00 1.39 H new ATOM 0 HH12 ARG A 471 -0.325 -2.480 -9.725 1.00 1.39 H new ATOM 0 HH21 ARG A 471 0.341 -5.918 -9.317 1.00 2.13 H new ATOM 0 HH22 ARG A 471 0.649 -4.476 -10.289 1.00 2.13 H new ATOM 1173 N GLU A 472 -1.755 -6.755 -2.950 1.00 0.20 N ATOM 1174 CA GLU A 472 -0.632 -7.323 -2.221 1.00 0.18 C ATOM 1175 C GLU A 472 0.417 -7.843 -3.190 1.00 0.18 C ATOM 1176 O GLU A 472 0.086 -8.526 -4.162 1.00 0.21 O ATOM 1177 CB GLU A 472 -1.102 -8.448 -1.297 1.00 0.21 C ATOM 1178 CG GLU A 472 -0.030 -9.489 -1.014 1.00 0.21 C ATOM 1179 CD GLU A 472 -0.385 -10.406 0.135 1.00 0.29 C ATOM 1180 OE1 GLU A 472 0.527 -10.792 0.890 1.00 0.62 O ATOM 1181 OE2 GLU A 472 -1.576 -10.748 0.291 1.00 0.65 O ATOM 0 H GLU A 472 -1.952 -7.218 -3.837 1.00 0.20 H new ATOM 0 HA GLU A 472 -0.187 -6.538 -1.610 1.00 0.18 H new ATOM 0 HB2 GLU A 472 -1.436 -8.017 -0.353 1.00 0.21 H new ATOM 0 HB3 GLU A 472 -1.965 -8.940 -1.746 1.00 0.21 H new ATOM 0 HG2 GLU A 472 0.134 -10.086 -1.911 1.00 0.21 H new ATOM 0 HG3 GLU A 472 0.910 -8.984 -0.791 1.00 0.21 H new ATOM 1188 N GLU A 473 1.673 -7.512 -2.935 1.00 0.16 N ATOM 1189 CA GLU A 473 2.761 -7.950 -3.796 1.00 0.17 C ATOM 1190 C GLU A 473 4.090 -7.851 -3.096 1.00 0.20 C ATOM 1191 O GLU A 473 4.359 -6.895 -2.370 1.00 0.26 O ATOM 1192 CB GLU A 473 2.773 -7.131 -5.096 1.00 0.23 C ATOM 1193 CG GLU A 473 3.927 -7.454 -6.037 1.00 0.27 C ATOM 1194 CD GLU A 473 3.834 -8.841 -6.633 1.00 1.24 C ATOM 1195 OE1 GLU A 473 4.222 -9.815 -5.947 1.00 2.26 O ATOM 1196 OE2 GLU A 473 3.366 -8.971 -7.784 1.00 1.25 O ATOM 0 H GLU A 473 1.964 -6.943 -2.140 1.00 0.16 H new ATOM 0 HA GLU A 473 2.594 -8.999 -4.042 1.00 0.17 H new ATOM 0 HB2 GLU A 473 1.834 -7.297 -5.623 1.00 0.23 H new ATOM 0 HB3 GLU A 473 2.813 -6.072 -4.843 1.00 0.23 H new ATOM 0 HG2 GLU A 473 3.948 -6.719 -6.842 1.00 0.27 H new ATOM 0 HG3 GLU A 473 4.868 -7.360 -5.495 1.00 0.27 H new ATOM 1203 N VAL A 474 4.928 -8.846 -3.327 1.00 0.24 N ATOM 1204 CA VAL A 474 6.229 -8.856 -2.725 1.00 0.28 C ATOM 1205 C VAL A 474 7.236 -8.233 -3.672 1.00 0.21 C ATOM 1206 O VAL A 474 7.402 -8.685 -4.804 1.00 0.28 O ATOM 1207 CB VAL A 474 6.718 -10.265 -2.360 1.00 0.49 C ATOM 1208 CG1 VAL A 474 7.872 -10.189 -1.372 1.00 0.80 C ATOM 1209 CG2 VAL A 474 5.590 -11.120 -1.811 1.00 1.22 C ATOM 0 H VAL A 474 4.724 -9.647 -3.924 1.00 0.24 H new ATOM 0 HA VAL A 474 6.143 -8.284 -1.801 1.00 0.28 H new ATOM 0 HB VAL A 474 7.075 -10.742 -3.273 1.00 0.49 H new ATOM 0 HG11 VAL A 474 8.206 -11.197 -1.124 1.00 0.80 H new ATOM 0 HG12 VAL A 474 8.697 -9.633 -1.818 1.00 0.80 H new ATOM 0 HG13 VAL A 474 7.542 -9.683 -0.465 1.00 0.80 H new ATOM 0 HG21 VAL A 474 5.972 -12.110 -1.563 1.00 1.22 H new ATOM 0 HG22 VAL A 474 5.183 -10.653 -0.914 1.00 1.22 H new ATOM 0 HG23 VAL A 474 4.804 -11.211 -2.561 1.00 1.22 H new ATOM 1219 N VAL A 475 7.899 -7.196 -3.216 1.00 0.19 N ATOM 1220 CA VAL A 475 8.860 -6.492 -4.041 1.00 0.19 C ATOM 1221 C VAL A 475 10.167 -6.297 -3.336 1.00 0.19 C ATOM 1222 O VAL A 475 10.244 -5.820 -2.207 1.00 0.26 O ATOM 1223 CB VAL A 475 8.361 -5.109 -4.492 1.00 0.22 C ATOM 1224 CG1 VAL A 475 8.470 -4.983 -5.996 1.00 0.41 C ATOM 1225 CG2 VAL A 475 6.934 -4.847 -4.035 1.00 0.32 C ATOM 0 H VAL A 475 7.792 -6.818 -2.275 1.00 0.19 H new ATOM 0 HA VAL A 475 8.995 -7.129 -4.915 1.00 0.19 H new ATOM 0 HB VAL A 475 8.995 -4.356 -4.024 1.00 0.22 H new ATOM 0 HG11 VAL A 475 8.114 -4.000 -6.306 1.00 0.41 H new ATOM 0 HG12 VAL A 475 9.511 -5.103 -6.297 1.00 0.41 H new ATOM 0 HG13 VAL A 475 7.864 -5.754 -6.471 1.00 0.41 H new ATOM 0 HG21 VAL A 475 6.619 -3.860 -4.374 1.00 0.32 H new ATOM 0 HG22 VAL A 475 6.272 -5.604 -4.457 1.00 0.32 H new ATOM 0 HG23 VAL A 475 6.887 -4.889 -2.947 1.00 0.32 H new ATOM 1235 N THR A 476 11.187 -6.699 -4.033 1.00 0.24 N ATOM 1236 CA THR A 476 12.533 -6.381 -3.688 1.00 0.24 C ATOM 1237 C THR A 476 12.874 -5.027 -4.266 1.00 0.26 C ATOM 1238 O THR A 476 12.762 -4.802 -5.472 1.00 0.33 O ATOM 1239 CB THR A 476 13.445 -7.439 -4.278 1.00 0.31 C ATOM 1240 OG1 THR A 476 13.218 -8.700 -3.632 1.00 0.32 O ATOM 1241 CG2 THR A 476 14.916 -7.042 -4.178 1.00 0.38 C ATOM 0 H THR A 476 11.101 -7.269 -4.874 1.00 0.24 H new ATOM 0 HA THR A 476 12.658 -6.354 -2.606 1.00 0.24 H new ATOM 0 HB THR A 476 13.206 -7.531 -5.338 1.00 0.31 H new ATOM 0 HG1 THR A 476 13.810 -9.378 -4.020 1.00 0.32 H new ATOM 0 HG21 THR A 476 15.535 -7.827 -4.612 1.00 0.38 H new ATOM 0 HG22 THR A 476 15.079 -6.110 -4.720 1.00 0.38 H new ATOM 0 HG23 THR A 476 15.185 -6.905 -3.131 1.00 0.38 H new ATOM 1249 N VAL A 477 13.264 -4.132 -3.405 1.00 0.25 N ATOM 1250 CA VAL A 477 13.530 -2.771 -3.794 1.00 0.29 C ATOM 1251 C VAL A 477 14.972 -2.624 -4.249 1.00 0.33 C ATOM 1252 O VAL A 477 15.882 -3.106 -3.586 1.00 0.37 O ATOM 1253 CB VAL A 477 13.239 -1.850 -2.607 1.00 0.28 C ATOM 1254 CG1 VAL A 477 13.627 -0.410 -2.907 1.00 0.35 C ATOM 1255 CG2 VAL A 477 11.770 -1.948 -2.239 1.00 0.31 C ATOM 0 H VAL A 477 13.408 -4.322 -2.413 1.00 0.25 H new ATOM 0 HA VAL A 477 12.887 -2.495 -4.630 1.00 0.29 H new ATOM 0 HB VAL A 477 13.845 -2.175 -1.761 1.00 0.28 H new ATOM 0 HG11 VAL A 477 13.406 0.214 -2.041 1.00 0.35 H new ATOM 0 HG12 VAL A 477 14.693 -0.359 -3.128 1.00 0.35 H new ATOM 0 HG13 VAL A 477 13.060 -0.052 -3.767 1.00 0.35 H new ATOM 0 HG21 VAL A 477 11.562 -1.292 -1.394 1.00 0.31 H new ATOM 0 HG22 VAL A 477 11.161 -1.646 -3.091 1.00 0.31 H new ATOM 0 HG23 VAL A 477 11.531 -2.976 -1.968 1.00 0.31 H new ATOM 1265 N GLY A 478 15.180 -1.977 -5.382 1.00 0.43 N ATOM 1266 CA GLY A 478 16.515 -1.800 -5.887 1.00 0.53 C ATOM 1267 C GLY A 478 16.613 -0.530 -6.711 1.00 1.15 C ATOM 1268 O GLY A 478 15.622 -0.134 -7.322 1.00 1.69 O ATOM 0 H GLY A 478 14.444 -1.571 -5.960 1.00 0.43 H new ATOM 0 HA2 GLY A 478 17.220 -1.756 -5.057 1.00 0.53 H new ATOM 0 HA3 GLY A 478 16.795 -2.658 -6.498 1.00 0.53 H new ATOM 1272 N ASN A 479 17.787 0.099 -6.754 1.00 1.80 N ATOM 1273 CA ASN A 479 17.961 1.360 -7.482 1.00 2.82 C ATOM 1274 C ASN A 479 19.415 1.776 -7.403 1.00 3.58 C ATOM 1275 O ASN A 479 19.748 2.951 -7.568 1.00 4.40 O ATOM 1276 CB ASN A 479 17.081 2.523 -6.946 1.00 3.20 C ATOM 1277 CG ASN A 479 15.985 2.920 -7.918 1.00 3.99 C ATOM 1278 OD1 ASN A 479 14.867 2.409 -7.862 1.00 4.47 O ATOM 1279 ND2 ASN A 479 16.297 3.840 -8.814 1.00 4.61 N ATOM 0 H ASN A 479 18.632 -0.242 -6.295 1.00 1.80 H new ATOM 0 HA ASN A 479 17.645 1.172 -8.508 1.00 2.82 H new ATOM 0 HB2 ASN A 479 16.631 2.227 -5.998 1.00 3.20 H new ATOM 0 HB3 ASN A 479 17.712 3.388 -6.743 1.00 3.20 H new ATOM 0 HD21 ASN A 479 15.600 4.150 -9.491 1.00 4.61 H new ATOM 0 HD22 ASN A 479 17.235 4.240 -8.829 1.00 4.61 H new ATOM 1286 N SER A 480 20.286 0.809 -7.158 1.00 3.56 N ATOM 1287 CA SER A 480 21.662 1.118 -6.818 1.00 4.40 C ATOM 1288 C SER A 480 22.531 -0.131 -6.943 1.00 4.81 C ATOM 1289 O SER A 480 23.237 -0.268 -7.964 1.00 4.88 O ATOM 1290 CB SER A 480 21.696 1.686 -5.395 1.00 4.37 C ATOM 1291 OG SER A 480 21.118 0.780 -4.468 1.00 4.36 O ATOM 1292 OXT SER A 480 22.475 -0.990 -6.035 1.00 5.40 O ATOM 0 H SER A 480 20.066 -0.186 -7.188 1.00 3.56 H new ATOM 0 HA SER A 480 22.064 1.861 -7.507 1.00 4.40 H new ATOM 0 HB2 SER A 480 22.727 1.896 -5.109 1.00 4.37 H new ATOM 0 HB3 SER A 480 21.158 2.633 -5.366 1.00 4.37 H new ATOM 0 HG SER A 480 21.361 -0.137 -4.712 1.00 4.36 H new TER 1298 SER A 480