USER MOD reduce.3.24.130724 H: found=0, std=0, add=569, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 570 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 451 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 454 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 374 SER OG : rot 180:sc= 0.0295 USER MOD Single : A 375 SER OG : rot 180:sc= 0 USER MOD Single : A 376 GLN : amide:sc= -0.8 K(o=-0.8,f=-3.1!) USER MOD Single : A 378 SER OG : rot 180:sc= 0 USER MOD Single : A 396 LYS NZ :NH3+ -167:sc= -0.0729 (180deg=-1.3) USER MOD Single : A 397 SER OG : rot -36:sc= 0.555 USER MOD Single : A 399 SER OG : rot 1:sc= 0.639 USER MOD Single : A 406 THR OG1 : rot 109:sc= -1.33 USER MOD Single : A 414 ASN : amide:sc= 0 X(o=0,f=0.012) USER MOD Single : A 420 ASN : amide:sc= -1.2 K(o=-1.2,f=-3.1!) USER MOD Single : A 421 ASN : amide:sc= 0.633 K(o=0.63,f=-0.052) USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 433 SER OG : rot 115:sc= 1.24 USER MOD Single : A 436 ASN : amide:sc= 0.0378 K(o=0.038,f=0.73) USER MOD Single : A 438 MET CE :methyl 145:sc= -0.291 (180deg=-1.7) USER MOD Single : A 440 THR OG1 : rot 180:sc= 0 USER MOD Single : A 442 SER OG : rot 180:sc= 0 USER MOD Single : A 446 SER OG : rot 13:sc= 0.0774 USER MOD Single : A 449 ASN : amide:sc= -0.852 X(o=-0.85,f=-0.38) USER MOD Single : A 453 THR OG1 : rot 52:sc= 0.911 USER MOD Single : A 457 SER OG : rot 180:sc= 0 USER MOD Single : A 459 SER OG : rot 180:sc= -0.0599 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 372 117.301 -19.688 6.295 1.00 0.00 N ATOM 2 CA GLU A 372 118.136 -20.280 5.255 1.00 0.00 C ATOM 3 C GLU A 372 119.614 -19.820 5.348 1.00 0.00 C ATOM 4 O GLU A 372 120.489 -20.665 5.560 1.00 0.00 O ATOM 5 CB GLU A 372 117.534 -20.118 3.830 1.00 0.00 C ATOM 6 CG GLU A 372 116.295 -20.987 3.537 1.00 0.00 C ATOM 7 CD GLU A 372 115.139 -20.737 4.473 1.00 0.00 C ATOM 8 OE1 GLU A 372 115.169 -21.256 5.604 1.00 0.00 O ATOM 9 OE2 GLU A 372 114.204 -20.020 4.112 1.00 0.00 O ATOM 0 HA GLU A 372 118.144 -21.353 5.446 1.00 0.00 H new ATOM 0 HB2 GLU A 372 117.267 -19.072 3.683 1.00 0.00 H new ATOM 0 HB3 GLU A 372 118.306 -20.356 3.098 1.00 0.00 H new ATOM 0 HG2 GLU A 372 115.968 -20.803 2.514 1.00 0.00 H new ATOM 0 HG3 GLU A 372 116.578 -22.038 3.597 1.00 0.00 H new ATOM 16 N PRO A 373 119.952 -18.495 5.241 1.00 0.00 N ATOM 17 CA PRO A 373 121.330 -18.081 5.340 1.00 0.00 C ATOM 18 C PRO A 373 121.791 -17.966 6.787 1.00 0.00 C ATOM 19 O PRO A 373 121.230 -17.201 7.580 1.00 0.00 O ATOM 20 CB PRO A 373 121.388 -16.714 4.650 1.00 0.00 C ATOM 21 CG PRO A 373 119.966 -16.267 4.466 1.00 0.00 C ATOM 22 CD PRO A 373 119.063 -17.338 5.029 1.00 0.00 C ATOM 0 HA PRO A 373 121.991 -18.813 4.876 1.00 0.00 H new ATOM 0 HB2 PRO A 373 121.944 -15.998 5.255 1.00 0.00 H new ATOM 0 HB3 PRO A 373 121.899 -16.786 3.690 1.00 0.00 H new ATOM 0 HG2 PRO A 373 119.796 -15.319 4.976 1.00 0.00 H new ATOM 0 HG3 PRO A 373 119.751 -16.104 3.410 1.00 0.00 H new ATOM 0 HD2 PRO A 373 118.600 -17.017 5.962 1.00 0.00 H new ATOM 0 HD3 PRO A 373 118.255 -17.579 4.339 1.00 0.00 H new ATOM 30 N SER A 374 122.790 -18.726 7.119 1.00 0.00 N ATOM 31 CA SER A 374 123.393 -18.714 8.427 1.00 0.00 C ATOM 32 C SER A 374 124.690 -17.909 8.357 1.00 0.00 C ATOM 33 O SER A 374 125.542 -17.952 9.241 1.00 0.00 O ATOM 34 CB SER A 374 123.640 -20.155 8.849 1.00 0.00 C ATOM 35 OG SER A 374 124.237 -20.884 7.782 1.00 0.00 O ATOM 0 H SER A 374 123.222 -19.389 6.476 1.00 0.00 H new ATOM 0 HA SER A 374 122.745 -18.245 9.167 1.00 0.00 H new ATOM 0 HB2 SER A 374 124.290 -20.179 9.724 1.00 0.00 H new ATOM 0 HB3 SER A 374 122.699 -20.624 9.138 1.00 0.00 H new ATOM 0 HG SER A 374 124.393 -21.809 8.065 1.00 0.00 H new ATOM 41 N SER A 375 124.776 -17.133 7.314 1.00 0.00 N ATOM 42 CA SER A 375 125.895 -16.320 7.016 1.00 0.00 C ATOM 43 C SER A 375 125.325 -15.075 6.382 1.00 0.00 C ATOM 44 O SER A 375 124.432 -15.167 5.512 1.00 0.00 O ATOM 45 CB SER A 375 126.831 -17.042 6.033 1.00 0.00 C ATOM 46 OG SER A 375 128.091 -16.386 5.933 1.00 0.00 O ATOM 0 H SER A 375 124.028 -17.055 6.625 1.00 0.00 H new ATOM 0 HA SER A 375 126.482 -16.090 7.906 1.00 0.00 H new ATOM 0 HB2 SER A 375 126.980 -18.071 6.361 1.00 0.00 H new ATOM 0 HB3 SER A 375 126.363 -17.085 5.049 1.00 0.00 H new ATOM 0 HG SER A 375 128.663 -16.871 5.302 1.00 0.00 H new ATOM 52 N GLN A 376 125.759 -13.932 6.822 1.00 0.00 N ATOM 53 CA GLN A 376 125.212 -12.717 6.300 1.00 0.00 C ATOM 54 C GLN A 376 126.243 -11.741 5.692 1.00 0.00 C ATOM 55 O GLN A 376 126.423 -11.777 4.479 1.00 0.00 O ATOM 56 CB GLN A 376 124.238 -12.049 7.275 1.00 0.00 C ATOM 57 CG GLN A 376 122.848 -12.631 7.332 1.00 0.00 C ATOM 58 CD GLN A 376 122.065 -12.313 6.097 1.00 0.00 C ATOM 59 OE1 GLN A 376 121.405 -11.277 6.027 1.00 0.00 O ATOM 60 NE2 GLN A 376 122.118 -13.175 5.120 1.00 0.00 N ATOM 0 H GLN A 376 126.481 -13.816 7.533 1.00 0.00 H new ATOM 0 HA GLN A 376 124.624 -13.028 5.437 1.00 0.00 H new ATOM 0 HB2 GLN A 376 124.669 -12.094 8.275 1.00 0.00 H new ATOM 0 HB3 GLN A 376 124.157 -10.995 7.010 1.00 0.00 H new ATOM 0 HG2 GLN A 376 122.911 -13.712 7.455 1.00 0.00 H new ATOM 0 HG3 GLN A 376 122.325 -12.241 8.205 1.00 0.00 H new ATOM 0 HE21 GLN A 376 122.677 -14.022 5.217 1.00 0.00 H new ATOM 0 HE22 GLN A 376 121.600 -13.002 4.258 1.00 0.00 H new ATOM 69 N PRO A 377 126.986 -10.900 6.500 1.00 0.00 N ATOM 70 CA PRO A 377 127.818 -9.809 5.967 1.00 0.00 C ATOM 71 C PRO A 377 129.009 -10.274 5.138 1.00 0.00 C ATOM 72 O PRO A 377 130.128 -10.439 5.636 1.00 0.00 O ATOM 73 CB PRO A 377 128.288 -9.049 7.206 1.00 0.00 C ATOM 74 CG PRO A 377 128.257 -10.065 8.278 1.00 0.00 C ATOM 75 CD PRO A 377 127.090 -10.945 7.967 1.00 0.00 C ATOM 0 HA PRO A 377 127.239 -9.202 5.271 1.00 0.00 H new ATOM 0 HB2 PRO A 377 129.290 -8.643 7.069 1.00 0.00 H new ATOM 0 HB3 PRO A 377 127.632 -8.209 7.432 1.00 0.00 H new ATOM 0 HG2 PRO A 377 129.184 -10.638 8.302 1.00 0.00 H new ATOM 0 HG3 PRO A 377 128.146 -9.598 9.257 1.00 0.00 H new ATOM 0 HD2 PRO A 377 127.252 -11.962 8.324 1.00 0.00 H new ATOM 0 HD3 PRO A 377 126.179 -10.581 8.442 1.00 0.00 H new ATOM 83 N SER A 378 128.738 -10.579 3.914 1.00 0.00 N ATOM 84 CA SER A 378 129.754 -10.921 2.997 1.00 0.00 C ATOM 85 C SER A 378 129.791 -9.828 1.938 1.00 0.00 C ATOM 86 O SER A 378 130.865 -9.375 1.549 1.00 0.00 O ATOM 87 CB SER A 378 129.484 -12.311 2.416 1.00 0.00 C ATOM 88 OG SER A 378 129.092 -13.199 3.472 1.00 0.00 O ATOM 0 H SER A 378 127.795 -10.596 3.526 1.00 0.00 H new ATOM 0 HA SER A 378 130.732 -10.980 3.474 1.00 0.00 H new ATOM 0 HB2 SER A 378 128.699 -12.256 1.662 1.00 0.00 H new ATOM 0 HB3 SER A 378 130.377 -12.690 1.920 1.00 0.00 H new ATOM 0 HG SER A 378 128.917 -14.090 3.102 1.00 0.00 H new ATOM 94 N ASP A 379 128.598 -9.388 1.462 1.00 0.00 N ATOM 95 CA ASP A 379 128.554 -8.210 0.547 1.00 0.00 C ATOM 96 C ASP A 379 128.952 -6.946 1.271 1.00 0.00 C ATOM 97 O ASP A 379 130.076 -6.464 1.135 1.00 0.00 O ATOM 98 CB ASP A 379 127.158 -8.017 -0.069 1.00 0.00 C ATOM 99 CG ASP A 379 127.050 -6.783 -0.959 1.00 0.00 C ATOM 100 OD1 ASP A 379 127.419 -6.836 -2.157 1.00 0.00 O ATOM 101 OD2 ASP A 379 126.560 -5.738 -0.445 1.00 0.00 O ATOM 0 H ASP A 379 127.693 -9.804 1.680 1.00 0.00 H new ATOM 0 HA ASP A 379 129.265 -8.410 -0.254 1.00 0.00 H new ATOM 0 HB2 ASP A 379 126.903 -8.900 -0.654 1.00 0.00 H new ATOM 0 HB3 ASP A 379 126.423 -7.942 0.733 1.00 0.00 H new ATOM 106 N CYS A 380 128.007 -6.440 2.028 1.00 0.00 N ATOM 107 CA CYS A 380 128.116 -5.267 2.838 1.00 0.00 C ATOM 108 C CYS A 380 126.751 -4.908 3.260 1.00 0.00 C ATOM 109 O CYS A 380 126.470 -4.848 4.427 1.00 0.00 O ATOM 110 CB CYS A 380 128.674 -4.062 2.111 1.00 0.00 C ATOM 111 SG CYS A 380 128.673 -2.550 3.163 1.00 0.00 S ATOM 0 H CYS A 380 127.085 -6.871 2.093 1.00 0.00 H new ATOM 0 HA CYS A 380 128.798 -5.503 3.655 1.00 0.00 H new ATOM 0 HB2 CYS A 380 129.692 -4.276 1.786 1.00 0.00 H new ATOM 0 HB3 CYS A 380 128.085 -3.877 1.213 1.00 0.00 H new ATOM 116 N GLY A 381 125.866 -4.710 2.290 1.00 0.00 N ATOM 117 CA GLY A 381 124.563 -4.285 2.663 1.00 0.00 C ATOM 118 C GLY A 381 123.464 -4.921 1.899 1.00 0.00 C ATOM 119 O GLY A 381 122.323 -4.520 2.015 1.00 0.00 O ATOM 0 H GLY A 381 126.033 -4.835 1.291 1.00 0.00 H new ATOM 0 HA2 GLY A 381 124.417 -4.491 3.723 1.00 0.00 H new ATOM 0 HA3 GLY A 381 124.498 -3.204 2.537 1.00 0.00 H new ATOM 123 N GLU A 382 123.786 -5.885 1.087 1.00 0.00 N ATOM 124 CA GLU A 382 122.745 -6.665 0.487 1.00 0.00 C ATOM 125 C GLU A 382 122.355 -7.718 1.528 1.00 0.00 C ATOM 126 O GLU A 382 121.201 -7.950 1.823 1.00 0.00 O ATOM 127 CB GLU A 382 123.258 -7.346 -0.776 1.00 0.00 C ATOM 128 CG GLU A 382 122.217 -8.192 -1.538 1.00 0.00 C ATOM 129 CD GLU A 382 121.195 -7.375 -2.308 1.00 0.00 C ATOM 130 OE1 GLU A 382 121.475 -7.018 -3.471 1.00 0.00 O ATOM 131 OE2 GLU A 382 120.108 -7.024 -1.761 1.00 0.00 O ATOM 0 H GLU A 382 124.738 -6.146 0.829 1.00 0.00 H new ATOM 0 HA GLU A 382 121.895 -6.045 0.203 1.00 0.00 H new ATOM 0 HB2 GLU A 382 123.644 -6.581 -1.450 1.00 0.00 H new ATOM 0 HB3 GLU A 382 124.097 -7.988 -0.508 1.00 0.00 H new ATOM 0 HG2 GLU A 382 122.739 -8.850 -2.233 1.00 0.00 H new ATOM 0 HG3 GLU A 382 121.694 -8.831 -0.827 1.00 0.00 H new ATOM 138 N VAL A 383 123.379 -8.248 2.162 1.00 0.00 N ATOM 139 CA VAL A 383 123.248 -9.310 3.128 1.00 0.00 C ATOM 140 C VAL A 383 123.518 -8.869 4.551 1.00 0.00 C ATOM 141 O VAL A 383 124.559 -9.190 5.105 1.00 0.00 O ATOM 142 CB VAL A 383 124.130 -10.537 2.820 1.00 0.00 C ATOM 143 CG1 VAL A 383 123.306 -11.685 2.255 1.00 0.00 C ATOM 144 CG2 VAL A 383 125.257 -10.168 1.880 1.00 0.00 C ATOM 0 H VAL A 383 124.342 -7.945 2.016 1.00 0.00 H new ATOM 0 HA VAL A 383 122.201 -9.599 3.041 1.00 0.00 H new ATOM 0 HB VAL A 383 124.567 -10.875 3.760 1.00 0.00 H new ATOM 0 HG11 VAL A 383 123.958 -12.534 2.049 1.00 0.00 H new ATOM 0 HG12 VAL A 383 122.546 -11.978 2.979 1.00 0.00 H new ATOM 0 HG13 VAL A 383 122.823 -11.366 1.331 1.00 0.00 H new ATOM 0 HG21 VAL A 383 125.865 -11.050 1.678 1.00 0.00 H new ATOM 0 HG22 VAL A 383 124.842 -9.791 0.945 1.00 0.00 H new ATOM 0 HG23 VAL A 383 125.876 -9.398 2.339 1.00 0.00 H new ATOM 154 N ILE A 384 122.631 -8.075 5.108 1.00 0.00 N ATOM 155 CA ILE A 384 122.732 -7.643 6.517 1.00 0.00 C ATOM 156 C ILE A 384 121.323 -7.415 7.099 1.00 0.00 C ATOM 157 O ILE A 384 120.928 -6.287 7.370 1.00 0.00 O ATOM 158 CB ILE A 384 123.575 -6.323 6.685 1.00 0.00 C ATOM 159 CG1 ILE A 384 123.097 -5.231 5.697 1.00 0.00 C ATOM 160 CG2 ILE A 384 125.071 -6.574 6.593 1.00 0.00 C ATOM 161 CD1 ILE A 384 123.753 -3.876 5.911 1.00 0.00 C ATOM 0 H ILE A 384 121.819 -7.703 4.616 1.00 0.00 H new ATOM 0 HA ILE A 384 123.246 -8.439 7.056 1.00 0.00 H new ATOM 0 HB ILE A 384 123.399 -5.950 7.694 1.00 0.00 H new ATOM 0 HG12 ILE A 384 123.297 -5.564 4.679 1.00 0.00 H new ATOM 0 HG13 ILE A 384 122.017 -5.119 5.789 1.00 0.00 H new ATOM 0 HG21 ILE A 384 125.606 -5.632 6.715 1.00 0.00 H new ATOM 0 HG22 ILE A 384 125.373 -7.267 7.378 1.00 0.00 H new ATOM 0 HG23 ILE A 384 125.309 -7.003 5.619 1.00 0.00 H new ATOM 0 HD11 ILE A 384 123.366 -3.165 5.181 1.00 0.00 H new ATOM 0 HD12 ILE A 384 123.532 -3.519 6.917 1.00 0.00 H new ATOM 0 HD13 ILE A 384 124.832 -3.971 5.789 1.00 0.00 H new ATOM 173 N GLU A 385 120.553 -8.508 7.267 1.00 0.00 N ATOM 174 CA GLU A 385 119.111 -8.466 7.706 1.00 0.00 C ATOM 175 C GLU A 385 118.207 -7.650 6.735 1.00 0.00 C ATOM 176 O GLU A 385 116.979 -7.614 6.872 1.00 0.00 O ATOM 177 CB GLU A 385 119.001 -7.937 9.158 1.00 0.00 C ATOM 178 CG GLU A 385 117.585 -7.821 9.705 1.00 0.00 C ATOM 179 CD GLU A 385 117.558 -7.540 11.162 1.00 0.00 C ATOM 180 OE1 GLU A 385 117.607 -8.495 11.955 1.00 0.00 O ATOM 181 OE2 GLU A 385 117.496 -6.363 11.550 1.00 0.00 O ATOM 0 H GLU A 385 120.898 -9.455 7.106 1.00 0.00 H new ATOM 0 HA GLU A 385 118.738 -9.490 7.678 1.00 0.00 H new ATOM 0 HB2 GLU A 385 119.572 -8.597 9.811 1.00 0.00 H new ATOM 0 HB3 GLU A 385 119.472 -6.955 9.206 1.00 0.00 H new ATOM 0 HG2 GLU A 385 117.059 -7.027 9.176 1.00 0.00 H new ATOM 0 HG3 GLU A 385 117.046 -8.747 9.507 1.00 0.00 H new ATOM 188 N GLU A 386 118.832 -7.090 5.741 1.00 0.00 N ATOM 189 CA GLU A 386 118.246 -6.239 4.755 1.00 0.00 C ATOM 190 C GLU A 386 117.110 -6.972 4.064 1.00 0.00 C ATOM 191 O GLU A 386 117.265 -8.102 3.583 1.00 0.00 O ATOM 192 CB GLU A 386 119.348 -5.883 3.762 1.00 0.00 C ATOM 193 CG GLU A 386 119.365 -4.430 3.254 1.00 0.00 C ATOM 194 CD GLU A 386 119.377 -3.388 4.357 1.00 0.00 C ATOM 195 OE1 GLU A 386 118.303 -2.979 4.820 1.00 0.00 O ATOM 196 OE2 GLU A 386 120.475 -2.939 4.749 1.00 0.00 O ATOM 0 H GLU A 386 119.832 -7.227 5.591 1.00 0.00 H new ATOM 0 HA GLU A 386 117.834 -5.333 5.200 1.00 0.00 H new ATOM 0 HB2 GLU A 386 120.310 -6.093 4.229 1.00 0.00 H new ATOM 0 HB3 GLU A 386 119.260 -6.545 2.901 1.00 0.00 H new ATOM 0 HG2 GLU A 386 120.243 -4.287 2.624 1.00 0.00 H new ATOM 0 HG3 GLU A 386 118.491 -4.266 2.624 1.00 0.00 H new ATOM 203 N CYS A 387 115.982 -6.339 4.054 1.00 0.00 N ATOM 204 CA CYS A 387 114.787 -6.856 3.434 1.00 0.00 C ATOM 205 C CYS A 387 114.838 -6.951 1.888 1.00 0.00 C ATOM 206 O CYS A 387 114.043 -7.711 1.345 1.00 0.00 O ATOM 207 CB CYS A 387 113.621 -5.980 3.773 1.00 0.00 C ATOM 208 SG CYS A 387 113.783 -4.296 3.160 1.00 0.00 S ATOM 0 H CYS A 387 115.854 -5.424 4.486 1.00 0.00 H new ATOM 0 HA CYS A 387 114.692 -7.869 3.826 1.00 0.00 H new ATOM 0 HB2 CYS A 387 112.714 -6.422 3.361 1.00 0.00 H new ATOM 0 HB3 CYS A 387 113.500 -5.954 4.856 1.00 0.00 H new ATOM 213 N PRO A 388 115.683 -6.123 1.130 1.00 0.00 N ATOM 214 CA PRO A 388 115.725 -6.166 -0.317 1.00 0.00 C ATOM 215 C PRO A 388 115.972 -7.589 -0.921 1.00 0.00 C ATOM 216 O PRO A 388 115.032 -8.404 -0.988 1.00 0.00 O ATOM 217 CB PRO A 388 116.830 -5.144 -0.704 1.00 0.00 C ATOM 218 CG PRO A 388 117.595 -4.989 0.548 1.00 0.00 C ATOM 219 CD PRO A 388 116.563 -5.051 1.601 1.00 0.00 C ATOM 0 HA PRO A 388 114.753 -5.909 -0.739 1.00 0.00 H new ATOM 0 HB2 PRO A 388 117.456 -5.515 -1.516 1.00 0.00 H new ATOM 0 HB3 PRO A 388 116.405 -4.197 -1.037 1.00 0.00 H new ATOM 0 HG2 PRO A 388 118.335 -5.781 0.666 1.00 0.00 H new ATOM 0 HG3 PRO A 388 118.135 -4.042 0.572 1.00 0.00 H new ATOM 0 HD2 PRO A 388 116.993 -5.280 2.576 1.00 0.00 H new ATOM 0 HD3 PRO A 388 116.030 -4.105 1.702 1.00 0.00 H new ATOM 227 N ILE A 389 117.198 -7.879 -1.409 1.00 0.00 N ATOM 228 CA ILE A 389 117.514 -9.190 -1.991 1.00 0.00 C ATOM 229 C ILE A 389 116.643 -9.401 -3.283 1.00 0.00 C ATOM 230 O ILE A 389 115.754 -8.570 -3.656 1.00 0.00 O ATOM 231 CB ILE A 389 117.275 -10.384 -0.938 1.00 0.00 C ATOM 232 CG1 ILE A 389 117.943 -10.096 0.415 1.00 0.00 C ATOM 233 CG2 ILE A 389 117.801 -11.733 -1.449 1.00 0.00 C ATOM 234 CD1 ILE A 389 119.458 -10.089 0.353 1.00 0.00 C ATOM 0 H ILE A 389 117.978 -7.222 -1.409 1.00 0.00 H new ATOM 0 HA ILE A 389 118.571 -9.209 -2.255 1.00 0.00 H new ATOM 0 HB ILE A 389 116.194 -10.443 -0.814 1.00 0.00 H new ATOM 0 HG12 ILE A 389 117.598 -9.130 0.783 1.00 0.00 H new ATOM 0 HG13 ILE A 389 117.620 -10.846 1.137 1.00 0.00 H new ATOM 0 HG21 ILE A 389 117.615 -12.503 -0.701 1.00 0.00 H new ATOM 0 HG22 ILE A 389 117.290 -11.996 -2.375 1.00 0.00 H new ATOM 0 HG23 ILE A 389 118.873 -11.659 -1.634 1.00 0.00 H new ATOM 0 HD11 ILE A 389 119.862 -9.879 1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 389 119.813 -11.063 0.015 1.00 0.00 H new ATOM 0 HD13 ILE A 389 119.790 -9.320 -0.344 1.00 0.00 H new ATOM 246 N ASP A 390 116.850 -10.480 -3.944 1.00 0.00 N ATOM 247 CA ASP A 390 116.091 -10.807 -5.108 1.00 0.00 C ATOM 248 C ASP A 390 114.638 -11.130 -4.751 1.00 0.00 C ATOM 249 O ASP A 390 113.815 -11.300 -5.638 1.00 0.00 O ATOM 250 CB ASP A 390 116.728 -11.958 -5.822 1.00 0.00 C ATOM 251 CG ASP A 390 116.444 -13.294 -5.177 1.00 0.00 C ATOM 252 OD1 ASP A 390 117.094 -13.628 -4.163 1.00 0.00 O ATOM 253 OD2 ASP A 390 115.544 -14.017 -5.659 1.00 0.00 O ATOM 0 H ASP A 390 117.557 -11.172 -3.695 1.00 0.00 H new ATOM 0 HA ASP A 390 116.082 -9.940 -5.768 1.00 0.00 H new ATOM 0 HB2 ASP A 390 116.374 -11.978 -6.853 1.00 0.00 H new ATOM 0 HB3 ASP A 390 117.806 -11.802 -5.858 1.00 0.00 H new ATOM 258 N ALA A 391 114.330 -11.172 -3.450 1.00 0.00 N ATOM 259 CA ALA A 391 112.983 -11.363 -2.968 1.00 0.00 C ATOM 260 C ALA A 391 112.214 -10.080 -3.202 1.00 0.00 C ATOM 261 O ALA A 391 111.028 -10.101 -3.528 1.00 0.00 O ATOM 262 CB ALA A 391 112.983 -11.710 -1.493 1.00 0.00 C ATOM 0 H ALA A 391 115.022 -11.072 -2.708 1.00 0.00 H new ATOM 0 HA ALA A 391 112.515 -12.190 -3.502 1.00 0.00 H new ATOM 0 HB1 ALA A 391 111.957 -11.849 -1.152 1.00 0.00 H new ATOM 0 HB2 ALA A 391 113.546 -12.630 -1.336 1.00 0.00 H new ATOM 0 HB3 ALA A 391 113.446 -10.900 -0.929 1.00 0.00 H new ATOM 268 N CYS A 392 112.938 -8.954 -3.078 1.00 0.00 N ATOM 269 CA CYS A 392 112.400 -7.620 -3.356 1.00 0.00 C ATOM 270 C CYS A 392 112.281 -7.437 -4.863 1.00 0.00 C ATOM 271 O CYS A 392 111.780 -6.425 -5.340 1.00 0.00 O ATOM 272 CB CYS A 392 113.311 -6.538 -2.767 1.00 0.00 C ATOM 273 SG CYS A 392 112.699 -4.816 -2.866 1.00 0.00 S ATOM 0 H CYS A 392 113.914 -8.948 -2.781 1.00 0.00 H new ATOM 0 HA CYS A 392 111.417 -7.526 -2.894 1.00 0.00 H new ATOM 0 HB2 CYS A 392 113.491 -6.777 -1.719 1.00 0.00 H new ATOM 0 HB3 CYS A 392 114.274 -6.588 -3.276 1.00 0.00 H new ATOM 278 N PHE A 393 112.854 -8.424 -5.569 1.00 0.00 N ATOM 279 CA PHE A 393 112.823 -8.612 -7.021 1.00 0.00 C ATOM 280 C PHE A 393 114.130 -8.181 -7.618 1.00 0.00 C ATOM 281 O PHE A 393 114.287 -7.035 -7.920 1.00 0.00 O ATOM 282 CB PHE A 393 111.626 -7.935 -7.752 1.00 0.00 C ATOM 283 CG PHE A 393 110.270 -8.559 -7.515 1.00 0.00 C ATOM 284 CD1 PHE A 393 109.901 -9.715 -8.181 1.00 0.00 C ATOM 285 CD2 PHE A 393 109.359 -7.974 -6.647 1.00 0.00 C ATOM 286 CE1 PHE A 393 108.656 -10.277 -7.986 1.00 0.00 C ATOM 287 CE2 PHE A 393 108.116 -8.532 -6.443 1.00 0.00 C ATOM 288 CZ PHE A 393 107.762 -9.683 -7.114 1.00 0.00 C ATOM 0 H PHE A 393 113.387 -9.160 -5.105 1.00 0.00 H new ATOM 0 HA PHE A 393 112.668 -9.680 -7.177 1.00 0.00 H new ATOM 0 HB2 PHE A 393 111.582 -6.890 -7.446 1.00 0.00 H new ATOM 0 HB3 PHE A 393 111.827 -7.945 -8.823 1.00 0.00 H new ATOM 0 HD1 PHE A 393 110.596 -10.183 -8.862 1.00 0.00 H new ATOM 0 HD2 PHE A 393 109.628 -7.068 -6.124 1.00 0.00 H new ATOM 0 HE1 PHE A 393 108.380 -11.178 -8.513 1.00 0.00 H new ATOM 0 HE2 PHE A 393 107.420 -8.069 -5.759 1.00 0.00 H new ATOM 0 HZ PHE A 393 106.787 -10.121 -6.959 1.00 0.00 H new ATOM 298 N LEU A 394 115.125 -9.112 -7.653 1.00 0.00 N ATOM 299 CA LEU A 394 116.474 -8.850 -8.214 1.00 0.00 C ATOM 300 C LEU A 394 117.292 -8.069 -7.176 1.00 0.00 C ATOM 301 O LEU A 394 116.716 -7.510 -6.241 1.00 0.00 O ATOM 302 CB LEU A 394 116.452 -8.049 -9.575 1.00 0.00 C ATOM 303 CG LEU A 394 115.976 -8.742 -10.871 1.00 0.00 C ATOM 304 CD1 LEU A 394 114.521 -9.172 -10.805 1.00 0.00 C ATOM 305 CD2 LEU A 394 116.185 -7.804 -12.041 1.00 0.00 C ATOM 0 H LEU A 394 115.011 -10.060 -7.294 1.00 0.00 H new ATOM 0 HA LEU A 394 116.924 -9.818 -8.436 1.00 0.00 H new ATOM 0 HB2 LEU A 394 115.821 -7.173 -9.425 1.00 0.00 H new ATOM 0 HB3 LEU A 394 117.464 -7.686 -9.754 1.00 0.00 H new ATOM 0 HG LEU A 394 116.567 -9.649 -10.998 1.00 0.00 H new ATOM 0 HD11 LEU A 394 114.241 -9.653 -11.742 1.00 0.00 H new ATOM 0 HD12 LEU A 394 114.386 -9.874 -9.982 1.00 0.00 H new ATOM 0 HD13 LEU A 394 113.890 -8.298 -10.643 1.00 0.00 H new ATOM 0 HD21 LEU A 394 115.851 -8.287 -12.959 1.00 0.00 H new ATOM 0 HD22 LEU A 394 115.611 -6.891 -11.882 1.00 0.00 H new ATOM 0 HD23 LEU A 394 117.243 -7.558 -12.125 1.00 0.00 H new ATOM 317 N PRO A 395 118.642 -8.085 -7.252 1.00 0.00 N ATOM 318 CA PRO A 395 119.518 -7.237 -6.407 1.00 0.00 C ATOM 319 C PRO A 395 119.316 -5.739 -6.647 1.00 0.00 C ATOM 320 O PRO A 395 120.258 -5.017 -6.901 1.00 0.00 O ATOM 321 CB PRO A 395 120.937 -7.631 -6.815 1.00 0.00 C ATOM 322 CG PRO A 395 120.799 -8.420 -8.069 1.00 0.00 C ATOM 323 CD PRO A 395 119.433 -9.023 -8.049 1.00 0.00 C ATOM 0 HA PRO A 395 119.299 -7.396 -5.351 1.00 0.00 H new ATOM 0 HB2 PRO A 395 121.556 -6.748 -6.976 1.00 0.00 H new ATOM 0 HB3 PRO A 395 121.418 -8.220 -6.034 1.00 0.00 H new ATOM 0 HG2 PRO A 395 120.928 -7.782 -8.944 1.00 0.00 H new ATOM 0 HG3 PRO A 395 121.563 -9.195 -8.125 1.00 0.00 H new ATOM 0 HD2 PRO A 395 119.029 -9.130 -9.056 1.00 0.00 H new ATOM 0 HD3 PRO A 395 119.442 -10.017 -7.602 1.00 0.00 H new ATOM 331 N LYS A 396 118.077 -5.311 -6.463 1.00 0.00 N ATOM 332 CA LYS A 396 117.559 -3.936 -6.534 1.00 0.00 C ATOM 333 C LYS A 396 118.260 -2.897 -7.433 1.00 0.00 C ATOM 334 O LYS A 396 117.702 -2.477 -8.475 1.00 0.00 O ATOM 335 CB LYS A 396 117.122 -3.469 -5.143 1.00 0.00 C ATOM 336 CG LYS A 396 117.984 -4.010 -4.035 1.00 0.00 C ATOM 337 CD LYS A 396 119.190 -3.105 -3.823 1.00 0.00 C ATOM 338 CE LYS A 396 120.472 -3.894 -3.670 1.00 0.00 C ATOM 339 NZ LYS A 396 120.628 -4.500 -2.337 1.00 0.00 N ATOM 0 H LYS A 396 117.333 -5.971 -6.239 1.00 0.00 H new ATOM 0 HA LYS A 396 116.675 -4.010 -7.168 1.00 0.00 H new ATOM 0 HB2 LYS A 396 117.142 -2.380 -5.110 1.00 0.00 H new ATOM 0 HB3 LYS A 396 116.090 -3.774 -4.973 1.00 0.00 H new ATOM 0 HG2 LYS A 396 117.405 -4.080 -3.114 1.00 0.00 H new ATOM 0 HG3 LYS A 396 118.315 -5.019 -4.281 1.00 0.00 H new ATOM 0 HD2 LYS A 396 119.283 -2.422 -4.667 1.00 0.00 H new ATOM 0 HD3 LYS A 396 119.033 -2.494 -2.934 1.00 0.00 H new ATOM 0 HE2 LYS A 396 120.499 -4.680 -4.424 1.00 0.00 H new ATOM 0 HE3 LYS A 396 121.320 -3.237 -3.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 396 121.606 -4.834 -2.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 396 120.414 -3.791 -1.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 396 119.974 -5.303 -2.242 1.00 0.00 H new ATOM 353 N SER A 397 119.451 -2.529 -7.063 1.00 0.00 N ATOM 354 CA SER A 397 120.285 -1.593 -7.775 1.00 0.00 C ATOM 355 C SER A 397 120.913 -2.268 -9.015 1.00 0.00 C ATOM 356 O SER A 397 121.786 -1.700 -9.658 1.00 0.00 O ATOM 357 CB SER A 397 121.370 -1.077 -6.816 1.00 0.00 C ATOM 358 OG SER A 397 122.214 -0.110 -7.429 1.00 0.00 O ATOM 0 H SER A 397 119.893 -2.888 -6.217 1.00 0.00 H new ATOM 0 HA SER A 397 119.687 -0.753 -8.128 1.00 0.00 H new ATOM 0 HB2 SER A 397 120.897 -0.639 -5.937 1.00 0.00 H new ATOM 0 HB3 SER A 397 121.974 -1.915 -6.468 1.00 0.00 H new ATOM 0 HG SER A 397 122.353 -0.347 -8.370 1.00 0.00 H new ATOM 364 N ASP A 398 120.445 -3.476 -9.315 1.00 0.00 N ATOM 365 CA ASP A 398 120.847 -4.249 -10.496 1.00 0.00 C ATOM 366 C ASP A 398 120.829 -3.424 -11.790 1.00 0.00 C ATOM 367 O ASP A 398 121.858 -2.989 -12.268 1.00 0.00 O ATOM 368 CB ASP A 398 120.018 -5.564 -10.575 1.00 0.00 C ATOM 369 CG ASP A 398 120.036 -6.241 -11.926 1.00 0.00 C ATOM 370 OD1 ASP A 398 120.916 -7.070 -12.181 1.00 0.00 O ATOM 371 OD2 ASP A 398 119.152 -5.960 -12.742 1.00 0.00 O ATOM 0 H ASP A 398 119.760 -3.959 -8.734 1.00 0.00 H new ATOM 0 HA ASP A 398 121.894 -4.530 -10.382 1.00 0.00 H new ATOM 0 HB2 ASP A 398 120.397 -6.262 -9.829 1.00 0.00 H new ATOM 0 HB3 ASP A 398 118.985 -5.343 -10.308 1.00 0.00 H new ATOM 376 N SER A 399 119.702 -3.228 -12.337 1.00 0.00 N ATOM 377 CA SER A 399 119.503 -2.411 -13.488 1.00 0.00 C ATOM 378 C SER A 399 118.069 -1.904 -13.453 1.00 0.00 C ATOM 379 O SER A 399 117.328 -2.026 -14.433 1.00 0.00 O ATOM 380 CB SER A 399 119.781 -3.192 -14.798 1.00 0.00 C ATOM 381 OG SER A 399 121.130 -3.655 -14.834 1.00 0.00 O ATOM 0 H SER A 399 118.840 -3.648 -11.988 1.00 0.00 H new ATOM 0 HA SER A 399 120.203 -1.576 -13.472 1.00 0.00 H new ATOM 0 HB2 SER A 399 119.099 -4.039 -14.874 1.00 0.00 H new ATOM 0 HB3 SER A 399 119.589 -2.550 -15.658 1.00 0.00 H new ATOM 0 HG SER A 399 121.589 -3.389 -14.010 1.00 0.00 H new ATOM 387 N ALA A 400 117.660 -1.459 -12.236 1.00 0.00 N ATOM 388 CA ALA A 400 116.380 -0.810 -11.991 1.00 0.00 C ATOM 389 C ALA A 400 115.224 -1.793 -11.965 1.00 0.00 C ATOM 390 O ALA A 400 114.489 -1.932 -12.943 1.00 0.00 O ATOM 391 CB ALA A 400 116.115 0.347 -12.968 1.00 0.00 C ATOM 0 H ALA A 400 118.231 -1.551 -11.396 1.00 0.00 H new ATOM 0 HA ALA A 400 116.450 -0.378 -10.993 1.00 0.00 H new ATOM 0 HB1 ALA A 400 115.148 0.798 -12.744 1.00 0.00 H new ATOM 0 HB2 ALA A 400 116.899 1.098 -12.864 1.00 0.00 H new ATOM 0 HB3 ALA A 400 116.110 -0.033 -13.989 1.00 0.00 H new ATOM 397 N ARG A 401 115.124 -2.540 -10.878 1.00 0.00 N ATOM 398 CA ARG A 401 114.034 -3.505 -10.732 1.00 0.00 C ATOM 399 C ARG A 401 112.688 -2.825 -10.483 1.00 0.00 C ATOM 400 O ARG A 401 112.671 -1.600 -10.234 1.00 0.00 O ATOM 401 CB ARG A 401 114.380 -4.587 -9.676 1.00 0.00 C ATOM 402 CG ARG A 401 114.822 -4.136 -8.274 1.00 0.00 C ATOM 403 CD ARG A 401 113.703 -3.753 -7.277 1.00 0.00 C ATOM 404 NE ARG A 401 113.240 -2.371 -7.381 1.00 0.00 N ATOM 405 CZ ARG A 401 112.989 -1.531 -6.345 1.00 0.00 C ATOM 406 NH1 ARG A 401 112.993 -1.964 -5.081 1.00 0.00 N ATOM 407 NH2 ARG A 401 112.635 -0.278 -6.599 1.00 0.00 N ATOM 0 H ARG A 401 115.772 -2.503 -10.091 1.00 0.00 H new ATOM 0 HA ARG A 401 113.922 -4.025 -11.683 1.00 0.00 H new ATOM 0 HB2 ARG A 401 113.504 -5.225 -9.557 1.00 0.00 H new ATOM 0 HB3 ARG A 401 115.174 -5.209 -10.089 1.00 0.00 H new ATOM 0 HG2 ARG A 401 115.412 -4.938 -7.830 1.00 0.00 H new ATOM 0 HG3 ARG A 401 115.484 -3.278 -8.387 1.00 0.00 H new ATOM 0 HD2 ARG A 401 112.854 -4.419 -7.431 1.00 0.00 H new ATOM 0 HD3 ARG A 401 114.064 -3.926 -6.263 1.00 0.00 H new ATOM 0 HE ARG A 401 113.091 -2.003 -8.321 1.00 0.00 H new ATOM 0 HH11 ARG A 401 113.188 -2.945 -4.878 1.00 0.00 H new ATOM 0 HH12 ARG A 401 112.802 -1.314 -4.319 1.00 0.00 H new ATOM 0 HH21 ARG A 401 112.554 0.044 -7.564 1.00 0.00 H new ATOM 0 HH22 ARG A 401 112.443 0.364 -5.830 1.00 0.00 H new ATOM 421 N PRO A 402 111.546 -3.600 -10.596 1.00 0.00 N ATOM 422 CA PRO A 402 110.164 -3.152 -10.307 1.00 0.00 C ATOM 423 C PRO A 402 110.055 -2.099 -9.186 1.00 0.00 C ATOM 424 O PRO A 402 110.859 -2.056 -8.311 1.00 0.00 O ATOM 425 CB PRO A 402 109.462 -4.464 -9.888 1.00 0.00 C ATOM 426 CG PRO A 402 110.426 -5.574 -10.211 1.00 0.00 C ATOM 427 CD PRO A 402 111.487 -4.980 -11.087 1.00 0.00 C ATOM 0 HA PRO A 402 109.726 -2.649 -11.169 1.00 0.00 H new ATOM 0 HB2 PRO A 402 109.220 -4.455 -8.825 1.00 0.00 H new ATOM 0 HB3 PRO A 402 108.524 -4.593 -10.427 1.00 0.00 H new ATOM 0 HG2 PRO A 402 110.861 -5.986 -9.301 1.00 0.00 H new ATOM 0 HG3 PRO A 402 109.917 -6.393 -10.720 1.00 0.00 H new ATOM 0 HD2 PRO A 402 112.442 -5.494 -10.977 1.00 0.00 H new ATOM 0 HD3 PRO A 402 111.219 -5.027 -12.142 1.00 0.00 H new ATOM 435 N PRO A 403 109.017 -1.288 -9.188 1.00 0.00 N ATOM 436 CA PRO A 403 108.908 -0.144 -8.278 1.00 0.00 C ATOM 437 C PRO A 403 108.701 -0.522 -6.815 1.00 0.00 C ATOM 438 O PRO A 403 108.262 -1.630 -6.484 1.00 0.00 O ATOM 439 CB PRO A 403 107.683 0.578 -8.783 1.00 0.00 C ATOM 440 CG PRO A 403 106.856 -0.506 -9.382 1.00 0.00 C ATOM 441 CD PRO A 403 107.827 -1.447 -10.013 1.00 0.00 C ATOM 0 HA PRO A 403 109.830 0.437 -8.282 1.00 0.00 H new ATOM 0 HB2 PRO A 403 107.155 1.084 -7.975 1.00 0.00 H new ATOM 0 HB3 PRO A 403 107.942 1.338 -9.520 1.00 0.00 H new ATOM 0 HG2 PRO A 403 106.259 -1.010 -8.622 1.00 0.00 H new ATOM 0 HG3 PRO A 403 106.161 -0.107 -10.120 1.00 0.00 H new ATOM 0 HD2 PRO A 403 107.461 -2.474 -10.001 1.00 0.00 H new ATOM 0 HD3 PRO A 403 108.020 -1.190 -11.055 1.00 0.00 H new ATOM 449 N ASP A 404 108.947 0.430 -5.957 1.00 0.00 N ATOM 450 CA ASP A 404 108.809 0.285 -4.496 1.00 0.00 C ATOM 451 C ASP A 404 107.386 0.620 -3.966 1.00 0.00 C ATOM 452 O ASP A 404 107.237 1.340 -2.977 1.00 0.00 O ATOM 453 CB ASP A 404 109.781 1.223 -3.820 1.00 0.00 C ATOM 454 CG ASP A 404 111.239 0.846 -3.999 1.00 0.00 C ATOM 455 OD1 ASP A 404 111.701 -0.173 -3.459 1.00 0.00 O ATOM 456 OD2 ASP A 404 111.939 1.547 -4.777 1.00 0.00 O ATOM 0 H ASP A 404 109.258 1.359 -6.241 1.00 0.00 H new ATOM 0 HA ASP A 404 109.008 -0.762 -4.269 1.00 0.00 H new ATOM 0 HB2 ASP A 404 109.628 2.229 -4.210 1.00 0.00 H new ATOM 0 HB3 ASP A 404 109.555 1.256 -2.754 1.00 0.00 H new ATOM 461 N CYS A 405 106.372 0.173 -4.665 1.00 0.00 N ATOM 462 CA CYS A 405 104.947 0.242 -4.184 1.00 0.00 C ATOM 463 C CYS A 405 104.375 1.624 -4.009 1.00 0.00 C ATOM 464 O CYS A 405 103.640 2.069 -4.861 1.00 0.00 O ATOM 465 CB CYS A 405 104.705 -0.568 -2.942 1.00 0.00 C ATOM 466 SG CYS A 405 104.377 -2.324 -3.265 1.00 0.00 S ATOM 0 H CYS A 405 106.474 -0.254 -5.586 1.00 0.00 H new ATOM 0 HA CYS A 405 104.404 -0.203 -5.018 1.00 0.00 H new ATOM 0 HB2 CYS A 405 105.574 -0.484 -2.290 1.00 0.00 H new ATOM 0 HB3 CYS A 405 103.859 -0.143 -2.402 1.00 0.00 H new ATOM 471 N THR A 406 104.615 2.277 -2.860 1.00 0.00 N ATOM 472 CA THR A 406 104.256 3.703 -2.649 1.00 0.00 C ATOM 473 C THR A 406 104.747 4.514 -3.862 1.00 0.00 C ATOM 474 O THR A 406 104.114 5.451 -4.335 1.00 0.00 O ATOM 475 CB THR A 406 104.991 4.202 -1.376 1.00 0.00 C ATOM 476 OG1 THR A 406 104.442 3.638 -0.190 1.00 0.00 O ATOM 477 CG2 THR A 406 105.060 5.702 -1.312 1.00 0.00 C ATOM 0 H THR A 406 105.060 1.842 -2.052 1.00 0.00 H new ATOM 0 HA THR A 406 103.178 3.819 -2.534 1.00 0.00 H new ATOM 0 HB THR A 406 106.019 3.848 -1.446 1.00 0.00 H new ATOM 0 HG1 THR A 406 105.073 2.990 0.187 1.00 0.00 H new ATOM 0 HG21 THR A 406 105.583 6.004 -0.404 1.00 0.00 H new ATOM 0 HG22 THR A 406 105.597 6.079 -2.182 1.00 0.00 H new ATOM 0 HG23 THR A 406 104.050 6.113 -1.303 1.00 0.00 H new ATOM 485 N ALA A 407 105.867 4.088 -4.310 1.00 0.00 N ATOM 486 CA ALA A 407 106.524 4.510 -5.515 1.00 0.00 C ATOM 487 C ALA A 407 105.553 4.513 -6.780 1.00 0.00 C ATOM 488 O ALA A 407 105.846 5.154 -7.783 1.00 0.00 O ATOM 489 CB ALA A 407 107.667 3.557 -5.665 1.00 0.00 C ATOM 0 H ALA A 407 106.402 3.377 -3.812 1.00 0.00 H new ATOM 0 HA ALA A 407 106.861 5.545 -5.454 1.00 0.00 H new ATOM 0 HB1 ALA A 407 108.230 3.803 -6.565 1.00 0.00 H new ATOM 0 HB2 ALA A 407 108.320 3.633 -4.796 1.00 0.00 H new ATOM 0 HB3 ALA A 407 107.284 2.539 -5.744 1.00 0.00 H new ATOM 495 N VAL A 408 104.440 3.763 -6.726 1.00 0.00 N ATOM 496 CA VAL A 408 103.405 3.798 -7.761 1.00 0.00 C ATOM 497 C VAL A 408 102.115 4.348 -7.147 1.00 0.00 C ATOM 498 O VAL A 408 101.229 4.812 -7.854 1.00 0.00 O ATOM 499 CB VAL A 408 103.090 2.369 -8.370 1.00 0.00 C ATOM 500 CG1 VAL A 408 104.345 1.601 -8.629 1.00 0.00 C ATOM 501 CG2 VAL A 408 102.119 1.532 -7.523 1.00 0.00 C ATOM 0 H VAL A 408 104.237 3.118 -5.963 1.00 0.00 H new ATOM 0 HA VAL A 408 103.778 4.429 -8.568 1.00 0.00 H new ATOM 0 HB VAL A 408 102.585 2.564 -9.316 1.00 0.00 H new ATOM 0 HG11 VAL A 408 104.095 0.626 -9.046 1.00 0.00 H new ATOM 0 HG12 VAL A 408 104.968 2.149 -9.336 1.00 0.00 H new ATOM 0 HG13 VAL A 408 104.889 1.467 -7.694 1.00 0.00 H new ATOM 0 HG21 VAL A 408 101.953 0.569 -8.005 1.00 0.00 H new ATOM 0 HG22 VAL A 408 102.544 1.374 -6.532 1.00 0.00 H new ATOM 0 HG23 VAL A 408 101.170 2.059 -7.430 1.00 0.00 H new ATOM 511 N GLY A 409 102.037 4.303 -5.819 1.00 0.00 N ATOM 512 CA GLY A 409 100.854 4.696 -5.154 1.00 0.00 C ATOM 513 C GLY A 409 100.317 3.684 -4.160 1.00 0.00 C ATOM 514 O GLY A 409 99.169 3.756 -3.807 1.00 0.00 O ATOM 0 H GLY A 409 102.792 3.995 -5.206 1.00 0.00 H new ATOM 0 HA2 GLY A 409 101.042 5.634 -4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 409 100.084 4.896 -5.899 1.00 0.00 H new ATOM 518 N ARG A 410 101.099 2.662 -3.811 1.00 0.00 N ATOM 519 CA ARG A 410 100.734 1.694 -2.756 1.00 0.00 C ATOM 520 C ARG A 410 101.322 2.101 -1.431 1.00 0.00 C ATOM 521 O ARG A 410 102.363 1.569 -1.042 1.00 0.00 O ATOM 522 CB ARG A 410 101.274 0.283 -3.075 1.00 0.00 C ATOM 523 CG ARG A 410 100.427 -0.542 -4.023 1.00 0.00 C ATOM 524 CD ARG A 410 98.898 -0.275 -3.824 1.00 0.00 C ATOM 525 NE ARG A 410 98.398 1.034 -4.314 1.00 0.00 N ATOM 526 CZ ARG A 410 97.106 1.340 -4.536 1.00 0.00 C ATOM 527 NH1 ARG A 410 96.169 0.405 -4.462 1.00 0.00 N ATOM 528 NH2 ARG A 410 96.767 2.594 -4.851 1.00 0.00 N ATOM 0 H ARG A 410 102.003 2.475 -4.246 1.00 0.00 H new ATOM 0 HA ARG A 410 99.645 1.681 -2.711 1.00 0.00 H new ATOM 0 HB2 ARG A 410 102.272 0.383 -3.501 1.00 0.00 H new ATOM 0 HB3 ARG A 410 101.380 -0.266 -2.139 1.00 0.00 H new ATOM 0 HG2 ARG A 410 100.705 -0.312 -5.052 1.00 0.00 H new ATOM 0 HG3 ARG A 410 100.634 -1.601 -3.866 1.00 0.00 H new ATOM 0 HD2 ARG A 410 98.342 -1.066 -4.328 1.00 0.00 H new ATOM 0 HD3 ARG A 410 98.671 -0.354 -2.761 1.00 0.00 H new ATOM 0 HE ARG A 410 99.090 1.761 -4.497 1.00 0.00 H new ATOM 0 HH11 ARG A 410 96.424 -0.556 -4.235 1.00 0.00 H new ATOM 0 HH12 ARG A 410 95.193 0.647 -4.632 1.00 0.00 H new ATOM 0 HH21 ARG A 410 97.486 3.314 -4.922 1.00 0.00 H new ATOM 0 HH22 ARG A 410 95.789 2.831 -5.020 1.00 0.00 H new ATOM 542 N PRO A 411 100.698 3.033 -0.682 1.00 0.00 N ATOM 543 CA PRO A 411 101.275 3.502 0.569 1.00 0.00 C ATOM 544 C PRO A 411 101.022 2.474 1.647 1.00 0.00 C ATOM 545 O PRO A 411 101.609 2.486 2.701 1.00 0.00 O ATOM 546 CB PRO A 411 100.488 4.775 0.852 1.00 0.00 C ATOM 547 CG PRO A 411 99.137 4.489 0.298 1.00 0.00 C ATOM 548 CD PRO A 411 99.372 3.671 -0.932 1.00 0.00 C ATOM 0 HA PRO A 411 102.352 3.668 0.529 1.00 0.00 H new ATOM 0 HB2 PRO A 411 100.445 4.989 1.920 1.00 0.00 H new ATOM 0 HB3 PRO A 411 100.942 5.641 0.371 1.00 0.00 H new ATOM 0 HG2 PRO A 411 98.525 3.947 1.018 1.00 0.00 H new ATOM 0 HG3 PRO A 411 98.607 5.412 0.060 1.00 0.00 H new ATOM 0 HD2 PRO A 411 98.589 2.926 -1.073 1.00 0.00 H new ATOM 0 HD3 PRO A 411 99.388 4.291 -1.829 1.00 0.00 H new ATOM 556 N ASP A 412 100.196 1.532 1.307 1.00 0.00 N ATOM 557 CA ASP A 412 99.770 0.505 2.238 1.00 0.00 C ATOM 558 C ASP A 412 100.889 -0.519 2.344 1.00 0.00 C ATOM 559 O ASP A 412 101.166 -1.107 3.393 1.00 0.00 O ATOM 560 CB ASP A 412 98.465 -0.102 1.716 1.00 0.00 C ATOM 561 CG ASP A 412 97.649 -0.778 2.774 1.00 0.00 C ATOM 562 OD1 ASP A 412 97.934 -0.593 3.970 1.00 0.00 O ATOM 563 OD2 ASP A 412 96.647 -1.422 2.422 1.00 0.00 O ATOM 0 H ASP A 412 99.791 1.444 0.375 1.00 0.00 H new ATOM 0 HA ASP A 412 99.576 0.900 3.235 1.00 0.00 H new ATOM 0 HB2 ASP A 412 97.867 0.685 1.256 1.00 0.00 H new ATOM 0 HB3 ASP A 412 98.698 -0.824 0.933 1.00 0.00 H new ATOM 568 N CYS A 413 101.620 -0.593 1.274 1.00 0.00 N ATOM 569 CA CYS A 413 102.733 -1.480 1.194 1.00 0.00 C ATOM 570 C CYS A 413 103.936 -0.849 1.798 1.00 0.00 C ATOM 571 O CYS A 413 104.902 -1.503 1.983 1.00 0.00 O ATOM 572 CB CYS A 413 103.008 -1.887 -0.209 1.00 0.00 C ATOM 573 SG CYS A 413 101.643 -2.737 -0.984 1.00 0.00 S ATOM 0 H CYS A 413 101.459 -0.039 0.433 1.00 0.00 H new ATOM 0 HA CYS A 413 102.484 -2.381 1.755 1.00 0.00 H new ATOM 0 HB2 CYS A 413 103.254 -1.001 -0.795 1.00 0.00 H new ATOM 0 HB3 CYS A 413 103.885 -2.534 -0.226 1.00 0.00 H new ATOM 578 N ASN A 414 103.895 0.490 2.008 1.00 0.00 N ATOM 579 CA ASN A 414 104.935 1.183 2.811 1.00 0.00 C ATOM 580 C ASN A 414 105.335 0.386 4.095 1.00 0.00 C ATOM 581 O ASN A 414 106.463 0.505 4.613 1.00 0.00 O ATOM 582 CB ASN A 414 104.507 2.633 3.126 1.00 0.00 C ATOM 583 CG ASN A 414 105.463 3.414 4.017 1.00 0.00 C ATOM 584 OD1 ASN A 414 106.402 4.030 3.528 1.00 0.00 O ATOM 585 ND2 ASN A 414 105.192 3.459 5.305 1.00 0.00 N ATOM 0 H ASN A 414 103.167 1.103 1.640 1.00 0.00 H new ATOM 0 HA ASN A 414 105.839 1.230 2.204 1.00 0.00 H new ATOM 0 HB2 ASN A 414 104.390 3.172 2.186 1.00 0.00 H new ATOM 0 HB3 ASN A 414 103.528 2.610 3.604 1.00 0.00 H new ATOM 0 HD21 ASN A 414 105.772 4.020 5.929 1.00 0.00 H new ATOM 0 HD22 ASN A 414 104.402 2.933 5.679 1.00 0.00 H new ATOM 592 N VAL A 415 104.453 -0.467 4.577 1.00 0.00 N ATOM 593 CA VAL A 415 104.854 -1.276 5.653 1.00 0.00 C ATOM 594 C VAL A 415 105.750 -2.425 5.191 1.00 0.00 C ATOM 595 O VAL A 415 105.358 -3.258 4.370 1.00 0.00 O ATOM 596 CB VAL A 415 103.738 -1.779 6.534 1.00 0.00 C ATOM 597 CG1 VAL A 415 104.313 -2.820 7.470 1.00 0.00 C ATOM 598 CG2 VAL A 415 103.172 -0.630 7.328 1.00 0.00 C ATOM 0 H VAL A 415 103.499 -0.598 4.242 1.00 0.00 H new ATOM 0 HA VAL A 415 105.432 -0.606 6.290 1.00 0.00 H new ATOM 0 HB VAL A 415 102.941 -2.216 5.933 1.00 0.00 H new ATOM 0 HG11 VAL A 415 103.525 -3.201 8.119 1.00 0.00 H new ATOM 0 HG12 VAL A 415 104.732 -3.641 6.888 1.00 0.00 H new ATOM 0 HG13 VAL A 415 105.098 -2.369 8.078 1.00 0.00 H new ATOM 0 HG21 VAL A 415 102.365 -0.991 7.966 1.00 0.00 H new ATOM 0 HG22 VAL A 415 103.956 -0.194 7.947 1.00 0.00 H new ATOM 0 HG23 VAL A 415 102.785 0.127 6.646 1.00 0.00 H new ATOM 608 N LEU A 416 106.950 -2.387 5.716 1.00 0.00 N ATOM 609 CA LEU A 416 108.018 -3.388 5.510 1.00 0.00 C ATOM 610 C LEU A 416 107.514 -4.881 5.511 1.00 0.00 C ATOM 611 O LEU A 416 107.686 -5.562 4.479 1.00 0.00 O ATOM 612 CB LEU A 416 109.149 -3.149 6.537 1.00 0.00 C ATOM 613 CG LEU A 416 110.545 -3.764 6.243 1.00 0.00 C ATOM 614 CD1 LEU A 416 110.566 -5.284 6.394 1.00 0.00 C ATOM 615 CD2 LEU A 416 110.986 -3.379 4.854 1.00 0.00 C ATOM 0 H LEU A 416 107.243 -1.628 6.332 1.00 0.00 H new ATOM 0 HA LEU A 416 108.408 -3.243 4.502 1.00 0.00 H new ATOM 0 HB2 LEU A 416 109.276 -2.072 6.649 1.00 0.00 H new ATOM 0 HB3 LEU A 416 108.812 -3.532 7.500 1.00 0.00 H new ATOM 0 HG LEU A 416 111.237 -3.362 6.983 1.00 0.00 H new ATOM 0 HD11 LEU A 416 111.567 -5.657 6.176 1.00 0.00 H new ATOM 0 HD12 LEU A 416 110.293 -5.552 7.415 1.00 0.00 H new ATOM 0 HD13 LEU A 416 109.854 -5.729 5.699 1.00 0.00 H new ATOM 0 HD21 LEU A 416 111.966 -3.812 4.650 1.00 0.00 H new ATOM 0 HD22 LEU A 416 110.266 -3.753 4.127 1.00 0.00 H new ATOM 0 HD23 LEU A 416 111.046 -2.293 4.779 1.00 0.00 H new ATOM 627 N PRO A 417 106.984 -5.465 6.665 1.00 0.00 N ATOM 628 CA PRO A 417 106.398 -6.803 6.631 1.00 0.00 C ATOM 629 C PRO A 417 105.324 -6.855 5.566 1.00 0.00 C ATOM 630 O PRO A 417 104.421 -6.013 5.557 1.00 0.00 O ATOM 631 CB PRO A 417 105.769 -6.996 8.021 1.00 0.00 C ATOM 632 CG PRO A 417 105.895 -5.689 8.727 1.00 0.00 C ATOM 633 CD PRO A 417 106.976 -4.919 8.037 1.00 0.00 C ATOM 0 HA PRO A 417 107.132 -7.576 6.403 1.00 0.00 H new ATOM 0 HB2 PRO A 417 104.723 -7.292 7.936 1.00 0.00 H new ATOM 0 HB3 PRO A 417 106.280 -7.786 8.572 1.00 0.00 H new ATOM 0 HG2 PRO A 417 104.953 -5.142 8.696 1.00 0.00 H new ATOM 0 HG3 PRO A 417 106.141 -5.841 9.778 1.00 0.00 H new ATOM 0 HD2 PRO A 417 106.768 -3.849 8.040 1.00 0.00 H new ATOM 0 HD3 PRO A 417 107.940 -5.057 8.527 1.00 0.00 H new ATOM 641 N PHE A 418 105.376 -7.852 4.711 1.00 0.00 N ATOM 642 CA PHE A 418 104.530 -7.848 3.557 1.00 0.00 C ATOM 643 C PHE A 418 103.124 -8.284 3.902 1.00 0.00 C ATOM 644 O PHE A 418 102.919 -9.373 4.447 1.00 0.00 O ATOM 645 CB PHE A 418 105.069 -8.760 2.459 1.00 0.00 C ATOM 646 CG PHE A 418 105.047 -8.098 1.108 1.00 0.00 C ATOM 647 CD1 PHE A 418 105.594 -6.835 0.928 1.00 0.00 C ATOM 648 CD2 PHE A 418 104.450 -8.715 0.034 1.00 0.00 C ATOM 649 CE1 PHE A 418 105.539 -6.218 -0.305 1.00 0.00 C ATOM 650 CE2 PHE A 418 104.389 -8.103 -1.197 1.00 0.00 C ATOM 651 CZ PHE A 418 104.935 -6.854 -1.367 1.00 0.00 C ATOM 0 H PHE A 418 105.989 -8.662 4.798 1.00 0.00 H new ATOM 0 HA PHE A 418 104.513 -6.821 3.193 1.00 0.00 H new ATOM 0 HB2 PHE A 418 106.091 -9.053 2.701 1.00 0.00 H new ATOM 0 HB3 PHE A 418 104.475 -9.673 2.424 1.00 0.00 H new ATOM 0 HD1 PHE A 418 106.066 -6.332 1.759 1.00 0.00 H new ATOM 0 HD2 PHE A 418 104.021 -9.698 0.159 1.00 0.00 H new ATOM 0 HE1 PHE A 418 105.970 -5.236 -0.437 1.00 0.00 H new ATOM 0 HE2 PHE A 418 103.913 -8.603 -2.027 1.00 0.00 H new ATOM 0 HZ PHE A 418 104.891 -6.371 -2.332 1.00 0.00 H new ATOM 661 N PRO A 419 102.128 -7.414 3.672 1.00 0.00 N ATOM 662 CA PRO A 419 100.750 -7.788 3.850 1.00 0.00 C ATOM 663 C PRO A 419 100.310 -8.701 2.736 1.00 0.00 C ATOM 664 O PRO A 419 99.719 -9.742 2.987 1.00 0.00 O ATOM 665 CB PRO A 419 99.966 -6.484 3.766 1.00 0.00 C ATOM 666 CG PRO A 419 100.970 -5.373 3.690 1.00 0.00 C ATOM 667 CD PRO A 419 102.284 -5.986 3.301 1.00 0.00 C ATOM 0 HA PRO A 419 100.595 -8.311 4.794 1.00 0.00 H new ATOM 0 HB2 PRO A 419 99.318 -6.479 2.889 1.00 0.00 H new ATOM 0 HB3 PRO A 419 99.323 -6.364 4.638 1.00 0.00 H new ATOM 0 HG2 PRO A 419 100.662 -4.626 2.958 1.00 0.00 H new ATOM 0 HG3 PRO A 419 101.053 -4.863 4.650 1.00 0.00 H new ATOM 0 HD2 PRO A 419 102.481 -5.868 2.236 1.00 0.00 H new ATOM 0 HD3 PRO A 419 103.115 -5.523 3.832 1.00 0.00 H new ATOM 675 N ASN A 420 100.568 -8.248 1.476 1.00 0.00 N ATOM 676 CA ASN A 420 100.220 -8.955 0.212 1.00 0.00 C ATOM 677 C ASN A 420 98.799 -9.409 0.165 1.00 0.00 C ATOM 678 O ASN A 420 98.430 -10.336 -0.535 1.00 0.00 O ATOM 679 CB ASN A 420 101.264 -10.023 -0.285 1.00 0.00 C ATOM 680 CG ASN A 420 101.846 -11.059 0.711 1.00 0.00 C ATOM 681 OD1 ASN A 420 103.016 -11.406 0.599 1.00 0.00 O ATOM 682 ND2 ASN A 420 101.085 -11.621 1.581 1.00 0.00 N ATOM 0 H ASN A 420 101.036 -7.357 1.309 1.00 0.00 H new ATOM 0 HA ASN A 420 100.304 -8.181 -0.551 1.00 0.00 H new ATOM 0 HB2 ASN A 420 100.796 -10.581 -1.096 1.00 0.00 H new ATOM 0 HB3 ASN A 420 102.105 -9.479 -0.715 1.00 0.00 H new ATOM 0 HD21 ASN A 420 101.454 -12.358 2.181 1.00 0.00 H new ATOM 0 HD22 ASN A 420 100.112 -11.330 1.671 1.00 0.00 H new ATOM 689 N ASN A 421 98.003 -8.692 0.899 1.00 0.00 N ATOM 690 CA ASN A 421 96.615 -8.971 1.041 1.00 0.00 C ATOM 691 C ASN A 421 95.757 -7.707 1.159 1.00 0.00 C ATOM 692 O ASN A 421 94.606 -7.780 1.585 1.00 0.00 O ATOM 693 CB ASN A 421 96.395 -9.820 2.282 1.00 0.00 C ATOM 694 CG ASN A 421 95.980 -11.246 1.991 1.00 0.00 C ATOM 695 OD1 ASN A 421 95.208 -11.848 2.743 1.00 0.00 O ATOM 696 ND2 ASN A 421 96.500 -11.820 0.942 1.00 0.00 N ATOM 0 H ASN A 421 98.314 -7.877 1.427 1.00 0.00 H new ATOM 0 HA ASN A 421 96.307 -9.497 0.138 1.00 0.00 H new ATOM 0 HB2 ASN A 421 97.314 -9.833 2.868 1.00 0.00 H new ATOM 0 HB3 ASN A 421 95.630 -9.349 2.900 1.00 0.00 H new ATOM 0 HD21 ASN A 421 96.272 -12.790 0.726 1.00 0.00 H new ATOM 0 HD22 ASN A 421 97.135 -11.299 0.338 1.00 0.00 H new ATOM 703 N ILE A 422 96.280 -6.569 0.742 1.00 0.00 N ATOM 704 CA ILE A 422 95.566 -5.283 0.874 1.00 0.00 C ATOM 705 C ILE A 422 95.838 -4.339 -0.314 1.00 0.00 C ATOM 706 O ILE A 422 94.896 -3.899 -0.979 1.00 0.00 O ATOM 707 CB ILE A 422 95.878 -4.551 2.216 1.00 0.00 C ATOM 708 CG1 ILE A 422 97.363 -4.608 2.520 1.00 0.00 C ATOM 709 CG2 ILE A 422 95.038 -5.058 3.395 1.00 0.00 C ATOM 710 CD1 ILE A 422 97.718 -4.083 3.870 1.00 0.00 C ATOM 0 H ILE A 422 97.199 -6.494 0.306 1.00 0.00 H new ATOM 0 HA ILE A 422 94.507 -5.542 0.874 1.00 0.00 H new ATOM 0 HB ILE A 422 95.590 -3.509 2.080 1.00 0.00 H new ATOM 0 HG12 ILE A 422 97.702 -5.641 2.441 1.00 0.00 H new ATOM 0 HG13 ILE A 422 97.902 -4.037 1.764 1.00 0.00 H new ATOM 0 HG21 ILE A 422 95.306 -4.506 4.296 1.00 0.00 H new ATOM 0 HG22 ILE A 422 93.980 -4.909 3.179 1.00 0.00 H new ATOM 0 HG23 ILE A 422 95.230 -6.120 3.549 1.00 0.00 H new ATOM 0 HD11 ILE A 422 98.796 -4.156 4.017 1.00 0.00 H new ATOM 0 HD12 ILE A 422 97.411 -3.040 3.947 1.00 0.00 H new ATOM 0 HD13 ILE A 422 97.208 -4.669 4.634 1.00 0.00 H new ATOM 722 N GLY A 423 97.107 -4.057 -0.593 1.00 0.00 N ATOM 723 CA GLY A 423 97.448 -3.129 -1.666 1.00 0.00 C ATOM 724 C GLY A 423 98.348 -3.749 -2.724 1.00 0.00 C ATOM 725 O GLY A 423 97.941 -3.858 -3.873 1.00 0.00 O ATOM 0 H GLY A 423 97.907 -4.452 -0.098 1.00 0.00 H new ATOM 0 HA2 GLY A 423 96.531 -2.776 -2.138 1.00 0.00 H new ATOM 0 HA3 GLY A 423 97.944 -2.257 -1.241 1.00 0.00 H new ATOM 729 N CYS A 424 99.582 -4.081 -2.336 1.00 0.00 N ATOM 730 CA CYS A 424 100.647 -4.734 -3.144 1.00 0.00 C ATOM 731 C CYS A 424 100.163 -5.601 -4.299 1.00 0.00 C ATOM 732 O CYS A 424 99.653 -6.703 -4.092 1.00 0.00 O ATOM 733 CB CYS A 424 101.527 -5.569 -2.213 1.00 0.00 C ATOM 734 SG CYS A 424 102.031 -4.711 -0.666 1.00 0.00 S ATOM 0 H CYS A 424 99.898 -3.893 -1.385 1.00 0.00 H new ATOM 0 HA CYS A 424 101.198 -3.921 -3.617 1.00 0.00 H new ATOM 0 HB2 CYS A 424 100.992 -6.481 -1.950 1.00 0.00 H new ATOM 0 HB3 CYS A 424 102.423 -5.870 -2.755 1.00 0.00 H new ATOM 739 N PRO A 425 100.295 -5.083 -5.532 1.00 0.00 N ATOM 740 CA PRO A 425 99.949 -5.805 -6.738 1.00 0.00 C ATOM 741 C PRO A 425 101.136 -6.564 -7.345 1.00 0.00 C ATOM 742 O PRO A 425 100.927 -7.528 -8.089 1.00 0.00 O ATOM 743 CB PRO A 425 99.548 -4.680 -7.707 1.00 0.00 C ATOM 744 CG PRO A 425 99.797 -3.392 -6.989 1.00 0.00 C ATOM 745 CD PRO A 425 100.680 -3.709 -5.850 1.00 0.00 C ATOM 0 HA PRO A 425 99.182 -6.555 -6.542 1.00 0.00 H new ATOM 0 HB2 PRO A 425 100.133 -4.732 -8.625 1.00 0.00 H new ATOM 0 HB3 PRO A 425 98.500 -4.769 -7.992 1.00 0.00 H new ATOM 0 HG2 PRO A 425 100.265 -2.663 -7.651 1.00 0.00 H new ATOM 0 HG3 PRO A 425 98.861 -2.954 -6.643 1.00 0.00 H new ATOM 0 HD2 PRO A 425 101.734 -3.634 -6.119 1.00 0.00 H new ATOM 0 HD3 PRO A 425 100.517 -3.036 -5.009 1.00 0.00 H new ATOM 753 N SER A 426 102.375 -6.182 -6.944 1.00 0.00 N ATOM 754 CA SER A 426 103.607 -6.661 -7.597 1.00 0.00 C ATOM 755 C SER A 426 104.854 -5.825 -7.224 1.00 0.00 C ATOM 756 O SER A 426 105.921 -6.024 -7.807 1.00 0.00 O ATOM 757 CB SER A 426 103.457 -6.687 -9.144 1.00 0.00 C ATOM 758 OG SER A 426 103.061 -5.405 -9.653 1.00 0.00 O ATOM 0 H SER A 426 102.541 -5.541 -6.168 1.00 0.00 H new ATOM 0 HA SER A 426 103.758 -7.675 -7.225 1.00 0.00 H new ATOM 0 HB2 SER A 426 104.402 -6.984 -9.598 1.00 0.00 H new ATOM 0 HB3 SER A 426 102.718 -7.437 -9.427 1.00 0.00 H new ATOM 0 HG SER A 426 102.976 -5.452 -10.628 1.00 0.00 H new ATOM 764 N CYS A 427 104.744 -4.885 -6.302 1.00 0.00 N ATOM 765 CA CYS A 427 105.898 -4.075 -5.968 1.00 0.00 C ATOM 766 C CYS A 427 106.503 -4.459 -4.576 1.00 0.00 C ATOM 767 O CYS A 427 106.003 -5.385 -3.932 1.00 0.00 O ATOM 768 CB CYS A 427 105.446 -2.645 -6.048 1.00 0.00 C ATOM 769 SG CYS A 427 103.858 -2.347 -5.212 1.00 0.00 S ATOM 0 H CYS A 427 103.892 -4.668 -5.785 1.00 0.00 H new ATOM 0 HA CYS A 427 106.718 -4.245 -6.666 1.00 0.00 H new ATOM 0 HB2 CYS A 427 106.208 -2.004 -5.605 1.00 0.00 H new ATOM 0 HB3 CYS A 427 105.357 -2.357 -7.095 1.00 0.00 H new ATOM 774 N CYS A 428 107.568 -3.752 -4.135 1.00 0.00 N ATOM 775 CA CYS A 428 108.269 -4.052 -2.855 1.00 0.00 C ATOM 776 C CYS A 428 107.796 -2.997 -1.823 1.00 0.00 C ATOM 777 O CYS A 428 107.316 -1.963 -2.253 1.00 0.00 O ATOM 778 CB CYS A 428 109.794 -3.922 -3.101 1.00 0.00 C ATOM 779 SG CYS A 428 110.874 -4.897 -1.977 1.00 0.00 S ATOM 0 H CYS A 428 107.966 -2.964 -4.646 1.00 0.00 H new ATOM 0 HA CYS A 428 108.053 -5.056 -2.489 1.00 0.00 H new ATOM 0 HB2 CYS A 428 110.004 -4.223 -4.127 1.00 0.00 H new ATOM 0 HB3 CYS A 428 110.068 -2.871 -3.015 1.00 0.00 H new ATOM 784 N PRO A 429 107.893 -3.228 -0.457 1.00 0.00 N ATOM 785 CA PRO A 429 107.381 -2.270 0.537 1.00 0.00 C ATOM 786 C PRO A 429 108.129 -0.909 0.613 1.00 0.00 C ATOM 787 O PRO A 429 108.038 -0.113 -0.315 1.00 0.00 O ATOM 788 CB PRO A 429 107.429 -3.041 1.861 1.00 0.00 C ATOM 789 CG PRO A 429 108.450 -4.085 1.671 1.00 0.00 C ATOM 790 CD PRO A 429 108.465 -4.423 0.214 1.00 0.00 C ATOM 0 HA PRO A 429 106.378 -1.945 0.260 1.00 0.00 H new ATOM 0 HB2 PRO A 429 107.690 -2.383 2.689 1.00 0.00 H new ATOM 0 HB3 PRO A 429 106.459 -3.479 2.096 1.00 0.00 H new ATOM 0 HG2 PRO A 429 109.429 -3.731 1.995 1.00 0.00 H new ATOM 0 HG3 PRO A 429 108.216 -4.966 2.269 1.00 0.00 H new ATOM 0 HD2 PRO A 429 109.478 -4.626 -0.135 1.00 0.00 H new ATOM 0 HD3 PRO A 429 107.872 -5.314 0.008 1.00 0.00 H new ATOM 798 N PHE A 430 108.872 -0.650 1.710 1.00 0.00 N ATOM 799 CA PHE A 430 109.546 0.634 1.921 1.00 0.00 C ATOM 800 C PHE A 430 110.286 0.573 3.251 1.00 0.00 C ATOM 801 O PHE A 430 110.328 -0.489 3.895 1.00 0.00 O ATOM 802 CB PHE A 430 108.501 1.765 1.982 1.00 0.00 C ATOM 803 CG PHE A 430 108.814 2.966 1.125 1.00 0.00 C ATOM 804 CD1 PHE A 430 108.771 2.871 -0.256 1.00 0.00 C ATOM 805 CD2 PHE A 430 109.126 4.185 1.695 1.00 0.00 C ATOM 806 CE1 PHE A 430 109.038 3.961 -1.051 1.00 0.00 C ATOM 807 CE2 PHE A 430 109.397 5.281 0.904 1.00 0.00 C ATOM 808 CZ PHE A 430 109.353 5.167 -0.472 1.00 0.00 C ATOM 0 H PHE A 430 109.016 -1.322 2.463 1.00 0.00 H new ATOM 0 HA PHE A 430 110.240 0.828 1.103 1.00 0.00 H new ATOM 0 HB2 PHE A 430 107.534 1.363 1.679 1.00 0.00 H new ATOM 0 HB3 PHE A 430 108.401 2.092 3.017 1.00 0.00 H new ATOM 0 HD1 PHE A 430 108.524 1.926 -0.716 1.00 0.00 H new ATOM 0 HD2 PHE A 430 109.158 4.280 2.770 1.00 0.00 H new ATOM 0 HE1 PHE A 430 109.000 3.870 -2.126 1.00 0.00 H new ATOM 0 HE2 PHE A 430 109.644 6.228 1.360 1.00 0.00 H new ATOM 0 HZ PHE A 430 109.566 6.025 -1.092 1.00 0.00 H new ATOM 818 N GLU A 431 110.871 1.697 3.651 1.00 0.00 N ATOM 819 CA GLU A 431 111.580 1.821 4.918 1.00 0.00 C ATOM 820 C GLU A 431 112.784 0.894 4.994 1.00 0.00 C ATOM 821 O GLU A 431 113.829 1.195 4.423 1.00 0.00 O ATOM 822 CB GLU A 431 110.635 1.632 6.122 1.00 0.00 C ATOM 823 CG GLU A 431 109.627 2.754 6.295 1.00 0.00 C ATOM 824 CD GLU A 431 110.302 4.061 6.584 1.00 0.00 C ATOM 825 OE1 GLU A 431 110.611 4.333 7.758 1.00 0.00 O ATOM 826 OE2 GLU A 431 110.583 4.826 5.648 1.00 0.00 O ATOM 0 H GLU A 431 110.866 2.555 3.099 1.00 0.00 H new ATOM 0 HA GLU A 431 111.964 2.840 4.966 1.00 0.00 H new ATOM 0 HB2 GLU A 431 110.099 0.690 6.006 1.00 0.00 H new ATOM 0 HB3 GLU A 431 111.232 1.550 7.030 1.00 0.00 H new ATOM 0 HG2 GLU A 431 109.025 2.846 5.391 1.00 0.00 H new ATOM 0 HG3 GLU A 431 108.944 2.509 7.108 1.00 0.00 H new ATOM 833 N CYS A 432 112.608 -0.244 5.663 1.00 0.00 N ATOM 834 CA CYS A 432 113.621 -1.307 5.835 1.00 0.00 C ATOM 835 C CYS A 432 114.788 -0.904 6.758 1.00 0.00 C ATOM 836 O CYS A 432 115.119 -1.622 7.707 1.00 0.00 O ATOM 837 CB CYS A 432 114.148 -1.774 4.487 1.00 0.00 C ATOM 838 SG CYS A 432 114.935 -3.370 4.507 1.00 0.00 S ATOM 0 H CYS A 432 111.725 -0.468 6.121 1.00 0.00 H new ATOM 0 HA CYS A 432 113.108 -2.132 6.330 1.00 0.00 H new ATOM 0 HB2 CYS A 432 113.320 -1.801 3.778 1.00 0.00 H new ATOM 0 HB3 CYS A 432 114.861 -1.037 4.116 1.00 0.00 H new ATOM 843 N SER A 433 115.328 0.258 6.512 1.00 0.00 N ATOM 844 CA SER A 433 116.488 0.812 7.163 1.00 0.00 C ATOM 845 C SER A 433 116.390 2.338 6.958 1.00 0.00 C ATOM 846 O SER A 433 115.510 2.769 6.203 1.00 0.00 O ATOM 847 CB SER A 433 117.774 0.213 6.525 1.00 0.00 C ATOM 848 OG SER A 433 117.894 -1.201 6.805 1.00 0.00 O ATOM 0 H SER A 433 114.946 0.886 5.805 1.00 0.00 H new ATOM 0 HA SER A 433 116.533 0.577 8.226 1.00 0.00 H new ATOM 0 HB2 SER A 433 117.754 0.371 5.447 1.00 0.00 H new ATOM 0 HB3 SER A 433 118.650 0.737 6.908 1.00 0.00 H new ATOM 0 HG SER A 433 117.828 -1.707 5.968 1.00 0.00 H new ATOM 854 N PRO A 434 117.205 3.184 7.643 1.00 0.00 N ATOM 855 CA PRO A 434 117.139 4.645 7.470 1.00 0.00 C ATOM 856 C PRO A 434 117.333 5.094 6.029 1.00 0.00 C ATOM 857 O PRO A 434 118.445 4.968 5.473 1.00 0.00 O ATOM 858 CB PRO A 434 118.285 5.171 8.314 1.00 0.00 C ATOM 859 CG PRO A 434 118.490 4.127 9.352 1.00 0.00 C ATOM 860 CD PRO A 434 118.209 2.813 8.665 1.00 0.00 C ATOM 0 HA PRO A 434 116.156 5.016 7.760 1.00 0.00 H new ATOM 0 HB2 PRO A 434 119.184 5.318 7.716 1.00 0.00 H new ATOM 0 HB3 PRO A 434 118.039 6.134 8.762 1.00 0.00 H new ATOM 0 HG2 PRO A 434 119.507 4.156 9.742 1.00 0.00 H new ATOM 0 HG3 PRO A 434 117.820 4.278 10.198 1.00 0.00 H new ATOM 0 HD2 PRO A 434 119.108 2.392 8.215 1.00 0.00 H new ATOM 0 HD3 PRO A 434 117.822 2.068 9.360 1.00 0.00 H new ATOM 868 N ASP A 435 116.237 5.576 5.438 1.00 0.00 N ATOM 869 CA ASP A 435 116.195 6.163 4.065 1.00 0.00 C ATOM 870 C ASP A 435 116.379 5.092 3.000 1.00 0.00 C ATOM 871 O ASP A 435 117.478 4.555 2.805 1.00 0.00 O ATOM 872 CB ASP A 435 117.235 7.273 3.904 1.00 0.00 C ATOM 873 CG ASP A 435 117.041 8.060 2.616 1.00 0.00 C ATOM 874 OD1 ASP A 435 116.044 8.826 2.512 1.00 0.00 O ATOM 875 OD2 ASP A 435 117.885 7.954 1.715 1.00 0.00 O ATOM 0 H ASP A 435 115.326 5.576 5.897 1.00 0.00 H new ATOM 0 HA ASP A 435 115.208 6.605 3.929 1.00 0.00 H new ATOM 0 HB2 ASP A 435 117.174 7.951 4.755 1.00 0.00 H new ATOM 0 HB3 ASP A 435 118.234 6.837 3.914 1.00 0.00 H new ATOM 880 N ASN A 436 115.299 4.765 2.336 1.00 0.00 N ATOM 881 CA ASN A 436 115.299 3.696 1.337 1.00 0.00 C ATOM 882 C ASN A 436 115.280 4.133 -0.181 1.00 0.00 C ATOM 883 O ASN A 436 115.378 3.237 -1.027 1.00 0.00 O ATOM 884 CB ASN A 436 114.136 2.730 1.588 1.00 0.00 C ATOM 885 CG ASN A 436 112.782 3.278 1.186 1.00 0.00 C ATOM 886 OD1 ASN A 436 112.119 3.938 1.976 1.00 0.00 O ATOM 887 ND2 ASN A 436 112.346 2.978 -0.020 1.00 0.00 N ATOM 0 H ASN A 436 114.395 5.221 2.462 1.00 0.00 H new ATOM 0 HA ASN A 436 116.270 3.221 1.481 1.00 0.00 H new ATOM 0 HB2 ASN A 436 114.320 1.806 1.040 1.00 0.00 H new ATOM 0 HB3 ASN A 436 114.113 2.473 2.647 1.00 0.00 H new ATOM 0 HD21 ASN A 436 111.426 3.298 -0.324 1.00 0.00 H new ATOM 0 HD22 ASN A 436 112.928 2.426 -0.650 1.00 0.00 H new ATOM 894 N PRO A 437 115.085 5.459 -0.590 1.00 0.00 N ATOM 895 CA PRO A 437 115.110 5.834 -2.024 1.00 0.00 C ATOM 896 C PRO A 437 116.376 5.370 -2.748 1.00 0.00 C ATOM 897 O PRO A 437 117.483 5.343 -2.171 1.00 0.00 O ATOM 898 CB PRO A 437 115.042 7.359 -1.997 1.00 0.00 C ATOM 899 CG PRO A 437 114.290 7.651 -0.762 1.00 0.00 C ATOM 900 CD PRO A 437 114.774 6.648 0.236 1.00 0.00 C ATOM 0 HA PRO A 437 114.293 5.362 -2.570 1.00 0.00 H new ATOM 0 HB2 PRO A 437 116.037 7.804 -1.975 1.00 0.00 H new ATOM 0 HB3 PRO A 437 114.535 7.753 -2.878 1.00 0.00 H new ATOM 0 HG2 PRO A 437 114.475 8.669 -0.419 1.00 0.00 H new ATOM 0 HG3 PRO A 437 113.216 7.559 -0.924 1.00 0.00 H new ATOM 0 HD2 PRO A 437 115.654 7.006 0.771 1.00 0.00 H new ATOM 0 HD3 PRO A 437 114.013 6.428 0.985 1.00 0.00 H new ATOM 908 N MET A 438 116.218 5.061 -4.001 1.00 0.00 N ATOM 909 CA MET A 438 117.272 4.524 -4.804 1.00 0.00 C ATOM 910 C MET A 438 117.036 4.897 -6.253 1.00 0.00 C ATOM 911 O MET A 438 115.908 4.810 -6.750 1.00 0.00 O ATOM 912 CB MET A 438 117.277 2.987 -4.661 1.00 0.00 C ATOM 913 CG MET A 438 118.302 2.249 -5.524 1.00 0.00 C ATOM 914 SD MET A 438 118.113 0.441 -5.452 1.00 0.00 S ATOM 915 CE MET A 438 116.421 0.258 -6.037 1.00 0.00 C ATOM 0 H MET A 438 115.337 5.178 -4.501 1.00 0.00 H new ATOM 0 HA MET A 438 118.231 4.927 -4.478 1.00 0.00 H new ATOM 0 HB2 MET A 438 117.461 2.737 -3.616 1.00 0.00 H new ATOM 0 HB3 MET A 438 116.283 2.613 -4.908 1.00 0.00 H new ATOM 0 HG2 MET A 438 118.204 2.579 -6.558 1.00 0.00 H new ATOM 0 HG3 MET A 438 119.306 2.518 -5.197 1.00 0.00 H new ATOM 0 HE1 MET A 438 116.336 -0.657 -6.624 1.00 0.00 H new ATOM 0 HE2 MET A 438 115.745 0.206 -5.184 1.00 0.00 H new ATOM 0 HE3 MET A 438 116.156 1.114 -6.658 1.00 0.00 H new ATOM 925 N PHE A 439 118.085 5.322 -6.909 1.00 0.00 N ATOM 926 CA PHE A 439 118.059 5.639 -8.303 1.00 0.00 C ATOM 927 C PHE A 439 119.498 5.561 -8.755 1.00 0.00 C ATOM 928 O PHE A 439 120.395 5.609 -7.905 1.00 0.00 O ATOM 929 CB PHE A 439 117.461 7.038 -8.559 1.00 0.00 C ATOM 930 CG PHE A 439 116.802 7.154 -9.913 1.00 0.00 C ATOM 931 CD1 PHE A 439 117.530 7.461 -11.047 1.00 0.00 C ATOM 932 CD2 PHE A 439 115.441 6.926 -10.042 1.00 0.00 C ATOM 933 CE1 PHE A 439 116.917 7.536 -12.279 1.00 0.00 C ATOM 934 CE2 PHE A 439 114.823 7.007 -11.273 1.00 0.00 C ATOM 935 CZ PHE A 439 115.563 7.310 -12.393 1.00 0.00 C ATOM 0 H PHE A 439 118.998 5.458 -6.474 1.00 0.00 H new ATOM 0 HA PHE A 439 117.424 4.949 -8.858 1.00 0.00 H new ATOM 0 HB2 PHE A 439 116.729 7.263 -7.783 1.00 0.00 H new ATOM 0 HB3 PHE A 439 118.250 7.786 -8.479 1.00 0.00 H new ATOM 0 HD1 PHE A 439 118.591 7.644 -10.967 1.00 0.00 H new ATOM 0 HD2 PHE A 439 114.856 6.682 -9.167 1.00 0.00 H new ATOM 0 HE1 PHE A 439 117.500 7.773 -13.157 1.00 0.00 H new ATOM 0 HE2 PHE A 439 113.760 6.833 -11.357 1.00 0.00 H new ATOM 0 HZ PHE A 439 115.083 7.370 -13.359 1.00 0.00 H new ATOM 945 N THR A 440 119.723 5.466 -10.046 1.00 0.00 N ATOM 946 CA THR A 440 121.040 5.212 -10.604 1.00 0.00 C ATOM 947 C THR A 440 121.500 3.805 -10.205 1.00 0.00 C ATOM 948 O THR A 440 122.184 3.604 -9.195 1.00 0.00 O ATOM 949 CB THR A 440 122.093 6.288 -10.221 1.00 0.00 C ATOM 950 OG1 THR A 440 121.607 7.580 -10.632 1.00 0.00 O ATOM 951 CG2 THR A 440 123.434 6.015 -10.913 1.00 0.00 C ATOM 0 H THR A 440 118.991 5.563 -10.749 1.00 0.00 H new ATOM 0 HA THR A 440 120.953 5.273 -11.689 1.00 0.00 H new ATOM 0 HB THR A 440 122.247 6.259 -9.142 1.00 0.00 H new ATOM 0 HG1 THR A 440 122.263 8.267 -10.393 1.00 0.00 H new ATOM 0 HG21 THR A 440 124.153 6.783 -10.628 1.00 0.00 H new ATOM 0 HG22 THR A 440 123.808 5.037 -10.610 1.00 0.00 H new ATOM 0 HG23 THR A 440 123.295 6.031 -11.994 1.00 0.00 H new ATOM 959 N PRO A 441 121.040 2.801 -10.950 1.00 0.00 N ATOM 960 CA PRO A 441 121.369 1.434 -10.691 1.00 0.00 C ATOM 961 C PRO A 441 122.643 1.042 -11.455 1.00 0.00 C ATOM 962 O PRO A 441 123.552 1.878 -11.584 1.00 0.00 O ATOM 963 CB PRO A 441 120.107 0.699 -11.186 1.00 0.00 C ATOM 964 CG PRO A 441 119.472 1.603 -12.201 1.00 0.00 C ATOM 965 CD PRO A 441 120.175 2.929 -12.133 1.00 0.00 C ATOM 0 HA PRO A 441 121.597 1.201 -9.651 1.00 0.00 H new ATOM 0 HB2 PRO A 441 120.364 -0.264 -11.628 1.00 0.00 H new ATOM 0 HB3 PRO A 441 119.424 0.498 -10.361 1.00 0.00 H new ATOM 0 HG2 PRO A 441 119.557 1.176 -13.200 1.00 0.00 H new ATOM 0 HG3 PRO A 441 118.408 1.723 -11.995 1.00 0.00 H new ATOM 0 HD2 PRO A 441 120.755 3.122 -13.035 1.00 0.00 H new ATOM 0 HD3 PRO A 441 119.469 3.752 -12.026 1.00 0.00 H new ATOM 973 N SER A 442 122.686 -0.186 -11.975 1.00 0.00 N ATOM 974 CA SER A 442 123.840 -0.792 -12.636 1.00 0.00 C ATOM 975 C SER A 442 124.858 -1.267 -11.594 1.00 0.00 C ATOM 976 O SER A 442 125.189 -0.528 -10.663 1.00 0.00 O ATOM 977 CB SER A 442 124.503 0.132 -13.681 1.00 0.00 C ATOM 978 OG SER A 442 123.537 0.645 -14.602 1.00 0.00 O ATOM 0 H SER A 442 121.881 -0.812 -11.945 1.00 0.00 H new ATOM 0 HA SER A 442 123.468 -1.652 -13.193 1.00 0.00 H new ATOM 0 HB2 SER A 442 125.002 0.958 -13.175 1.00 0.00 H new ATOM 0 HB3 SER A 442 125.270 -0.420 -14.224 1.00 0.00 H new ATOM 0 HG SER A 442 123.982 1.228 -15.252 1.00 0.00 H new ATOM 984 N PRO A 443 125.369 -2.508 -11.721 1.00 0.00 N ATOM 985 CA PRO A 443 126.397 -3.054 -10.802 1.00 0.00 C ATOM 986 C PRO A 443 127.669 -2.208 -10.824 1.00 0.00 C ATOM 987 O PRO A 443 128.424 -2.152 -9.855 1.00 0.00 O ATOM 988 CB PRO A 443 126.686 -4.427 -11.393 1.00 0.00 C ATOM 989 CG PRO A 443 125.437 -4.784 -12.108 1.00 0.00 C ATOM 990 CD PRO A 443 124.970 -3.511 -12.730 1.00 0.00 C ATOM 0 HA PRO A 443 126.063 -3.074 -9.765 1.00 0.00 H new ATOM 0 HB2 PRO A 443 127.539 -4.397 -12.071 1.00 0.00 H new ATOM 0 HB3 PRO A 443 126.922 -5.154 -10.616 1.00 0.00 H new ATOM 0 HG2 PRO A 443 125.619 -5.548 -12.863 1.00 0.00 H new ATOM 0 HG3 PRO A 443 124.691 -5.185 -11.422 1.00 0.00 H new ATOM 0 HD2 PRO A 443 125.445 -3.330 -13.694 1.00 0.00 H new ATOM 0 HD3 PRO A 443 123.893 -3.512 -12.900 1.00 0.00 H new ATOM 998 N ASP A 444 127.872 -1.541 -11.935 1.00 0.00 N ATOM 999 CA ASP A 444 129.019 -0.629 -12.112 1.00 0.00 C ATOM 1000 C ASP A 444 128.517 0.786 -12.276 1.00 0.00 C ATOM 1001 O ASP A 444 129.231 1.690 -12.708 1.00 0.00 O ATOM 1002 CB ASP A 444 129.998 -1.044 -13.264 1.00 0.00 C ATOM 1003 CG ASP A 444 130.771 -2.311 -12.976 1.00 0.00 C ATOM 1004 OD1 ASP A 444 130.196 -3.422 -13.030 1.00 0.00 O ATOM 1005 OD2 ASP A 444 131.983 -2.228 -12.686 1.00 0.00 O ATOM 0 H ASP A 444 127.260 -1.602 -12.749 1.00 0.00 H new ATOM 0 HA ASP A 444 129.625 -0.697 -11.208 1.00 0.00 H new ATOM 0 HB2 ASP A 444 129.428 -1.178 -14.183 1.00 0.00 H new ATOM 0 HB3 ASP A 444 130.702 -0.231 -13.441 1.00 0.00 H new ATOM 1010 N GLY A 445 127.277 0.957 -11.870 1.00 0.00 N ATOM 1011 CA GLY A 445 126.583 2.236 -11.924 1.00 0.00 C ATOM 1012 C GLY A 445 127.189 3.338 -11.082 1.00 0.00 C ATOM 1013 O GLY A 445 127.101 4.502 -11.442 1.00 0.00 O ATOM 0 H GLY A 445 126.709 0.202 -11.486 1.00 0.00 H new ATOM 0 HA2 GLY A 445 126.551 2.570 -12.961 1.00 0.00 H new ATOM 0 HA3 GLY A 445 125.551 2.084 -11.606 1.00 0.00 H new ATOM 1017 N SER A 446 127.746 3.000 -9.953 1.00 0.00 N ATOM 1018 CA SER A 446 128.333 3.979 -9.055 1.00 0.00 C ATOM 1019 C SER A 446 129.486 3.385 -8.321 1.00 0.00 C ATOM 1020 O SER A 446 129.695 2.174 -8.429 1.00 0.00 O ATOM 1021 CB SER A 446 127.283 4.378 -7.985 1.00 0.00 C ATOM 1022 OG SER A 446 126.330 5.293 -8.503 1.00 0.00 O ATOM 0 H SER A 446 127.811 2.038 -9.621 1.00 0.00 H new ATOM 0 HA SER A 446 128.656 4.835 -9.647 1.00 0.00 H new ATOM 0 HB2 SER A 446 126.772 3.485 -7.625 1.00 0.00 H new ATOM 0 HB3 SER A 446 127.788 4.824 -7.128 1.00 0.00 H new ATOM 0 HG SER A 446 126.402 5.323 -9.480 1.00 0.00 H new ATOM 1028 N PRO A 447 130.325 4.246 -7.648 1.00 0.00 N ATOM 1029 CA PRO A 447 131.313 3.791 -6.684 1.00 0.00 C ATOM 1030 C PRO A 447 130.584 2.908 -5.687 1.00 0.00 C ATOM 1031 O PRO A 447 129.738 3.391 -4.922 1.00 0.00 O ATOM 1032 CB PRO A 447 131.787 5.092 -5.993 1.00 0.00 C ATOM 1033 CG PRO A 447 130.866 6.163 -6.485 1.00 0.00 C ATOM 1034 CD PRO A 447 130.389 5.706 -7.819 1.00 0.00 C ATOM 0 HA PRO A 447 132.145 3.233 -7.113 1.00 0.00 H new ATOM 0 HB2 PRO A 447 131.738 5.000 -4.908 1.00 0.00 H new ATOM 0 HB3 PRO A 447 132.823 5.317 -6.248 1.00 0.00 H new ATOM 0 HG2 PRO A 447 130.031 6.306 -5.799 1.00 0.00 H new ATOM 0 HG3 PRO A 447 131.384 7.119 -6.561 1.00 0.00 H new ATOM 0 HD2 PRO A 447 129.416 6.129 -8.069 1.00 0.00 H new ATOM 0 HD3 PRO A 447 131.075 5.992 -8.616 1.00 0.00 H new ATOM 1042 N PRO A 448 130.824 1.606 -5.749 1.00 0.00 N ATOM 1043 CA PRO A 448 130.076 0.622 -4.980 1.00 0.00 C ATOM 1044 C PRO A 448 130.195 0.783 -3.469 1.00 0.00 C ATOM 1045 O PRO A 448 129.321 0.310 -2.740 1.00 0.00 O ATOM 1046 CB PRO A 448 130.690 -0.723 -5.397 1.00 0.00 C ATOM 1047 CG PRO A 448 131.350 -0.450 -6.693 1.00 0.00 C ATOM 1048 CD PRO A 448 131.827 0.967 -6.606 1.00 0.00 C ATOM 0 HA PRO A 448 129.010 0.723 -5.186 1.00 0.00 H new ATOM 0 HB2 PRO A 448 131.406 -1.078 -4.655 1.00 0.00 H new ATOM 0 HB3 PRO A 448 129.925 -1.493 -5.497 1.00 0.00 H new ATOM 0 HG2 PRO A 448 132.181 -1.135 -6.862 1.00 0.00 H new ATOM 0 HG3 PRO A 448 130.655 -0.580 -7.523 1.00 0.00 H new ATOM 0 HD2 PRO A 448 132.825 1.030 -6.173 1.00 0.00 H new ATOM 0 HD3 PRO A 448 131.875 1.437 -7.588 1.00 0.00 H new ATOM 1056 N ASN A 449 131.307 1.398 -3.020 1.00 0.00 N ATOM 1057 CA ASN A 449 131.635 1.628 -1.591 1.00 0.00 C ATOM 1058 C ASN A 449 131.674 0.305 -0.826 1.00 0.00 C ATOM 1059 O ASN A 449 131.689 -0.759 -1.455 1.00 0.00 O ATOM 1060 CB ASN A 449 130.749 2.726 -0.870 1.00 0.00 C ATOM 1061 CG ASN A 449 129.263 2.369 -0.631 1.00 0.00 C ATOM 1062 OD1 ASN A 449 128.398 2.688 -1.445 1.00 0.00 O ATOM 1063 ND2 ASN A 449 128.950 1.737 0.477 1.00 0.00 N ATOM 0 H ASN A 449 132.021 1.759 -3.652 1.00 0.00 H new ATOM 0 HA ASN A 449 132.635 2.062 -1.581 1.00 0.00 H new ATOM 0 HB2 ASN A 449 131.204 2.952 0.094 1.00 0.00 H new ATOM 0 HB3 ASN A 449 130.789 3.639 -1.463 1.00 0.00 H new ATOM 0 HD21 ASN A 449 127.977 1.503 0.673 1.00 0.00 H new ATOM 0 HD22 ASN A 449 129.680 1.480 1.141 1.00 0.00 H new ATOM 1070 N CYS A 450 131.790 0.352 0.509 1.00 0.00 N ATOM 1071 CA CYS A 450 131.786 -0.876 1.324 1.00 0.00 C ATOM 1072 C CYS A 450 133.009 -1.739 1.065 1.00 0.00 C ATOM 1073 O CYS A 450 132.929 -2.977 1.156 1.00 0.00 O ATOM 1074 CB CYS A 450 130.525 -1.683 1.056 1.00 0.00 C ATOM 1075 SG CYS A 450 129.042 -1.071 1.862 1.00 0.00 S ATOM 0 H CYS A 450 131.887 1.215 1.044 1.00 0.00 H new ATOM 0 HA CYS A 450 131.811 -0.568 2.369 1.00 0.00 H new ATOM 0 HB2 CYS A 450 130.351 -1.709 -0.020 1.00 0.00 H new ATOM 0 HB3 CYS A 450 130.696 -2.711 1.376 1.00 0.00 H new ATOM 1080 N SER A 451 134.146 -1.060 0.817 1.00 0.00 N ATOM 1081 CA SER A 451 135.463 -1.606 0.486 1.00 0.00 C ATOM 1082 C SER A 451 135.820 -1.460 -1.012 1.00 0.00 C ATOM 1083 O SER A 451 136.844 -0.863 -1.320 1.00 0.00 O ATOM 1084 CB SER A 451 135.776 -2.986 1.084 1.00 0.00 C ATOM 1085 OG SER A 451 135.507 -3.002 2.497 1.00 0.00 O ATOM 0 H SER A 451 134.162 -0.041 0.847 1.00 0.00 H new ATOM 0 HA SER A 451 136.162 -0.959 1.016 1.00 0.00 H new ATOM 0 HB2 SER A 451 135.176 -3.748 0.586 1.00 0.00 H new ATOM 0 HB3 SER A 451 136.822 -3.236 0.905 1.00 0.00 H new ATOM 0 HG SER A 451 135.711 -3.890 2.859 1.00 0.00 H new ATOM 1091 N PRO A 452 135.016 -1.965 -1.992 1.00 0.00 N ATOM 1092 CA PRO A 452 135.287 -1.698 -3.401 1.00 0.00 C ATOM 1093 C PRO A 452 134.959 -0.241 -3.788 1.00 0.00 C ATOM 1094 O PRO A 452 133.877 0.046 -4.283 1.00 0.00 O ATOM 1095 CB PRO A 452 134.387 -2.680 -4.171 1.00 0.00 C ATOM 1096 CG PRO A 452 133.916 -3.650 -3.144 1.00 0.00 C ATOM 1097 CD PRO A 452 133.877 -2.886 -1.856 1.00 0.00 C ATOM 0 HA PRO A 452 136.344 -1.830 -3.631 1.00 0.00 H new ATOM 0 HB2 PRO A 452 133.550 -2.164 -4.641 1.00 0.00 H new ATOM 0 HB3 PRO A 452 134.939 -3.182 -4.966 1.00 0.00 H new ATOM 0 HG2 PRO A 452 132.931 -4.042 -3.397 1.00 0.00 H new ATOM 0 HG3 PRO A 452 134.590 -4.504 -3.073 1.00 0.00 H new ATOM 0 HD2 PRO A 452 132.936 -2.350 -1.731 1.00 0.00 H new ATOM 0 HD3 PRO A 452 133.987 -3.542 -0.993 1.00 0.00 H new ATOM 1105 N THR A 453 135.899 0.631 -3.452 1.00 0.00 N ATOM 1106 CA THR A 453 135.960 2.095 -3.694 1.00 0.00 C ATOM 1107 C THR A 453 137.074 2.640 -2.782 1.00 0.00 C ATOM 1108 O THR A 453 137.664 3.694 -3.044 1.00 0.00 O ATOM 1109 CB THR A 453 134.597 2.898 -3.450 1.00 0.00 C ATOM 1110 OG1 THR A 453 133.613 2.521 -4.413 1.00 0.00 O ATOM 1111 CG2 THR A 453 134.783 4.408 -3.553 1.00 0.00 C ATOM 0 H THR A 453 136.729 0.315 -2.951 1.00 0.00 H new ATOM 0 HA THR A 453 136.157 2.247 -4.755 1.00 0.00 H new ATOM 0 HB THR A 453 134.276 2.644 -2.440 1.00 0.00 H new ATOM 0 HG1 THR A 453 133.531 1.545 -4.432 1.00 0.00 H new ATOM 0 HG21 THR A 453 133.828 4.905 -3.379 1.00 0.00 H new ATOM 0 HG22 THR A 453 135.505 4.737 -2.806 1.00 0.00 H new ATOM 0 HG23 THR A 453 135.149 4.663 -4.548 1.00 0.00 H new ATOM 1119 N MET A 454 137.372 1.865 -1.712 1.00 0.00 N ATOM 1120 CA MET A 454 138.475 2.172 -0.779 1.00 0.00 C ATOM 1121 C MET A 454 139.776 2.412 -1.497 1.00 0.00 C ATOM 1122 O MET A 454 140.523 3.324 -1.148 1.00 0.00 O ATOM 1123 CB MET A 454 138.660 1.061 0.237 1.00 0.00 C ATOM 1124 CG MET A 454 137.703 1.131 1.406 1.00 0.00 C ATOM 1125 SD MET A 454 137.952 -0.198 2.597 1.00 0.00 S ATOM 1126 CE MET A 454 136.697 0.214 3.808 1.00 0.00 C ATOM 0 H MET A 454 136.857 1.017 -1.475 1.00 0.00 H new ATOM 0 HA MET A 454 138.193 3.090 -0.263 1.00 0.00 H new ATOM 0 HB2 MET A 454 138.536 0.101 -0.263 1.00 0.00 H new ATOM 0 HB3 MET A 454 139.682 1.094 0.615 1.00 0.00 H new ATOM 0 HG2 MET A 454 137.822 2.090 1.910 1.00 0.00 H new ATOM 0 HG3 MET A 454 136.679 1.091 1.034 1.00 0.00 H new ATOM 0 HE1 MET A 454 136.718 -0.516 4.617 1.00 0.00 H new ATOM 0 HE2 MET A 454 136.892 1.208 4.211 1.00 0.00 H new ATOM 0 HE3 MET A 454 135.716 0.201 3.334 1.00 0.00 H new ATOM 1136 N LEU A 455 140.062 1.583 -2.481 1.00 0.00 N ATOM 1137 CA LEU A 455 141.221 1.789 -3.297 1.00 0.00 C ATOM 1138 C LEU A 455 140.943 2.958 -4.240 1.00 0.00 C ATOM 1139 O LEU A 455 139.975 2.926 -4.998 1.00 0.00 O ATOM 1140 CB LEU A 455 141.662 0.463 -4.007 1.00 0.00 C ATOM 1141 CG LEU A 455 140.624 -0.342 -4.836 1.00 0.00 C ATOM 1142 CD1 LEU A 455 140.414 0.223 -6.239 1.00 0.00 C ATOM 1143 CD2 LEU A 455 141.028 -1.805 -4.900 1.00 0.00 C ATOM 0 H LEU A 455 139.504 0.765 -2.727 1.00 0.00 H new ATOM 0 HA LEU A 455 142.083 2.062 -2.689 1.00 0.00 H new ATOM 0 HB2 LEU A 455 142.491 0.708 -4.671 1.00 0.00 H new ATOM 0 HB3 LEU A 455 142.055 -0.204 -3.239 1.00 0.00 H new ATOM 0 HG LEU A 455 139.667 -0.252 -4.323 1.00 0.00 H new ATOM 0 HD11 LEU A 455 139.678 -0.382 -6.769 1.00 0.00 H new ATOM 0 HD12 LEU A 455 140.056 1.250 -6.168 1.00 0.00 H new ATOM 0 HD13 LEU A 455 141.358 0.205 -6.784 1.00 0.00 H new ATOM 0 HD21 LEU A 455 140.293 -2.360 -5.483 1.00 0.00 H new ATOM 0 HD22 LEU A 455 142.007 -1.892 -5.372 1.00 0.00 H new ATOM 0 HD23 LEU A 455 141.074 -2.214 -3.891 1.00 0.00 H new ATOM 1155 N PRO A 456 141.707 4.059 -4.146 1.00 0.00 N ATOM 1156 CA PRO A 456 141.423 5.222 -4.945 1.00 0.00 C ATOM 1157 C PRO A 456 141.648 4.979 -6.429 1.00 0.00 C ATOM 1158 O PRO A 456 142.731 4.558 -6.858 1.00 0.00 O ATOM 1159 CB PRO A 456 142.406 6.278 -4.450 1.00 0.00 C ATOM 1160 CG PRO A 456 142.911 5.762 -3.150 1.00 0.00 C ATOM 1161 CD PRO A 456 142.862 4.270 -3.264 1.00 0.00 C ATOM 0 HA PRO A 456 140.378 5.513 -4.843 1.00 0.00 H new ATOM 0 HB2 PRO A 456 143.221 6.421 -5.160 1.00 0.00 H new ATOM 0 HB3 PRO A 456 141.917 7.244 -4.327 1.00 0.00 H new ATOM 0 HG2 PRO A 456 143.927 6.108 -2.959 1.00 0.00 H new ATOM 0 HG3 PRO A 456 142.294 6.113 -2.323 1.00 0.00 H new ATOM 0 HD2 PRO A 456 143.779 3.865 -3.692 1.00 0.00 H new ATOM 0 HD3 PRO A 456 142.725 3.793 -2.294 1.00 0.00 H new ATOM 1169 N SER A 457 140.643 5.258 -7.195 1.00 0.00 N ATOM 1170 CA SER A 457 140.677 5.180 -8.605 1.00 0.00 C ATOM 1171 C SER A 457 139.466 5.988 -9.049 1.00 0.00 C ATOM 1172 O SER A 457 138.379 5.446 -9.246 1.00 0.00 O ATOM 1173 CB SER A 457 140.591 3.703 -9.080 1.00 0.00 C ATOM 1174 OG SER A 457 140.968 3.549 -10.448 1.00 0.00 O ATOM 0 H SER A 457 139.739 5.559 -6.830 1.00 0.00 H new ATOM 0 HA SER A 457 141.604 5.566 -9.029 1.00 0.00 H new ATOM 0 HB2 SER A 457 141.237 3.085 -8.456 1.00 0.00 H new ATOM 0 HB3 SER A 457 139.573 3.339 -8.943 1.00 0.00 H new ATOM 0 HG SER A 457 140.900 2.605 -10.702 1.00 0.00 H new ATOM 1180 N PRO A 458 139.606 7.327 -9.048 1.00 0.00 N ATOM 1181 CA PRO A 458 138.507 8.223 -9.360 1.00 0.00 C ATOM 1182 C PRO A 458 138.233 8.240 -10.852 1.00 0.00 C ATOM 1183 O PRO A 458 137.111 8.418 -11.306 1.00 0.00 O ATOM 1184 CB PRO A 458 139.014 9.607 -8.893 1.00 0.00 C ATOM 1185 CG PRO A 458 140.307 9.348 -8.189 1.00 0.00 C ATOM 1186 CD PRO A 458 140.837 8.073 -8.753 1.00 0.00 C ATOM 0 HA PRO A 458 137.575 7.925 -8.879 1.00 0.00 H new ATOM 0 HB2 PRO A 458 139.157 10.278 -9.740 1.00 0.00 H new ATOM 0 HB3 PRO A 458 138.294 10.083 -8.227 1.00 0.00 H new ATOM 0 HG2 PRO A 458 141.009 10.166 -8.349 1.00 0.00 H new ATOM 0 HG3 PRO A 458 140.155 9.265 -7.113 1.00 0.00 H new ATOM 0 HD2 PRO A 458 141.435 8.242 -9.649 1.00 0.00 H new ATOM 0 HD3 PRO A 458 141.472 7.546 -8.041 1.00 0.00 H new ATOM 1194 N SER A 459 139.281 8.098 -11.597 1.00 0.00 N ATOM 1195 CA SER A 459 139.278 8.075 -12.968 1.00 0.00 C ATOM 1196 C SER A 459 140.434 7.174 -13.354 1.00 0.00 C ATOM 1197 O SER A 459 140.240 6.177 -14.078 1.00 0.00 O ATOM 1198 CB SER A 459 139.504 9.482 -13.456 1.00 0.00 C ATOM 1199 OG SER A 459 138.485 10.370 -12.975 1.00 0.00 O ATOM 0 H SER A 459 140.216 7.989 -11.203 1.00 0.00 H new ATOM 0 HA SER A 459 138.345 7.711 -13.398 1.00 0.00 H new ATOM 0 HB2 SER A 459 140.481 9.832 -13.123 1.00 0.00 H new ATOM 0 HB3 SER A 459 139.515 9.494 -14.546 1.00 0.00 H new ATOM 0 HG SER A 459 138.658 11.276 -13.306 1.00 0.00 H new TER 1205 SER A 459