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 -56:sc= 1.21 USER MOD Set 1.2: A 476 THR OG1 : rot 180:sc= 1.03 USER MOD Set 2.1: A 450 THR OG1 : rot 84:sc= 0.113 USER MOD Set 2.2: A 455 TYR OH : rot 28:sc= 0.88 USER MOD Set 3.1: A 409 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 443 SER OG : rot -28:sc= -0.161 USER MOD Set 4.1: A 416 THR OG1 : rot 150:sc= 1.48 USER MOD Set 4.2: A 419 TYR OH : rot 141:sc= 0.0894 USER MOD Set 5.1: A 414 GLN : amide:sc= -0.896! C(o=0.12!,f=-6.3!) USER MOD Set 5.2: A 463 LYS NZ :NH3+ -145:sc= 1.01 (180deg=0.388) USER MOD Set 6.1: A 407 THR OG1 : rot -80:sc= 1.18 USER MOD Set 6.2: A 445 THR OG1 : rot 180:sc= 1.07 USER MOD Single : A 395 ASN : amide:sc= 0.438 K(o=0.44,f=-8.6!) USER MOD Single : A 397 SER OG : rot 59:sc= 1.24 USER MOD Single : A 398 THR OG1 : rot 180:sc= 0 USER MOD Single : A 400 GLN : amide:sc= -3.85! K(o=-3.8!,f=-0.35) USER MOD Single : A 404 SER OG : rot 160:sc= 0 USER MOD Single : A 405 GLN : amide:sc= -0.23 K(o=-0.23,f=-4.3!) USER MOD Single : A 406 THR OG1 : rot 180:sc=-0.00495 USER MOD Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 422 SER OG : rot 43:sc= -4.03! USER MOD Single : A 423 CYS SG : rot -125:sc= -3.06! USER MOD Single : A 424 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 428 THR OG1 : rot -119:sc= 0.0297 USER MOD Single : A 434 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 440 THR OG1 : rot 180:sc=0.000267 USER MOD Single : A 441 SER OG : rot -170:sc= -0.26 USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 447 THR OG1 : rot -81:sc= 0.0962 USER MOD Single : A 456 ASN : amide:sc= -1.65! C(o=-1.6!,f=-4.3!) USER MOD Single : A 465 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.017) USER MOD Single : A 466 GLN : amide:sc= 0 X(o=0,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+ -109:sc= 0.562 (180deg=-0.874) USER MOD Single : A 479 ASN : amide:sc= 0.00233 X(o=0.0023,f=0) USER MOD Single : A 480 SER OG : rot 37:sc= 1.05 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 395 15.529 18.794 4.300 1.00 7.64 N ATOM 2 CA ASN A 395 15.602 17.666 5.251 1.00 7.05 C ATOM 3 C ASN A 395 14.311 16.860 5.181 1.00 6.89 C ATOM 4 O ASN A 395 13.266 17.378 4.781 1.00 7.24 O ATOM 5 CB ASN A 395 15.837 18.187 6.673 1.00 7.73 C ATOM 6 CG ASN A 395 16.436 17.151 7.613 1.00 8.25 C ATOM 7 OD1 ASN A 395 16.222 15.951 7.466 1.00 8.44 O ATOM 8 ND2 ASN A 395 17.194 17.613 8.594 1.00 8.76 N ATOM 0 HA ASN A 395 16.438 17.020 4.983 1.00 7.05 H new ATOM 0 HB2 ASN A 395 16.500 19.051 6.629 1.00 7.73 H new ATOM 0 HB3 ASN A 395 14.889 18.533 7.085 1.00 7.73 H new ATOM 0 HD21 ASN A 395 17.621 16.966 9.257 1.00 8.76 H new ATOM 0 HD22 ASN A 395 17.352 18.616 8.688 1.00 8.76 H new ATOM 17 N ALA A 396 14.399 15.618 5.620 1.00 6.67 N ATOM 18 CA ALA A 396 13.371 14.587 5.397 1.00 6.81 C ATOM 19 C ALA A 396 14.008 13.243 5.685 1.00 6.05 C ATOM 20 O ALA A 396 13.527 12.468 6.513 1.00 6.42 O ATOM 21 CB ALA A 396 12.854 14.610 3.961 1.00 7.55 C ATOM 0 H ALA A 396 15.199 15.279 6.154 1.00 6.67 H new ATOM 0 HA ALA A 396 12.520 14.775 6.051 1.00 6.81 H new ATOM 0 HB1 ALA A 396 12.097 13.836 3.834 1.00 7.55 H new ATOM 0 HB2 ALA A 396 12.415 15.585 3.748 1.00 7.55 H new ATOM 0 HB3 ALA A 396 13.680 14.426 3.274 1.00 7.55 H new ATOM 27 N SER A 397 15.106 12.990 4.981 1.00 5.23 N ATOM 28 CA SER A 397 16.010 11.902 5.319 1.00 4.72 C ATOM 29 C SER A 397 16.505 12.090 6.782 1.00 4.61 C ATOM 30 O SER A 397 17.050 13.152 7.090 1.00 4.53 O ATOM 31 CB SER A 397 17.224 11.962 4.377 1.00 4.27 C ATOM 32 OG SER A 397 18.171 10.953 4.693 1.00 4.45 O ATOM 0 H SER A 397 15.391 13.531 4.165 1.00 5.23 H new ATOM 0 HA SER A 397 15.498 10.945 5.219 1.00 4.72 H new ATOM 0 HB2 SER A 397 16.893 11.843 3.345 1.00 4.27 H new ATOM 0 HB3 SER A 397 17.695 12.942 4.450 1.00 4.27 H new ATOM 0 HG SER A 397 17.746 10.073 4.625 1.00 4.45 H new ATOM 38 N THR A 398 16.340 11.110 7.700 1.00 5.02 N ATOM 39 CA THR A 398 16.820 11.311 9.089 1.00 5.32 C ATOM 40 C THR A 398 17.493 10.037 9.596 1.00 5.50 C ATOM 41 O THR A 398 17.332 9.650 10.753 1.00 6.31 O ATOM 42 CB THR A 398 15.678 11.720 10.066 1.00 6.23 C ATOM 43 OG1 THR A 398 14.477 11.003 9.747 1.00 6.75 O ATOM 44 CG2 THR A 398 15.404 13.230 10.049 1.00 6.37 C ATOM 0 H THR A 398 15.898 10.209 7.518 1.00 5.02 H new ATOM 0 HA THR A 398 17.536 12.132 9.063 1.00 5.32 H new ATOM 0 HB THR A 398 16.008 11.461 11.072 1.00 6.23 H new ATOM 0 HG1 THR A 398 13.765 11.265 10.367 1.00 6.75 H new ATOM 0 HG21 THR A 398 14.600 13.462 10.747 1.00 6.37 H new ATOM 0 HG22 THR A 398 16.306 13.767 10.343 1.00 6.37 H new ATOM 0 HG23 THR A 398 15.112 13.535 9.044 1.00 6.37 H new ATOM 52 N GLY A 399 18.258 9.396 8.715 1.00 4.93 N ATOM 53 CA GLY A 399 18.871 8.121 9.041 1.00 5.31 C ATOM 54 C GLY A 399 18.886 7.210 7.836 1.00 4.62 C ATOM 55 O GLY A 399 19.786 6.388 7.668 1.00 4.48 O ATOM 0 H GLY A 399 18.464 9.740 7.777 1.00 4.93 H new ATOM 0 HA2 GLY A 399 19.890 8.282 9.394 1.00 5.31 H new ATOM 0 HA3 GLY A 399 18.323 7.646 9.855 1.00 5.31 H new ATOM 59 N GLN A 400 17.878 7.366 6.990 1.00 4.32 N ATOM 60 CA GLN A 400 17.806 6.616 5.741 1.00 3.59 C ATOM 61 C GLN A 400 18.200 7.514 4.605 1.00 2.81 C ATOM 62 O GLN A 400 17.472 8.427 4.253 1.00 2.93 O ATOM 63 CB GLN A 400 16.415 6.012 5.475 1.00 3.81 C ATOM 64 CG GLN A 400 15.886 5.034 6.522 1.00 4.51 C ATOM 65 CD GLN A 400 16.528 3.647 6.518 1.00 4.68 C ATOM 66 OE1 GLN A 400 15.867 2.667 6.855 1.00 5.27 O ATOM 67 NE2 GLN A 400 17.799 3.529 6.154 1.00 4.54 N ATOM 0 H GLN A 400 17.098 8.005 7.144 1.00 4.32 H new ATOM 0 HA GLN A 400 18.496 5.776 5.827 1.00 3.59 H new ATOM 0 HB2 GLN A 400 15.700 6.830 5.380 1.00 3.81 H new ATOM 0 HB3 GLN A 400 16.443 5.500 4.513 1.00 3.81 H new ATOM 0 HG2 GLN A 400 16.026 5.476 7.509 1.00 4.51 H new ATOM 0 HG3 GLN A 400 14.812 4.918 6.374 1.00 4.51 H new ATOM 0 HE21 GLN A 400 18.329 4.355 5.878 1.00 4.54 H new ATOM 0 HE22 GLN A 400 18.245 2.612 6.150 1.00 4.54 H new ATOM 76 N GLU A 401 19.412 7.352 4.136 1.00 2.28 N ATOM 77 CA GLU A 401 19.799 7.965 2.871 1.00 1.62 C ATOM 78 C GLU A 401 19.918 7.012 1.697 1.00 1.37 C ATOM 79 O GLU A 401 20.399 7.392 0.630 1.00 1.38 O ATOM 80 CB GLU A 401 21.024 8.833 3.005 1.00 1.30 C ATOM 81 CG GLU A 401 21.974 8.363 4.077 1.00 1.92 C ATOM 82 CD GLU A 401 22.638 7.040 3.748 1.00 2.22 C ATOM 83 OE1 GLU A 401 22.159 5.994 4.237 1.00 2.91 O ATOM 84 OE2 GLU A 401 23.634 7.041 2.997 1.00 2.28 O ATOM 0 H GLU A 401 20.144 6.811 4.596 1.00 2.28 H new ATOM 0 HA GLU A 401 18.952 8.605 2.624 1.00 1.62 H new ATOM 0 HB2 GLU A 401 21.549 8.859 2.050 1.00 1.30 H new ATOM 0 HB3 GLU A 401 20.714 9.854 3.226 1.00 1.30 H new ATOM 0 HG2 GLU A 401 22.743 9.120 4.229 1.00 1.92 H new ATOM 0 HG3 GLU A 401 21.431 8.266 5.017 1.00 1.92 H new ATOM 91 N ALA A 402 19.470 5.800 1.873 1.00 1.24 N ATOM 92 CA ALA A 402 19.490 4.828 0.803 1.00 1.04 C ATOM 93 C ALA A 402 18.087 4.669 0.281 1.00 0.82 C ATOM 94 O ALA A 402 17.604 3.575 -0.025 1.00 0.79 O ATOM 95 CB ALA A 402 20.080 3.528 1.280 1.00 1.18 C ATOM 0 H ALA A 402 19.083 5.455 2.752 1.00 1.24 H new ATOM 0 HA ALA A 402 20.127 5.169 -0.013 1.00 1.04 H new ATOM 0 HB1 ALA A 402 20.087 2.809 0.461 1.00 1.18 H new ATOM 0 HB2 ALA A 402 21.101 3.696 1.624 1.00 1.18 H new ATOM 0 HB3 ALA A 402 19.481 3.136 2.102 1.00 1.18 H new ATOM 101 N LEU A 403 17.455 5.811 0.213 1.00 0.75 N ATOM 102 CA LEU A 403 16.043 5.940 0.013 1.00 0.58 C ATOM 103 C LEU A 403 15.640 5.596 -1.408 1.00 0.57 C ATOM 104 O LEU A 403 15.987 6.304 -2.354 1.00 0.90 O ATOM 105 CB LEU A 403 15.688 7.387 0.322 1.00 0.59 C ATOM 106 CG LEU A 403 16.184 7.889 1.680 1.00 0.79 C ATOM 107 CD1 LEU A 403 16.215 9.405 1.697 1.00 1.70 C ATOM 108 CD2 LEU A 403 15.255 7.389 2.764 1.00 1.52 C ATOM 0 H LEU A 403 17.932 6.709 0.299 1.00 0.75 H new ATOM 0 HA LEU A 403 15.510 5.246 0.663 1.00 0.58 H new ATOM 0 HB2 LEU A 403 16.103 8.024 -0.459 1.00 0.59 H new ATOM 0 HB3 LEU A 403 14.604 7.498 0.282 1.00 0.59 H new ATOM 0 HG LEU A 403 17.192 7.514 1.855 1.00 0.79 H new ATOM 0 HD11 LEU A 403 16.569 9.751 2.668 1.00 1.70 H new ATOM 0 HD12 LEU A 403 16.886 9.764 0.917 1.00 1.70 H new ATOM 0 HD13 LEU A 403 15.212 9.791 1.518 1.00 1.70 H new ATOM 0 HD21 LEU A 403 15.604 7.744 3.734 1.00 1.52 H new ATOM 0 HD22 LEU A 403 14.248 7.763 2.581 1.00 1.52 H new ATOM 0 HD23 LEU A 403 15.243 6.299 2.759 1.00 1.52 H new ATOM 120 N SER A 404 14.919 4.505 -1.554 1.00 0.30 N ATOM 121 CA SER A 404 14.350 4.149 -2.831 1.00 0.27 C ATOM 122 C SER A 404 12.868 4.479 -2.826 1.00 0.28 C ATOM 123 O SER A 404 12.232 4.510 -1.767 1.00 0.43 O ATOM 124 CB SER A 404 14.576 2.669 -3.120 1.00 0.28 C ATOM 125 OG SER A 404 14.113 2.317 -4.414 1.00 1.04 O ATOM 0 H SER A 404 14.714 3.849 -0.800 1.00 0.30 H new ATOM 0 HA SER A 404 14.839 4.721 -3.620 1.00 0.27 H new ATOM 0 HB2 SER A 404 15.638 2.439 -3.037 1.00 0.28 H new ATOM 0 HB3 SER A 404 14.060 2.068 -2.371 1.00 0.28 H new ATOM 0 HG SER A 404 14.541 1.483 -4.699 1.00 1.04 H new ATOM 131 N GLN A 405 12.328 4.749 -3.998 1.00 0.26 N ATOM 132 CA GLN A 405 10.930 5.103 -4.121 1.00 0.26 C ATOM 133 C GLN A 405 10.196 4.083 -4.974 1.00 0.27 C ATOM 134 O GLN A 405 10.661 3.706 -6.051 1.00 0.43 O ATOM 135 CB GLN A 405 10.736 6.503 -4.722 1.00 0.30 C ATOM 136 CG GLN A 405 11.952 7.426 -4.640 1.00 0.33 C ATOM 137 CD GLN A 405 13.001 7.161 -5.716 1.00 0.58 C ATOM 138 OE1 GLN A 405 13.937 6.390 -5.506 1.00 0.99 O ATOM 139 NE2 GLN A 405 12.852 7.789 -6.873 1.00 0.91 N ATOM 0 H GLN A 405 12.839 4.730 -4.881 1.00 0.26 H new ATOM 0 HA GLN A 405 10.516 5.108 -3.113 1.00 0.26 H new ATOM 0 HB2 GLN A 405 10.453 6.394 -5.769 1.00 0.30 H new ATOM 0 HB3 GLN A 405 9.900 6.985 -4.215 1.00 0.30 H new ATOM 0 HG2 GLN A 405 11.617 8.460 -4.719 1.00 0.33 H new ATOM 0 HG3 GLN A 405 12.415 7.315 -3.659 1.00 0.33 H new ATOM 0 HE21 GLN A 405 12.064 8.421 -7.012 1.00 0.91 H new ATOM 0 HE22 GLN A 405 13.525 7.640 -7.624 1.00 0.91 H new ATOM 148 N THR A 406 9.066 3.625 -4.473 1.00 0.18 N ATOM 149 CA THR A 406 8.219 2.706 -5.193 1.00 0.19 C ATOM 150 C THR A 406 6.865 3.328 -5.434 1.00 0.17 C ATOM 151 O THR A 406 6.046 3.460 -4.527 1.00 0.16 O ATOM 152 CB THR A 406 8.058 1.397 -4.409 1.00 0.21 C ATOM 153 OG1 THR A 406 9.327 0.739 -4.284 1.00 0.27 O ATOM 154 CG2 THR A 406 7.059 0.471 -5.067 1.00 0.29 C ATOM 0 H THR A 406 8.712 3.883 -3.552 1.00 0.18 H new ATOM 0 HA THR A 406 8.687 2.485 -6.152 1.00 0.19 H new ATOM 0 HB THR A 406 7.679 1.648 -3.418 1.00 0.21 H new ATOM 0 HG1 THR A 406 9.215 -0.095 -3.781 1.00 0.27 H new ATOM 0 HG21 THR A 406 6.972 -0.445 -4.483 1.00 0.29 H new ATOM 0 HG22 THR A 406 6.087 0.962 -5.119 1.00 0.29 H new ATOM 0 HG23 THR A 406 7.397 0.228 -6.074 1.00 0.29 H new ATOM 162 N THR A 407 6.667 3.750 -6.652 1.00 0.19 N ATOM 163 CA THR A 407 5.400 4.263 -7.080 1.00 0.19 C ATOM 164 C THR A 407 4.451 3.104 -7.362 1.00 0.19 C ATOM 165 O THR A 407 4.404 2.559 -8.466 1.00 0.26 O ATOM 166 CB THR A 407 5.595 5.126 -8.322 1.00 0.24 C ATOM 167 OG1 THR A 407 6.328 6.311 -7.974 1.00 0.26 O ATOM 168 CG2 THR A 407 4.262 5.501 -8.972 1.00 0.24 C ATOM 0 H THR A 407 7.384 3.747 -7.377 1.00 0.19 H new ATOM 0 HA THR A 407 4.964 4.882 -6.296 1.00 0.19 H new ATOM 0 HB THR A 407 6.159 4.544 -9.051 1.00 0.24 H new ATOM 0 HG1 THR A 407 5.720 6.966 -7.572 1.00 0.26 H new ATOM 0 HG21 THR A 407 4.447 6.116 -9.853 1.00 0.24 H new ATOM 0 HG22 THR A 407 3.733 4.595 -9.266 1.00 0.24 H new ATOM 0 HG23 THR A 407 3.655 6.060 -8.260 1.00 0.24 H new ATOM 176 N ILE A 408 3.717 2.717 -6.343 1.00 0.21 N ATOM 177 CA ILE A 408 2.789 1.624 -6.450 1.00 0.21 C ATOM 178 C ILE A 408 1.399 2.158 -6.668 1.00 0.18 C ATOM 179 O ILE A 408 0.963 3.107 -6.018 1.00 0.16 O ATOM 180 CB ILE A 408 2.831 0.656 -5.236 1.00 0.23 C ATOM 181 CG1 ILE A 408 1.708 -0.346 -5.333 1.00 0.21 C ATOM 182 CG2 ILE A 408 2.773 1.360 -3.885 1.00 0.25 C ATOM 183 CD1 ILE A 408 1.785 -1.475 -4.333 1.00 0.27 C ATOM 0 H ILE A 408 3.749 3.152 -5.421 1.00 0.21 H new ATOM 0 HA ILE A 408 3.093 1.029 -7.311 1.00 0.21 H new ATOM 0 HB ILE A 408 3.797 0.154 -5.284 1.00 0.23 H new ATOM 0 HG12 ILE A 408 0.760 0.176 -5.200 1.00 0.21 H new ATOM 0 HG13 ILE A 408 1.701 -0.768 -6.338 1.00 0.21 H new ATOM 0 HG21 ILE A 408 2.807 0.619 -3.087 1.00 0.25 H new ATOM 0 HG22 ILE A 408 3.624 2.035 -3.790 1.00 0.25 H new ATOM 0 HG23 ILE A 408 1.847 1.930 -3.811 1.00 0.25 H new ATOM 0 HD11 ILE A 408 0.938 -2.146 -4.476 1.00 0.27 H new ATOM 0 HD12 ILE A 408 2.714 -2.027 -4.478 1.00 0.27 H new ATOM 0 HD13 ILE A 408 1.759 -1.068 -3.322 1.00 0.27 H new ATOM 195 N SER A 409 0.739 1.576 -7.633 1.00 0.18 N ATOM 196 CA SER A 409 -0.578 2.011 -8.019 1.00 0.16 C ATOM 197 C SER A 409 -1.571 0.862 -7.907 1.00 0.13 C ATOM 198 O SER A 409 -1.204 -0.311 -8.011 1.00 0.15 O ATOM 199 CB SER A 409 -0.529 2.558 -9.439 1.00 0.21 C ATOM 200 OG SER A 409 0.636 3.344 -9.629 1.00 0.71 O ATOM 0 H SER A 409 1.097 0.789 -8.173 1.00 0.18 H new ATOM 0 HA SER A 409 -0.913 2.802 -7.348 1.00 0.16 H new ATOM 0 HB2 SER A 409 -0.539 1.734 -10.153 1.00 0.21 H new ATOM 0 HB3 SER A 409 -1.417 3.160 -9.634 1.00 0.21 H new ATOM 0 HG SER A 409 0.653 3.687 -10.547 1.00 0.71 H new ATOM 206 N TRP A 410 -2.822 1.213 -7.685 1.00 0.16 N ATOM 207 CA TRP A 410 -3.882 0.236 -7.485 1.00 0.17 C ATOM 208 C TRP A 410 -5.153 0.741 -8.076 1.00 0.18 C ATOM 209 O TRP A 410 -5.271 1.912 -8.446 1.00 0.19 O ATOM 210 CB TRP A 410 -4.086 -0.065 -5.993 1.00 0.16 C ATOM 211 CG TRP A 410 -4.361 1.164 -5.162 1.00 0.14 C ATOM 212 CD1 TRP A 410 -5.570 1.713 -4.794 1.00 0.14 C ATOM 213 CD2 TRP A 410 -3.361 2.008 -4.608 1.00 0.13 C ATOM 214 NE1 TRP A 410 -5.353 2.837 -4.027 1.00 0.13 N ATOM 215 CE2 TRP A 410 -4.001 3.038 -3.904 1.00 0.12 C ATOM 216 CE3 TRP A 410 -1.976 1.972 -4.645 1.00 0.14 C ATOM 217 CZ2 TRP A 410 -3.285 4.032 -3.239 1.00 0.14 C ATOM 218 CZ3 TRP A 410 -1.262 2.945 -3.996 1.00 0.15 C ATOM 219 CH2 TRP A 410 -1.914 3.971 -3.296 1.00 0.14 C ATOM 0 H TRP A 410 -3.136 2.182 -7.638 1.00 0.16 H new ATOM 0 HA TRP A 410 -3.589 -0.689 -7.982 1.00 0.17 H new ATOM 0 HB2 TRP A 410 -4.916 -0.762 -5.882 1.00 0.16 H new ATOM 0 HB3 TRP A 410 -3.197 -0.564 -5.606 1.00 0.16 H new ATOM 0 HD1 TRP A 410 -6.540 1.322 -5.065 1.00 0.14 H new ATOM 0 HE1 TRP A 410 -6.079 3.424 -3.617 1.00 0.13 H new ATOM 0 HE3 TRP A 410 -1.465 1.185 -5.180 1.00 0.14 H new ATOM 0 HZ2 TRP A 410 -3.789 4.820 -2.699 1.00 0.14 H new ATOM 0 HZ3 TRP A 410 -0.183 2.922 -4.024 1.00 0.15 H new ATOM 0 HH2 TRP A 410 -1.328 4.726 -2.793 1.00 0.14 H new ATOM 230 N ALA A 411 -6.102 -0.145 -8.167 1.00 0.19 N ATOM 231 CA ALA A 411 -7.326 0.169 -8.787 1.00 0.22 C ATOM 232 C ALA A 411 -8.298 0.717 -7.776 1.00 0.19 C ATOM 233 O ALA A 411 -8.398 0.228 -6.649 1.00 0.19 O ATOM 234 CB ALA A 411 -7.875 -1.035 -9.494 1.00 0.26 C ATOM 0 H ALA A 411 -6.036 -1.098 -7.810 1.00 0.19 H new ATOM 0 HA ALA A 411 -7.160 0.943 -9.536 1.00 0.22 H new ATOM 0 HB1 ALA A 411 -8.822 -0.778 -9.969 1.00 0.26 H new ATOM 0 HB2 ALA A 411 -7.166 -1.366 -10.253 1.00 0.26 H new ATOM 0 HB3 ALA A 411 -8.036 -1.837 -8.774 1.00 0.26 H new ATOM 240 N PRO A 412 -8.992 1.762 -8.190 1.00 0.20 N ATOM 241 CA PRO A 412 -9.932 2.482 -7.359 1.00 0.19 C ATOM 242 C PRO A 412 -10.919 1.563 -6.679 1.00 0.20 C ATOM 243 O PRO A 412 -11.658 0.826 -7.332 1.00 0.23 O ATOM 244 CB PRO A 412 -10.688 3.377 -8.323 1.00 0.24 C ATOM 245 CG PRO A 412 -9.933 3.375 -9.614 1.00 0.26 C ATOM 246 CD PRO A 412 -8.880 2.308 -9.535 1.00 0.23 C ATOM 0 HA PRO A 412 -9.409 3.020 -6.568 1.00 0.19 H new ATOM 0 HB2 PRO A 412 -11.704 3.011 -8.471 1.00 0.24 H new ATOM 0 HB3 PRO A 412 -10.768 4.389 -7.926 1.00 0.24 H new ATOM 0 HG2 PRO A 412 -10.607 3.184 -10.449 1.00 0.26 H new ATOM 0 HG3 PRO A 412 -9.476 4.349 -9.790 1.00 0.26 H new ATOM 0 HD2 PRO A 412 -9.043 1.537 -10.288 1.00 0.23 H new ATOM 0 HD3 PRO A 412 -7.887 2.721 -9.711 1.00 0.23 H new ATOM 254 N PHE A 413 -10.931 1.618 -5.370 1.00 0.21 N ATOM 255 CA PHE A 413 -11.823 0.796 -4.596 1.00 0.30 C ATOM 256 C PHE A 413 -13.132 1.531 -4.307 1.00 0.51 C ATOM 257 O PHE A 413 -14.174 0.900 -4.112 1.00 1.35 O ATOM 258 CB PHE A 413 -11.127 0.356 -3.304 1.00 0.30 C ATOM 259 CG PHE A 413 -12.022 -0.342 -2.332 1.00 0.37 C ATOM 260 CD1 PHE A 413 -12.512 0.337 -1.239 1.00 0.36 C ATOM 261 CD2 PHE A 413 -12.389 -1.663 -2.521 1.00 0.51 C ATOM 262 CE1 PHE A 413 -13.354 -0.282 -0.340 1.00 0.45 C ATOM 263 CE2 PHE A 413 -13.228 -2.295 -1.626 1.00 0.61 C ATOM 264 CZ PHE A 413 -13.714 -1.604 -0.532 1.00 0.57 C ATOM 0 H PHE A 413 -10.329 2.228 -4.817 1.00 0.21 H new ATOM 0 HA PHE A 413 -12.077 -0.094 -5.171 1.00 0.30 H new ATOM 0 HB2 PHE A 413 -10.299 -0.306 -3.558 1.00 0.30 H new ATOM 0 HB3 PHE A 413 -10.697 1.233 -2.820 1.00 0.30 H new ATOM 0 HD1 PHE A 413 -12.233 1.369 -1.084 1.00 0.36 H new ATOM 0 HD2 PHE A 413 -12.015 -2.205 -3.377 1.00 0.51 H new ATOM 0 HE1 PHE A 413 -13.732 0.264 0.512 1.00 0.45 H new ATOM 0 HE2 PHE A 413 -13.504 -3.328 -1.780 1.00 0.61 H new ATOM 0 HZ PHE A 413 -14.372 -2.094 0.170 1.00 0.57 H new ATOM 274 N GLN A 414 -13.039 2.864 -4.258 1.00 0.54 N ATOM 275 CA GLN A 414 -14.225 3.767 -4.184 1.00 0.53 C ATOM 276 C GLN A 414 -14.494 4.237 -2.789 1.00 0.44 C ATOM 277 O GLN A 414 -14.706 3.482 -1.836 1.00 0.48 O ATOM 278 CB GLN A 414 -15.513 3.203 -4.877 1.00 0.71 C ATOM 279 CG GLN A 414 -16.832 3.621 -4.236 1.00 1.28 C ATOM 280 CD GLN A 414 -17.265 2.722 -3.075 1.00 1.51 C ATOM 281 OE1 GLN A 414 -17.981 3.173 -2.180 1.00 2.11 O ATOM 282 NE2 GLN A 414 -16.811 1.461 -3.035 1.00 1.89 N ATOM 0 H GLN A 414 -12.148 3.360 -4.268 1.00 0.54 H new ATOM 0 HA GLN A 414 -13.948 4.640 -4.775 1.00 0.53 H new ATOM 0 HB2 GLN A 414 -15.516 3.524 -5.919 1.00 0.71 H new ATOM 0 HB3 GLN A 414 -15.458 2.114 -4.879 1.00 0.71 H new ATOM 0 HG2 GLN A 414 -16.742 4.646 -3.876 1.00 1.28 H new ATOM 0 HG3 GLN A 414 -17.612 3.618 -4.997 1.00 1.28 H new ATOM 0 HE21 GLN A 414 -16.219 1.108 -3.787 1.00 1.89 H new ATOM 0 HE22 GLN A 414 -17.057 0.855 -2.253 1.00 1.89 H new ATOM 291 N ASP A 415 -14.419 5.540 -2.738 1.00 0.39 N ATOM 292 CA ASP A 415 -14.699 6.357 -1.591 1.00 0.34 C ATOM 293 C ASP A 415 -14.030 5.886 -0.316 1.00 0.31 C ATOM 294 O ASP A 415 -14.614 5.962 0.764 1.00 0.35 O ATOM 295 CB ASP A 415 -16.199 6.501 -1.352 1.00 0.40 C ATOM 296 CG ASP A 415 -16.888 7.331 -2.417 1.00 0.45 C ATOM 297 OD1 ASP A 415 -17.259 6.778 -3.473 1.00 0.58 O ATOM 298 OD2 ASP A 415 -17.049 8.549 -2.209 1.00 0.59 O ATOM 0 H ASP A 415 -14.143 6.093 -3.549 1.00 0.39 H new ATOM 0 HA ASP A 415 -14.270 7.328 -1.838 1.00 0.34 H new ATOM 0 HB2 ASP A 415 -16.653 5.511 -1.319 1.00 0.40 H new ATOM 0 HB3 ASP A 415 -16.364 6.960 -0.377 1.00 0.40 H new ATOM 303 N THR A 416 -12.808 5.440 -0.431 1.00 0.27 N ATOM 304 CA THR A 416 -12.053 5.011 0.716 1.00 0.23 C ATOM 305 C THR A 416 -11.688 6.214 1.583 1.00 0.24 C ATOM 306 O THR A 416 -11.448 7.304 1.076 1.00 0.25 O ATOM 307 CB THR A 416 -10.789 4.291 0.241 1.00 0.19 C ATOM 308 OG1 THR A 416 -11.159 3.199 -0.608 1.00 0.22 O ATOM 309 CG2 THR A 416 -9.975 3.780 1.412 1.00 0.22 C ATOM 0 H THR A 416 -12.309 5.364 -1.318 1.00 0.27 H new ATOM 0 HA THR A 416 -12.653 4.327 1.316 1.00 0.23 H new ATOM 0 HB THR A 416 -10.173 5.000 -0.312 1.00 0.19 H new ATOM 0 HG1 THR A 416 -10.455 3.048 -1.273 1.00 0.22 H new ATOM 0 HG21 THR A 416 -9.084 3.273 1.042 1.00 0.22 H new ATOM 0 HG22 THR A 416 -9.680 4.618 2.044 1.00 0.22 H new ATOM 0 HG23 THR A 416 -10.575 3.080 1.994 1.00 0.22 H new ATOM 317 N SER A 417 -11.744 6.033 2.893 1.00 0.25 N ATOM 318 CA SER A 417 -11.359 7.086 3.814 1.00 0.28 C ATOM 319 C SER A 417 -9.835 7.168 3.910 1.00 0.27 C ATOM 320 O SER A 417 -9.268 8.245 4.079 1.00 0.33 O ATOM 321 CB SER A 417 -11.983 6.831 5.191 1.00 0.32 C ATOM 322 OG SER A 417 -13.389 6.667 5.082 1.00 1.14 O ATOM 0 H SER A 417 -12.052 5.169 3.340 1.00 0.25 H new ATOM 0 HA SER A 417 -11.729 8.042 3.442 1.00 0.28 H new ATOM 0 HB2 SER A 417 -11.541 5.940 5.637 1.00 0.32 H new ATOM 0 HB3 SER A 417 -11.760 7.664 5.857 1.00 0.32 H new ATOM 0 HG SER A 417 -13.769 6.504 5.970 1.00 1.14 H new ATOM 328 N GLU A 418 -9.178 6.018 3.782 1.00 0.23 N ATOM 329 CA GLU A 418 -7.725 5.939 3.838 1.00 0.25 C ATOM 330 C GLU A 418 -7.203 4.671 3.169 1.00 0.19 C ATOM 331 O GLU A 418 -7.712 3.594 3.421 1.00 0.28 O ATOM 332 CB GLU A 418 -7.280 5.929 5.291 1.00 0.36 C ATOM 333 CG GLU A 418 -6.666 7.216 5.732 1.00 0.84 C ATOM 334 CD GLU A 418 -6.355 7.247 7.214 1.00 0.86 C ATOM 335 OE1 GLU A 418 -5.701 6.311 7.712 1.00 1.31 O ATOM 336 OE2 GLU A 418 -6.749 8.224 7.888 1.00 1.37 O ATOM 0 H GLU A 418 -9.638 5.119 3.637 1.00 0.23 H new ATOM 0 HA GLU A 418 -7.324 6.804 3.309 1.00 0.25 H new ATOM 0 HB2 GLU A 418 -8.139 5.709 5.925 1.00 0.36 H new ATOM 0 HB3 GLU A 418 -6.561 5.123 5.437 1.00 0.36 H new ATOM 0 HG2 GLU A 418 -5.747 7.385 5.170 1.00 0.84 H new ATOM 0 HG3 GLU A 418 -7.342 8.036 5.491 1.00 0.84 H new ATOM 343 N TYR A 419 -6.186 4.781 2.336 1.00 0.17 N ATOM 344 CA TYR A 419 -5.508 3.583 1.853 1.00 0.16 C ATOM 345 C TYR A 419 -4.206 3.431 2.612 1.00 0.19 C ATOM 346 O TYR A 419 -3.225 4.116 2.313 1.00 0.29 O ATOM 347 CB TYR A 419 -5.206 3.609 0.342 1.00 0.16 C ATOM 348 CG TYR A 419 -6.436 3.702 -0.578 1.00 0.14 C ATOM 349 CD1 TYR A 419 -7.255 2.587 -0.827 1.00 0.12 C ATOM 350 CD2 TYR A 419 -6.783 4.897 -1.216 1.00 0.17 C ATOM 351 CE1 TYR A 419 -8.356 2.676 -1.667 1.00 0.12 C ATOM 352 CE2 TYR A 419 -7.880 4.972 -2.047 1.00 0.18 C ATOM 353 CZ TYR A 419 -8.659 3.868 -2.269 1.00 0.14 C ATOM 354 OH TYR A 419 -9.763 3.968 -3.088 1.00 0.19 O ATOM 0 H TYR A 419 -5.814 5.663 1.984 1.00 0.17 H new ATOM 0 HA TYR A 419 -6.181 2.742 2.022 1.00 0.16 H new ATOM 0 HB2 TYR A 419 -4.554 4.457 0.134 1.00 0.16 H new ATOM 0 HB3 TYR A 419 -4.649 2.708 0.085 1.00 0.16 H new ATOM 0 HD1 TYR A 419 -7.023 1.643 -0.356 1.00 0.12 H new ATOM 0 HD2 TYR A 419 -6.180 5.778 -1.054 1.00 0.17 H new ATOM 0 HE1 TYR A 419 -8.972 1.807 -1.845 1.00 0.12 H new ATOM 0 HE2 TYR A 419 -8.127 5.908 -2.526 1.00 0.18 H new ATOM 0 HH TYR A 419 -10.207 4.828 -2.936 1.00 0.19 H new ATOM 364 N ILE A 420 -4.204 2.573 3.616 1.00 0.18 N ATOM 365 CA ILE A 420 -2.988 2.305 4.348 1.00 0.18 C ATOM 366 C ILE A 420 -2.207 1.225 3.639 1.00 0.17 C ATOM 367 O ILE A 420 -2.681 0.095 3.475 1.00 0.21 O ATOM 368 CB ILE A 420 -3.238 1.891 5.814 1.00 0.22 C ATOM 369 CG1 ILE A 420 -3.727 3.092 6.615 1.00 0.32 C ATOM 370 CG2 ILE A 420 -1.956 1.337 6.443 1.00 0.26 C ATOM 371 CD1 ILE A 420 -4.842 2.776 7.573 1.00 0.32 C ATOM 0 H ILE A 420 -5.023 2.057 3.938 1.00 0.18 H new ATOM 0 HA ILE A 420 -2.421 3.235 4.379 1.00 0.18 H new ATOM 0 HB ILE A 420 -3.999 1.111 5.829 1.00 0.22 H new ATOM 0 HG12 ILE A 420 -2.889 3.508 7.174 1.00 0.32 H new ATOM 0 HG13 ILE A 420 -4.064 3.864 5.923 1.00 0.32 H new ATOM 0 HG21 ILE A 420 -2.152 1.051 7.476 1.00 0.26 H new ATOM 0 HG22 ILE A 420 -1.623 0.464 5.881 1.00 0.26 H new ATOM 0 HG23 ILE A 420 -1.179 2.101 6.420 1.00 0.26 H new ATOM 0 HD11 ILE A 420 -5.133 3.682 8.104 1.00 0.32 H new ATOM 0 HD12 ILE A 420 -5.698 2.389 7.020 1.00 0.32 H new ATOM 0 HD13 ILE A 420 -4.504 2.028 8.290 1.00 0.32 H new ATOM 383 N ILE A 421 -1.026 1.581 3.203 1.00 0.15 N ATOM 384 CA ILE A 421 -0.160 0.644 2.533 1.00 0.18 C ATOM 385 C ILE A 421 0.805 0.083 3.551 1.00 0.19 C ATOM 386 O ILE A 421 1.424 0.828 4.311 1.00 0.30 O ATOM 387 CB ILE A 421 0.633 1.290 1.386 1.00 0.19 C ATOM 388 CG1 ILE A 421 -0.319 1.775 0.282 1.00 0.20 C ATOM 389 CG2 ILE A 421 1.628 0.272 0.842 1.00 0.24 C ATOM 390 CD1 ILE A 421 0.272 2.834 -0.617 1.00 0.32 C ATOM 0 H ILE A 421 -0.640 2.520 3.301 1.00 0.15 H new ATOM 0 HA ILE A 421 -0.780 -0.138 2.094 1.00 0.18 H new ATOM 0 HB ILE A 421 1.176 2.159 1.756 1.00 0.19 H new ATOM 0 HG12 ILE A 421 -0.618 0.922 -0.327 1.00 0.20 H new ATOM 0 HG13 ILE A 421 -1.224 2.169 0.744 1.00 0.20 H new ATOM 0 HG21 ILE A 421 2.197 0.719 0.027 1.00 0.24 H new ATOM 0 HG22 ILE A 421 2.310 -0.031 1.637 1.00 0.24 H new ATOM 0 HG23 ILE A 421 1.090 -0.601 0.473 1.00 0.24 H new ATOM 0 HD11 ILE A 421 -0.462 3.123 -1.369 1.00 0.32 H new ATOM 0 HD12 ILE A 421 0.545 3.706 -0.022 1.00 0.32 H new ATOM 0 HD13 ILE A 421 1.160 2.439 -1.110 1.00 0.32 H new ATOM 402 N SER A 422 0.919 -1.216 3.569 1.00 0.14 N ATOM 403 CA SER A 422 1.751 -1.878 4.544 1.00 0.14 C ATOM 404 C SER A 422 2.940 -2.541 3.872 1.00 0.16 C ATOM 405 O SER A 422 2.822 -3.593 3.251 1.00 0.36 O ATOM 406 CB SER A 422 0.952 -2.904 5.352 1.00 0.18 C ATOM 407 OG SER A 422 0.444 -3.956 4.543 1.00 0.88 O ATOM 0 H SER A 422 0.445 -1.842 2.918 1.00 0.14 H new ATOM 0 HA SER A 422 2.120 -1.120 5.235 1.00 0.14 H new ATOM 0 HB2 SER A 422 1.588 -3.324 6.131 1.00 0.18 H new ATOM 0 HB3 SER A 422 0.124 -2.402 5.853 1.00 0.18 H new ATOM 0 HG SER A 422 1.135 -4.246 3.911 1.00 0.88 H new ATOM 413 N CYS A 423 4.081 -1.902 3.974 1.00 0.14 N ATOM 414 CA CYS A 423 5.313 -2.482 3.483 1.00 0.12 C ATOM 415 C CYS A 423 5.980 -3.310 4.573 1.00 0.12 C ATOM 416 O CYS A 423 6.645 -2.770 5.456 1.00 0.13 O ATOM 417 CB CYS A 423 6.255 -1.394 2.997 1.00 0.14 C ATOM 418 SG CYS A 423 5.646 -0.471 1.569 1.00 0.95 S ATOM 0 H CYS A 423 4.184 -0.978 4.393 1.00 0.14 H new ATOM 0 HA CYS A 423 5.077 -3.136 2.644 1.00 0.12 H new ATOM 0 HB2 CYS A 423 6.439 -0.697 3.814 1.00 0.14 H new ATOM 0 HB3 CYS A 423 7.213 -1.846 2.741 1.00 0.14 H new ATOM 0 HG CYS A 423 6.528 -0.515 0.615 1.00 0.95 H new ATOM 424 N HIS A 424 5.784 -4.618 4.515 1.00 0.13 N ATOM 425 CA HIS A 424 6.378 -5.530 5.490 1.00 0.15 C ATOM 426 C HIS A 424 7.725 -6.029 5.001 1.00 0.15 C ATOM 427 O HIS A 424 7.809 -6.770 4.025 1.00 0.16 O ATOM 428 CB HIS A 424 5.472 -6.728 5.751 1.00 0.18 C ATOM 429 CG HIS A 424 4.252 -6.431 6.562 1.00 0.19 C ATOM 430 ND1 HIS A 424 4.166 -6.683 7.914 1.00 0.24 N ATOM 431 CD2 HIS A 424 3.051 -5.918 6.201 1.00 0.24 C ATOM 432 CE1 HIS A 424 2.968 -6.345 8.347 1.00 0.25 C ATOM 433 NE2 HIS A 424 2.273 -5.876 7.330 1.00 0.25 N ATOM 0 H HIS A 424 5.217 -5.077 3.802 1.00 0.13 H new ATOM 0 HA HIS A 424 6.506 -4.973 6.418 1.00 0.15 H new ATOM 0 HB2 HIS A 424 5.161 -7.145 4.793 1.00 0.18 H new ATOM 0 HB3 HIS A 424 6.051 -7.498 6.261 1.00 0.18 H new ATOM 0 HD2 HIS A 424 2.761 -5.601 5.210 1.00 0.24 H new ATOM 0 HE1 HIS A 424 2.615 -6.437 9.364 1.00 0.25 H new ATOM 0 HE2 HIS A 424 1.312 -5.537 7.375 1.00 0.25 H new ATOM 442 N PRO A 425 8.787 -5.618 5.678 1.00 0.17 N ATOM 443 CA PRO A 425 10.146 -6.032 5.361 1.00 0.17 C ATOM 444 C PRO A 425 10.402 -7.484 5.690 1.00 0.18 C ATOM 445 O PRO A 425 10.108 -7.975 6.781 1.00 0.24 O ATOM 446 CB PRO A 425 11.038 -5.131 6.217 1.00 0.21 C ATOM 447 CG PRO A 425 10.124 -4.174 6.911 1.00 0.32 C ATOM 448 CD PRO A 425 8.734 -4.717 6.818 1.00 0.22 C ATOM 0 HA PRO A 425 10.340 -5.938 4.293 1.00 0.17 H new ATOM 0 HB2 PRO A 425 11.606 -5.718 6.938 1.00 0.21 H new ATOM 0 HB3 PRO A 425 11.761 -4.599 5.599 1.00 0.21 H new ATOM 0 HG2 PRO A 425 10.418 -4.054 7.954 1.00 0.32 H new ATOM 0 HG3 PRO A 425 10.181 -3.189 6.448 1.00 0.32 H new ATOM 0 HD2 PRO A 425 8.448 -5.242 7.729 1.00 0.22 H new ATOM 0 HD3 PRO A 425 8.004 -3.922 6.666 1.00 0.22 H new ATOM 456 N VAL A 426 10.946 -8.144 4.706 1.00 0.15 N ATOM 457 CA VAL A 426 11.310 -9.534 4.794 1.00 0.19 C ATOM 458 C VAL A 426 12.832 -9.646 4.846 1.00 0.20 C ATOM 459 O VAL A 426 13.532 -8.971 4.091 1.00 0.20 O ATOM 460 CB VAL A 426 10.816 -10.291 3.557 1.00 0.20 C ATOM 461 CG1 VAL A 426 10.946 -11.796 3.725 1.00 0.27 C ATOM 462 CG2 VAL A 426 9.401 -9.900 3.182 1.00 0.21 C ATOM 0 H VAL A 426 11.154 -7.723 3.800 1.00 0.15 H new ATOM 0 HA VAL A 426 10.858 -9.961 5.689 1.00 0.19 H new ATOM 0 HB VAL A 426 11.464 -9.998 2.731 1.00 0.20 H new ATOM 0 HG11 VAL A 426 10.585 -12.295 2.826 1.00 0.27 H new ATOM 0 HG12 VAL A 426 11.992 -12.055 3.888 1.00 0.27 H new ATOM 0 HG13 VAL A 426 10.354 -12.119 4.582 1.00 0.27 H new ATOM 0 HG21 VAL A 426 9.090 -10.460 2.300 1.00 0.21 H new ATOM 0 HG22 VAL A 426 8.729 -10.126 4.010 1.00 0.21 H new ATOM 0 HG23 VAL A 426 9.364 -8.832 2.965 1.00 0.21 H new ATOM 472 N GLY A 427 13.343 -10.471 5.737 1.00 0.26 N ATOM 473 CA GLY A 427 14.783 -10.662 5.837 1.00 0.29 C ATOM 474 C GLY A 427 15.387 -9.847 6.959 1.00 0.32 C ATOM 475 O GLY A 427 16.250 -10.327 7.696 1.00 0.38 O ATOM 0 H GLY A 427 12.792 -11.017 6.399 1.00 0.26 H new ATOM 0 HA2 GLY A 427 14.998 -11.718 6.000 1.00 0.29 H new ATOM 0 HA3 GLY A 427 15.252 -10.383 4.893 1.00 0.29 H new ATOM 479 N THR A 428 14.920 -8.616 7.093 1.00 0.31 N ATOM 480 CA THR A 428 15.368 -7.728 8.147 1.00 0.37 C ATOM 481 C THR A 428 14.449 -7.776 9.346 1.00 0.41 C ATOM 482 O THR A 428 13.433 -8.476 9.348 1.00 0.41 O ATOM 483 CB THR A 428 15.407 -6.275 7.674 1.00 0.37 C ATOM 484 OG1 THR A 428 14.267 -5.991 6.851 1.00 0.30 O ATOM 485 CG2 THR A 428 16.685 -5.970 6.912 1.00 0.42 C ATOM 0 H THR A 428 14.220 -8.207 6.473 1.00 0.31 H new ATOM 0 HA THR A 428 16.366 -8.071 8.420 1.00 0.37 H new ATOM 0 HB THR A 428 15.383 -5.638 8.558 1.00 0.37 H new ATOM 0 HG1 THR A 428 14.567 -5.728 5.956 1.00 0.30 H new ATOM 0 HG21 THR A 428 16.678 -4.928 6.591 1.00 0.42 H new ATOM 0 HG22 THR A 428 17.545 -6.144 7.559 1.00 0.42 H new ATOM 0 HG23 THR A 428 16.751 -6.618 6.038 1.00 0.42 H new ATOM 493 N ASP A 429 14.821 -7.028 10.369 1.00 0.48 N ATOM 494 CA ASP A 429 13.961 -6.830 11.514 1.00 0.54 C ATOM 495 C ASP A 429 13.241 -5.491 11.422 1.00 0.49 C ATOM 496 O ASP A 429 12.732 -4.973 12.418 1.00 0.59 O ATOM 497 CB ASP A 429 14.760 -6.899 12.809 1.00 0.69 C ATOM 498 CG ASP A 429 13.882 -7.091 14.030 1.00 1.09 C ATOM 499 OD1 ASP A 429 13.307 -8.190 14.185 1.00 1.06 O ATOM 500 OD2 ASP A 429 13.763 -6.153 14.845 1.00 1.78 O ATOM 0 H ASP A 429 15.718 -6.547 10.427 1.00 0.48 H new ATOM 0 HA ASP A 429 13.220 -7.629 11.517 1.00 0.54 H new ATOM 0 HB2 ASP A 429 15.474 -7.721 12.747 1.00 0.69 H new ATOM 0 HB3 ASP A 429 15.338 -5.982 12.923 1.00 0.69 H new ATOM 505 N GLU A 430 13.195 -4.928 10.223 1.00 0.40 N ATOM 506 CA GLU A 430 12.530 -3.660 10.013 1.00 0.38 C ATOM 507 C GLU A 430 11.049 -3.801 10.239 1.00 0.31 C ATOM 508 O GLU A 430 10.454 -4.847 9.972 1.00 0.33 O ATOM 509 CB GLU A 430 12.790 -3.130 8.602 1.00 0.38 C ATOM 510 CG GLU A 430 14.233 -2.761 8.303 1.00 0.48 C ATOM 511 CD GLU A 430 14.439 -2.416 6.845 1.00 1.58 C ATOM 512 OE1 GLU A 430 14.659 -3.344 6.039 1.00 2.50 O ATOM 513 OE2 GLU A 430 14.385 -1.218 6.496 1.00 1.64 O ATOM 0 H GLU A 430 13.611 -5.333 9.384 1.00 0.40 H new ATOM 0 HA GLU A 430 12.936 -2.947 10.731 1.00 0.38 H new ATOM 0 HB2 GLU A 430 12.469 -3.884 7.883 1.00 0.38 H new ATOM 0 HB3 GLU A 430 12.167 -2.250 8.441 1.00 0.38 H new ATOM 0 HG2 GLU A 430 14.526 -1.912 8.921 1.00 0.48 H new ATOM 0 HG3 GLU A 430 14.884 -3.592 8.574 1.00 0.48 H new ATOM 520 N GLU A 431 10.464 -2.745 10.755 1.00 0.29 N ATOM 521 CA GLU A 431 9.069 -2.727 11.010 1.00 0.26 C ATOM 522 C GLU A 431 8.342 -2.276 9.753 1.00 0.24 C ATOM 523 O GLU A 431 8.906 -1.562 8.919 1.00 0.26 O ATOM 524 CB GLU A 431 8.754 -1.813 12.195 1.00 0.29 C ATOM 525 CG GLU A 431 8.513 -0.377 11.794 1.00 0.63 C ATOM 526 CD GLU A 431 8.018 0.474 12.944 1.00 0.87 C ATOM 527 OE1 GLU A 431 8.847 1.139 13.599 1.00 1.11 O ATOM 528 OE2 GLU A 431 6.797 0.474 13.203 1.00 1.05 O ATOM 0 H GLU A 431 10.952 -1.885 11.004 1.00 0.29 H new ATOM 0 HA GLU A 431 8.729 -3.729 11.273 1.00 0.26 H new ATOM 0 HB2 GLU A 431 7.872 -2.191 12.712 1.00 0.29 H new ATOM 0 HB3 GLU A 431 9.581 -1.851 12.904 1.00 0.29 H new ATOM 0 HG2 GLU A 431 9.438 0.048 11.405 1.00 0.63 H new ATOM 0 HG3 GLU A 431 7.783 -0.347 10.985 1.00 0.63 H new ATOM 535 N PRO A 432 7.098 -2.713 9.605 1.00 0.23 N ATOM 536 CA PRO A 432 6.289 -2.413 8.438 1.00 0.21 C ATOM 537 C PRO A 432 6.078 -0.926 8.264 1.00 0.20 C ATOM 538 O PRO A 432 5.483 -0.263 9.118 1.00 0.24 O ATOM 539 CB PRO A 432 4.946 -3.103 8.701 1.00 0.24 C ATOM 540 CG PRO A 432 4.993 -3.613 10.109 1.00 0.23 C ATOM 541 CD PRO A 432 6.413 -3.529 10.592 1.00 0.24 C ATOM 0 HA PRO A 432 6.775 -2.759 7.526 1.00 0.21 H new ATOM 0 HB2 PRO A 432 4.120 -2.404 8.570 1.00 0.24 H new ATOM 0 HB3 PRO A 432 4.787 -3.921 7.998 1.00 0.24 H new ATOM 0 HG2 PRO A 432 4.338 -3.022 10.749 1.00 0.23 H new ATOM 0 HG3 PRO A 432 4.637 -4.642 10.152 1.00 0.23 H new ATOM 0 HD2 PRO A 432 6.467 -3.078 11.583 1.00 0.24 H new ATOM 0 HD3 PRO A 432 6.864 -4.519 10.667 1.00 0.24 H new ATOM 549 N LEU A 433 6.570 -0.409 7.155 1.00 0.20 N ATOM 550 CA LEU A 433 6.321 0.955 6.788 1.00 0.20 C ATOM 551 C LEU A 433 4.890 1.085 6.346 1.00 0.20 C ATOM 552 O LEU A 433 4.464 0.462 5.372 1.00 0.30 O ATOM 553 CB LEU A 433 7.236 1.389 5.662 1.00 0.22 C ATOM 554 CG LEU A 433 8.630 1.859 6.076 1.00 0.24 C ATOM 555 CD1 LEU A 433 9.496 0.694 6.523 1.00 0.65 C ATOM 556 CD2 LEU A 433 9.298 2.621 4.940 1.00 0.73 C ATOM 0 H LEU A 433 7.149 -0.926 6.493 1.00 0.20 H new ATOM 0 HA LEU A 433 6.513 1.593 7.651 1.00 0.20 H new ATOM 0 HB2 LEU A 433 7.346 0.556 4.968 1.00 0.22 H new ATOM 0 HB3 LEU A 433 6.749 2.197 5.115 1.00 0.22 H new ATOM 0 HG LEU A 433 8.516 2.533 6.925 1.00 0.24 H new ATOM 0 HD11 LEU A 433 10.481 1.062 6.811 1.00 0.65 H new ATOM 0 HD12 LEU A 433 9.030 0.200 7.376 1.00 0.65 H new ATOM 0 HD13 LEU A 433 9.600 -0.018 5.704 1.00 0.65 H new ATOM 0 HD21 LEU A 433 10.289 2.947 5.254 1.00 0.73 H new ATOM 0 HD22 LEU A 433 9.389 1.971 4.070 1.00 0.73 H new ATOM 0 HD23 LEU A 433 8.695 3.491 4.681 1.00 0.73 H new ATOM 568 N GLN A 434 4.155 1.862 7.078 1.00 0.17 N ATOM 569 CA GLN A 434 2.765 2.067 6.781 1.00 0.17 C ATOM 570 C GLN A 434 2.537 3.452 6.250 1.00 0.20 C ATOM 571 O GLN A 434 2.800 4.454 6.918 1.00 0.27 O ATOM 572 CB GLN A 434 1.901 1.800 7.998 1.00 0.18 C ATOM 573 CG GLN A 434 1.516 0.343 8.124 1.00 0.21 C ATOM 574 CD GLN A 434 0.824 0.034 9.440 1.00 0.38 C ATOM 575 OE1 GLN A 434 0.123 0.882 9.995 1.00 1.26 O ATOM 576 NE2 GLN A 434 1.021 -1.165 9.964 1.00 0.74 N ATOM 0 H GLN A 434 4.495 2.371 7.894 1.00 0.17 H new ATOM 0 HA GLN A 434 2.475 1.355 6.008 1.00 0.17 H new ATOM 0 HB2 GLN A 434 2.436 2.110 8.895 1.00 0.18 H new ATOM 0 HB3 GLN A 434 0.998 2.408 7.939 1.00 0.18 H new ATOM 0 HG2 GLN A 434 0.857 0.072 7.299 1.00 0.21 H new ATOM 0 HG3 GLN A 434 2.410 -0.274 8.034 1.00 0.21 H new ATOM 0 HE21 GLN A 434 1.607 -1.844 9.478 1.00 0.74 H new ATOM 0 HE22 GLN A 434 0.587 -1.410 10.854 1.00 0.74 H new ATOM 585 N PHE A 435 2.069 3.484 5.035 1.00 0.20 N ATOM 586 CA PHE A 435 1.821 4.735 4.341 1.00 0.23 C ATOM 587 C PHE A 435 0.333 4.971 4.210 1.00 0.21 C ATOM 588 O PHE A 435 -0.399 4.131 3.700 1.00 0.24 O ATOM 589 CB PHE A 435 2.469 4.748 2.956 1.00 0.25 C ATOM 590 CG PHE A 435 3.972 4.763 2.964 1.00 0.31 C ATOM 591 CD1 PHE A 435 4.690 3.578 2.967 1.00 0.36 C ATOM 592 CD2 PHE A 435 4.665 5.962 2.946 1.00 0.38 C ATOM 593 CE1 PHE A 435 6.072 3.588 2.949 1.00 0.43 C ATOM 594 CE2 PHE A 435 6.046 5.979 2.933 1.00 0.46 C ATOM 595 CZ PHE A 435 6.750 4.790 2.935 1.00 0.47 C ATOM 0 H PHE A 435 1.846 2.651 4.490 1.00 0.20 H new ATOM 0 HA PHE A 435 2.268 5.535 4.931 1.00 0.23 H new ATOM 0 HB2 PHE A 435 2.131 3.871 2.404 1.00 0.25 H new ATOM 0 HB3 PHE A 435 2.114 5.623 2.412 1.00 0.25 H new ATOM 0 HD1 PHE A 435 4.163 2.635 2.984 1.00 0.36 H new ATOM 0 HD2 PHE A 435 4.119 6.894 2.942 1.00 0.38 H new ATOM 0 HE1 PHE A 435 6.620 2.657 2.946 1.00 0.43 H new ATOM 0 HE2 PHE A 435 6.575 6.920 2.921 1.00 0.46 H new ATOM 0 HZ PHE A 435 7.830 4.801 2.926 1.00 0.47 H new ATOM 605 N ARG A 436 -0.102 6.111 4.688 1.00 0.22 N ATOM 606 CA ARG A 436 -1.495 6.495 4.601 1.00 0.21 C ATOM 607 C ARG A 436 -1.671 7.545 3.519 1.00 0.19 C ATOM 608 O ARG A 436 -1.243 8.688 3.676 1.00 0.27 O ATOM 609 CB ARG A 436 -1.982 7.037 5.943 1.00 0.27 C ATOM 610 CG ARG A 436 -2.267 5.944 6.953 1.00 0.72 C ATOM 611 CD ARG A 436 -2.303 6.463 8.372 1.00 0.74 C ATOM 612 NE ARG A 436 -3.459 7.316 8.620 1.00 1.52 N ATOM 613 CZ ARG A 436 -3.452 8.385 9.413 1.00 2.15 C ATOM 614 NH1 ARG A 436 -2.343 8.745 10.047 1.00 2.32 N ATOM 615 NH2 ARG A 436 -4.565 9.089 9.578 1.00 3.14 N ATOM 0 H ARG A 436 0.495 6.799 5.147 1.00 0.22 H new ATOM 0 HA ARG A 436 -2.088 5.616 4.347 1.00 0.21 H new ATOM 0 HB2 ARG A 436 -1.231 7.714 6.350 1.00 0.27 H new ATOM 0 HB3 ARG A 436 -2.887 7.624 5.785 1.00 0.27 H new ATOM 0 HG2 ARG A 436 -3.222 5.475 6.717 1.00 0.72 H new ATOM 0 HG3 ARG A 436 -1.503 5.170 6.872 1.00 0.72 H new ATOM 0 HD2 ARG A 436 -2.320 5.621 9.064 1.00 0.74 H new ATOM 0 HD3 ARG A 436 -1.390 7.024 8.575 1.00 0.74 H new ATOM 0 HE ARG A 436 -4.334 7.077 8.153 1.00 1.52 H new ATOM 0 HH11 ARG A 436 -1.488 8.201 9.928 1.00 2.32 H new ATOM 0 HH12 ARG A 436 -2.345 9.565 10.653 1.00 2.32 H new ATOM 0 HH21 ARG A 436 -5.421 8.810 9.098 1.00 3.14 H new ATOM 0 HH22 ARG A 436 -4.565 9.909 10.185 1.00 3.14 H new ATOM 629 N VAL A 437 -2.280 7.150 2.419 1.00 0.17 N ATOM 630 CA VAL A 437 -2.573 8.066 1.342 1.00 0.16 C ATOM 631 C VAL A 437 -4.061 8.333 1.297 1.00 0.16 C ATOM 632 O VAL A 437 -4.870 7.545 1.802 1.00 0.17 O ATOM 633 CB VAL A 437 -2.079 7.558 -0.036 1.00 0.16 C ATOM 634 CG1 VAL A 437 -0.600 7.211 0.016 1.00 0.20 C ATOM 635 CG2 VAL A 437 -2.889 6.370 -0.525 1.00 0.14 C ATOM 0 H VAL A 437 -2.583 6.191 2.250 1.00 0.17 H new ATOM 0 HA VAL A 437 -2.030 8.989 1.545 1.00 0.16 H new ATOM 0 HB VAL A 437 -2.223 8.369 -0.750 1.00 0.16 H new ATOM 0 HG11 VAL A 437 -0.275 6.857 -0.962 1.00 0.20 H new ATOM 0 HG12 VAL A 437 -0.028 8.097 0.289 1.00 0.20 H new ATOM 0 HG13 VAL A 437 -0.435 6.430 0.758 1.00 0.20 H new ATOM 0 HG21 VAL A 437 -2.510 6.045 -1.494 1.00 0.14 H new ATOM 0 HG22 VAL A 437 -2.804 5.552 0.191 1.00 0.14 H new ATOM 0 HG23 VAL A 437 -3.935 6.659 -0.623 1.00 0.14 H new ATOM 645 N PRO A 438 -4.411 9.481 0.742 1.00 0.17 N ATOM 646 CA PRO A 438 -5.793 9.954 0.643 1.00 0.18 C ATOM 647 C PRO A 438 -6.714 8.888 0.041 1.00 0.16 C ATOM 648 O PRO A 438 -6.331 8.181 -0.894 1.00 0.14 O ATOM 649 CB PRO A 438 -5.650 11.177 -0.293 1.00 0.19 C ATOM 650 CG PRO A 438 -4.268 11.661 -0.019 1.00 0.21 C ATOM 651 CD PRO A 438 -3.452 10.432 0.178 1.00 0.19 C ATOM 0 HA PRO A 438 -6.244 10.190 1.607 1.00 0.18 H new ATOM 0 HB2 PRO A 438 -5.779 10.900 -1.339 1.00 0.19 H new ATOM 0 HB3 PRO A 438 -6.395 11.942 -0.072 1.00 0.19 H new ATOM 0 HG2 PRO A 438 -3.888 12.256 -0.849 1.00 0.21 H new ATOM 0 HG3 PRO A 438 -4.242 12.296 0.866 1.00 0.21 H new ATOM 0 HD2 PRO A 438 -3.033 10.072 -0.762 1.00 0.19 H new ATOM 0 HD3 PRO A 438 -2.615 10.608 0.854 1.00 0.19 H new ATOM 659 N GLY A 439 -7.926 8.789 0.572 1.00 0.19 N ATOM 660 CA GLY A 439 -8.828 7.712 0.224 1.00 0.20 C ATOM 661 C GLY A 439 -9.347 7.748 -1.203 1.00 0.18 C ATOM 662 O GLY A 439 -10.034 6.822 -1.634 1.00 0.20 O ATOM 0 H GLY A 439 -8.304 9.450 1.250 1.00 0.19 H new ATOM 0 HA2 GLY A 439 -8.317 6.763 0.385 1.00 0.20 H new ATOM 0 HA3 GLY A 439 -9.679 7.736 0.905 1.00 0.20 H new ATOM 666 N THR A 440 -9.070 8.811 -1.930 1.00 0.16 N ATOM 667 CA THR A 440 -9.464 8.863 -3.323 1.00 0.18 C ATOM 668 C THR A 440 -8.271 8.566 -4.250 1.00 0.16 C ATOM 669 O THR A 440 -8.453 8.230 -5.419 1.00 0.19 O ATOM 670 CB THR A 440 -10.077 10.228 -3.675 1.00 0.24 C ATOM 671 OG1 THR A 440 -9.243 11.285 -3.181 1.00 0.27 O ATOM 672 CG2 THR A 440 -11.474 10.360 -3.088 1.00 0.29 C ATOM 0 H THR A 440 -8.582 9.638 -1.587 1.00 0.16 H new ATOM 0 HA THR A 440 -10.221 8.093 -3.475 1.00 0.18 H new ATOM 0 HB THR A 440 -10.147 10.301 -4.760 1.00 0.24 H new ATOM 0 HG1 THR A 440 -9.641 12.150 -3.412 1.00 0.27 H new ATOM 0 HG21 THR A 440 -11.888 11.334 -3.350 1.00 0.29 H new ATOM 0 HG22 THR A 440 -12.113 9.574 -3.490 1.00 0.29 H new ATOM 0 HG23 THR A 440 -11.423 10.267 -2.003 1.00 0.29 H new ATOM 680 N SER A 441 -7.054 8.696 -3.717 1.00 0.13 N ATOM 681 CA SER A 441 -5.835 8.400 -4.462 1.00 0.12 C ATOM 682 C SER A 441 -5.767 6.931 -4.861 1.00 0.11 C ATOM 683 O SER A 441 -6.205 6.058 -4.120 1.00 0.12 O ATOM 684 CB SER A 441 -4.626 8.752 -3.602 1.00 0.13 C ATOM 685 OG SER A 441 -4.610 10.136 -3.290 1.00 0.16 O ATOM 0 H SER A 441 -6.889 9.008 -2.760 1.00 0.13 H new ATOM 0 HA SER A 441 -5.837 8.996 -5.375 1.00 0.12 H new ATOM 0 HB2 SER A 441 -4.647 8.168 -2.682 1.00 0.13 H new ATOM 0 HB3 SER A 441 -3.710 8.484 -4.128 1.00 0.13 H new ATOM 0 HG SER A 441 -3.753 10.368 -2.876 1.00 0.16 H new ATOM 691 N THR A 442 -5.216 6.656 -6.030 1.00 0.10 N ATOM 692 CA THR A 442 -5.099 5.287 -6.495 1.00 0.12 C ATOM 693 C THR A 442 -3.654 4.939 -6.845 1.00 0.13 C ATOM 694 O THR A 442 -3.383 3.908 -7.461 1.00 0.16 O ATOM 695 CB THR A 442 -6.022 5.021 -7.703 1.00 0.13 C ATOM 696 OG1 THR A 442 -5.842 6.042 -8.695 1.00 0.14 O ATOM 697 CG2 THR A 442 -7.481 4.985 -7.266 1.00 0.17 C ATOM 0 H THR A 442 -4.845 7.358 -6.670 1.00 0.10 H new ATOM 0 HA THR A 442 -5.416 4.643 -5.675 1.00 0.12 H new ATOM 0 HB THR A 442 -5.758 4.053 -8.129 1.00 0.13 H new ATOM 0 HG1 THR A 442 -6.430 5.864 -9.458 1.00 0.14 H new ATOM 0 HG21 THR A 442 -8.116 4.796 -8.132 1.00 0.17 H new ATOM 0 HG22 THR A 442 -7.622 4.191 -6.533 1.00 0.17 H new ATOM 0 HG23 THR A 442 -7.751 5.942 -6.820 1.00 0.17 H new ATOM 705 N SER A 443 -2.722 5.799 -6.442 1.00 0.12 N ATOM 706 CA SER A 443 -1.306 5.577 -6.715 1.00 0.15 C ATOM 707 C SER A 443 -0.457 6.381 -5.737 1.00 0.15 C ATOM 708 O SER A 443 -0.826 7.497 -5.360 1.00 0.19 O ATOM 709 CB SER A 443 -0.955 5.966 -8.160 1.00 0.17 C ATOM 710 OG SER A 443 -1.894 5.443 -9.088 1.00 1.08 O ATOM 0 H SER A 443 -2.922 6.655 -5.926 1.00 0.12 H new ATOM 0 HA SER A 443 -1.095 4.515 -6.588 1.00 0.15 H new ATOM 0 HB2 SER A 443 -0.924 7.052 -8.247 1.00 0.17 H new ATOM 0 HB3 SER A 443 0.041 5.598 -8.404 1.00 0.17 H new ATOM 0 HG SER A 443 -2.290 4.623 -8.726 1.00 1.08 H new ATOM 716 N ALA A 444 0.661 5.810 -5.311 1.00 0.14 N ATOM 717 CA ALA A 444 1.531 6.471 -4.347 1.00 0.15 C ATOM 718 C ALA A 444 2.976 6.125 -4.552 1.00 0.16 C ATOM 719 O ALA A 444 3.359 4.961 -4.651 1.00 0.15 O ATOM 720 CB ALA A 444 1.120 6.121 -2.931 1.00 0.16 C ATOM 0 H ALA A 444 0.987 4.893 -5.616 1.00 0.14 H new ATOM 0 HA ALA A 444 1.420 7.543 -4.507 1.00 0.15 H new ATOM 0 HB1 ALA A 444 1.781 6.624 -2.225 1.00 0.16 H new ATOM 0 HB2 ALA A 444 0.093 6.444 -2.760 1.00 0.16 H new ATOM 0 HB3 ALA A 444 1.189 5.043 -2.788 1.00 0.16 H new ATOM 726 N THR A 445 3.761 7.168 -4.631 1.00 0.24 N ATOM 727 CA THR A 445 5.184 7.048 -4.589 1.00 0.25 C ATOM 728 C THR A 445 5.648 6.839 -3.165 1.00 0.26 C ATOM 729 O THR A 445 5.506 7.707 -2.298 1.00 0.33 O ATOM 730 CB THR A 445 5.836 8.296 -5.164 1.00 0.31 C ATOM 731 OG1 THR A 445 5.529 8.412 -6.563 1.00 0.34 O ATOM 732 CG2 THR A 445 7.345 8.263 -4.954 1.00 0.34 C ATOM 0 H THR A 445 3.424 8.126 -4.727 1.00 0.24 H new ATOM 0 HA THR A 445 5.477 6.187 -5.189 1.00 0.25 H new ATOM 0 HB THR A 445 5.439 9.166 -4.641 1.00 0.31 H new ATOM 0 HG1 THR A 445 5.952 9.219 -6.925 1.00 0.34 H new ATOM 0 HG21 THR A 445 7.790 9.165 -5.373 1.00 0.34 H new ATOM 0 HG22 THR A 445 7.563 8.212 -3.887 1.00 0.34 H new ATOM 0 HG23 THR A 445 7.763 7.388 -5.451 1.00 0.34 H new ATOM 740 N LEU A 446 6.179 5.668 -2.937 1.00 0.22 N ATOM 741 CA LEU A 446 6.619 5.280 -1.615 1.00 0.25 C ATOM 742 C LEU A 446 8.117 5.468 -1.431 1.00 0.24 C ATOM 743 O LEU A 446 8.925 4.682 -1.921 1.00 0.23 O ATOM 744 CB LEU A 446 6.202 3.821 -1.328 1.00 0.25 C ATOM 745 CG LEU A 446 4.834 3.632 -0.627 1.00 0.32 C ATOM 746 CD1 LEU A 446 3.754 4.451 -1.309 1.00 0.65 C ATOM 747 CD2 LEU A 446 4.439 2.163 -0.634 1.00 0.59 C ATOM 0 H LEU A 446 6.320 4.957 -3.654 1.00 0.22 H new ATOM 0 HA LEU A 446 6.131 5.936 -0.894 1.00 0.25 H new ATOM 0 HB2 LEU A 446 6.182 3.277 -2.272 1.00 0.25 H new ATOM 0 HB3 LEU A 446 6.972 3.359 -0.710 1.00 0.25 H new ATOM 0 HG LEU A 446 4.934 3.977 0.402 1.00 0.32 H new ATOM 0 HD11 LEU A 446 2.804 4.299 -0.796 1.00 0.65 H new ATOM 0 HD12 LEU A 446 4.021 5.507 -1.273 1.00 0.65 H new ATOM 0 HD13 LEU A 446 3.660 4.136 -2.348 1.00 0.65 H new ATOM 0 HD21 LEU A 446 3.476 2.043 -0.138 1.00 0.59 H new ATOM 0 HD22 LEU A 446 4.364 1.811 -1.663 1.00 0.59 H new ATOM 0 HD23 LEU A 446 5.194 1.581 -0.106 1.00 0.59 H new ATOM 759 N THR A 447 8.467 6.533 -0.723 1.00 0.30 N ATOM 760 CA THR A 447 9.850 6.829 -0.390 1.00 0.30 C ATOM 761 C THR A 447 10.252 6.167 0.924 1.00 0.29 C ATOM 762 O THR A 447 9.444 6.030 1.841 1.00 0.36 O ATOM 763 CB THR A 447 10.067 8.347 -0.252 1.00 0.39 C ATOM 764 OG1 THR A 447 8.835 8.982 0.109 1.00 0.86 O ATOM 765 CG2 THR A 447 10.616 8.961 -1.522 1.00 0.60 C ATOM 0 H THR A 447 7.799 7.215 -0.364 1.00 0.30 H new ATOM 0 HA THR A 447 10.465 6.438 -1.201 1.00 0.30 H new ATOM 0 HB THR A 447 10.807 8.506 0.532 1.00 0.39 H new ATOM 0 HG1 THR A 447 8.286 9.109 -0.692 1.00 0.86 H new ATOM 0 HG21 THR A 447 10.753 10.033 -1.378 1.00 0.60 H new ATOM 0 HG22 THR A 447 11.575 8.502 -1.763 1.00 0.60 H new ATOM 0 HG23 THR A 447 9.916 8.791 -2.340 1.00 0.60 H new ATOM 773 N GLY A 448 11.500 5.749 0.993 1.00 0.30 N ATOM 774 CA GLY A 448 12.068 5.268 2.239 1.00 0.38 C ATOM 775 C GLY A 448 12.187 3.766 2.314 1.00 0.30 C ATOM 776 O GLY A 448 12.545 3.223 3.357 1.00 0.38 O ATOM 0 H GLY A 448 12.142 5.732 0.200 1.00 0.30 H new ATOM 0 HA2 GLY A 448 13.056 5.708 2.371 1.00 0.38 H new ATOM 0 HA3 GLY A 448 11.451 5.616 3.067 1.00 0.38 H new ATOM 780 N LEU A 449 11.899 3.086 1.222 1.00 0.28 N ATOM 781 CA LEU A 449 12.123 1.661 1.159 1.00 0.25 C ATOM 782 C LEU A 449 13.600 1.390 0.947 1.00 0.25 C ATOM 783 O LEU A 449 14.191 1.830 -0.043 1.00 0.34 O ATOM 784 CB LEU A 449 11.287 1.034 0.054 1.00 0.24 C ATOM 785 CG LEU A 449 9.779 1.164 0.243 1.00 0.21 C ATOM 786 CD1 LEU A 449 9.056 0.790 -1.030 1.00 0.27 C ATOM 787 CD2 LEU A 449 9.313 0.277 1.375 1.00 0.23 C ATOM 0 H LEU A 449 11.512 3.497 0.372 1.00 0.28 H new ATOM 0 HA LEU A 449 11.815 1.208 2.101 1.00 0.25 H new ATOM 0 HB2 LEU A 449 11.561 1.494 -0.896 1.00 0.24 H new ATOM 0 HB3 LEU A 449 11.540 -0.024 -0.019 1.00 0.24 H new ATOM 0 HG LEU A 449 9.551 2.201 0.488 1.00 0.21 H new ATOM 0 HD11 LEU A 449 7.981 0.888 -0.880 1.00 0.27 H new ATOM 0 HD12 LEU A 449 9.372 1.453 -1.836 1.00 0.27 H new ATOM 0 HD13 LEU A 449 9.293 -0.241 -1.294 1.00 0.27 H new ATOM 0 HD21 LEU A 449 8.235 0.380 1.498 1.00 0.23 H new ATOM 0 HD22 LEU A 449 9.554 -0.761 1.147 1.00 0.23 H new ATOM 0 HD23 LEU A 449 9.813 0.571 2.298 1.00 0.23 H new ATOM 799 N THR A 450 14.195 0.697 1.899 1.00 0.22 N ATOM 800 CA THR A 450 15.617 0.434 1.880 1.00 0.23 C ATOM 801 C THR A 450 15.951 -0.625 0.863 1.00 0.22 C ATOM 802 O THR A 450 15.628 -1.804 1.009 1.00 0.38 O ATOM 803 CB THR A 450 16.103 -0.004 3.276 1.00 0.27 C ATOM 804 OG1 THR A 450 15.454 0.783 4.285 1.00 0.32 O ATOM 805 CG2 THR A 450 17.610 0.144 3.412 1.00 0.34 C ATOM 0 H THR A 450 13.707 0.303 2.703 1.00 0.22 H new ATOM 0 HA THR A 450 16.128 1.356 1.602 1.00 0.23 H new ATOM 0 HB THR A 450 15.850 -1.056 3.404 1.00 0.27 H new ATOM 0 HG1 THR A 450 14.575 0.398 4.485 1.00 0.32 H new ATOM 0 HG21 THR A 450 17.918 -0.174 4.408 1.00 0.34 H new ATOM 0 HG22 THR A 450 18.105 -0.475 2.664 1.00 0.34 H new ATOM 0 HG23 THR A 450 17.888 1.187 3.261 1.00 0.34 H new ATOM 813 N ARG A 451 16.567 -0.156 -0.192 1.00 0.29 N ATOM 814 CA ARG A 451 17.036 -0.996 -1.262 1.00 0.26 C ATOM 815 C ARG A 451 17.928 -2.112 -0.770 1.00 0.26 C ATOM 816 O ARG A 451 18.856 -1.913 0.017 1.00 0.30 O ATOM 817 CB ARG A 451 17.732 -0.147 -2.300 1.00 0.31 C ATOM 818 CG ARG A 451 18.910 0.606 -1.752 1.00 0.32 C ATOM 819 CD ARG A 451 19.385 1.641 -2.736 1.00 0.43 C ATOM 820 NE ARG A 451 19.828 1.035 -3.998 1.00 1.32 N ATOM 821 CZ ARG A 451 19.943 1.696 -5.153 1.00 1.75 C ATOM 822 NH1 ARG A 451 19.672 2.995 -5.217 1.00 1.39 N ATOM 823 NH2 ARG A 451 20.335 1.058 -6.250 1.00 2.70 N ATOM 0 H ARG A 451 16.759 0.836 -0.333 1.00 0.29 H new ATOM 0 HA ARG A 451 16.172 -1.481 -1.717 1.00 0.26 H new ATOM 0 HB2 ARG A 451 18.065 -0.785 -3.119 1.00 0.31 H new ATOM 0 HB3 ARG A 451 17.018 0.562 -2.719 1.00 0.31 H new ATOM 0 HG2 ARG A 451 18.635 1.088 -0.814 1.00 0.32 H new ATOM 0 HG3 ARG A 451 19.720 -0.089 -1.528 1.00 0.32 H new ATOM 0 HD2 ARG A 451 18.580 2.348 -2.936 1.00 0.43 H new ATOM 0 HD3 ARG A 451 20.206 2.208 -2.298 1.00 0.43 H new ATOM 0 HE ARG A 451 20.064 0.043 -3.992 1.00 1.32 H new ATOM 0 HH11 ARG A 451 19.373 3.496 -4.380 1.00 1.39 H new ATOM 0 HH12 ARG A 451 19.763 3.492 -6.103 1.00 1.39 H new ATOM 0 HH21 ARG A 451 20.549 0.061 -6.211 1.00 2.70 H new ATOM 0 HH22 ARG A 451 20.422 1.565 -7.131 1.00 2.70 H new ATOM 837 N GLY A 452 17.606 -3.290 -1.257 1.00 0.28 N ATOM 838 CA GLY A 452 18.279 -4.486 -0.855 1.00 0.34 C ATOM 839 C GLY A 452 17.430 -5.298 0.096 1.00 0.32 C ATOM 840 O GLY A 452 17.719 -6.462 0.376 1.00 0.41 O ATOM 0 H GLY A 452 16.867 -3.436 -1.944 1.00 0.28 H new ATOM 0 HA2 GLY A 452 18.519 -5.084 -1.734 1.00 0.34 H new ATOM 0 HA3 GLY A 452 19.224 -4.231 -0.376 1.00 0.34 H new ATOM 844 N ALA A 453 16.366 -4.674 0.578 1.00 0.32 N ATOM 845 CA ALA A 453 15.424 -5.317 1.475 1.00 0.31 C ATOM 846 C ALA A 453 14.139 -5.611 0.754 1.00 0.27 C ATOM 847 O ALA A 453 13.659 -4.833 -0.076 1.00 0.35 O ATOM 848 CB ALA A 453 15.176 -4.443 2.696 1.00 0.32 C ATOM 0 H ALA A 453 16.133 -3.706 0.357 1.00 0.32 H new ATOM 0 HA ALA A 453 15.848 -6.262 1.815 1.00 0.31 H new ATOM 0 HB1 ALA A 453 14.467 -4.938 3.360 1.00 0.32 H new ATOM 0 HB2 ALA A 453 16.116 -4.281 3.224 1.00 0.32 H new ATOM 0 HB3 ALA A 453 14.767 -3.483 2.380 1.00 0.32 H new ATOM 854 N THR A 454 13.636 -6.774 1.050 1.00 0.23 N ATOM 855 CA THR A 454 12.393 -7.244 0.524 1.00 0.21 C ATOM 856 C THR A 454 11.227 -6.642 1.295 1.00 0.17 C ATOM 857 O THR A 454 11.190 -6.706 2.518 1.00 0.19 O ATOM 858 CB THR A 454 12.367 -8.764 0.645 1.00 0.22 C ATOM 859 OG1 THR A 454 13.362 -9.349 -0.192 1.00 0.29 O ATOM 860 CG2 THR A 454 11.003 -9.330 0.275 1.00 0.24 C ATOM 0 H THR A 454 14.091 -7.435 1.679 1.00 0.23 H new ATOM 0 HA THR A 454 12.298 -6.946 -0.520 1.00 0.21 H new ATOM 0 HB THR A 454 12.574 -9.010 1.686 1.00 0.22 H new ATOM 0 HG1 THR A 454 13.225 -9.056 -1.117 1.00 0.29 H new ATOM 0 HG21 THR A 454 11.021 -10.415 0.373 1.00 0.24 H new ATOM 0 HG22 THR A 454 10.245 -8.918 0.942 1.00 0.24 H new ATOM 0 HG23 THR A 454 10.765 -9.062 -0.754 1.00 0.24 H new ATOM 868 N TYR A 455 10.293 -6.041 0.587 1.00 0.16 N ATOM 869 CA TYR A 455 9.113 -5.486 1.221 1.00 0.16 C ATOM 870 C TYR A 455 7.851 -6.101 0.633 1.00 0.13 C ATOM 871 O TYR A 455 7.593 -5.986 -0.563 1.00 0.15 O ATOM 872 CB TYR A 455 9.077 -3.964 1.065 1.00 0.23 C ATOM 873 CG TYR A 455 10.173 -3.237 1.819 1.00 0.22 C ATOM 874 CD1 TYR A 455 10.027 -2.928 3.166 1.00 0.20 C ATOM 875 CD2 TYR A 455 11.344 -2.849 1.182 1.00 0.28 C ATOM 876 CE1 TYR A 455 11.018 -2.252 3.855 1.00 0.22 C ATOM 877 CE2 TYR A 455 12.339 -2.177 1.864 1.00 0.30 C ATOM 878 CZ TYR A 455 12.173 -1.880 3.200 1.00 0.26 C ATOM 879 OH TYR A 455 13.160 -1.200 3.881 1.00 0.29 O ATOM 0 H TYR A 455 10.327 -5.924 -0.426 1.00 0.16 H new ATOM 0 HA TYR A 455 9.158 -5.724 2.284 1.00 0.16 H new ATOM 0 HB2 TYR A 455 9.154 -3.716 0.006 1.00 0.23 H new ATOM 0 HB3 TYR A 455 8.110 -3.597 1.409 1.00 0.23 H new ATOM 0 HD1 TYR A 455 9.125 -3.220 3.683 1.00 0.20 H new ATOM 0 HD2 TYR A 455 11.479 -3.077 0.135 1.00 0.28 H new ATOM 0 HE1 TYR A 455 10.888 -2.017 4.901 1.00 0.22 H new ATOM 0 HE2 TYR A 455 13.244 -1.885 1.353 1.00 0.30 H new ATOM 0 HH TYR A 455 13.125 -1.438 4.831 1.00 0.29 H new ATOM 889 N ASN A 456 7.085 -6.782 1.471 1.00 0.12 N ATOM 890 CA ASN A 456 5.772 -7.259 1.070 1.00 0.12 C ATOM 891 C ASN A 456 4.799 -6.116 1.207 1.00 0.13 C ATOM 892 O ASN A 456 4.398 -5.748 2.311 1.00 0.15 O ATOM 893 CB ASN A 456 5.313 -8.455 1.914 1.00 0.14 C ATOM 894 CG ASN A 456 4.071 -9.130 1.322 1.00 0.17 C ATOM 895 OD1 ASN A 456 3.795 -8.983 0.131 1.00 0.17 O ATOM 896 ND2 ASN A 456 3.327 -9.908 2.117 1.00 0.20 N ATOM 0 H ASN A 456 7.349 -7.016 2.428 1.00 0.12 H new ATOM 0 HA ASN A 456 5.819 -7.605 0.037 1.00 0.12 H new ATOM 0 HB2 ASN A 456 6.122 -9.182 1.984 1.00 0.14 H new ATOM 0 HB3 ASN A 456 5.096 -8.121 2.929 1.00 0.14 H new ATOM 0 HD21 ASN A 456 2.513 -10.393 1.739 1.00 0.20 H new ATOM 0 HD22 ASN A 456 3.574 -10.016 3.101 1.00 0.20 H new ATOM 903 N ILE A 457 4.461 -5.546 0.076 1.00 0.13 N ATOM 904 CA ILE A 457 3.684 -4.335 0.025 1.00 0.14 C ATOM 905 C ILE A 457 2.203 -4.654 -0.114 1.00 0.14 C ATOM 906 O ILE A 457 1.767 -5.242 -1.102 1.00 0.18 O ATOM 907 CB ILE A 457 4.154 -3.457 -1.146 1.00 0.16 C ATOM 908 CG1 ILE A 457 5.599 -2.998 -0.911 1.00 0.19 C ATOM 909 CG2 ILE A 457 3.227 -2.256 -1.329 1.00 0.18 C ATOM 910 CD1 ILE A 457 6.115 -2.026 -1.952 1.00 0.22 C ATOM 0 H ILE A 457 4.720 -5.913 -0.840 1.00 0.13 H new ATOM 0 HA ILE A 457 3.830 -3.788 0.957 1.00 0.14 H new ATOM 0 HB ILE A 457 4.120 -4.048 -2.061 1.00 0.16 H new ATOM 0 HG12 ILE A 457 5.665 -2.531 0.072 1.00 0.19 H new ATOM 0 HG13 ILE A 457 6.249 -3.873 -0.893 1.00 0.19 H new ATOM 0 HG21 ILE A 457 3.579 -1.649 -2.163 1.00 0.18 H new ATOM 0 HG22 ILE A 457 2.215 -2.605 -1.536 1.00 0.18 H new ATOM 0 HG23 ILE A 457 3.225 -1.656 -0.419 1.00 0.18 H new ATOM 0 HD11 ILE A 457 7.142 -1.750 -1.715 1.00 0.22 H new ATOM 0 HD12 ILE A 457 6.083 -2.495 -2.935 1.00 0.22 H new ATOM 0 HD13 ILE A 457 5.491 -1.132 -1.956 1.00 0.22 H new ATOM 922 N ILE A 458 1.445 -4.270 0.891 1.00 0.16 N ATOM 923 CA ILE A 458 0.019 -4.526 0.920 1.00 0.18 C ATOM 924 C ILE A 458 -0.731 -3.201 0.951 1.00 0.20 C ATOM 925 O ILE A 458 -0.229 -2.222 1.481 1.00 0.29 O ATOM 926 CB ILE A 458 -0.359 -5.378 2.147 1.00 0.22 C ATOM 927 CG1 ILE A 458 0.316 -6.742 2.062 1.00 0.21 C ATOM 928 CG2 ILE A 458 -1.861 -5.554 2.254 1.00 0.29 C ATOM 929 CD1 ILE A 458 0.110 -7.574 3.295 1.00 0.27 C ATOM 0 H ILE A 458 1.798 -3.773 1.709 1.00 0.16 H new ATOM 0 HA ILE A 458 -0.258 -5.081 0.024 1.00 0.18 H new ATOM 0 HB ILE A 458 -0.014 -4.855 3.039 1.00 0.22 H new ATOM 0 HG12 ILE A 458 -0.072 -7.281 1.197 1.00 0.21 H new ATOM 0 HG13 ILE A 458 1.385 -6.603 1.898 1.00 0.21 H new ATOM 0 HG21 ILE A 458 -2.095 -6.160 3.130 1.00 0.29 H new ATOM 0 HG22 ILE A 458 -2.336 -4.578 2.351 1.00 0.29 H new ATOM 0 HG23 ILE A 458 -2.234 -6.052 1.359 1.00 0.29 H new ATOM 0 HD11 ILE A 458 0.614 -8.533 3.175 1.00 0.27 H new ATOM 0 HD12 ILE A 458 0.523 -7.053 4.159 1.00 0.27 H new ATOM 0 HD13 ILE A 458 -0.956 -7.741 3.448 1.00 0.27 H new ATOM 941 N VAL A 459 -1.908 -3.161 0.365 1.00 0.17 N ATOM 942 CA VAL A 459 -2.705 -1.953 0.360 1.00 0.18 C ATOM 943 C VAL A 459 -4.088 -2.281 0.882 1.00 0.18 C ATOM 944 O VAL A 459 -4.803 -3.090 0.286 1.00 0.23 O ATOM 945 CB VAL A 459 -2.832 -1.343 -1.051 1.00 0.19 C ATOM 946 CG1 VAL A 459 -3.430 0.050 -0.981 1.00 0.20 C ATOM 947 CG2 VAL A 459 -1.491 -1.322 -1.780 1.00 0.20 C ATOM 0 H VAL A 459 -2.335 -3.953 -0.115 1.00 0.17 H new ATOM 0 HA VAL A 459 -2.207 -1.219 0.994 1.00 0.18 H new ATOM 0 HB VAL A 459 -3.505 -1.980 -1.625 1.00 0.19 H new ATOM 0 HG11 VAL A 459 -3.511 0.462 -1.987 1.00 0.20 H new ATOM 0 HG12 VAL A 459 -4.421 -0.002 -0.529 1.00 0.20 H new ATOM 0 HG13 VAL A 459 -2.789 0.691 -0.377 1.00 0.20 H new ATOM 0 HG21 VAL A 459 -1.622 -0.885 -2.770 1.00 0.20 H new ATOM 0 HG22 VAL A 459 -0.777 -0.726 -1.212 1.00 0.20 H new ATOM 0 HG23 VAL A 459 -1.115 -2.340 -1.879 1.00 0.20 H new ATOM 957 N GLU A 460 -4.451 -1.687 2.002 1.00 0.18 N ATOM 958 CA GLU A 460 -5.734 -1.960 2.616 1.00 0.22 C ATOM 959 C GLU A 460 -6.555 -0.683 2.717 1.00 0.21 C ATOM 960 O GLU A 460 -6.049 0.368 3.113 1.00 0.30 O ATOM 961 CB GLU A 460 -5.550 -2.590 3.996 1.00 0.30 C ATOM 962 CG GLU A 460 -4.800 -3.916 3.971 1.00 0.36 C ATOM 963 CD GLU A 460 -4.615 -4.521 5.348 1.00 0.60 C ATOM 964 OE1 GLU A 460 -3.827 -3.970 6.147 1.00 0.79 O ATOM 965 OE2 GLU A 460 -5.236 -5.563 5.633 1.00 0.82 O ATOM 0 H GLU A 460 -3.875 -1.012 2.505 1.00 0.18 H new ATOM 0 HA GLU A 460 -6.272 -2.669 1.987 1.00 0.22 H new ATOM 0 HB2 GLU A 460 -5.012 -1.891 4.636 1.00 0.30 H new ATOM 0 HB3 GLU A 460 -6.530 -2.746 4.448 1.00 0.30 H new ATOM 0 HG2 GLU A 460 -5.342 -4.621 3.341 1.00 0.36 H new ATOM 0 HG3 GLU A 460 -3.823 -3.765 3.513 1.00 0.36 H new ATOM 972 N ALA A 461 -7.817 -0.786 2.357 1.00 0.16 N ATOM 973 CA ALA A 461 -8.696 0.366 2.297 1.00 0.15 C ATOM 974 C ALA A 461 -9.448 0.561 3.589 1.00 0.14 C ATOM 975 O ALA A 461 -10.251 -0.283 3.986 1.00 0.17 O ATOM 976 CB ALA A 461 -9.670 0.223 1.142 1.00 0.16 C ATOM 0 H ALA A 461 -8.262 -1.666 2.098 1.00 0.16 H new ATOM 0 HA ALA A 461 -8.075 1.248 2.138 1.00 0.15 H new ATOM 0 HB1 ALA A 461 -10.324 1.094 1.108 1.00 0.16 H new ATOM 0 HB2 ALA A 461 -9.116 0.148 0.206 1.00 0.16 H new ATOM 0 HB3 ALA A 461 -10.270 -0.676 1.281 1.00 0.16 H new ATOM 982 N LEU A 462 -9.180 1.680 4.230 1.00 0.16 N ATOM 983 CA LEU A 462 -9.889 2.067 5.420 1.00 0.20 C ATOM 984 C LEU A 462 -11.258 2.588 5.003 1.00 0.22 C ATOM 985 O LEU A 462 -11.386 3.712 4.510 1.00 0.24 O ATOM 986 CB LEU A 462 -9.127 3.147 6.198 1.00 0.25 C ATOM 987 CG LEU A 462 -9.272 3.034 7.719 1.00 0.34 C ATOM 988 CD1 LEU A 462 -8.406 4.042 8.439 1.00 0.85 C ATOM 989 CD2 LEU A 462 -10.715 3.203 8.139 1.00 0.78 C ATOM 0 H LEU A 462 -8.463 2.343 3.936 1.00 0.16 H new ATOM 0 HA LEU A 462 -9.990 1.205 6.079 1.00 0.20 H new ATOM 0 HB2 LEU A 462 -8.070 3.091 5.938 1.00 0.25 H new ATOM 0 HB3 LEU A 462 -9.481 4.128 5.881 1.00 0.25 H new ATOM 0 HG LEU A 462 -8.936 2.035 7.999 1.00 0.34 H new ATOM 0 HD11 LEU A 462 -8.536 3.931 9.515 1.00 0.85 H new ATOM 0 HD12 LEU A 462 -7.360 3.874 8.181 1.00 0.85 H new ATOM 0 HD13 LEU A 462 -8.696 5.050 8.141 1.00 0.85 H new ATOM 0 HD21 LEU A 462 -10.791 3.118 9.223 1.00 0.78 H new ATOM 0 HD22 LEU A 462 -11.073 4.184 7.826 1.00 0.78 H new ATOM 0 HD23 LEU A 462 -11.323 2.429 7.671 1.00 0.78 H new ATOM 1001 N LYS A 463 -12.264 1.756 5.167 1.00 0.23 N ATOM 1002 CA LYS A 463 -13.607 2.079 4.744 1.00 0.30 C ATOM 1003 C LYS A 463 -14.576 1.452 5.730 1.00 0.40 C ATOM 1004 O LYS A 463 -14.434 0.270 6.053 1.00 0.50 O ATOM 1005 CB LYS A 463 -13.845 1.535 3.333 1.00 0.31 C ATOM 1006 CG LYS A 463 -15.190 1.920 2.736 1.00 0.38 C ATOM 1007 CD LYS A 463 -15.148 3.277 2.056 1.00 0.42 C ATOM 1008 CE LYS A 463 -16.476 3.601 1.406 1.00 0.95 C ATOM 1009 NZ LYS A 463 -16.748 2.723 0.241 1.00 1.62 N ATOM 0 H LYS A 463 -12.172 0.836 5.598 1.00 0.23 H new ATOM 0 HA LYS A 463 -13.755 3.159 4.722 1.00 0.30 H new ATOM 0 HB2 LYS A 463 -13.052 1.896 2.678 1.00 0.31 H new ATOM 0 HB3 LYS A 463 -13.768 0.448 3.357 1.00 0.31 H new ATOM 0 HG2 LYS A 463 -15.495 1.163 2.014 1.00 0.38 H new ATOM 0 HG3 LYS A 463 -15.945 1.933 3.523 1.00 0.38 H new ATOM 0 HD2 LYS A 463 -14.900 4.046 2.787 1.00 0.42 H new ATOM 0 HD3 LYS A 463 -14.359 3.286 1.304 1.00 0.42 H new ATOM 0 HE2 LYS A 463 -17.276 3.491 2.139 1.00 0.95 H new ATOM 0 HE3 LYS A 463 -16.479 4.643 1.085 1.00 0.95 H new ATOM 0 HZ1 LYS A 463 -17.256 3.262 -0.489 1.00 1.62 H new ATOM 0 HZ2 LYS A 463 -15.849 2.375 -0.149 1.00 1.62 H new ATOM 0 HZ3 LYS A 463 -17.330 1.916 0.543 1.00 1.62 H new ATOM 1023 N ASP A 464 -15.565 2.222 6.185 1.00 0.58 N ATOM 1024 CA ASP A 464 -16.372 1.802 7.364 1.00 0.61 C ATOM 1025 C ASP A 464 -15.515 1.138 8.450 1.00 0.51 C ATOM 1026 O ASP A 464 -15.634 -0.064 8.697 1.00 0.53 O ATOM 1027 CB ASP A 464 -17.451 0.816 6.976 1.00 0.72 C ATOM 1028 CG ASP A 464 -18.465 1.363 5.990 1.00 1.08 C ATOM 1029 OD1 ASP A 464 -18.918 0.596 5.114 1.00 1.85 O ATOM 1030 OD2 ASP A 464 -18.815 2.561 6.077 1.00 1.15 O ATOM 0 H ASP A 464 -15.833 3.118 5.778 1.00 0.58 H new ATOM 0 HA ASP A 464 -16.814 2.719 7.753 1.00 0.61 H new ATOM 0 HB2 ASP A 464 -16.982 -0.068 6.545 1.00 0.72 H new ATOM 0 HB3 ASP A 464 -17.974 0.493 7.876 1.00 0.72 H new ATOM 1035 N GLN A 465 -14.694 1.944 9.103 1.00 0.52 N ATOM 1036 CA GLN A 465 -13.782 1.533 10.177 1.00 0.49 C ATOM 1037 C GLN A 465 -12.765 0.430 9.810 1.00 0.44 C ATOM 1038 O GLN A 465 -11.734 0.308 10.473 1.00 0.66 O ATOM 1039 CB GLN A 465 -14.585 1.096 11.399 1.00 0.56 C ATOM 1040 CG GLN A 465 -15.566 2.151 11.884 1.00 0.67 C ATOM 1041 CD GLN A 465 -16.314 1.731 13.134 1.00 0.78 C ATOM 1042 OE1 GLN A 465 -17.452 2.145 13.357 1.00 1.32 O ATOM 1043 NE2 GLN A 465 -15.686 0.912 13.961 1.00 1.39 N ATOM 0 H GLN A 465 -14.636 2.941 8.898 1.00 0.52 H new ATOM 0 HA GLN A 465 -13.181 2.418 10.384 1.00 0.49 H new ATOM 0 HB2 GLN A 465 -15.132 0.185 11.158 1.00 0.56 H new ATOM 0 HB3 GLN A 465 -13.897 0.850 12.208 1.00 0.56 H new ATOM 0 HG2 GLN A 465 -15.027 3.077 12.083 1.00 0.67 H new ATOM 0 HG3 GLN A 465 -16.284 2.364 11.092 1.00 0.67 H new ATOM 0 HE21 GLN A 465 -14.743 0.590 13.742 1.00 1.39 H new ATOM 0 HE22 GLN A 465 -16.145 0.602 14.818 1.00 1.39 H new ATOM 1052 N GLN A 466 -13.021 -0.356 8.777 1.00 0.36 N ATOM 1053 CA GLN A 466 -12.192 -1.523 8.494 1.00 0.36 C ATOM 1054 C GLN A 466 -11.244 -1.287 7.341 1.00 0.28 C ATOM 1055 O GLN A 466 -11.377 -0.324 6.596 1.00 0.29 O ATOM 1056 CB GLN A 466 -13.062 -2.738 8.195 1.00 0.54 C ATOM 1057 CG GLN A 466 -13.729 -3.306 9.420 1.00 1.20 C ATOM 1058 CD GLN A 466 -14.607 -4.495 9.101 1.00 1.42 C ATOM 1059 OE1 GLN A 466 -15.796 -4.347 8.824 1.00 1.60 O ATOM 1060 NE2 GLN A 466 -14.029 -5.682 9.133 1.00 2.13 N ATOM 0 H GLN A 466 -13.790 -0.211 8.123 1.00 0.36 H new ATOM 0 HA GLN A 466 -11.595 -1.708 9.387 1.00 0.36 H new ATOM 0 HB2 GLN A 466 -13.826 -2.460 7.469 1.00 0.54 H new ATOM 0 HB3 GLN A 466 -12.449 -3.511 7.732 1.00 0.54 H new ATOM 0 HG2 GLN A 466 -12.967 -3.604 10.140 1.00 1.20 H new ATOM 0 HG3 GLN A 466 -14.331 -2.531 9.895 1.00 1.20 H new ATOM 0 HE21 GLN A 466 -13.040 -5.761 9.368 1.00 2.13 H new ATOM 0 HE22 GLN A 466 -14.572 -6.520 8.923 1.00 2.13 H new ATOM 1069 N ARG A 467 -10.293 -2.191 7.209 1.00 0.33 N ATOM 1070 CA ARG A 467 -9.273 -2.102 6.181 1.00 0.30 C ATOM 1071 C ARG A 467 -9.355 -3.306 5.249 1.00 0.33 C ATOM 1072 O ARG A 467 -9.006 -4.424 5.626 1.00 0.51 O ATOM 1073 CB ARG A 467 -7.896 -2.019 6.830 1.00 0.36 C ATOM 1074 CG ARG A 467 -7.768 -0.864 7.807 1.00 0.34 C ATOM 1075 CD ARG A 467 -6.565 -1.047 8.711 1.00 0.43 C ATOM 1076 NE ARG A 467 -6.369 0.078 9.628 1.00 1.24 N ATOM 1077 CZ ARG A 467 -5.173 0.469 10.074 1.00 1.67 C ATOM 1078 NH1 ARG A 467 -4.069 -0.136 9.649 1.00 1.51 N ATOM 1079 NH2 ARG A 467 -5.077 1.472 10.936 1.00 2.58 N ATOM 0 H ARG A 467 -10.205 -3.009 7.812 1.00 0.33 H new ATOM 0 HA ARG A 467 -9.439 -1.201 5.590 1.00 0.30 H new ATOM 0 HB2 ARG A 467 -7.690 -2.953 7.352 1.00 0.36 H new ATOM 0 HB3 ARG A 467 -7.140 -1.915 6.052 1.00 0.36 H new ATOM 0 HG2 ARG A 467 -7.675 0.073 7.258 1.00 0.34 H new ATOM 0 HG3 ARG A 467 -8.673 -0.792 8.410 1.00 0.34 H new ATOM 0 HD2 ARG A 467 -6.686 -1.964 9.288 1.00 0.43 H new ATOM 0 HD3 ARG A 467 -5.672 -1.171 8.099 1.00 0.43 H new ATOM 0 HE ARG A 467 -7.192 0.591 9.943 1.00 1.24 H new ATOM 0 HH11 ARG A 467 -4.133 -0.903 8.979 1.00 1.51 H new ATOM 0 HH12 ARG A 467 -3.157 0.166 9.993 1.00 1.51 H new ATOM 0 HH21 ARG A 467 -5.919 1.948 11.261 1.00 2.58 H new ATOM 0 HH22 ARG A 467 -4.161 1.768 11.274 1.00 2.58 H new ATOM 1093 N HIS A 468 -9.814 -3.060 4.034 1.00 0.28 N ATOM 1094 CA HIS A 468 -10.062 -4.129 3.067 1.00 0.32 C ATOM 1095 C HIS A 468 -8.823 -4.362 2.181 1.00 0.24 C ATOM 1096 O HIS A 468 -8.218 -3.398 1.724 1.00 0.27 O ATOM 1097 CB HIS A 468 -11.260 -3.777 2.165 1.00 0.44 C ATOM 1098 CG HIS A 468 -12.582 -3.704 2.870 1.00 0.75 C ATOM 1099 ND1 HIS A 468 -13.630 -4.552 2.581 1.00 1.02 N ATOM 1100 CD2 HIS A 468 -13.046 -2.854 3.820 1.00 1.01 C ATOM 1101 CE1 HIS A 468 -14.674 -4.227 3.317 1.00 1.26 C ATOM 1102 NE2 HIS A 468 -14.347 -3.201 4.078 1.00 1.25 N ATOM 0 H HIS A 468 -10.025 -2.124 3.687 1.00 0.28 H new ATOM 0 HA HIS A 468 -10.282 -5.037 3.628 1.00 0.32 H new ATOM 0 HB2 HIS A 468 -11.066 -2.817 1.687 1.00 0.44 H new ATOM 0 HB3 HIS A 468 -11.329 -4.520 1.371 1.00 0.44 H new ATOM 0 HD2 HIS A 468 -12.493 -2.052 4.287 1.00 1.01 H new ATOM 0 HE1 HIS A 468 -15.636 -4.718 3.300 1.00 1.26 H new ATOM 0 HE2 HIS A 468 -14.962 -2.741 4.749 1.00 1.25 H new ATOM 1111 N LYS A 469 -8.441 -5.630 1.947 1.00 0.27 N ATOM 1112 CA LYS A 469 -7.340 -5.936 0.983 1.00 0.40 C ATOM 1113 C LYS A 469 -7.679 -5.386 -0.394 1.00 0.29 C ATOM 1114 O LYS A 469 -8.700 -5.743 -0.985 1.00 0.37 O ATOM 1115 CB LYS A 469 -7.040 -7.443 0.812 1.00 0.80 C ATOM 1116 CG LYS A 469 -5.996 -7.736 -0.262 1.00 0.70 C ATOM 1117 CD LYS A 469 -4.571 -7.413 0.174 1.00 0.70 C ATOM 1118 CE LYS A 469 -4.075 -8.372 1.249 1.00 0.41 C ATOM 1119 NZ LYS A 469 -4.264 -9.799 0.864 1.00 0.84 N ATOM 0 H LYS A 469 -8.858 -6.447 2.393 1.00 0.27 H new ATOM 0 HA LYS A 469 -6.456 -5.464 1.412 1.00 0.40 H new ATOM 0 HB2 LYS A 469 -6.695 -7.847 1.764 1.00 0.80 H new ATOM 0 HB3 LYS A 469 -7.964 -7.964 0.561 1.00 0.80 H new ATOM 0 HG2 LYS A 469 -6.054 -8.789 -0.537 1.00 0.70 H new ATOM 0 HG3 LYS A 469 -6.234 -7.160 -1.156 1.00 0.70 H new ATOM 0 HD2 LYS A 469 -3.907 -7.461 -0.689 1.00 0.70 H new ATOM 0 HD3 LYS A 469 -4.530 -6.391 0.552 1.00 0.70 H new ATOM 0 HE2 LYS A 469 -3.018 -8.186 1.439 1.00 0.41 H new ATOM 0 HE3 LYS A 469 -4.606 -8.176 2.181 1.00 0.41 H new ATOM 0 HZ1 LYS A 469 -5.019 -10.218 1.444 1.00 0.84 H new ATOM 0 HZ2 LYS A 469 -4.527 -9.856 -0.141 1.00 0.84 H new ATOM 0 HZ3 LYS A 469 -3.378 -10.321 1.020 1.00 0.84 H new ATOM 1133 N VAL A 470 -6.825 -4.518 -0.892 1.00 0.23 N ATOM 1134 CA VAL A 470 -6.957 -3.993 -2.238 1.00 0.18 C ATOM 1135 C VAL A 470 -5.859 -4.551 -3.115 1.00 0.18 C ATOM 1136 O VAL A 470 -6.094 -5.005 -4.234 1.00 0.29 O ATOM 1137 CB VAL A 470 -6.843 -2.466 -2.233 1.00 0.22 C ATOM 1138 CG1 VAL A 470 -7.136 -1.883 -3.610 1.00 0.61 C ATOM 1139 CG2 VAL A 470 -7.754 -1.886 -1.172 1.00 0.59 C ATOM 0 H VAL A 470 -6.021 -4.156 -0.379 1.00 0.23 H new ATOM 0 HA VAL A 470 -7.934 -4.285 -2.623 1.00 0.18 H new ATOM 0 HB VAL A 470 -5.816 -2.192 -1.989 1.00 0.22 H new ATOM 0 HG11 VAL A 470 -7.047 -0.797 -3.572 1.00 0.61 H new ATOM 0 HG12 VAL A 470 -6.423 -2.281 -4.333 1.00 0.61 H new ATOM 0 HG13 VAL A 470 -8.148 -2.153 -3.912 1.00 0.61 H new ATOM 0 HG21 VAL A 470 -7.668 -0.799 -1.173 1.00 0.59 H new ATOM 0 HG22 VAL A 470 -8.785 -2.169 -1.383 1.00 0.59 H new ATOM 0 HG23 VAL A 470 -7.465 -2.271 -0.194 1.00 0.59 H new ATOM 1149 N ARG A 471 -4.658 -4.523 -2.570 1.00 0.17 N ATOM 1150 CA ARG A 471 -3.463 -4.893 -3.294 1.00 0.19 C ATOM 1151 C ARG A 471 -2.459 -5.544 -2.370 1.00 0.18 C ATOM 1152 O ARG A 471 -2.386 -5.213 -1.191 1.00 0.22 O ATOM 1153 CB ARG A 471 -2.866 -3.667 -3.935 1.00 0.28 C ATOM 1154 CG ARG A 471 -3.353 -3.460 -5.351 1.00 0.77 C ATOM 1155 CD ARG A 471 -2.186 -3.373 -6.293 1.00 0.52 C ATOM 1156 NE ARG A 471 -1.601 -4.678 -6.594 1.00 1.18 N ATOM 1157 CZ ARG A 471 -0.355 -4.850 -7.036 1.00 1.45 C ATOM 1158 NH1 ARG A 471 0.420 -3.796 -7.277 1.00 1.39 N ATOM 1159 NH2 ARG A 471 0.111 -6.076 -7.248 1.00 2.13 N ATOM 0 H ARG A 471 -4.486 -4.240 -1.605 1.00 0.17 H new ATOM 0 HA ARG A 471 -3.726 -5.614 -4.068 1.00 0.19 H new ATOM 0 HB2 ARG A 471 -3.115 -2.790 -3.337 1.00 0.28 H new ATOM 0 HB3 ARG A 471 -1.779 -3.754 -3.937 1.00 0.28 H new ATOM 0 HG2 ARG A 471 -4.005 -4.283 -5.643 1.00 0.77 H new ATOM 0 HG3 ARG A 471 -3.946 -2.547 -5.410 1.00 0.77 H new ATOM 0 HD2 ARG A 471 -2.509 -2.902 -7.221 1.00 0.52 H new ATOM 0 HD3 ARG A 471 -1.422 -2.729 -5.858 1.00 0.52 H new ATOM 0 HE ARG A 471 -2.180 -5.506 -6.458 1.00 1.18 H new ATOM 0 HH11 ARG A 471 0.061 -2.854 -7.124 1.00 1.39 H new ATOM 0 HH12 ARG A 471 1.373 -3.930 -7.615 1.00 1.39 H new ATOM 0 HH21 ARG A 471 -0.484 -6.885 -7.073 1.00 2.13 H new ATOM 0 HH22 ARG A 471 1.064 -6.208 -7.586 1.00 2.13 H new ATOM 1173 N GLU A 472 -1.728 -6.498 -2.898 1.00 0.20 N ATOM 1174 CA GLU A 472 -0.656 -7.144 -2.158 1.00 0.18 C ATOM 1175 C GLU A 472 0.396 -7.667 -3.111 1.00 0.18 C ATOM 1176 O GLU A 472 0.071 -8.355 -4.084 1.00 0.21 O ATOM 1177 CB GLU A 472 -1.181 -8.277 -1.277 1.00 0.21 C ATOM 1178 CG GLU A 472 -0.102 -9.278 -0.900 1.00 0.21 C ATOM 1179 CD GLU A 472 -0.478 -10.145 0.283 1.00 0.29 C ATOM 1180 OE1 GLU A 472 0.416 -10.476 1.092 1.00 0.62 O ATOM 1181 OE2 GLU A 472 -1.664 -10.517 0.402 1.00 0.65 O ATOM 0 H GLU A 472 -1.854 -6.850 -3.847 1.00 0.20 H new ATOM 0 HA GLU A 472 -0.208 -6.396 -1.504 1.00 0.18 H new ATOM 0 HB2 GLU A 472 -1.612 -7.855 -0.369 1.00 0.21 H new ATOM 0 HB3 GLU A 472 -1.984 -8.796 -1.800 1.00 0.21 H new ATOM 0 HG2 GLU A 472 0.107 -9.917 -1.758 1.00 0.21 H new ATOM 0 HG3 GLU A 472 0.818 -8.741 -0.670 1.00 0.21 H new ATOM 1188 N GLU A 473 1.647 -7.344 -2.845 1.00 0.16 N ATOM 1189 CA GLU A 473 2.721 -7.783 -3.708 1.00 0.17 C ATOM 1190 C GLU A 473 4.060 -7.696 -3.026 1.00 0.20 C ATOM 1191 O GLU A 473 4.363 -6.720 -2.343 1.00 0.26 O ATOM 1192 CB GLU A 473 2.704 -6.958 -4.998 1.00 0.23 C ATOM 1193 CG GLU A 473 3.792 -7.307 -5.992 1.00 0.27 C ATOM 1194 CD GLU A 473 3.663 -6.500 -7.263 1.00 1.24 C ATOM 1195 OE1 GLU A 473 4.557 -5.677 -7.547 1.00 2.26 O ATOM 1196 OE2 GLU A 473 2.648 -6.666 -7.977 1.00 1.25 O ATOM 0 H GLU A 473 1.941 -6.784 -2.045 1.00 0.16 H new ATOM 0 HA GLU A 473 2.563 -8.834 -3.950 1.00 0.17 H new ATOM 0 HB2 GLU A 473 1.736 -7.086 -5.481 1.00 0.23 H new ATOM 0 HB3 GLU A 473 2.794 -5.903 -4.739 1.00 0.23 H new ATOM 0 HG2 GLU A 473 4.768 -7.126 -5.542 1.00 0.27 H new ATOM 0 HG3 GLU A 473 3.743 -8.370 -6.228 1.00 0.27 H new ATOM 1203 N VAL A 474 4.864 -8.727 -3.215 1.00 0.24 N ATOM 1204 CA VAL A 474 6.162 -8.750 -2.608 1.00 0.28 C ATOM 1205 C VAL A 474 7.188 -8.171 -3.561 1.00 0.21 C ATOM 1206 O VAL A 474 7.315 -8.618 -4.703 1.00 0.28 O ATOM 1207 CB VAL A 474 6.613 -10.162 -2.202 1.00 0.49 C ATOM 1208 CG1 VAL A 474 7.772 -10.096 -1.220 1.00 0.80 C ATOM 1209 CG2 VAL A 474 5.463 -10.968 -1.626 1.00 1.22 C ATOM 0 H VAL A 474 4.636 -9.546 -3.779 1.00 0.24 H new ATOM 0 HA VAL A 474 6.087 -8.151 -1.701 1.00 0.28 H new ATOM 0 HB VAL A 474 6.955 -10.672 -3.103 1.00 0.49 H new ATOM 0 HG11 VAL A 474 8.075 -11.107 -0.946 1.00 0.80 H new ATOM 0 HG12 VAL A 474 8.612 -9.578 -1.683 1.00 0.80 H new ATOM 0 HG13 VAL A 474 7.461 -9.556 -0.326 1.00 0.80 H new ATOM 0 HG21 VAL A 474 5.817 -11.961 -1.350 1.00 1.22 H new ATOM 0 HG22 VAL A 474 5.072 -10.463 -0.743 1.00 1.22 H new ATOM 0 HG23 VAL A 474 4.673 -11.059 -2.372 1.00 1.22 H new ATOM 1219 N VAL A 475 7.909 -7.175 -3.096 1.00 0.19 N ATOM 1220 CA VAL A 475 8.905 -6.512 -3.915 1.00 0.19 C ATOM 1221 C VAL A 475 10.167 -6.236 -3.153 1.00 0.19 C ATOM 1222 O VAL A 475 10.196 -5.505 -2.165 1.00 0.26 O ATOM 1223 CB VAL A 475 8.405 -5.186 -4.517 1.00 0.22 C ATOM 1224 CG1 VAL A 475 8.249 -5.313 -6.022 1.00 0.41 C ATOM 1225 CG2 VAL A 475 7.094 -4.749 -3.881 1.00 0.32 C ATOM 0 H VAL A 475 7.825 -6.803 -2.150 1.00 0.19 H new ATOM 0 HA VAL A 475 9.107 -7.211 -4.726 1.00 0.19 H new ATOM 0 HB VAL A 475 9.151 -4.420 -4.305 1.00 0.22 H new ATOM 0 HG11 VAL A 475 7.895 -4.367 -6.432 1.00 0.41 H new ATOM 0 HG12 VAL A 475 9.212 -5.564 -6.468 1.00 0.41 H new ATOM 0 HG13 VAL A 475 7.528 -6.099 -6.248 1.00 0.41 H new ATOM 0 HG21 VAL A 475 6.768 -3.810 -4.328 1.00 0.32 H new ATOM 0 HG22 VAL A 475 6.335 -5.513 -4.049 1.00 0.32 H new ATOM 0 HG23 VAL A 475 7.238 -4.610 -2.809 1.00 0.32 H new ATOM 1235 N THR A 476 11.198 -6.872 -3.625 1.00 0.24 N ATOM 1236 CA THR A 476 12.541 -6.559 -3.251 1.00 0.24 C ATOM 1237 C THR A 476 12.974 -5.297 -3.974 1.00 0.26 C ATOM 1238 O THR A 476 12.716 -5.129 -5.166 1.00 0.33 O ATOM 1239 CB THR A 476 13.429 -7.727 -3.644 1.00 0.31 C ATOM 1240 OG1 THR A 476 13.056 -8.892 -2.889 1.00 0.32 O ATOM 1241 CG2 THR A 476 14.907 -7.412 -3.441 1.00 0.38 C ATOM 0 H THR A 476 11.125 -7.638 -4.294 1.00 0.24 H new ATOM 0 HA THR A 476 12.616 -6.390 -2.177 1.00 0.24 H new ATOM 0 HB THR A 476 13.284 -7.918 -4.707 1.00 0.31 H new ATOM 0 HG1 THR A 476 13.629 -9.645 -3.145 1.00 0.32 H new ATOM 0 HG21 THR A 476 15.506 -8.274 -3.734 1.00 0.38 H new ATOM 0 HG22 THR A 476 15.183 -6.553 -4.053 1.00 0.38 H new ATOM 0 HG23 THR A 476 15.089 -7.184 -2.391 1.00 0.38 H new ATOM 1249 N VAL A 477 13.600 -4.412 -3.244 1.00 0.25 N ATOM 1250 CA VAL A 477 13.936 -3.106 -3.757 1.00 0.29 C ATOM 1251 C VAL A 477 15.405 -3.032 -4.158 1.00 0.33 C ATOM 1252 O VAL A 477 16.262 -3.610 -3.498 1.00 0.37 O ATOM 1253 CB VAL A 477 13.608 -2.062 -2.682 1.00 0.28 C ATOM 1254 CG1 VAL A 477 14.062 -0.670 -3.083 1.00 0.35 C ATOM 1255 CG2 VAL A 477 12.117 -2.077 -2.399 1.00 0.31 C ATOM 0 H VAL A 477 13.891 -4.573 -2.280 1.00 0.25 H new ATOM 0 HA VAL A 477 13.351 -2.907 -4.655 1.00 0.29 H new ATOM 0 HB VAL A 477 14.154 -2.325 -1.776 1.00 0.28 H new ATOM 0 HG11 VAL A 477 13.809 0.037 -2.293 1.00 0.35 H new ATOM 0 HG12 VAL A 477 15.141 -0.670 -3.239 1.00 0.35 H new ATOM 0 HG13 VAL A 477 13.562 -0.376 -4.006 1.00 0.35 H new ATOM 0 HG21 VAL A 477 11.884 -1.335 -1.635 1.00 0.31 H new ATOM 0 HG22 VAL A 477 11.571 -1.841 -3.312 1.00 0.31 H new ATOM 0 HG23 VAL A 477 11.824 -3.066 -2.046 1.00 0.31 H new ATOM 1265 N GLY A 478 15.684 -2.336 -5.251 1.00 0.43 N ATOM 1266 CA GLY A 478 17.056 -2.139 -5.676 1.00 0.53 C ATOM 1267 C GLY A 478 17.300 -2.512 -7.130 1.00 1.15 C ATOM 1268 O GLY A 478 17.333 -1.625 -7.984 1.00 1.69 O ATOM 0 H GLY A 478 14.983 -1.903 -5.853 1.00 0.43 H new ATOM 0 HA2 GLY A 478 17.328 -1.094 -5.527 1.00 0.53 H new ATOM 0 HA3 GLY A 478 17.714 -2.733 -5.041 1.00 0.53 H new ATOM 1272 N ASN A 479 17.452 -3.807 -7.440 1.00 1.80 N ATOM 1273 CA ASN A 479 17.810 -4.214 -8.807 1.00 2.82 C ATOM 1274 C ASN A 479 17.834 -5.719 -8.897 1.00 3.58 C ATOM 1275 O ASN A 479 18.669 -6.297 -9.597 1.00 4.40 O ATOM 1276 CB ASN A 479 19.203 -3.694 -9.212 1.00 3.20 C ATOM 1277 CG ASN A 479 19.238 -3.193 -10.642 1.00 3.99 C ATOM 1278 OD1 ASN A 479 18.997 -2.016 -10.907 1.00 4.47 O ATOM 1279 ND2 ASN A 479 19.541 -4.082 -11.575 1.00 4.61 N ATOM 0 H ASN A 479 17.336 -4.576 -6.780 1.00 1.80 H new ATOM 0 HA ASN A 479 17.063 -3.790 -9.478 1.00 2.82 H new ATOM 0 HB2 ASN A 479 19.497 -2.888 -8.540 1.00 3.20 H new ATOM 0 HB3 ASN A 479 19.935 -4.492 -9.091 1.00 3.20 H new ATOM 0 HD21 ASN A 479 19.581 -3.800 -12.554 1.00 4.61 H new ATOM 0 HD22 ASN A 479 19.734 -5.049 -11.314 1.00 4.61 H new ATOM 1286 N SER A 480 16.930 -6.364 -8.192 1.00 3.56 N ATOM 1287 CA SER A 480 17.084 -7.781 -7.956 1.00 4.40 C ATOM 1288 C SER A 480 15.737 -8.445 -7.674 1.00 4.81 C ATOM 1289 O SER A 480 15.285 -8.422 -6.510 1.00 4.88 O ATOM 1290 CB SER A 480 18.067 -7.927 -6.791 1.00 4.37 C ATOM 1291 OG SER A 480 17.534 -7.372 -5.598 1.00 4.36 O ATOM 1292 OXT SER A 480 15.126 -8.975 -8.625 1.00 5.40 O ATOM 0 H SER A 480 16.098 -5.941 -7.780 1.00 3.56 H new ATOM 0 HA SER A 480 17.474 -8.289 -8.838 1.00 4.40 H new ATOM 0 HB2 SER A 480 18.296 -8.981 -6.634 1.00 4.37 H new ATOM 0 HB3 SER A 480 19.005 -7.431 -7.039 1.00 4.37 H new ATOM 0 HG SER A 480 16.572 -7.553 -5.554 1.00 4.36 H new TER 1298 SER A 480