USER MOD reduce.3.24.130724 H: found=0, std=0, add=834, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 832 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 63 HIS : no HD1:sc= -3.57 K(o=-9.3,f=-7.5) USER MOD Set 1.2: A 79 TYR OH : rot 145:sc= -5.74! USER MOD Set 2.1: A 55 THR OG1 : rot -106:sc= -5.17! USER MOD Set 2.2: A 57 GLN : amide:sc= -1.21 K(o=-6.4,f=-7.8!) USER MOD Set 3.1: A 11 ASN : amide:sc= 0.0256 K(o=-0.27,f=-2.1) USER MOD Set 3.2: A 32 ASN : amide:sc= -0.299 K(o=-0.27,f=-3.3!) USER MOD Set 4.1: A 15 ASN : amide:sc= -0.69 K(o=-1.5,f=-10!) USER MOD Set 4.2: A 30 SER OG : rot -167:sc= -0.835 USER MOD Set 5.1: A 5 SER OG : rot 180:sc= -0.198 USER MOD Set 5.2: A 14 HIS : no HD1:sc= -12.2! C(o=-12!,f=-14!) USER MOD Single : A 1 VAL N :NH3+ 155:sc= -0.0648 (180deg=-0.691) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= -0.0403 X(o=-0.04,f=-0.35) USER MOD Single : A 8 SER OG : rot 180:sc= 0.117 USER MOD Single : A 10 SER OG : rot 180:sc= 0.153 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot -7:sc= -3.9 USER MOD Single : A 22 THR OG1 : rot 49:sc= 0.381 USER MOD Single : A 25 SER OG : rot 62:sc= -6.24! USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.173 USER MOD Single : A 29 TYR OH : rot 180:sc= -1.2 USER MOD Single : A 33 SER OG : rot 55:sc= 1.16 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -53:sc= -5.85! USER MOD Single : A 40 ASN : amide:sc= -0.387 X(o=-0.39,f=-0.017) USER MOD Single : A 41 SER OG : rot 180:sc= 0.00639 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= -0.161 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.155 USER MOD Single : A 67 SER OG : rot -160:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -5.24! C(o=-5.2!,f=-10!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -64:sc= -2.24! USER MOD Single : A 73 SER OG : rot 41:sc= 0.346 USER MOD Single : A 76 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.519) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0.184! USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -1.34 K(o=-1.3,f=-2) USER MOD Single : A 84 ASN : amide:sc= -2.51! K(o=-2.5!,f=-1.8) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -160:sc= -0.0361 (180deg=-0.676) USER MOD Single : A 96 SER OG : rot -68:sc= 0.632 USER MOD Single : A 98 SER OG : rot 120:sc= -1.57! USER MOD Single : A 99 SER OG : rot 101:sc= -1.92! USER MOD Single : A 100 SER OG : rot -7:sc= 0.897 USER MOD Single : A 101 SER OG : rot -160:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.0123 USER MOD Single : A 104 SER OG : rot 180:sc= -1.79! USER MOD Single : A 107 ASN : amide:sc= -5.39! C(o=-5.4!,f=-9.6!) USER MOD Single : A 108 THR OG1 : rot 180:sc=-0.00957 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 16.007 -14.517 -36.948 1.00 0.00 N ATOM 2 CA VAL A 1 15.568 -13.911 -35.655 1.00 0.00 C ATOM 3 C VAL A 1 16.452 -14.414 -34.510 1.00 0.00 C ATOM 4 O VAL A 1 16.667 -15.599 -34.354 1.00 0.00 O ATOM 5 CB VAL A 1 14.123 -14.377 -35.462 1.00 0.00 C ATOM 6 CG1 VAL A 1 14.105 -15.875 -35.155 1.00 0.00 C ATOM 7 CG2 VAL A 1 13.491 -13.609 -34.298 1.00 0.00 C ATOM 0 H1 VAL A 1 15.208 -14.532 -37.613 1.00 0.00 H new ATOM 0 H2 VAL A 1 16.782 -13.952 -37.351 1.00 0.00 H new ATOM 0 H3 VAL A 1 16.337 -15.489 -36.781 1.00 0.00 H new ATOM 0 HA VAL A 1 15.644 -12.824 -35.664 1.00 0.00 H new ATOM 0 HB VAL A 1 13.556 -14.188 -36.373 1.00 0.00 H new ATOM 0 HG11 VAL A 1 13.076 -16.206 -35.018 1.00 0.00 H new ATOM 0 HG12 VAL A 1 14.554 -16.422 -35.984 1.00 0.00 H new ATOM 0 HG13 VAL A 1 14.672 -16.067 -34.244 1.00 0.00 H new ATOM 0 HG21 VAL A 1 12.462 -13.940 -34.160 1.00 0.00 H new ATOM 0 HG22 VAL A 1 14.058 -13.798 -33.387 1.00 0.00 H new ATOM 0 HG23 VAL A 1 13.502 -12.541 -34.518 1.00 0.00 H new ATOM 19 N LYS A 2 16.969 -13.522 -33.710 1.00 0.00 N ATOM 20 CA LYS A 2 17.840 -13.951 -32.578 1.00 0.00 C ATOM 21 C LYS A 2 17.375 -13.293 -31.276 1.00 0.00 C ATOM 22 O LYS A 2 16.579 -12.375 -31.284 1.00 0.00 O ATOM 23 CB LYS A 2 19.244 -13.475 -32.955 1.00 0.00 C ATOM 24 CG LYS A 2 19.799 -14.363 -34.071 1.00 0.00 C ATOM 25 CD LYS A 2 20.671 -13.524 -35.008 1.00 0.00 C ATOM 26 CE LYS A 2 19.918 -13.265 -36.315 1.00 0.00 C ATOM 27 NZ LYS A 2 20.981 -13.012 -37.328 1.00 0.00 N ATOM 0 H LYS A 2 16.826 -12.515 -33.791 1.00 0.00 H new ATOM 0 HA LYS A 2 17.808 -15.028 -32.415 1.00 0.00 H new ATOM 0 HB2 LYS A 2 19.212 -12.436 -33.284 1.00 0.00 H new ATOM 0 HB3 LYS A 2 19.899 -13.514 -32.085 1.00 0.00 H new ATOM 0 HG2 LYS A 2 20.385 -15.177 -33.644 1.00 0.00 H new ATOM 0 HG3 LYS A 2 18.980 -14.817 -34.629 1.00 0.00 H new ATOM 0 HD2 LYS A 2 20.929 -12.578 -34.532 1.00 0.00 H new ATOM 0 HD3 LYS A 2 21.607 -14.044 -35.213 1.00 0.00 H new ATOM 0 HE2 LYS A 2 19.304 -14.121 -36.593 1.00 0.00 H new ATOM 0 HE3 LYS A 2 19.249 -12.409 -36.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 20.542 -12.826 -38.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 21.546 -12.187 -37.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 21.598 -13.846 -37.399 1.00 0.00 H new ATOM 41 N CYS A 3 17.858 -13.759 -30.156 1.00 0.00 N ATOM 42 CA CYS A 3 17.434 -13.162 -28.856 1.00 0.00 C ATOM 43 C CYS A 3 18.597 -12.420 -28.196 1.00 0.00 C ATOM 44 O CYS A 3 19.363 -12.991 -27.446 1.00 0.00 O ATOM 45 CB CYS A 3 17.016 -14.350 -27.995 1.00 0.00 C ATOM 46 SG CYS A 3 15.213 -14.423 -27.886 1.00 0.00 S ATOM 0 H CYS A 3 18.527 -14.526 -30.084 1.00 0.00 H new ATOM 0 HA CYS A 3 16.630 -12.438 -28.986 1.00 0.00 H new ATOM 0 HB2 CYS A 3 17.401 -15.275 -28.424 1.00 0.00 H new ATOM 0 HB3 CYS A 3 17.446 -14.257 -26.998 1.00 0.00 H new ATOM 51 N GLN A 4 18.726 -11.150 -28.453 1.00 0.00 N ATOM 52 CA GLN A 4 19.829 -10.371 -27.823 1.00 0.00 C ATOM 53 C GLN A 4 19.336 -9.760 -26.516 1.00 0.00 C ATOM 54 O GLN A 4 18.217 -9.987 -26.103 1.00 0.00 O ATOM 55 CB GLN A 4 20.177 -9.280 -28.835 1.00 0.00 C ATOM 56 CG GLN A 4 20.692 -9.928 -30.121 1.00 0.00 C ATOM 57 CD GLN A 4 20.428 -8.995 -31.304 1.00 0.00 C ATOM 58 OE1 GLN A 4 19.318 -8.539 -31.496 1.00 0.00 O ATOM 59 NE2 GLN A 4 21.408 -8.689 -32.109 1.00 0.00 N ATOM 0 H GLN A 4 18.116 -10.616 -29.072 1.00 0.00 H new ATOM 0 HA GLN A 4 20.697 -10.986 -27.586 1.00 0.00 H new ATOM 0 HB2 GLN A 4 19.298 -8.672 -29.048 1.00 0.00 H new ATOM 0 HB3 GLN A 4 20.934 -8.613 -28.422 1.00 0.00 H new ATOM 0 HG2 GLN A 4 21.759 -10.132 -30.036 1.00 0.00 H new ATOM 0 HG3 GLN A 4 20.197 -10.886 -30.282 1.00 0.00 H new ATOM 0 HE21 GLN A 4 22.339 -9.072 -31.947 1.00 0.00 H new ATOM 0 HE22 GLN A 4 21.243 -8.067 -32.900 1.00 0.00 H new ATOM 68 N SER A 5 20.167 -8.996 -25.864 1.00 0.00 N ATOM 69 CA SER A 5 19.757 -8.365 -24.573 1.00 0.00 C ATOM 70 C SER A 5 18.283 -7.951 -24.633 1.00 0.00 C ATOM 71 O SER A 5 17.848 -7.343 -25.590 1.00 0.00 O ATOM 72 CB SER A 5 20.658 -7.139 -24.429 1.00 0.00 C ATOM 73 OG SER A 5 19.904 -5.964 -24.703 1.00 0.00 O ATOM 0 H SER A 5 21.116 -8.779 -26.168 1.00 0.00 H new ATOM 0 HA SER A 5 19.860 -9.045 -23.727 1.00 0.00 H new ATOM 0 HB2 SER A 5 21.070 -7.093 -23.421 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.502 -7.211 -25.115 1.00 0.00 H new ATOM 0 HG SER A 5 20.480 -5.177 -24.610 1.00 0.00 H new ATOM 79 N PRO A 6 17.560 -8.314 -23.609 1.00 0.00 N ATOM 80 CA PRO A 6 16.109 -7.999 -23.547 1.00 0.00 C ATOM 81 C PRO A 6 15.879 -6.497 -23.378 1.00 0.00 C ATOM 82 O PRO A 6 16.735 -5.784 -22.901 1.00 0.00 O ATOM 83 CB PRO A 6 15.638 -8.756 -22.309 1.00 0.00 C ATOM 84 CG PRO A 6 16.858 -8.897 -21.463 1.00 0.00 C ATOM 85 CD PRO A 6 18.013 -9.043 -22.419 1.00 0.00 C ATOM 0 HA PRO A 6 15.576 -8.282 -24.455 1.00 0.00 H new ATOM 0 HB2 PRO A 6 14.854 -8.209 -21.785 1.00 0.00 H new ATOM 0 HB3 PRO A 6 15.225 -9.729 -22.574 1.00 0.00 H new ATOM 0 HG2 PRO A 6 16.991 -8.026 -20.821 1.00 0.00 H new ATOM 0 HG3 PRO A 6 16.781 -9.766 -20.809 1.00 0.00 H new ATOM 0 HD2 PRO A 6 18.929 -8.617 -22.011 1.00 0.00 H new ATOM 0 HD3 PRO A 6 18.220 -10.089 -22.643 1.00 0.00 H new ATOM 93 N PRO A 7 14.712 -6.071 -23.766 1.00 0.00 N ATOM 94 CA PRO A 7 14.352 -4.643 -23.644 1.00 0.00 C ATOM 95 C PRO A 7 14.038 -4.316 -22.184 1.00 0.00 C ATOM 96 O PRO A 7 13.935 -5.195 -21.352 1.00 0.00 O ATOM 97 CB PRO A 7 13.105 -4.510 -24.510 1.00 0.00 C ATOM 98 CG PRO A 7 12.508 -5.882 -24.548 1.00 0.00 C ATOM 99 CD PRO A 7 13.632 -6.869 -24.352 1.00 0.00 C ATOM 0 HA PRO A 7 15.147 -3.965 -23.954 1.00 0.00 H new ATOM 0 HB2 PRO A 7 12.407 -3.788 -24.087 1.00 0.00 H new ATOM 0 HB3 PRO A 7 13.356 -4.162 -25.512 1.00 0.00 H new ATOM 0 HG2 PRO A 7 11.757 -5.995 -23.766 1.00 0.00 H new ATOM 0 HG3 PRO A 7 12.006 -6.056 -25.500 1.00 0.00 H new ATOM 0 HD2 PRO A 7 13.336 -7.684 -23.692 1.00 0.00 H new ATOM 0 HD3 PRO A 7 13.937 -7.319 -25.297 1.00 0.00 H new ATOM 107 N SER A 8 13.881 -3.065 -21.864 1.00 0.00 N ATOM 108 CA SER A 8 13.568 -2.701 -20.454 1.00 0.00 C ATOM 109 C SER A 8 12.146 -3.139 -20.108 1.00 0.00 C ATOM 110 O SER A 8 11.410 -3.615 -20.949 1.00 0.00 O ATOM 111 CB SER A 8 13.690 -1.180 -20.395 1.00 0.00 C ATOM 112 OG SER A 8 13.184 -0.620 -21.600 1.00 0.00 O ATOM 0 H SER A 8 13.955 -2.281 -22.512 1.00 0.00 H new ATOM 0 HA SER A 8 14.237 -3.186 -19.743 1.00 0.00 H new ATOM 0 HB2 SER A 8 13.136 -0.792 -19.540 1.00 0.00 H new ATOM 0 HB3 SER A 8 14.732 -0.893 -20.257 1.00 0.00 H new ATOM 0 HG SER A 8 13.260 0.356 -21.564 1.00 0.00 H new ATOM 118 N ILE A 9 11.749 -2.973 -18.879 1.00 0.00 N ATOM 119 CA ILE A 9 10.367 -3.373 -18.485 1.00 0.00 C ATOM 120 C ILE A 9 9.767 -2.364 -17.532 1.00 0.00 C ATOM 121 O ILE A 9 10.287 -1.285 -17.330 1.00 0.00 O ATOM 122 CB ILE A 9 10.460 -4.737 -17.797 1.00 0.00 C ATOM 123 CG1 ILE A 9 11.796 -4.904 -17.058 1.00 0.00 C ATOM 124 CG2 ILE A 9 10.301 -5.823 -18.845 1.00 0.00 C ATOM 125 CD1 ILE A 9 11.513 -5.272 -15.599 1.00 0.00 C ATOM 0 H ILE A 9 12.318 -2.579 -18.130 1.00 0.00 H new ATOM 0 HA ILE A 9 9.728 -3.421 -19.367 1.00 0.00 H new ATOM 0 HB ILE A 9 9.666 -4.812 -17.054 1.00 0.00 H new ATOM 0 HG12 ILE A 9 12.395 -5.681 -17.533 1.00 0.00 H new ATOM 0 HG13 ILE A 9 12.373 -3.981 -17.109 1.00 0.00 H new ATOM 0 HG21 ILE A 9 10.365 -6.801 -18.368 1.00 0.00 H new ATOM 0 HG22 ILE A 9 9.331 -5.720 -19.332 1.00 0.00 H new ATOM 0 HG23 ILE A 9 11.092 -5.729 -19.589 1.00 0.00 H new ATOM 0 HD11 ILE A 9 12.455 -5.393 -15.065 1.00 0.00 H new ATOM 0 HD12 ILE A 9 10.930 -4.479 -15.130 1.00 0.00 H new ATOM 0 HD13 ILE A 9 10.952 -6.206 -15.562 1.00 0.00 H new ATOM 137 N SER A 10 8.658 -2.716 -16.963 1.00 0.00 N ATOM 138 CA SER A 10 7.972 -1.800 -16.023 1.00 0.00 C ATOM 139 C SER A 10 8.990 -1.079 -15.133 1.00 0.00 C ATOM 140 O SER A 10 9.372 -1.571 -14.091 1.00 0.00 O ATOM 141 CB SER A 10 7.057 -2.691 -15.180 1.00 0.00 C ATOM 142 OG SER A 10 7.037 -4.004 -15.726 1.00 0.00 O ATOM 0 H SER A 10 8.191 -3.611 -17.110 1.00 0.00 H new ATOM 0 HA SER A 10 7.412 -1.027 -16.549 1.00 0.00 H new ATOM 0 HB2 SER A 10 7.410 -2.720 -14.149 1.00 0.00 H new ATOM 0 HB3 SER A 10 6.048 -2.279 -15.160 1.00 0.00 H new ATOM 0 HG SER A 10 6.452 -4.575 -15.185 1.00 0.00 H new ATOM 148 N ASN A 11 9.435 0.081 -15.539 1.00 0.00 N ATOM 149 CA ASN A 11 10.432 0.827 -14.717 1.00 0.00 C ATOM 150 C ASN A 11 11.493 -0.135 -14.175 1.00 0.00 C ATOM 151 O ASN A 11 11.902 -0.044 -13.034 1.00 0.00 O ATOM 152 CB ASN A 11 9.628 1.442 -13.572 1.00 0.00 C ATOM 153 CG ASN A 11 9.405 2.931 -13.846 1.00 0.00 C ATOM 154 OD1 ASN A 11 10.346 3.699 -13.901 1.00 0.00 O ATOM 155 ND2 ASN A 11 8.191 3.374 -14.023 1.00 0.00 N ATOM 0 H ASN A 11 9.152 0.543 -16.403 1.00 0.00 H new ATOM 0 HA ASN A 11 10.957 1.587 -15.295 1.00 0.00 H new ATOM 0 HB2 ASN A 11 8.670 0.932 -13.472 1.00 0.00 H new ATOM 0 HB3 ASN A 11 10.159 1.311 -12.629 1.00 0.00 H new ATOM 0 HD21 ASN A 11 8.031 4.364 -14.207 1.00 0.00 H new ATOM 0 HD22 ASN A 11 7.401 2.730 -13.977 1.00 0.00 H new ATOM 162 N GLY A 12 11.937 -1.059 -14.983 1.00 0.00 N ATOM 163 CA GLY A 12 12.967 -2.031 -14.515 1.00 0.00 C ATOM 164 C GLY A 12 13.974 -2.294 -15.638 1.00 0.00 C ATOM 165 O GLY A 12 13.632 -2.302 -16.804 1.00 0.00 O ATOM 0 H GLY A 12 11.631 -1.183 -15.948 1.00 0.00 H new ATOM 0 HA2 GLY A 12 13.480 -1.638 -13.637 1.00 0.00 H new ATOM 0 HA3 GLY A 12 12.491 -2.964 -14.214 1.00 0.00 H new ATOM 169 N ARG A 13 15.215 -2.512 -15.294 1.00 0.00 N ATOM 170 CA ARG A 13 16.245 -2.777 -16.340 1.00 0.00 C ATOM 171 C ARG A 13 16.391 -4.272 -16.581 1.00 0.00 C ATOM 172 O ARG A 13 15.579 -5.073 -16.164 1.00 0.00 O ATOM 173 CB ARG A 13 17.549 -2.208 -15.784 1.00 0.00 C ATOM 174 CG ARG A 13 18.144 -1.218 -16.788 1.00 0.00 C ATOM 175 CD ARG A 13 19.604 -1.584 -17.062 1.00 0.00 C ATOM 176 NE ARG A 13 20.399 -0.514 -16.399 1.00 0.00 N ATOM 177 CZ ARG A 13 21.699 -0.504 -16.508 1.00 0.00 C ATOM 178 NH1 ARG A 13 22.369 -1.621 -16.432 1.00 0.00 N ATOM 179 NH2 ARG A 13 22.329 0.624 -16.691 1.00 0.00 N ATOM 0 H ARG A 13 15.560 -2.518 -14.334 1.00 0.00 H new ATOM 0 HA ARG A 13 15.973 -2.323 -17.293 1.00 0.00 H new ATOM 0 HB2 ARG A 13 17.364 -1.710 -14.832 1.00 0.00 H new ATOM 0 HB3 ARG A 13 18.256 -3.014 -15.590 1.00 0.00 H new ATOM 0 HG2 ARG A 13 17.573 -1.238 -17.716 1.00 0.00 H new ATOM 0 HG3 ARG A 13 18.080 -0.203 -16.396 1.00 0.00 H new ATOM 0 HD2 ARG A 13 19.848 -2.566 -16.656 1.00 0.00 H new ATOM 0 HD3 ARG A 13 19.808 -1.622 -18.132 1.00 0.00 H new ATOM 0 HE ARG A 13 19.927 0.212 -15.859 1.00 0.00 H new ATOM 0 HH11 ARG A 13 21.876 -2.502 -16.287 1.00 0.00 H new ATOM 0 HH12 ARG A 13 23.385 -1.613 -16.517 1.00 0.00 H new ATOM 0 HH21 ARG A 13 21.805 1.497 -16.749 1.00 0.00 H new ATOM 0 HH22 ARG A 13 23.345 0.632 -16.776 1.00 0.00 H new ATOM 193 N HIS A 14 17.427 -4.637 -17.264 1.00 0.00 N ATOM 194 CA HIS A 14 17.667 -6.076 -17.569 1.00 0.00 C ATOM 195 C HIS A 14 19.164 -6.329 -17.778 1.00 0.00 C ATOM 196 O HIS A 14 19.805 -5.679 -18.579 1.00 0.00 O ATOM 197 CB HIS A 14 16.883 -6.330 -18.856 1.00 0.00 C ATOM 198 CG HIS A 14 17.640 -5.783 -20.033 1.00 0.00 C ATOM 199 ND1 HIS A 14 18.521 -6.564 -20.757 1.00 0.00 N ATOM 200 CD2 HIS A 14 17.636 -4.554 -20.644 1.00 0.00 C ATOM 201 CE1 HIS A 14 19.002 -5.815 -21.760 1.00 0.00 C ATOM 202 NE2 HIS A 14 18.499 -4.575 -21.738 1.00 0.00 N ATOM 0 H HIS A 14 18.131 -3.997 -17.632 1.00 0.00 H new ATOM 0 HA HIS A 14 17.351 -6.737 -16.762 1.00 0.00 H new ATOM 0 HB2 HIS A 14 16.716 -7.399 -18.985 1.00 0.00 H new ATOM 0 HB3 HIS A 14 15.902 -5.859 -18.793 1.00 0.00 H new ATOM 0 HD2 HIS A 14 17.054 -3.702 -20.326 1.00 0.00 H new ATOM 0 HE1 HIS A 14 19.709 -6.169 -22.496 1.00 0.00 H new ATOM 0 HE2 HIS A 14 18.703 -3.811 -22.382 1.00 0.00 H new ATOM 210 N ASN A 15 19.727 -7.266 -17.064 1.00 0.00 N ATOM 211 CA ASN A 15 21.182 -7.551 -17.228 1.00 0.00 C ATOM 212 C ASN A 15 21.455 -9.046 -17.042 1.00 0.00 C ATOM 213 O ASN A 15 21.322 -9.581 -15.960 1.00 0.00 O ATOM 214 CB ASN A 15 21.873 -6.743 -16.128 1.00 0.00 C ATOM 215 CG ASN A 15 21.838 -5.257 -16.486 1.00 0.00 C ATOM 216 OD1 ASN A 15 21.109 -4.492 -15.885 1.00 0.00 O ATOM 217 ND2 ASN A 15 22.602 -4.811 -17.445 1.00 0.00 N ATOM 0 H ASN A 15 19.245 -7.845 -16.376 1.00 0.00 H new ATOM 0 HA ASN A 15 21.543 -7.282 -18.221 1.00 0.00 H new ATOM 0 HB2 ASN A 15 21.375 -6.909 -15.173 1.00 0.00 H new ATOM 0 HB3 ASN A 15 22.905 -7.075 -16.012 1.00 0.00 H new ATOM 0 HD21 ASN A 15 22.587 -3.821 -17.690 1.00 0.00 H new ATOM 0 HD22 ASN A 15 23.214 -5.452 -17.950 1.00 0.00 H new ATOM 224 N GLY A 16 21.841 -9.721 -18.089 1.00 0.00 N ATOM 225 CA GLY A 16 22.128 -11.179 -17.970 1.00 0.00 C ATOM 226 C GLY A 16 23.630 -11.411 -18.139 1.00 0.00 C ATOM 227 O GLY A 16 24.072 -12.505 -18.430 1.00 0.00 O ATOM 0 H GLY A 16 21.970 -9.327 -19.021 1.00 0.00 H new ATOM 0 HA2 GLY A 16 21.798 -11.549 -16.999 1.00 0.00 H new ATOM 0 HA3 GLY A 16 21.575 -11.734 -18.728 1.00 0.00 H new ATOM 231 N TYR A 17 24.417 -10.386 -17.959 1.00 0.00 N ATOM 232 CA TYR A 17 25.892 -10.537 -18.108 1.00 0.00 C ATOM 233 C TYR A 17 26.249 -10.831 -19.567 1.00 0.00 C ATOM 234 O TYR A 17 27.164 -11.577 -19.853 1.00 0.00 O ATOM 235 CB TYR A 17 26.271 -11.719 -17.215 1.00 0.00 C ATOM 236 CG TYR A 17 27.675 -11.521 -16.695 1.00 0.00 C ATOM 237 CD1 TYR A 17 28.607 -10.806 -17.456 1.00 0.00 C ATOM 238 CD2 TYR A 17 28.046 -12.048 -15.451 1.00 0.00 C ATOM 239 CE1 TYR A 17 29.908 -10.617 -16.975 1.00 0.00 C ATOM 240 CE2 TYR A 17 29.348 -11.860 -14.970 1.00 0.00 C ATOM 241 CZ TYR A 17 30.278 -11.144 -15.733 1.00 0.00 C ATOM 242 OH TYR A 17 31.561 -10.956 -15.260 1.00 0.00 O ATOM 0 H TYR A 17 24.101 -9.448 -17.714 1.00 0.00 H new ATOM 0 HA TYR A 17 26.426 -9.630 -17.825 1.00 0.00 H new ATOM 0 HB2 TYR A 17 25.571 -11.801 -16.383 1.00 0.00 H new ATOM 0 HB3 TYR A 17 26.207 -12.650 -17.778 1.00 0.00 H new ATOM 0 HD1 TYR A 17 28.322 -10.400 -18.415 1.00 0.00 H new ATOM 0 HD2 TYR A 17 27.328 -12.600 -14.863 1.00 0.00 H new ATOM 0 HE1 TYR A 17 30.626 -10.064 -17.563 1.00 0.00 H new ATOM 0 HE2 TYR A 17 29.634 -12.267 -14.011 1.00 0.00 H new ATOM 0 HH TYR A 17 31.652 -11.384 -14.383 1.00 0.00 H new ATOM 252 N GLU A 18 25.536 -10.249 -20.492 1.00 0.00 N ATOM 253 CA GLU A 18 25.838 -10.496 -21.931 1.00 0.00 C ATOM 254 C GLU A 18 24.828 -9.772 -22.820 1.00 0.00 C ATOM 255 O GLU A 18 23.979 -9.040 -22.351 1.00 0.00 O ATOM 256 CB GLU A 18 25.719 -12.009 -22.117 1.00 0.00 C ATOM 257 CG GLU A 18 24.410 -12.509 -21.498 1.00 0.00 C ATOM 258 CD GLU A 18 24.497 -14.020 -21.277 1.00 0.00 C ATOM 259 OE1 GLU A 18 24.164 -14.753 -22.193 1.00 0.00 O ATOM 260 OE2 GLU A 18 24.897 -14.419 -20.196 1.00 0.00 O ATOM 0 H GLU A 18 24.758 -9.614 -20.314 1.00 0.00 H new ATOM 0 HA GLU A 18 26.827 -10.128 -22.206 1.00 0.00 H new ATOM 0 HB2 GLU A 18 25.748 -12.257 -23.178 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.567 -12.509 -21.650 1.00 0.00 H new ATOM 0 HG2 GLU A 18 24.226 -12.002 -20.551 1.00 0.00 H new ATOM 0 HG3 GLU A 18 23.572 -12.274 -22.154 1.00 0.00 H new ATOM 267 N ASP A 19 24.913 -9.977 -24.104 1.00 0.00 N ATOM 268 CA ASP A 19 23.960 -9.309 -25.034 1.00 0.00 C ATOM 269 C ASP A 19 23.321 -10.343 -25.962 1.00 0.00 C ATOM 270 O ASP A 19 22.459 -10.029 -26.759 1.00 0.00 O ATOM 271 CB ASP A 19 24.812 -8.323 -25.835 1.00 0.00 C ATOM 272 CG ASP A 19 25.439 -7.299 -24.885 1.00 0.00 C ATOM 273 OD1 ASP A 19 24.694 -6.657 -24.163 1.00 0.00 O ATOM 274 OD2 ASP A 19 26.652 -7.175 -24.898 1.00 0.00 O ATOM 0 H ASP A 19 25.603 -10.580 -24.551 1.00 0.00 H new ATOM 0 HA ASP A 19 23.148 -8.809 -24.506 1.00 0.00 H new ATOM 0 HB2 ASP A 19 25.592 -8.857 -26.377 1.00 0.00 H new ATOM 0 HB3 ASP A 19 24.197 -7.816 -26.579 1.00 0.00 H new ATOM 279 N PHE A 20 23.737 -11.577 -25.866 1.00 0.00 N ATOM 280 CA PHE A 20 23.153 -12.630 -26.743 1.00 0.00 C ATOM 281 C PHE A 20 22.281 -13.580 -25.921 1.00 0.00 C ATOM 282 O PHE A 20 22.513 -13.793 -24.748 1.00 0.00 O ATOM 283 CB PHE A 20 24.353 -13.376 -27.323 1.00 0.00 C ATOM 284 CG PHE A 20 24.529 -12.992 -28.770 1.00 0.00 C ATOM 285 CD1 PHE A 20 23.675 -13.522 -29.744 1.00 0.00 C ATOM 286 CD2 PHE A 20 25.547 -12.106 -29.139 1.00 0.00 C ATOM 287 CE1 PHE A 20 23.839 -13.166 -31.087 1.00 0.00 C ATOM 288 CE2 PHE A 20 25.712 -11.749 -30.482 1.00 0.00 C ATOM 289 CZ PHE A 20 24.858 -12.280 -31.456 1.00 0.00 C ATOM 0 H PHE A 20 24.456 -11.900 -25.218 1.00 0.00 H new ATOM 0 HA PHE A 20 22.518 -12.209 -27.523 1.00 0.00 H new ATOM 0 HB2 PHE A 20 25.253 -13.133 -26.759 1.00 0.00 H new ATOM 0 HB3 PHE A 20 24.203 -14.452 -27.236 1.00 0.00 H new ATOM 0 HD1 PHE A 20 22.889 -14.206 -29.459 1.00 0.00 H new ATOM 0 HD2 PHE A 20 26.206 -11.697 -28.387 1.00 0.00 H new ATOM 0 HE1 PHE A 20 23.180 -13.575 -31.839 1.00 0.00 H new ATOM 0 HE2 PHE A 20 26.497 -11.065 -30.767 1.00 0.00 H new ATOM 0 HZ PHE A 20 24.985 -12.006 -32.493 1.00 0.00 H new ATOM 299 N TYR A 21 21.282 -14.151 -26.533 1.00 0.00 N ATOM 300 CA TYR A 21 20.384 -15.089 -25.801 1.00 0.00 C ATOM 301 C TYR A 21 19.509 -15.846 -26.795 1.00 0.00 C ATOM 302 O TYR A 21 18.328 -16.035 -26.584 1.00 0.00 O ATOM 303 CB TYR A 21 19.540 -14.196 -24.885 1.00 0.00 C ATOM 304 CG TYR A 21 20.254 -13.990 -23.563 1.00 0.00 C ATOM 305 CD1 TYR A 21 20.960 -15.045 -22.963 1.00 0.00 C ATOM 306 CD2 TYR A 21 20.214 -12.737 -22.939 1.00 0.00 C ATOM 307 CE1 TYR A 21 21.620 -14.843 -21.745 1.00 0.00 C ATOM 308 CE2 TYR A 21 20.874 -12.537 -21.720 1.00 0.00 C ATOM 309 CZ TYR A 21 21.577 -13.590 -21.124 1.00 0.00 C ATOM 310 OH TYR A 21 22.227 -13.394 -19.923 1.00 0.00 O ATOM 0 H TYR A 21 21.047 -14.008 -27.515 1.00 0.00 H new ATOM 0 HA TYR A 21 20.931 -15.839 -25.230 1.00 0.00 H new ATOM 0 HB2 TYR A 21 19.361 -13.234 -25.365 1.00 0.00 H new ATOM 0 HB3 TYR A 21 18.565 -14.653 -24.714 1.00 0.00 H new ATOM 0 HD1 TYR A 21 20.994 -16.013 -23.441 1.00 0.00 H new ATOM 0 HD2 TYR A 21 19.673 -11.923 -23.399 1.00 0.00 H new ATOM 0 HE1 TYR A 21 22.163 -15.655 -21.284 1.00 0.00 H new ATOM 0 HE2 TYR A 21 20.840 -11.570 -21.240 1.00 0.00 H new ATOM 0 HH TYR A 21 22.569 -14.251 -19.592 1.00 0.00 H new ATOM 320 N THR A 22 20.082 -16.281 -27.884 1.00 0.00 N ATOM 321 CA THR A 22 19.281 -17.015 -28.897 1.00 0.00 C ATOM 322 C THR A 22 18.519 -18.182 -28.277 1.00 0.00 C ATOM 323 O THR A 22 19.041 -19.261 -28.081 1.00 0.00 O ATOM 324 CB THR A 22 20.263 -17.545 -29.921 1.00 0.00 C ATOM 325 OG1 THR A 22 21.341 -18.196 -29.260 1.00 0.00 O ATOM 326 CG2 THR A 22 20.796 -16.397 -30.780 1.00 0.00 C ATOM 0 H THR A 22 21.068 -16.159 -28.113 1.00 0.00 H new ATOM 0 HA THR A 22 18.542 -16.348 -29.340 1.00 0.00 H new ATOM 0 HB THR A 22 19.753 -18.261 -30.566 1.00 0.00 H new ATOM 0 HG1 THR A 22 20.987 -18.819 -28.592 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.501 -16.788 -31.513 1.00 0.00 H new ATOM 0 HG22 THR A 22 19.967 -15.913 -31.296 1.00 0.00 H new ATOM 0 HG23 THR A 22 21.300 -15.670 -30.143 1.00 0.00 H new ATOM 334 N ASP A 23 17.279 -17.958 -28.012 1.00 0.00 N ATOM 335 CA ASP A 23 16.393 -19.020 -27.438 1.00 0.00 C ATOM 336 C ASP A 23 17.019 -19.689 -26.209 1.00 0.00 C ATOM 337 O ASP A 23 18.204 -19.589 -25.961 1.00 0.00 O ATOM 338 CB ASP A 23 16.230 -20.039 -28.566 1.00 0.00 C ATOM 339 CG ASP A 23 15.441 -21.245 -28.054 1.00 0.00 C ATOM 340 OD1 ASP A 23 14.260 -21.087 -27.790 1.00 0.00 O ATOM 341 OD2 ASP A 23 16.030 -22.306 -27.934 1.00 0.00 O ATOM 0 H ASP A 23 16.816 -17.063 -28.169 1.00 0.00 H new ATOM 0 HA ASP A 23 15.445 -18.602 -27.099 1.00 0.00 H new ATOM 0 HB2 ASP A 23 15.712 -19.584 -29.410 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.208 -20.357 -28.927 1.00 0.00 H new ATOM 346 N GLY A 24 16.216 -20.378 -25.441 1.00 0.00 N ATOM 347 CA GLY A 24 16.739 -21.070 -24.231 1.00 0.00 C ATOM 348 C GLY A 24 17.602 -20.107 -23.426 1.00 0.00 C ATOM 349 O GLY A 24 18.496 -20.510 -22.709 1.00 0.00 O ATOM 0 H GLY A 24 15.215 -20.490 -25.603 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.912 -21.431 -23.620 1.00 0.00 H new ATOM 0 HA3 GLY A 24 17.324 -21.942 -24.523 1.00 0.00 H new ATOM 353 N SER A 25 17.345 -18.837 -23.536 1.00 0.00 N ATOM 354 CA SER A 25 18.160 -17.857 -22.770 1.00 0.00 C ATOM 355 C SER A 25 17.354 -17.293 -21.609 1.00 0.00 C ATOM 356 O SER A 25 16.181 -17.570 -21.460 1.00 0.00 O ATOM 357 CB SER A 25 18.498 -16.756 -23.762 1.00 0.00 C ATOM 358 OG SER A 25 19.530 -17.210 -24.626 1.00 0.00 O ATOM 0 H SER A 25 16.611 -18.436 -24.119 1.00 0.00 H new ATOM 0 HA SER A 25 19.055 -18.313 -22.347 1.00 0.00 H new ATOM 0 HB2 SER A 25 17.614 -16.487 -24.341 1.00 0.00 H new ATOM 0 HB3 SER A 25 18.818 -15.858 -23.233 1.00 0.00 H new ATOM 0 HG SER A 25 19.213 -17.985 -25.135 1.00 0.00 H new ATOM 364 N VAL A 26 17.972 -16.502 -20.782 1.00 0.00 N ATOM 365 CA VAL A 26 17.229 -15.928 -19.634 1.00 0.00 C ATOM 366 C VAL A 26 17.877 -14.632 -19.163 1.00 0.00 C ATOM 367 O VAL A 26 19.055 -14.407 -19.357 1.00 0.00 O ATOM 368 CB VAL A 26 17.303 -17.000 -18.551 1.00 0.00 C ATOM 369 CG1 VAL A 26 16.934 -16.395 -17.197 1.00 0.00 C ATOM 370 CG2 VAL A 26 16.331 -18.130 -18.893 1.00 0.00 C ATOM 0 H VAL A 26 18.953 -16.230 -20.851 1.00 0.00 H new ATOM 0 HA VAL A 26 16.201 -15.676 -19.892 1.00 0.00 H new ATOM 0 HB VAL A 26 18.318 -17.394 -18.499 1.00 0.00 H new ATOM 0 HG11 VAL A 26 16.989 -17.165 -16.427 1.00 0.00 H new ATOM 0 HG12 VAL A 26 17.630 -15.591 -16.956 1.00 0.00 H new ATOM 0 HG13 VAL A 26 15.920 -15.997 -17.241 1.00 0.00 H new ATOM 0 HG21 VAL A 26 16.381 -18.898 -18.122 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.317 -17.734 -18.946 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.602 -18.564 -19.855 1.00 0.00 H new ATOM 380 N VAL A 27 17.110 -13.770 -18.555 1.00 0.00 N ATOM 381 CA VAL A 27 17.687 -12.477 -18.086 1.00 0.00 C ATOM 382 C VAL A 27 17.077 -12.031 -16.772 1.00 0.00 C ATOM 383 O VAL A 27 15.882 -11.848 -16.659 1.00 0.00 O ATOM 384 CB VAL A 27 17.335 -11.473 -19.173 1.00 0.00 C ATOM 385 CG1 VAL A 27 17.564 -10.046 -18.666 1.00 0.00 C ATOM 386 CG2 VAL A 27 18.228 -11.722 -20.366 1.00 0.00 C ATOM 0 H VAL A 27 16.117 -13.902 -18.363 1.00 0.00 H new ATOM 0 HA VAL A 27 18.760 -12.569 -17.916 1.00 0.00 H new ATOM 0 HB VAL A 27 16.287 -11.588 -19.449 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.309 -9.335 -19.452 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.935 -9.864 -17.794 1.00 0.00 H new ATOM 0 HG13 VAL A 27 18.611 -9.922 -18.390 1.00 0.00 H new ATOM 0 HG21 VAL A 27 17.988 -11.009 -21.155 1.00 0.00 H new ATOM 0 HG22 VAL A 27 19.270 -11.600 -20.072 1.00 0.00 H new ATOM 0 HG23 VAL A 27 18.071 -12.736 -20.733 1.00 0.00 H new ATOM 396 N THR A 28 17.887 -11.802 -15.786 1.00 0.00 N ATOM 397 CA THR A 28 17.325 -11.314 -14.513 1.00 0.00 C ATOM 398 C THR A 28 16.953 -9.849 -14.707 1.00 0.00 C ATOM 399 O THR A 28 17.803 -8.984 -14.769 1.00 0.00 O ATOM 400 CB THR A 28 18.433 -11.473 -13.470 1.00 0.00 C ATOM 401 OG1 THR A 28 19.568 -12.085 -14.068 1.00 0.00 O ATOM 402 CG2 THR A 28 17.929 -12.344 -12.320 1.00 0.00 C ATOM 0 H THR A 28 18.899 -11.930 -15.807 1.00 0.00 H new ATOM 0 HA THR A 28 16.436 -11.858 -14.194 1.00 0.00 H new ATOM 0 HB THR A 28 18.713 -10.492 -13.087 1.00 0.00 H new ATOM 0 HG1 THR A 28 20.277 -12.184 -13.399 1.00 0.00 H new ATOM 0 HG21 THR A 28 18.718 -12.458 -11.577 1.00 0.00 H new ATOM 0 HG22 THR A 28 17.061 -11.872 -11.859 1.00 0.00 H new ATOM 0 HG23 THR A 28 17.647 -13.325 -12.703 1.00 0.00 H new ATOM 410 N TYR A 29 15.692 -9.567 -14.844 1.00 0.00 N ATOM 411 CA TYR A 29 15.277 -8.159 -15.079 1.00 0.00 C ATOM 412 C TYR A 29 15.534 -7.312 -13.831 1.00 0.00 C ATOM 413 O TYR A 29 15.108 -7.644 -12.744 1.00 0.00 O ATOM 414 CB TYR A 29 13.776 -8.233 -15.376 1.00 0.00 C ATOM 415 CG TYR A 29 13.540 -8.337 -16.866 1.00 0.00 C ATOM 416 CD1 TYR A 29 14.599 -8.632 -17.737 1.00 0.00 C ATOM 417 CD2 TYR A 29 12.253 -8.139 -17.376 1.00 0.00 C ATOM 418 CE1 TYR A 29 14.369 -8.728 -19.112 1.00 0.00 C ATOM 419 CE2 TYR A 29 12.022 -8.237 -18.751 1.00 0.00 C ATOM 420 CZ TYR A 29 13.080 -8.530 -19.622 1.00 0.00 C ATOM 421 OH TYR A 29 12.852 -8.625 -20.979 1.00 0.00 O ATOM 0 H TYR A 29 14.932 -10.246 -14.804 1.00 0.00 H new ATOM 0 HA TYR A 29 15.834 -7.697 -15.894 1.00 0.00 H new ATOM 0 HB2 TYR A 29 13.341 -9.095 -14.871 1.00 0.00 H new ATOM 0 HB3 TYR A 29 13.277 -7.348 -14.983 1.00 0.00 H new ATOM 0 HD1 TYR A 29 15.593 -8.785 -17.345 1.00 0.00 H new ATOM 0 HD2 TYR A 29 11.437 -7.910 -16.707 1.00 0.00 H new ATOM 0 HE1 TYR A 29 15.186 -8.955 -19.781 1.00 0.00 H new ATOM 0 HE2 TYR A 29 11.027 -8.087 -19.143 1.00 0.00 H new ATOM 0 HH TYR A 29 11.904 -8.461 -21.164 1.00 0.00 H new ATOM 431 N SER A 30 16.231 -6.220 -13.983 1.00 0.00 N ATOM 432 CA SER A 30 16.521 -5.348 -12.809 1.00 0.00 C ATOM 433 C SER A 30 15.354 -4.389 -12.566 1.00 0.00 C ATOM 434 O SER A 30 14.587 -4.089 -13.459 1.00 0.00 O ATOM 435 CB SER A 30 17.782 -4.568 -13.186 1.00 0.00 C ATOM 436 OG SER A 30 18.256 -5.010 -14.452 1.00 0.00 O ATOM 0 H SER A 30 16.613 -5.893 -14.870 1.00 0.00 H new ATOM 0 HA SER A 30 16.660 -5.925 -11.895 1.00 0.00 H new ATOM 0 HB2 SER A 30 17.565 -3.500 -13.220 1.00 0.00 H new ATOM 0 HB3 SER A 30 18.551 -4.713 -12.428 1.00 0.00 H new ATOM 0 HG SER A 30 19.162 -4.667 -14.600 1.00 0.00 H new ATOM 442 N CYS A 31 15.214 -3.907 -11.363 1.00 0.00 N ATOM 443 CA CYS A 31 14.097 -2.970 -11.062 1.00 0.00 C ATOM 444 C CYS A 31 14.644 -1.673 -10.462 1.00 0.00 C ATOM 445 O CYS A 31 15.705 -1.652 -9.869 1.00 0.00 O ATOM 446 CB CYS A 31 13.231 -3.710 -10.044 1.00 0.00 C ATOM 447 SG CYS A 31 12.549 -5.202 -10.806 1.00 0.00 S ATOM 0 H CYS A 31 15.825 -4.122 -10.575 1.00 0.00 H new ATOM 0 HA CYS A 31 13.534 -2.693 -11.953 1.00 0.00 H new ATOM 0 HB2 CYS A 31 13.825 -3.974 -9.169 1.00 0.00 H new ATOM 0 HB3 CYS A 31 12.424 -3.064 -9.698 1.00 0.00 H new ATOM 452 N ASN A 32 13.928 -0.591 -10.611 1.00 0.00 N ATOM 453 CA ASN A 32 14.408 0.705 -10.048 1.00 0.00 C ATOM 454 C ASN A 32 14.997 0.489 -8.652 1.00 0.00 C ATOM 455 O ASN A 32 14.519 -0.321 -7.883 1.00 0.00 O ATOM 456 CB ASN A 32 13.164 1.590 -9.974 1.00 0.00 C ATOM 457 CG ASN A 32 13.116 2.507 -11.197 1.00 0.00 C ATOM 458 OD1 ASN A 32 14.082 2.616 -11.927 1.00 0.00 O ATOM 459 ND2 ASN A 32 12.026 3.175 -11.453 1.00 0.00 N ATOM 0 H ASN A 32 13.033 -0.548 -11.098 1.00 0.00 H new ATOM 0 HA ASN A 32 15.192 1.155 -10.657 1.00 0.00 H new ATOM 0 HB2 ASN A 32 12.267 0.972 -9.934 1.00 0.00 H new ATOM 0 HB3 ASN A 32 13.182 2.185 -9.061 1.00 0.00 H new ATOM 0 HD21 ASN A 32 11.983 3.789 -12.266 1.00 0.00 H new ATOM 0 HD22 ASN A 32 11.216 3.083 -10.840 1.00 0.00 H new ATOM 466 N SER A 33 16.037 1.203 -8.322 1.00 0.00 N ATOM 467 CA SER A 33 16.661 1.036 -6.979 1.00 0.00 C ATOM 468 C SER A 33 15.606 1.174 -5.876 1.00 0.00 C ATOM 469 O SER A 33 15.375 2.249 -5.358 1.00 0.00 O ATOM 470 CB SER A 33 17.690 2.161 -6.880 1.00 0.00 C ATOM 471 OG SER A 33 17.016 3.412 -6.846 1.00 0.00 O ATOM 0 H SER A 33 16.482 1.895 -8.924 1.00 0.00 H new ATOM 0 HA SER A 33 17.115 0.053 -6.857 1.00 0.00 H new ATOM 0 HB2 SER A 33 18.296 2.037 -5.983 1.00 0.00 H new ATOM 0 HB3 SER A 33 18.370 2.124 -7.731 1.00 0.00 H new ATOM 0 HG SER A 33 16.365 3.413 -6.113 1.00 0.00 H new ATOM 477 N GLY A 34 14.968 0.095 -5.506 1.00 0.00 N ATOM 478 CA GLY A 34 13.939 0.175 -4.430 1.00 0.00 C ATOM 479 C GLY A 34 12.626 -0.454 -4.906 1.00 0.00 C ATOM 480 O GLY A 34 11.601 -0.322 -4.267 1.00 0.00 O ATOM 0 H GLY A 34 15.114 -0.834 -5.901 1.00 0.00 H new ATOM 0 HA2 GLY A 34 14.295 -0.340 -3.538 1.00 0.00 H new ATOM 0 HA3 GLY A 34 13.773 1.216 -4.153 1.00 0.00 H new ATOM 484 N TYR A 35 12.643 -1.135 -6.019 1.00 0.00 N ATOM 485 CA TYR A 35 11.387 -1.765 -6.521 1.00 0.00 C ATOM 486 C TYR A 35 11.433 -3.284 -6.321 1.00 0.00 C ATOM 487 O TYR A 35 12.488 -3.885 -6.262 1.00 0.00 O ATOM 488 CB TYR A 35 11.326 -1.411 -8.009 1.00 0.00 C ATOM 489 CG TYR A 35 10.431 -0.206 -8.202 1.00 0.00 C ATOM 490 CD1 TYR A 35 10.253 0.710 -7.157 1.00 0.00 C ATOM 491 CD2 TYR A 35 9.777 -0.004 -9.425 1.00 0.00 C ATOM 492 CE1 TYR A 35 9.425 1.824 -7.333 1.00 0.00 C ATOM 493 CE2 TYR A 35 8.948 1.112 -9.600 1.00 0.00 C ATOM 494 CZ TYR A 35 8.773 2.025 -8.554 1.00 0.00 C ATOM 495 OH TYR A 35 7.956 3.124 -8.727 1.00 0.00 O ATOM 0 H TYR A 35 13.468 -1.283 -6.601 1.00 0.00 H new ATOM 0 HA TYR A 35 10.507 -1.408 -5.986 1.00 0.00 H new ATOM 0 HB2 TYR A 35 12.327 -1.199 -8.385 1.00 0.00 H new ATOM 0 HB3 TYR A 35 10.944 -2.257 -8.580 1.00 0.00 H new ATOM 0 HD1 TYR A 35 10.756 0.556 -6.214 1.00 0.00 H new ATOM 0 HD2 TYR A 35 9.912 -0.708 -10.232 1.00 0.00 H new ATOM 0 HE1 TYR A 35 9.289 2.529 -6.526 1.00 0.00 H new ATOM 0 HE2 TYR A 35 8.444 1.268 -10.542 1.00 0.00 H new ATOM 0 HH TYR A 35 7.582 3.114 -9.633 1.00 0.00 H new ATOM 505 N SER A 36 10.290 -3.902 -6.205 1.00 0.00 N ATOM 506 CA SER A 36 10.237 -5.377 -5.996 1.00 0.00 C ATOM 507 C SER A 36 10.181 -6.108 -7.337 1.00 0.00 C ATOM 508 O SER A 36 9.459 -5.721 -8.235 1.00 0.00 O ATOM 509 CB SER A 36 8.939 -5.608 -5.219 1.00 0.00 C ATOM 510 OG SER A 36 8.499 -4.374 -4.664 1.00 0.00 O ATOM 0 H SER A 36 9.380 -3.443 -6.247 1.00 0.00 H new ATOM 0 HA SER A 36 11.115 -5.750 -5.469 1.00 0.00 H new ATOM 0 HB2 SER A 36 8.174 -6.017 -5.879 1.00 0.00 H new ATOM 0 HB3 SER A 36 9.101 -6.339 -4.427 1.00 0.00 H new ATOM 0 HG SER A 36 9.227 -3.970 -4.147 1.00 0.00 H new ATOM 516 N LEU A 37 10.920 -7.175 -7.476 1.00 0.00 N ATOM 517 CA LEU A 37 10.881 -7.935 -8.755 1.00 0.00 C ATOM 518 C LEU A 37 9.956 -9.141 -8.603 1.00 0.00 C ATOM 519 O LEU A 37 10.339 -10.169 -8.082 1.00 0.00 O ATOM 520 CB LEU A 37 12.315 -8.395 -9.018 1.00 0.00 C ATOM 521 CG LEU A 37 12.341 -9.223 -10.305 1.00 0.00 C ATOM 522 CD1 LEU A 37 12.996 -8.413 -11.424 1.00 0.00 C ATOM 523 CD2 LEU A 37 13.139 -10.508 -10.077 1.00 0.00 C ATOM 0 H LEU A 37 11.545 -7.551 -6.763 1.00 0.00 H new ATOM 0 HA LEU A 37 10.506 -7.328 -9.579 1.00 0.00 H new ATOM 0 HB2 LEU A 37 12.976 -7.534 -9.110 1.00 0.00 H new ATOM 0 HB3 LEU A 37 12.680 -8.989 -8.180 1.00 0.00 H new ATOM 0 HG LEU A 37 11.319 -9.476 -10.588 1.00 0.00 H new ATOM 0 HD11 LEU A 37 13.013 -9.005 -12.339 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.426 -7.499 -11.593 1.00 0.00 H new ATOM 0 HD13 LEU A 37 14.016 -8.157 -11.138 1.00 0.00 H new ATOM 0 HD21 LEU A 37 13.155 -11.094 -10.996 1.00 0.00 H new ATOM 0 HD22 LEU A 37 14.160 -10.256 -9.790 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.672 -11.090 -9.283 1.00 0.00 H new ATOM 535 N ILE A 38 8.740 -9.025 -9.056 1.00 0.00 N ATOM 536 CA ILE A 38 7.795 -10.173 -8.935 1.00 0.00 C ATOM 537 C ILE A 38 7.798 -10.972 -10.237 1.00 0.00 C ATOM 538 O ILE A 38 7.876 -10.421 -11.314 1.00 0.00 O ATOM 539 CB ILE A 38 6.394 -9.588 -8.674 1.00 0.00 C ATOM 540 CG1 ILE A 38 6.465 -8.119 -8.231 1.00 0.00 C ATOM 541 CG2 ILE A 38 5.725 -10.395 -7.568 1.00 0.00 C ATOM 542 CD1 ILE A 38 7.365 -7.994 -7.001 1.00 0.00 C ATOM 0 H ILE A 38 8.359 -8.191 -9.503 1.00 0.00 H new ATOM 0 HA ILE A 38 8.086 -10.839 -8.123 1.00 0.00 H new ATOM 0 HB ILE A 38 5.826 -9.640 -9.603 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.854 -7.503 -9.042 1.00 0.00 H new ATOM 0 HG13 ILE A 38 5.466 -7.750 -8.001 1.00 0.00 H new ATOM 0 HG21 ILE A 38 4.732 -9.991 -7.373 1.00 0.00 H new ATOM 0 HG22 ILE A 38 5.639 -11.436 -7.879 1.00 0.00 H new ATOM 0 HG23 ILE A 38 6.325 -10.336 -6.660 1.00 0.00 H new ATOM 0 HD11 ILE A 38 7.413 -6.950 -6.690 1.00 0.00 H new ATOM 0 HD12 ILE A 38 6.957 -8.596 -6.189 1.00 0.00 H new ATOM 0 HD13 ILE A 38 8.367 -8.346 -7.246 1.00 0.00 H new ATOM 554 N GLY A 39 7.717 -12.266 -10.152 1.00 0.00 N ATOM 555 CA GLY A 39 7.722 -13.084 -11.395 1.00 0.00 C ATOM 556 C GLY A 39 8.839 -14.123 -11.319 1.00 0.00 C ATOM 557 O GLY A 39 8.869 -14.956 -10.435 1.00 0.00 O ATOM 0 H GLY A 39 7.648 -12.793 -9.281 1.00 0.00 H new ATOM 0 HA2 GLY A 39 6.759 -13.579 -11.521 1.00 0.00 H new ATOM 0 HA3 GLY A 39 7.867 -12.442 -12.264 1.00 0.00 H new ATOM 561 N ASN A 40 9.759 -14.079 -12.241 1.00 0.00 N ATOM 562 CA ASN A 40 10.878 -15.060 -12.225 1.00 0.00 C ATOM 563 C ASN A 40 12.219 -14.322 -12.231 1.00 0.00 C ATOM 564 O ASN A 40 12.404 -13.363 -12.954 1.00 0.00 O ATOM 565 CB ASN A 40 10.707 -15.876 -13.507 1.00 0.00 C ATOM 566 CG ASN A 40 10.123 -17.249 -13.168 1.00 0.00 C ATOM 567 OD1 ASN A 40 10.485 -18.241 -13.769 1.00 0.00 O ATOM 568 ND2 ASN A 40 9.227 -17.349 -12.224 1.00 0.00 N ATOM 0 H ASN A 40 9.784 -13.405 -13.006 1.00 0.00 H new ATOM 0 HA ASN A 40 10.865 -15.692 -11.337 1.00 0.00 H new ATOM 0 HB2 ASN A 40 10.049 -15.351 -14.199 1.00 0.00 H new ATOM 0 HB3 ASN A 40 11.669 -15.992 -14.007 1.00 0.00 H new ATOM 0 HD21 ASN A 40 8.831 -18.260 -11.991 1.00 0.00 H new ATOM 0 HD22 ASN A 40 8.923 -16.516 -11.719 1.00 0.00 H new ATOM 575 N SER A 41 13.156 -14.761 -11.437 1.00 0.00 N ATOM 576 CA SER A 41 14.485 -14.084 -11.405 1.00 0.00 C ATOM 577 C SER A 41 15.253 -14.390 -12.693 1.00 0.00 C ATOM 578 O SER A 41 16.358 -14.894 -12.666 1.00 0.00 O ATOM 579 CB SER A 41 15.207 -14.677 -10.196 1.00 0.00 C ATOM 580 OG SER A 41 15.296 -16.087 -10.348 1.00 0.00 O ATOM 0 H SER A 41 13.060 -15.559 -10.809 1.00 0.00 H new ATOM 0 HA SER A 41 14.398 -13.000 -11.330 1.00 0.00 H new ATOM 0 HB2 SER A 41 16.204 -14.246 -10.106 1.00 0.00 H new ATOM 0 HB3 SER A 41 14.669 -14.432 -9.280 1.00 0.00 H new ATOM 0 HG SER A 41 15.760 -16.471 -9.575 1.00 0.00 H new ATOM 586 N GLY A 42 14.668 -14.094 -13.819 1.00 0.00 N ATOM 587 CA GLY A 42 15.350 -14.369 -15.114 1.00 0.00 C ATOM 588 C GLY A 42 14.302 -14.539 -16.212 1.00 0.00 C ATOM 589 O GLY A 42 13.492 -15.444 -16.174 1.00 0.00 O ATOM 0 H GLY A 42 13.743 -13.672 -13.899 1.00 0.00 H new ATOM 0 HA2 GLY A 42 16.025 -13.550 -15.364 1.00 0.00 H new ATOM 0 HA3 GLY A 42 15.958 -15.270 -15.033 1.00 0.00 H new ATOM 593 N VAL A 43 14.315 -13.685 -17.198 1.00 0.00 N ATOM 594 CA VAL A 43 13.319 -13.819 -18.300 1.00 0.00 C ATOM 595 C VAL A 43 13.637 -15.091 -19.076 1.00 0.00 C ATOM 596 O VAL A 43 14.579 -15.781 -18.757 1.00 0.00 O ATOM 597 CB VAL A 43 13.491 -12.591 -19.199 1.00 0.00 C ATOM 598 CG1 VAL A 43 12.191 -12.350 -19.968 1.00 0.00 C ATOM 599 CG2 VAL A 43 13.798 -11.353 -18.357 1.00 0.00 C ATOM 0 H VAL A 43 14.967 -12.906 -17.289 1.00 0.00 H new ATOM 0 HA VAL A 43 12.295 -13.878 -17.930 1.00 0.00 H new ATOM 0 HB VAL A 43 14.317 -12.771 -19.888 1.00 0.00 H new ATOM 0 HG11 VAL A 43 12.305 -11.477 -20.611 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.963 -13.223 -20.579 1.00 0.00 H new ATOM 0 HG13 VAL A 43 11.378 -12.178 -19.263 1.00 0.00 H new ATOM 0 HG21 VAL A 43 13.917 -10.489 -19.011 1.00 0.00 H new ATOM 0 HG22 VAL A 43 12.977 -11.172 -17.663 1.00 0.00 H new ATOM 0 HG23 VAL A 43 14.719 -11.514 -17.796 1.00 0.00 H new ATOM 609 N LEU A 44 12.883 -15.413 -20.088 1.00 0.00 N ATOM 610 CA LEU A 44 13.191 -16.651 -20.859 1.00 0.00 C ATOM 611 C LEU A 44 13.001 -16.414 -22.357 1.00 0.00 C ATOM 612 O LEU A 44 11.893 -16.390 -22.856 1.00 0.00 O ATOM 613 CB LEU A 44 12.199 -17.705 -20.354 1.00 0.00 C ATOM 614 CG LEU A 44 12.131 -18.869 -21.352 1.00 0.00 C ATOM 615 CD1 LEU A 44 12.526 -20.171 -20.657 1.00 0.00 C ATOM 616 CD2 LEU A 44 10.704 -18.995 -21.890 1.00 0.00 C ATOM 0 H LEU A 44 12.076 -14.881 -20.413 1.00 0.00 H new ATOM 0 HA LEU A 44 14.225 -16.966 -20.718 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.508 -18.070 -19.375 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.212 -17.260 -20.231 1.00 0.00 H new ATOM 0 HG LEU A 44 12.819 -18.677 -22.175 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.476 -20.994 -21.370 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.543 -20.085 -20.273 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.842 -20.365 -19.831 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.654 -19.821 -22.599 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.019 -19.184 -21.064 1.00 0.00 H new ATOM 0 HD23 LEU A 44 10.421 -18.069 -22.391 1.00 0.00 H new ATOM 628 N CYS A 45 14.072 -16.266 -23.085 1.00 0.00 N ATOM 629 CA CYS A 45 13.929 -16.063 -24.553 1.00 0.00 C ATOM 630 C CYS A 45 13.738 -17.416 -25.232 1.00 0.00 C ATOM 631 O CYS A 45 14.639 -18.234 -25.275 1.00 0.00 O ATOM 632 CB CYS A 45 15.227 -15.410 -25.020 1.00 0.00 C ATOM 633 SG CYS A 45 14.823 -13.923 -25.970 1.00 0.00 S ATOM 0 H CYS A 45 15.029 -16.276 -22.733 1.00 0.00 H new ATOM 0 HA CYS A 45 13.069 -15.440 -24.799 1.00 0.00 H new ATOM 0 HB2 CYS A 45 15.850 -15.153 -24.163 1.00 0.00 H new ATOM 0 HB3 CYS A 45 15.800 -16.106 -25.633 1.00 0.00 H new ATOM 638 N SER A 46 12.567 -17.662 -25.750 1.00 0.00 N ATOM 639 CA SER A 46 12.307 -18.969 -26.418 1.00 0.00 C ATOM 640 C SER A 46 11.740 -18.749 -27.825 1.00 0.00 C ATOM 641 O SER A 46 10.578 -18.434 -27.992 1.00 0.00 O ATOM 642 CB SER A 46 11.273 -19.663 -25.534 1.00 0.00 C ATOM 643 OG SER A 46 11.676 -21.007 -25.306 1.00 0.00 O ATOM 0 H SER A 46 11.779 -17.015 -25.740 1.00 0.00 H new ATOM 0 HA SER A 46 13.217 -19.559 -26.532 1.00 0.00 H new ATOM 0 HB2 SER A 46 11.175 -19.135 -24.586 1.00 0.00 H new ATOM 0 HB3 SER A 46 10.294 -19.641 -26.013 1.00 0.00 H new ATOM 0 HG SER A 46 11.015 -21.455 -24.737 1.00 0.00 H new ATOM 649 N GLY A 47 12.546 -18.916 -28.837 1.00 0.00 N ATOM 650 CA GLY A 47 12.045 -18.721 -30.228 1.00 0.00 C ATOM 651 C GLY A 47 12.206 -17.256 -30.636 1.00 0.00 C ATOM 652 O GLY A 47 11.381 -16.703 -31.337 1.00 0.00 O ATOM 0 H GLY A 47 13.529 -19.179 -28.762 1.00 0.00 H new ATOM 0 HA2 GLY A 47 12.596 -19.362 -30.916 1.00 0.00 H new ATOM 0 HA3 GLY A 47 10.997 -19.012 -30.291 1.00 0.00 H new ATOM 656 N GLY A 48 13.260 -16.620 -30.207 1.00 0.00 N ATOM 657 CA GLY A 48 13.466 -15.192 -30.578 1.00 0.00 C ATOM 658 C GLY A 48 12.357 -14.336 -29.960 1.00 0.00 C ATOM 659 O GLY A 48 11.956 -13.331 -30.513 1.00 0.00 O ATOM 0 H GLY A 48 13.986 -17.026 -29.617 1.00 0.00 H new ATOM 0 HA2 GLY A 48 14.440 -14.852 -30.227 1.00 0.00 H new ATOM 0 HA3 GLY A 48 13.462 -15.083 -31.663 1.00 0.00 H new ATOM 663 N GLU A 49 11.855 -14.726 -28.819 1.00 0.00 N ATOM 664 CA GLU A 49 10.769 -13.933 -28.170 1.00 0.00 C ATOM 665 C GLU A 49 10.874 -14.025 -26.646 1.00 0.00 C ATOM 666 O GLU A 49 10.536 -15.030 -26.053 1.00 0.00 O ATOM 667 CB GLU A 49 9.466 -14.577 -28.646 1.00 0.00 C ATOM 668 CG GLU A 49 9.286 -14.330 -30.145 1.00 0.00 C ATOM 669 CD GLU A 49 7.817 -14.531 -30.521 1.00 0.00 C ATOM 670 OE1 GLU A 49 7.392 -15.673 -30.577 1.00 0.00 O ATOM 671 OE2 GLU A 49 7.143 -13.540 -30.745 1.00 0.00 O ATOM 0 H GLU A 49 12.149 -15.558 -28.308 1.00 0.00 H new ATOM 0 HA GLU A 49 10.827 -12.876 -28.431 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.483 -15.648 -28.444 1.00 0.00 H new ATOM 0 HB3 GLU A 49 8.622 -14.162 -28.095 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.602 -13.318 -30.398 1.00 0.00 H new ATOM 0 HG3 GLU A 49 9.915 -15.013 -30.715 1.00 0.00 H new ATOM 678 N TRP A 50 11.329 -12.984 -26.005 1.00 0.00 N ATOM 679 CA TRP A 50 11.437 -13.023 -24.519 1.00 0.00 C ATOM 680 C TRP A 50 10.058 -13.298 -23.913 1.00 0.00 C ATOM 681 O TRP A 50 9.057 -12.789 -24.376 1.00 0.00 O ATOM 682 CB TRP A 50 11.929 -11.629 -24.118 1.00 0.00 C ATOM 683 CG TRP A 50 13.402 -11.519 -24.358 1.00 0.00 C ATOM 684 CD1 TRP A 50 13.979 -10.796 -25.348 1.00 0.00 C ATOM 685 CD2 TRP A 50 14.491 -12.130 -23.610 1.00 0.00 C ATOM 686 NE1 TRP A 50 15.354 -10.929 -25.255 1.00 0.00 N ATOM 687 CE2 TRP A 50 15.719 -11.743 -24.199 1.00 0.00 C ATOM 688 CE3 TRP A 50 14.530 -12.978 -22.491 1.00 0.00 C ATOM 689 CZ2 TRP A 50 16.943 -12.182 -23.692 1.00 0.00 C ATOM 690 CZ3 TRP A 50 15.757 -13.419 -21.977 1.00 0.00 C ATOM 691 CH2 TRP A 50 16.959 -13.024 -22.577 1.00 0.00 C ATOM 0 H TRP A 50 11.629 -12.113 -26.442 1.00 0.00 H new ATOM 0 HA TRP A 50 12.111 -13.805 -24.168 1.00 0.00 H new ATOM 0 HB2 TRP A 50 11.401 -10.868 -24.693 1.00 0.00 H new ATOM 0 HB3 TRP A 50 11.708 -11.445 -23.067 1.00 0.00 H new ATOM 0 HD1 TRP A 50 13.453 -10.212 -26.088 1.00 0.00 H new ATOM 0 HE1 TRP A 50 16.017 -10.481 -25.888 1.00 0.00 H new ATOM 0 HE3 TRP A 50 13.608 -13.292 -22.024 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 17.868 -11.874 -24.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 15.776 -14.067 -21.113 1.00 0.00 H new ATOM 0 HH2 TRP A 50 17.900 -13.371 -22.177 1.00 0.00 H new ATOM 702 N SER A 51 9.989 -14.104 -22.888 1.00 0.00 N ATOM 703 CA SER A 51 8.661 -14.404 -22.277 1.00 0.00 C ATOM 704 C SER A 51 8.773 -14.538 -20.754 1.00 0.00 C ATOM 705 O SER A 51 9.852 -14.578 -20.196 1.00 0.00 O ATOM 706 CB SER A 51 8.237 -15.734 -22.898 1.00 0.00 C ATOM 707 OG SER A 51 8.322 -15.639 -24.314 1.00 0.00 O ATOM 0 H SER A 51 10.787 -14.564 -22.450 1.00 0.00 H new ATOM 0 HA SER A 51 7.940 -13.608 -22.464 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.878 -16.538 -22.537 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.218 -15.980 -22.599 1.00 0.00 H new ATOM 0 HG SER A 51 8.052 -16.491 -24.716 1.00 0.00 H new ATOM 713 N ASP A 52 7.654 -14.613 -20.084 1.00 0.00 N ATOM 714 CA ASP A 52 7.660 -14.751 -18.597 1.00 0.00 C ATOM 715 C ASP A 52 8.509 -13.655 -17.951 1.00 0.00 C ATOM 716 O ASP A 52 9.528 -13.924 -17.345 1.00 0.00 O ATOM 717 CB ASP A 52 8.255 -16.133 -18.324 1.00 0.00 C ATOM 718 CG ASP A 52 7.850 -16.596 -16.923 1.00 0.00 C ATOM 719 OD1 ASP A 52 7.573 -15.743 -16.096 1.00 0.00 O ATOM 720 OD2 ASP A 52 7.825 -17.795 -16.700 1.00 0.00 O ATOM 0 H ASP A 52 6.726 -14.584 -20.507 1.00 0.00 H new ATOM 0 HA ASP A 52 6.659 -14.650 -18.177 1.00 0.00 H new ATOM 0 HB2 ASP A 52 7.903 -16.846 -19.070 1.00 0.00 H new ATOM 0 HB3 ASP A 52 9.341 -16.096 -18.406 1.00 0.00 H new ATOM 725 N PRO A 53 8.041 -12.451 -18.101 1.00 0.00 N ATOM 726 CA PRO A 53 8.724 -11.273 -17.534 1.00 0.00 C ATOM 727 C PRO A 53 8.190 -10.973 -16.128 1.00 0.00 C ATOM 728 O PRO A 53 7.001 -11.052 -15.890 1.00 0.00 O ATOM 729 CB PRO A 53 8.328 -10.161 -18.499 1.00 0.00 C ATOM 730 CG PRO A 53 7.025 -10.601 -19.116 1.00 0.00 C ATOM 731 CD PRO A 53 6.833 -12.074 -18.823 1.00 0.00 C ATOM 0 HA PRO A 53 9.802 -11.400 -17.433 1.00 0.00 H new ATOM 0 HB2 PRO A 53 8.213 -9.212 -17.976 1.00 0.00 H new ATOM 0 HB3 PRO A 53 9.093 -10.014 -19.262 1.00 0.00 H new ATOM 0 HG2 PRO A 53 6.197 -10.022 -18.708 1.00 0.00 H new ATOM 0 HG3 PRO A 53 7.036 -10.426 -20.192 1.00 0.00 H new ATOM 0 HD2 PRO A 53 5.939 -12.248 -18.224 1.00 0.00 H new ATOM 0 HD3 PRO A 53 6.720 -12.652 -19.740 1.00 0.00 H new ATOM 739 N PRO A 54 9.087 -10.627 -15.244 1.00 0.00 N ATOM 740 CA PRO A 54 8.697 -10.299 -13.859 1.00 0.00 C ATOM 741 C PRO A 54 8.240 -8.842 -13.774 1.00 0.00 C ATOM 742 O PRO A 54 8.136 -8.154 -14.770 1.00 0.00 O ATOM 743 CB PRO A 54 9.978 -10.528 -13.067 1.00 0.00 C ATOM 744 CG PRO A 54 11.100 -10.358 -14.051 1.00 0.00 C ATOM 745 CD PRO A 54 10.533 -10.513 -15.446 1.00 0.00 C ATOM 0 HA PRO A 54 7.866 -10.897 -13.485 1.00 0.00 H new ATOM 0 HB2 PRO A 54 10.064 -9.815 -12.247 1.00 0.00 H new ATOM 0 HB3 PRO A 54 9.992 -11.524 -12.625 1.00 0.00 H new ATOM 0 HG2 PRO A 54 11.562 -9.378 -13.935 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.878 -11.100 -13.872 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.780 -9.656 -16.072 1.00 0.00 H new ATOM 0 HD3 PRO A 54 10.935 -11.396 -15.942 1.00 0.00 H new ATOM 753 N THR A 55 7.945 -8.377 -12.596 1.00 0.00 N ATOM 754 CA THR A 55 7.467 -6.972 -12.447 1.00 0.00 C ATOM 755 C THR A 55 8.328 -6.188 -11.460 1.00 0.00 C ATOM 756 O THR A 55 8.760 -6.701 -10.449 1.00 0.00 O ATOM 757 CB THR A 55 6.052 -7.106 -11.888 1.00 0.00 C ATOM 758 OG1 THR A 55 6.048 -8.097 -10.875 1.00 0.00 O ATOM 759 CG2 THR A 55 5.095 -7.519 -13.001 1.00 0.00 C ATOM 0 H THR A 55 8.013 -8.907 -11.727 1.00 0.00 H new ATOM 0 HA THR A 55 7.511 -6.436 -13.395 1.00 0.00 H new ATOM 0 HB THR A 55 5.731 -6.150 -11.475 1.00 0.00 H new ATOM 0 HG1 THR A 55 5.615 -8.909 -11.213 1.00 0.00 H new ATOM 0 HG21 THR A 55 4.087 -7.613 -12.598 1.00 0.00 H new ATOM 0 HG22 THR A 55 5.102 -6.763 -13.786 1.00 0.00 H new ATOM 0 HG23 THR A 55 5.411 -8.476 -13.416 1.00 0.00 H new ATOM 767 N CYS A 56 8.543 -4.932 -11.732 1.00 0.00 N ATOM 768 CA CYS A 56 9.337 -4.092 -10.797 1.00 0.00 C ATOM 769 C CYS A 56 8.391 -3.134 -10.087 1.00 0.00 C ATOM 770 O CYS A 56 8.247 -1.985 -10.458 1.00 0.00 O ATOM 771 CB CYS A 56 10.336 -3.337 -11.674 1.00 0.00 C ATOM 772 SG CYS A 56 11.510 -4.512 -12.394 1.00 0.00 S ATOM 0 H CYS A 56 8.202 -4.451 -12.564 1.00 0.00 H new ATOM 0 HA CYS A 56 9.858 -4.671 -10.034 1.00 0.00 H new ATOM 0 HB2 CYS A 56 9.811 -2.800 -12.464 1.00 0.00 H new ATOM 0 HB3 CYS A 56 10.867 -2.592 -11.081 1.00 0.00 H new ATOM 777 N GLN A 57 7.721 -3.617 -9.083 1.00 0.00 N ATOM 778 CA GLN A 57 6.747 -2.763 -8.351 1.00 0.00 C ATOM 779 C GLN A 57 7.268 -2.455 -6.944 1.00 0.00 C ATOM 780 O GLN A 57 8.455 -2.399 -6.713 1.00 0.00 O ATOM 781 CB GLN A 57 5.438 -3.577 -8.279 1.00 0.00 C ATOM 782 CG GLN A 57 5.543 -4.888 -9.075 1.00 0.00 C ATOM 783 CD GLN A 57 4.141 -5.423 -9.375 1.00 0.00 C ATOM 784 OE1 GLN A 57 3.167 -4.705 -9.264 1.00 0.00 O ATOM 785 NE2 GLN A 57 3.997 -6.663 -9.755 1.00 0.00 N ATOM 0 H GLN A 57 7.806 -4.572 -8.735 1.00 0.00 H new ATOM 0 HA GLN A 57 6.592 -1.808 -8.853 1.00 0.00 H new ATOM 0 HB2 GLN A 57 5.204 -3.800 -7.238 1.00 0.00 H new ATOM 0 HB3 GLN A 57 4.615 -2.979 -8.669 1.00 0.00 H new ATOM 0 HG2 GLN A 57 6.084 -4.717 -10.006 1.00 0.00 H new ATOM 0 HG3 GLN A 57 6.110 -5.625 -8.507 1.00 0.00 H new ATOM 0 HE21 GLN A 57 4.814 -7.266 -9.848 1.00 0.00 H new ATOM 0 HE22 GLN A 57 3.067 -7.029 -9.959 1.00 0.00 H new ATOM 794 N ILE A 58 6.388 -2.260 -6.002 1.00 0.00 N ATOM 795 CA ILE A 58 6.833 -1.972 -4.605 1.00 0.00 C ATOM 796 C ILE A 58 6.125 -2.949 -3.665 1.00 0.00 C ATOM 797 O ILE A 58 4.913 -3.003 -3.615 1.00 0.00 O ATOM 798 CB ILE A 58 6.428 -0.519 -4.289 1.00 0.00 C ATOM 799 CG1 ILE A 58 6.008 0.225 -5.565 1.00 0.00 C ATOM 800 CG2 ILE A 58 7.621 0.206 -3.663 1.00 0.00 C ATOM 801 CD1 ILE A 58 4.561 -0.128 -5.908 1.00 0.00 C ATOM 0 H ILE A 58 5.377 -2.287 -6.137 1.00 0.00 H new ATOM 0 HA ILE A 58 7.910 -2.089 -4.484 1.00 0.00 H new ATOM 0 HB ILE A 58 5.583 -0.536 -3.600 1.00 0.00 H new ATOM 0 HG12 ILE A 58 6.107 1.301 -5.421 1.00 0.00 H new ATOM 0 HG13 ILE A 58 6.665 -0.047 -6.391 1.00 0.00 H new ATOM 0 HG21 ILE A 58 7.343 1.235 -3.436 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.914 -0.302 -2.744 1.00 0.00 H new ATOM 0 HG23 ILE A 58 8.457 0.202 -4.362 1.00 0.00 H new ATOM 0 HD11 ILE A 58 4.263 0.400 -6.814 1.00 0.00 H new ATOM 0 HD12 ILE A 58 4.477 -1.203 -6.070 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.910 0.167 -5.085 1.00 0.00 H new ATOM 813 N VAL A 59 6.864 -3.748 -2.945 1.00 0.00 N ATOM 814 CA VAL A 59 6.211 -4.744 -2.046 1.00 0.00 C ATOM 815 C VAL A 59 6.503 -4.461 -0.584 1.00 0.00 C ATOM 816 O VAL A 59 6.923 -5.328 0.151 1.00 0.00 O ATOM 817 CB VAL A 59 6.834 -6.072 -2.430 1.00 0.00 C ATOM 818 CG1 VAL A 59 6.591 -6.354 -3.914 1.00 0.00 C ATOM 819 CG2 VAL A 59 8.329 -5.996 -2.149 1.00 0.00 C ATOM 0 H VAL A 59 7.884 -3.756 -2.939 1.00 0.00 H new ATOM 0 HA VAL A 59 5.127 -4.721 -2.158 1.00 0.00 H new ATOM 0 HB VAL A 59 6.386 -6.879 -1.851 1.00 0.00 H new ATOM 0 HG11 VAL A 59 7.042 -7.310 -4.181 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.519 -6.392 -4.106 1.00 0.00 H new ATOM 0 HG13 VAL A 59 7.039 -5.561 -4.513 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.798 -6.942 -2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 59 8.770 -5.192 -2.738 1.00 0.00 H new ATOM 0 HG23 VAL A 59 8.490 -5.800 -1.089 1.00 0.00 H new ATOM 829 N LYS A 60 6.263 -3.282 -0.139 1.00 0.00 N ATOM 830 CA LYS A 60 6.523 -3.006 1.296 1.00 0.00 C ATOM 831 C LYS A 60 5.460 -3.731 2.123 1.00 0.00 C ATOM 832 O LYS A 60 4.284 -3.642 1.842 1.00 0.00 O ATOM 833 CB LYS A 60 6.407 -1.491 1.457 1.00 0.00 C ATOM 834 CG LYS A 60 7.291 -0.795 0.421 1.00 0.00 C ATOM 835 CD LYS A 60 6.712 0.585 0.100 1.00 0.00 C ATOM 836 CE LYS A 60 7.671 1.670 0.595 1.00 0.00 C ATOM 837 NZ LYS A 60 7.220 2.919 -0.079 1.00 0.00 N ATOM 0 H LYS A 60 5.904 -2.501 -0.687 1.00 0.00 H new ATOM 0 HA LYS A 60 7.503 -3.349 1.628 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.370 -1.180 1.332 1.00 0.00 H new ATOM 0 HB3 LYS A 60 6.709 -1.198 2.463 1.00 0.00 H new ATOM 0 HG2 LYS A 60 8.307 -0.695 0.803 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.349 -1.397 -0.486 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.557 0.685 -0.974 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.738 0.702 0.575 1.00 0.00 H new ATOM 0 HE2 LYS A 60 7.629 1.769 1.680 1.00 0.00 H new ATOM 0 HE3 LYS A 60 8.703 1.433 0.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 7.830 3.710 0.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 7.278 2.797 -1.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.237 3.124 0.191 1.00 0.00 H new ATOM 851 N CYS A 61 5.857 -4.477 3.115 1.00 0.00 N ATOM 852 CA CYS A 61 4.851 -5.234 3.917 1.00 0.00 C ATOM 853 C CYS A 61 4.423 -4.480 5.173 1.00 0.00 C ATOM 854 O CYS A 61 4.988 -3.464 5.526 1.00 0.00 O ATOM 855 CB CYS A 61 5.561 -6.521 4.309 1.00 0.00 C ATOM 856 SG CYS A 61 5.376 -7.732 2.986 1.00 0.00 S ATOM 0 H CYS A 61 6.827 -4.596 3.406 1.00 0.00 H new ATOM 0 HA CYS A 61 3.940 -5.398 3.342 1.00 0.00 H new ATOM 0 HB2 CYS A 61 6.617 -6.325 4.493 1.00 0.00 H new ATOM 0 HB3 CYS A 61 5.143 -6.912 5.237 1.00 0.00 H new ATOM 861 N PRO A 62 3.430 -5.038 5.810 1.00 0.00 N ATOM 862 CA PRO A 62 2.887 -4.465 7.056 1.00 0.00 C ATOM 863 C PRO A 62 3.700 -4.942 8.256 1.00 0.00 C ATOM 864 O PRO A 62 4.368 -4.180 8.926 1.00 0.00 O ATOM 865 CB PRO A 62 1.475 -5.043 7.120 1.00 0.00 C ATOM 866 CG PRO A 62 1.508 -6.308 6.316 1.00 0.00 C ATOM 867 CD PRO A 62 2.719 -6.261 5.417 1.00 0.00 C ATOM 0 HA PRO A 62 2.911 -3.375 7.073 1.00 0.00 H new ATOM 0 HB2 PRO A 62 1.182 -5.244 8.151 1.00 0.00 H new ATOM 0 HB3 PRO A 62 0.747 -4.341 6.713 1.00 0.00 H new ATOM 0 HG2 PRO A 62 1.556 -7.176 6.974 1.00 0.00 H new ATOM 0 HG3 PRO A 62 0.598 -6.407 5.724 1.00 0.00 H new ATOM 0 HD2 PRO A 62 3.345 -7.143 5.551 1.00 0.00 H new ATOM 0 HD3 PRO A 62 2.431 -6.231 4.366 1.00 0.00 H new ATOM 875 N HIS A 63 3.624 -6.210 8.527 1.00 0.00 N ATOM 876 CA HIS A 63 4.352 -6.802 9.678 1.00 0.00 C ATOM 877 C HIS A 63 3.823 -8.214 9.896 1.00 0.00 C ATOM 878 O HIS A 63 2.627 -8.420 9.963 1.00 0.00 O ATOM 879 CB HIS A 63 4.002 -5.918 10.870 1.00 0.00 C ATOM 880 CG HIS A 63 5.250 -5.311 11.445 1.00 0.00 C ATOM 881 ND1 HIS A 63 5.218 -4.175 12.237 1.00 0.00 N ATOM 882 CD2 HIS A 63 6.570 -5.677 11.367 1.00 0.00 C ATOM 883 CE1 HIS A 63 6.481 -3.900 12.603 1.00 0.00 C ATOM 884 NE2 HIS A 63 7.347 -4.785 12.100 1.00 0.00 N ATOM 0 H HIS A 63 3.074 -6.877 7.986 1.00 0.00 H new ATOM 0 HA HIS A 63 5.430 -6.854 9.527 1.00 0.00 H new ATOM 0 HB2 HIS A 63 3.315 -5.131 10.560 1.00 0.00 H new ATOM 0 HB3 HIS A 63 3.490 -6.506 11.631 1.00 0.00 H new ATOM 0 HD2 HIS A 63 6.948 -6.528 10.820 1.00 0.00 H new ATOM 0 HE1 HIS A 63 6.762 -3.065 13.228 1.00 0.00 H new ATOM 0 HE2 HIS A 63 8.359 -4.803 12.226 1.00 0.00 H new ATOM 892 N PRO A 64 4.718 -9.148 9.982 1.00 0.00 N ATOM 893 CA PRO A 64 4.304 -10.549 10.173 1.00 0.00 C ATOM 894 C PRO A 64 3.827 -10.758 11.608 1.00 0.00 C ATOM 895 O PRO A 64 4.423 -11.480 12.380 1.00 0.00 O ATOM 896 CB PRO A 64 5.571 -11.334 9.877 1.00 0.00 C ATOM 897 CG PRO A 64 6.698 -10.389 10.143 1.00 0.00 C ATOM 898 CD PRO A 64 6.174 -8.996 9.917 1.00 0.00 C ATOM 0 HA PRO A 64 3.474 -10.857 9.536 1.00 0.00 H new ATOM 0 HB2 PRO A 64 5.642 -12.218 10.511 1.00 0.00 H new ATOM 0 HB3 PRO A 64 5.585 -11.681 8.844 1.00 0.00 H new ATOM 0 HG2 PRO A 64 7.062 -10.502 11.164 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.538 -10.596 9.480 1.00 0.00 H new ATOM 0 HD2 PRO A 64 6.537 -8.305 10.678 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.491 -8.602 8.951 1.00 0.00 H new ATOM 906 N THR A 65 2.751 -10.117 11.962 1.00 0.00 N ATOM 907 CA THR A 65 2.215 -10.251 13.345 1.00 0.00 C ATOM 908 C THR A 65 1.311 -11.476 13.450 1.00 0.00 C ATOM 909 O THR A 65 0.972 -12.095 12.463 1.00 0.00 O ATOM 910 CB THR A 65 1.411 -8.974 13.578 1.00 0.00 C ATOM 911 OG1 THR A 65 1.102 -8.375 12.324 1.00 0.00 O ATOM 912 CG2 THR A 65 2.235 -8.009 14.428 1.00 0.00 C ATOM 0 H THR A 65 2.215 -9.502 11.350 1.00 0.00 H new ATOM 0 HA THR A 65 3.007 -10.380 14.083 1.00 0.00 H new ATOM 0 HB THR A 65 0.483 -9.210 14.099 1.00 0.00 H new ATOM 0 HG1 THR A 65 0.585 -7.556 12.471 1.00 0.00 H new ATOM 0 HG21 THR A 65 1.665 -7.095 14.597 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.467 -8.475 15.386 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.162 -7.767 13.908 1.00 0.00 H new ATOM 920 N ILE A 66 0.919 -11.838 14.641 1.00 0.00 N ATOM 921 CA ILE A 66 0.037 -13.031 14.794 1.00 0.00 C ATOM 922 C ILE A 66 -0.508 -13.110 16.229 1.00 0.00 C ATOM 923 O ILE A 66 -0.027 -12.449 17.128 1.00 0.00 O ATOM 924 CB ILE A 66 0.906 -14.263 14.415 1.00 0.00 C ATOM 925 CG1 ILE A 66 0.738 -15.400 15.427 1.00 0.00 C ATOM 926 CG2 ILE A 66 2.387 -13.892 14.334 1.00 0.00 C ATOM 927 CD1 ILE A 66 1.273 -16.688 14.803 1.00 0.00 C ATOM 0 H ILE A 66 1.169 -11.364 15.509 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.839 -12.983 14.147 1.00 0.00 H new ATOM 0 HB ILE A 66 0.562 -14.599 13.437 1.00 0.00 H new ATOM 0 HG12 ILE A 66 1.278 -15.172 16.346 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -0.312 -15.517 15.695 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.969 -14.774 14.067 1.00 0.00 H new ATOM 0 HG22 ILE A 66 2.528 -13.121 13.576 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.721 -13.516 15.301 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.161 -17.509 15.511 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.713 -16.913 13.895 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.327 -16.562 14.557 1.00 0.00 H new ATOM 939 N SER A 67 -1.530 -13.899 16.432 1.00 0.00 N ATOM 940 CA SER A 67 -2.144 -14.018 17.787 1.00 0.00 C ATOM 941 C SER A 67 -1.190 -14.672 18.794 1.00 0.00 C ATOM 942 O SER A 67 -1.365 -15.811 19.166 1.00 0.00 O ATOM 943 CB SER A 67 -3.376 -14.902 17.578 1.00 0.00 C ATOM 944 OG SER A 67 -4.310 -14.234 16.734 1.00 0.00 O ATOM 0 H SER A 67 -1.969 -14.471 15.711 1.00 0.00 H new ATOM 0 HA SER A 67 -2.386 -13.038 18.198 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.082 -15.852 17.131 1.00 0.00 H new ATOM 0 HB3 SER A 67 -3.838 -15.131 18.538 1.00 0.00 H new ATOM 0 HG SER A 67 -5.199 -14.630 16.851 1.00 0.00 H new ATOM 950 N ASN A 68 -0.201 -13.950 19.257 1.00 0.00 N ATOM 951 CA ASN A 68 0.757 -14.510 20.273 1.00 0.00 C ATOM 952 C ASN A 68 1.774 -15.478 19.650 1.00 0.00 C ATOM 953 O ASN A 68 2.850 -15.670 20.182 1.00 0.00 O ATOM 954 CB ASN A 68 -0.111 -15.246 21.296 1.00 0.00 C ATOM 955 CG ASN A 68 0.275 -14.801 22.708 1.00 0.00 C ATOM 956 OD1 ASN A 68 1.207 -14.043 22.885 1.00 0.00 O ATOM 957 ND2 ASN A 68 -0.408 -15.244 23.729 1.00 0.00 N ATOM 0 H ASN A 68 -0.010 -12.988 18.975 1.00 0.00 H new ATOM 0 HA ASN A 68 1.345 -13.708 20.720 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -1.165 -15.036 21.113 1.00 0.00 H new ATOM 0 HB3 ASN A 68 0.022 -16.323 21.194 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -0.158 -14.953 24.674 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -1.191 -15.881 23.581 1.00 0.00 H new ATOM 964 N GLY A 69 1.463 -16.092 18.543 1.00 0.00 N ATOM 965 CA GLY A 69 2.439 -17.039 17.926 1.00 0.00 C ATOM 966 C GLY A 69 3.402 -16.267 17.024 1.00 0.00 C ATOM 967 O GLY A 69 3.765 -16.715 15.955 1.00 0.00 O ATOM 0 H GLY A 69 0.582 -15.982 18.040 1.00 0.00 H new ATOM 0 HA2 GLY A 69 2.994 -17.563 18.704 1.00 0.00 H new ATOM 0 HA3 GLY A 69 1.910 -17.796 17.347 1.00 0.00 H new ATOM 971 N TYR A 70 3.798 -15.099 17.440 1.00 0.00 N ATOM 972 CA TYR A 70 4.714 -14.273 16.610 1.00 0.00 C ATOM 973 C TYR A 70 5.812 -15.083 15.967 1.00 0.00 C ATOM 974 O TYR A 70 6.176 -16.161 16.393 1.00 0.00 O ATOM 975 CB TYR A 70 5.359 -13.257 17.539 1.00 0.00 C ATOM 976 CG TYR A 70 5.798 -13.932 18.819 1.00 0.00 C ATOM 977 CD1 TYR A 70 6.998 -14.655 18.841 1.00 0.00 C ATOM 978 CD2 TYR A 70 5.022 -13.833 19.980 1.00 0.00 C ATOM 979 CE1 TYR A 70 7.422 -15.278 20.018 1.00 0.00 C ATOM 980 CE2 TYR A 70 5.449 -14.457 21.160 1.00 0.00 C ATOM 981 CZ TYR A 70 6.648 -15.178 21.179 1.00 0.00 C ATOM 982 OH TYR A 70 7.067 -15.791 22.341 1.00 0.00 O ATOM 0 H TYR A 70 3.524 -14.678 18.327 1.00 0.00 H new ATOM 0 HA TYR A 70 4.135 -13.815 15.808 1.00 0.00 H new ATOM 0 HB2 TYR A 70 6.217 -12.796 17.048 1.00 0.00 H new ATOM 0 HB3 TYR A 70 4.653 -12.458 17.763 1.00 0.00 H new ATOM 0 HD1 TYR A 70 7.597 -14.731 17.946 1.00 0.00 H new ATOM 0 HD2 TYR A 70 4.096 -13.277 19.966 1.00 0.00 H new ATOM 0 HE1 TYR A 70 8.346 -15.836 20.031 1.00 0.00 H new ATOM 0 HE2 TYR A 70 4.851 -14.381 22.056 1.00 0.00 H new ATOM 0 HH TYR A 70 6.415 -15.623 23.053 1.00 0.00 H new ATOM 992 N LEU A 71 6.355 -14.511 14.948 1.00 0.00 N ATOM 993 CA LEU A 71 7.480 -15.148 14.214 1.00 0.00 C ATOM 994 C LEU A 71 8.481 -15.741 15.215 1.00 0.00 C ATOM 995 O LEU A 71 8.464 -16.922 15.500 1.00 0.00 O ATOM 996 CB LEU A 71 8.125 -14.021 13.388 1.00 0.00 C ATOM 997 CG LEU A 71 7.994 -12.665 14.101 1.00 0.00 C ATOM 998 CD1 LEU A 71 9.360 -12.021 14.247 1.00 0.00 C ATOM 999 CD2 LEU A 71 7.092 -11.755 13.269 1.00 0.00 C ATOM 0 H LEU A 71 6.065 -13.606 14.577 1.00 0.00 H new ATOM 0 HA LEU A 71 7.148 -15.964 13.572 1.00 0.00 H new ATOM 0 HB2 LEU A 71 9.178 -14.246 13.220 1.00 0.00 H new ATOM 0 HB3 LEU A 71 7.650 -13.967 12.408 1.00 0.00 H new ATOM 0 HG LEU A 71 7.565 -12.815 15.092 1.00 0.00 H new ATOM 0 HD11 LEU A 71 9.257 -11.061 14.753 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.009 -12.672 14.833 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.797 -11.866 13.260 1.00 0.00 H new ATOM 0 HD21 LEU A 71 6.992 -10.790 13.765 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.531 -11.612 12.282 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.109 -12.214 13.165 1.00 0.00 H new ATOM 1011 N SER A 72 9.346 -14.918 15.752 1.00 0.00 N ATOM 1012 CA SER A 72 10.362 -15.394 16.747 1.00 0.00 C ATOM 1013 C SER A 72 11.529 -16.082 16.032 1.00 0.00 C ATOM 1014 O SER A 72 12.332 -16.756 16.645 1.00 0.00 O ATOM 1015 CB SER A 72 9.634 -16.382 17.666 1.00 0.00 C ATOM 1016 OG SER A 72 10.088 -17.701 17.392 1.00 0.00 O ATOM 0 H SER A 72 9.394 -13.921 15.541 1.00 0.00 H new ATOM 0 HA SER A 72 10.780 -14.563 17.315 1.00 0.00 H new ATOM 0 HB2 SER A 72 9.821 -16.130 18.710 1.00 0.00 H new ATOM 0 HB3 SER A 72 8.557 -16.316 17.510 1.00 0.00 H new ATOM 0 HG SER A 72 9.847 -17.946 16.474 1.00 0.00 H new ATOM 1022 N SER A 73 11.631 -15.919 14.740 1.00 0.00 N ATOM 1023 CA SER A 73 12.751 -16.569 13.998 1.00 0.00 C ATOM 1024 C SER A 73 13.029 -15.826 12.687 1.00 0.00 C ATOM 1025 O SER A 73 13.057 -16.414 11.624 1.00 0.00 O ATOM 1026 CB SER A 73 12.263 -17.990 13.717 1.00 0.00 C ATOM 1027 OG SER A 73 12.829 -18.879 14.671 1.00 0.00 O ATOM 0 H SER A 73 10.991 -15.367 14.169 1.00 0.00 H new ATOM 0 HA SER A 73 13.681 -16.559 14.566 1.00 0.00 H new ATOM 0 HB2 SER A 73 11.175 -18.030 13.767 1.00 0.00 H new ATOM 0 HB3 SER A 73 12.547 -18.292 12.709 1.00 0.00 H new ATOM 0 HG SER A 73 12.815 -18.460 15.557 1.00 0.00 H new ATOM 1033 N GLY A 74 13.239 -14.539 12.753 1.00 0.00 N ATOM 1034 CA GLY A 74 13.518 -13.765 11.510 1.00 0.00 C ATOM 1035 C GLY A 74 12.481 -12.650 11.358 1.00 0.00 C ATOM 1036 O GLY A 74 11.311 -12.902 11.149 1.00 0.00 O ATOM 0 H GLY A 74 13.229 -13.991 13.613 1.00 0.00 H new ATOM 0 HA2 GLY A 74 14.521 -13.340 11.551 1.00 0.00 H new ATOM 0 HA3 GLY A 74 13.487 -14.425 10.643 1.00 0.00 H new ATOM 1040 N PHE A 75 12.900 -11.419 11.464 1.00 0.00 N ATOM 1041 CA PHE A 75 11.935 -10.291 11.329 1.00 0.00 C ATOM 1042 C PHE A 75 12.684 -8.956 11.298 1.00 0.00 C ATOM 1043 O PHE A 75 13.820 -8.858 11.717 1.00 0.00 O ATOM 1044 CB PHE A 75 11.036 -10.411 12.567 1.00 0.00 C ATOM 1045 CG PHE A 75 10.452 -9.067 12.957 1.00 0.00 C ATOM 1046 CD1 PHE A 75 11.271 -8.078 13.519 1.00 0.00 C ATOM 1047 CD2 PHE A 75 9.087 -8.818 12.769 1.00 0.00 C ATOM 1048 CE1 PHE A 75 10.725 -6.843 13.888 1.00 0.00 C ATOM 1049 CE2 PHE A 75 8.541 -7.581 13.139 1.00 0.00 C ATOM 1050 CZ PHE A 75 9.361 -6.594 13.697 1.00 0.00 C ATOM 0 H PHE A 75 13.867 -11.146 11.638 1.00 0.00 H new ATOM 0 HA PHE A 75 11.356 -10.330 10.407 1.00 0.00 H new ATOM 0 HB2 PHE A 75 10.229 -11.116 12.366 1.00 0.00 H new ATOM 0 HB3 PHE A 75 11.612 -10.815 13.400 1.00 0.00 H new ATOM 0 HD1 PHE A 75 12.324 -8.269 13.667 1.00 0.00 H new ATOM 0 HD2 PHE A 75 8.454 -9.580 12.338 1.00 0.00 H new ATOM 0 HE1 PHE A 75 11.357 -6.081 14.321 1.00 0.00 H new ATOM 0 HE2 PHE A 75 7.488 -7.390 12.993 1.00 0.00 H new ATOM 0 HZ PHE A 75 8.941 -5.640 13.980 1.00 0.00 H new ATOM 1060 N LYS A 76 12.051 -7.930 10.802 1.00 0.00 N ATOM 1061 CA LYS A 76 12.718 -6.599 10.738 1.00 0.00 C ATOM 1062 C LYS A 76 11.670 -5.487 10.795 1.00 0.00 C ATOM 1063 O LYS A 76 10.486 -5.733 10.686 1.00 0.00 O ATOM 1064 CB LYS A 76 13.439 -6.588 9.390 1.00 0.00 C ATOM 1065 CG LYS A 76 14.662 -5.675 9.472 1.00 0.00 C ATOM 1066 CD LYS A 76 14.571 -4.600 8.388 1.00 0.00 C ATOM 1067 CE LYS A 76 15.264 -3.326 8.875 1.00 0.00 C ATOM 1068 NZ LYS A 76 16.669 -3.735 9.150 1.00 0.00 N ATOM 0 H LYS A 76 11.099 -7.955 10.437 1.00 0.00 H new ATOM 0 HA LYS A 76 13.404 -6.434 11.569 1.00 0.00 H new ATOM 0 HB2 LYS A 76 13.744 -7.599 9.121 1.00 0.00 H new ATOM 0 HB3 LYS A 76 12.764 -6.240 8.608 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.716 -5.210 10.456 1.00 0.00 H new ATOM 0 HG3 LYS A 76 15.574 -6.259 9.344 1.00 0.00 H new ATOM 0 HD2 LYS A 76 15.040 -4.954 7.470 1.00 0.00 H new ATOM 0 HD3 LYS A 76 13.527 -4.392 8.153 1.00 0.00 H new ATOM 0 HE2 LYS A 76 15.222 -2.540 8.121 1.00 0.00 H new ATOM 0 HE3 LYS A 76 14.784 -2.933 9.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 17.293 -2.907 9.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 16.734 -4.129 10.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 16.962 -4.455 8.459 1.00 0.00 H new ATOM 1082 N ARG A 77 12.091 -4.265 10.961 1.00 0.00 N ATOM 1083 CA ARG A 77 11.107 -3.148 11.020 1.00 0.00 C ATOM 1084 C ARG A 77 10.292 -3.107 9.726 1.00 0.00 C ATOM 1085 O ARG A 77 9.129 -2.756 9.720 1.00 0.00 O ATOM 1086 CB ARG A 77 11.949 -1.882 11.166 1.00 0.00 C ATOM 1087 CG ARG A 77 11.909 -1.411 12.619 1.00 0.00 C ATOM 1088 CD ARG A 77 12.767 -0.154 12.774 1.00 0.00 C ATOM 1089 NE ARG A 77 12.032 0.906 12.031 1.00 0.00 N ATOM 1090 CZ ARG A 77 12.076 2.143 12.444 1.00 0.00 C ATOM 1091 NH1 ARG A 77 13.217 2.679 12.779 1.00 0.00 N ATOM 1092 NH2 ARG A 77 10.977 2.843 12.522 1.00 0.00 N ATOM 0 H ARG A 77 13.069 -3.991 11.058 1.00 0.00 H new ATOM 0 HA ARG A 77 10.400 -3.258 11.842 1.00 0.00 H new ATOM 0 HB2 ARG A 77 12.978 -2.079 10.864 1.00 0.00 H new ATOM 0 HB3 ARG A 77 11.568 -1.101 10.508 1.00 0.00 H new ATOM 0 HG2 ARG A 77 10.881 -1.201 12.916 1.00 0.00 H new ATOM 0 HG3 ARG A 77 12.277 -2.198 13.277 1.00 0.00 H new ATOM 0 HD2 ARG A 77 12.891 0.113 13.824 1.00 0.00 H new ATOM 0 HD3 ARG A 77 13.765 -0.304 12.363 1.00 0.00 H new ATOM 0 HE ARG A 77 11.494 0.665 11.199 1.00 0.00 H new ATOM 0 HH11 ARG A 77 14.075 2.131 12.718 1.00 0.00 H new ATOM 0 HH12 ARG A 77 13.251 3.646 13.102 1.00 0.00 H new ATOM 0 HH21 ARG A 77 10.085 2.423 12.260 1.00 0.00 H new ATOM 0 HH22 ARG A 77 11.010 3.810 12.845 1.00 0.00 H new ATOM 1106 N SER A 78 10.899 -3.469 8.631 1.00 0.00 N ATOM 1107 CA SER A 78 10.168 -3.458 7.330 1.00 0.00 C ATOM 1108 C SER A 78 10.589 -4.658 6.472 1.00 0.00 C ATOM 1109 O SER A 78 11.556 -5.333 6.764 1.00 0.00 O ATOM 1110 CB SER A 78 10.575 -2.147 6.661 1.00 0.00 C ATOM 1111 OG SER A 78 9.426 -1.533 6.093 1.00 0.00 O ATOM 0 H SER A 78 11.871 -3.773 8.579 1.00 0.00 H new ATOM 0 HA SER A 78 9.088 -3.530 7.462 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.034 -1.480 7.391 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.320 -2.336 5.888 1.00 0.00 H new ATOM 0 HG SER A 78 9.684 -0.690 5.664 1.00 0.00 H new ATOM 1117 N TYR A 79 9.867 -4.929 5.417 1.00 0.00 N ATOM 1118 CA TYR A 79 10.223 -6.087 4.542 1.00 0.00 C ATOM 1119 C TYR A 79 9.988 -5.728 3.071 1.00 0.00 C ATOM 1120 O TYR A 79 10.076 -4.580 2.685 1.00 0.00 O ATOM 1121 CB TYR A 79 9.284 -7.217 4.967 1.00 0.00 C ATOM 1122 CG TYR A 79 9.174 -7.258 6.473 1.00 0.00 C ATOM 1123 CD1 TYR A 79 8.385 -6.315 7.145 1.00 0.00 C ATOM 1124 CD2 TYR A 79 9.855 -8.243 7.197 1.00 0.00 C ATOM 1125 CE1 TYR A 79 8.280 -6.359 8.538 1.00 0.00 C ATOM 1126 CE2 TYR A 79 9.749 -8.285 8.590 1.00 0.00 C ATOM 1127 CZ TYR A 79 8.961 -7.344 9.259 1.00 0.00 C ATOM 1128 OH TYR A 79 8.856 -7.388 10.630 1.00 0.00 O ATOM 0 H TYR A 79 9.046 -4.400 5.123 1.00 0.00 H new ATOM 0 HA TYR A 79 11.271 -6.369 4.643 1.00 0.00 H new ATOM 0 HB2 TYR A 79 8.298 -7.067 4.526 1.00 0.00 H new ATOM 0 HB3 TYR A 79 9.658 -8.171 4.595 1.00 0.00 H new ATOM 0 HD1 TYR A 79 7.858 -5.555 6.587 1.00 0.00 H new ATOM 0 HD2 TYR A 79 10.462 -8.971 6.679 1.00 0.00 H new ATOM 0 HE1 TYR A 79 7.673 -5.632 9.057 1.00 0.00 H new ATOM 0 HE2 TYR A 79 10.276 -9.044 9.149 1.00 0.00 H new ATOM 0 HH TYR A 79 8.867 -8.321 10.929 1.00 0.00 H new ATOM 1138 N SER A 80 9.687 -6.697 2.244 1.00 0.00 N ATOM 1139 CA SER A 80 9.448 -6.387 0.803 1.00 0.00 C ATOM 1140 C SER A 80 8.658 -7.517 0.112 1.00 0.00 C ATOM 1141 O SER A 80 7.448 -7.572 0.187 1.00 0.00 O ATOM 1142 CB SER A 80 10.842 -6.250 0.192 1.00 0.00 C ATOM 1143 OG SER A 80 11.481 -7.520 0.185 1.00 0.00 O ATOM 0 H SER A 80 9.597 -7.680 2.501 1.00 0.00 H new ATOM 0 HA SER A 80 8.853 -5.483 0.678 1.00 0.00 H new ATOM 0 HB2 SER A 80 10.769 -5.861 -0.824 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.434 -5.536 0.765 1.00 0.00 H new ATOM 0 HG SER A 80 12.375 -7.434 -0.208 1.00 0.00 H new ATOM 1149 N TYR A 81 9.321 -8.396 -0.600 1.00 0.00 N ATOM 1150 CA TYR A 81 8.581 -9.481 -1.314 1.00 0.00 C ATOM 1151 C TYR A 81 9.049 -10.872 -0.839 1.00 0.00 C ATOM 1152 O TYR A 81 8.890 -11.863 -1.525 1.00 0.00 O ATOM 1153 CB TYR A 81 8.878 -9.215 -2.805 1.00 0.00 C ATOM 1154 CG TYR A 81 9.516 -10.408 -3.478 1.00 0.00 C ATOM 1155 CD1 TYR A 81 8.712 -11.389 -4.066 1.00 0.00 C ATOM 1156 CD2 TYR A 81 10.908 -10.526 -3.515 1.00 0.00 C ATOM 1157 CE1 TYR A 81 9.301 -12.492 -4.693 1.00 0.00 C ATOM 1158 CE2 TYR A 81 11.500 -11.628 -4.141 1.00 0.00 C ATOM 1159 CZ TYR A 81 10.696 -12.613 -4.731 1.00 0.00 C ATOM 1160 OH TYR A 81 11.277 -13.701 -5.349 1.00 0.00 O ATOM 0 H TYR A 81 10.334 -8.409 -0.717 1.00 0.00 H new ATOM 0 HA TYR A 81 7.509 -9.477 -1.119 1.00 0.00 H new ATOM 0 HB2 TYR A 81 7.951 -8.962 -3.319 1.00 0.00 H new ATOM 0 HB3 TYR A 81 9.538 -8.352 -2.895 1.00 0.00 H new ATOM 0 HD1 TYR A 81 7.636 -11.295 -4.036 1.00 0.00 H new ATOM 0 HD2 TYR A 81 11.527 -9.766 -3.060 1.00 0.00 H new ATOM 0 HE1 TYR A 81 8.680 -13.250 -5.148 1.00 0.00 H new ATOM 0 HE2 TYR A 81 12.576 -11.720 -4.170 1.00 0.00 H new ATOM 0 HH TYR A 81 12.252 -13.630 -5.287 1.00 0.00 H new ATOM 1170 N ASN A 82 9.595 -10.959 0.344 1.00 0.00 N ATOM 1171 CA ASN A 82 10.038 -12.287 0.861 1.00 0.00 C ATOM 1172 C ASN A 82 10.295 -12.218 2.370 1.00 0.00 C ATOM 1173 O ASN A 82 9.373 -12.108 3.153 1.00 0.00 O ATOM 1174 CB ASN A 82 11.317 -12.607 0.090 1.00 0.00 C ATOM 1175 CG ASN A 82 11.756 -14.037 0.403 1.00 0.00 C ATOM 1176 OD1 ASN A 82 12.755 -14.248 1.061 1.00 0.00 O ATOM 1177 ND2 ASN A 82 11.047 -15.037 -0.046 1.00 0.00 N ATOM 0 H ASN A 82 9.753 -10.172 0.973 1.00 0.00 H new ATOM 0 HA ASN A 82 9.283 -13.060 0.719 1.00 0.00 H new ATOM 0 HB2 ASN A 82 11.147 -12.493 -0.981 1.00 0.00 H new ATOM 0 HB3 ASN A 82 12.105 -11.905 0.364 1.00 0.00 H new ATOM 0 HD21 ASN A 82 11.332 -15.995 0.156 1.00 0.00 H new ATOM 0 HD22 ASN A 82 10.208 -14.860 -0.599 1.00 0.00 H new ATOM 1184 N ASP A 83 11.527 -12.296 2.797 1.00 0.00 N ATOM 1185 CA ASP A 83 11.793 -12.250 4.259 1.00 0.00 C ATOM 1186 C ASP A 83 10.860 -13.229 4.968 1.00 0.00 C ATOM 1187 O ASP A 83 9.881 -12.846 5.575 1.00 0.00 O ATOM 1188 CB ASP A 83 11.493 -10.809 4.677 1.00 0.00 C ATOM 1189 CG ASP A 83 12.789 -10.119 5.104 1.00 0.00 C ATOM 1190 OD1 ASP A 83 13.516 -9.675 4.232 1.00 0.00 O ATOM 1191 OD2 ASP A 83 13.032 -10.047 6.298 1.00 0.00 O ATOM 0 H ASP A 83 12.351 -12.389 2.202 1.00 0.00 H new ATOM 0 HA ASP A 83 12.815 -12.530 4.514 1.00 0.00 H new ATOM 0 HB2 ASP A 83 11.036 -10.267 3.849 1.00 0.00 H new ATOM 0 HB3 ASP A 83 10.776 -10.799 5.498 1.00 0.00 H new ATOM 1196 N ASN A 84 11.152 -14.496 4.876 1.00 0.00 N ATOM 1197 CA ASN A 84 10.278 -15.513 5.522 1.00 0.00 C ATOM 1198 C ASN A 84 10.390 -15.441 7.050 1.00 0.00 C ATOM 1199 O ASN A 84 11.465 -15.529 7.608 1.00 0.00 O ATOM 1200 CB ASN A 84 10.804 -16.857 5.016 1.00 0.00 C ATOM 1201 CG ASN A 84 10.086 -17.993 5.747 1.00 0.00 C ATOM 1202 OD1 ASN A 84 8.988 -17.818 6.236 1.00 0.00 O ATOM 1203 ND2 ASN A 84 10.665 -19.159 5.843 1.00 0.00 N ATOM 0 H ASN A 84 11.960 -14.872 4.380 1.00 0.00 H new ATOM 0 HA ASN A 84 9.227 -15.357 5.280 1.00 0.00 H new ATOM 0 HB2 ASN A 84 10.642 -16.942 3.941 1.00 0.00 H new ATOM 0 HB3 ASN A 84 11.879 -16.925 5.183 1.00 0.00 H new ATOM 0 HD21 ASN A 84 10.195 -19.923 6.329 1.00 0.00 H new ATOM 0 HD22 ASN A 84 11.587 -19.306 5.432 1.00 0.00 H new ATOM 1210 N VAL A 85 9.284 -15.302 7.730 1.00 0.00 N ATOM 1211 CA VAL A 85 9.325 -15.250 9.220 1.00 0.00 C ATOM 1212 C VAL A 85 8.742 -16.549 9.792 1.00 0.00 C ATOM 1213 O VAL A 85 7.630 -16.925 9.483 1.00 0.00 O ATOM 1214 CB VAL A 85 8.464 -14.051 9.616 1.00 0.00 C ATOM 1215 CG1 VAL A 85 9.189 -12.758 9.243 1.00 0.00 C ATOM 1216 CG2 VAL A 85 7.125 -14.108 8.882 1.00 0.00 C ATOM 0 H VAL A 85 8.354 -15.222 7.318 1.00 0.00 H new ATOM 0 HA VAL A 85 10.340 -15.149 9.604 1.00 0.00 H new ATOM 0 HB VAL A 85 8.288 -14.077 10.691 1.00 0.00 H new ATOM 0 HG11 VAL A 85 8.575 -11.902 9.525 1.00 0.00 H new ATOM 0 HG12 VAL A 85 10.142 -12.710 9.770 1.00 0.00 H new ATOM 0 HG13 VAL A 85 9.367 -12.738 8.168 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.516 -13.251 9.169 1.00 0.00 H new ATOM 0 HG22 VAL A 85 7.299 -14.086 7.806 1.00 0.00 H new ATOM 0 HG23 VAL A 85 6.604 -15.028 9.147 1.00 0.00 H new ATOM 1226 N ASP A 86 9.477 -17.236 10.626 1.00 0.00 N ATOM 1227 CA ASP A 86 8.946 -18.506 11.211 1.00 0.00 C ATOM 1228 C ASP A 86 8.024 -18.165 12.375 1.00 0.00 C ATOM 1229 O ASP A 86 8.414 -17.470 13.286 1.00 0.00 O ATOM 1230 CB ASP A 86 10.178 -19.269 11.701 1.00 0.00 C ATOM 1231 CG ASP A 86 10.405 -20.496 10.817 1.00 0.00 C ATOM 1232 OD1 ASP A 86 9.476 -21.271 10.663 1.00 0.00 O ATOM 1233 OD2 ASP A 86 11.506 -20.641 10.309 1.00 0.00 O ATOM 0 H ASP A 86 10.416 -16.976 10.927 1.00 0.00 H new ATOM 0 HA ASP A 86 8.374 -19.098 10.497 1.00 0.00 H new ATOM 0 HB2 ASP A 86 11.054 -18.621 11.674 1.00 0.00 H new ATOM 0 HB3 ASP A 86 10.040 -19.575 12.738 1.00 0.00 H new ATOM 1238 N PHE A 87 6.800 -18.616 12.348 1.00 0.00 N ATOM 1239 CA PHE A 87 5.868 -18.263 13.456 1.00 0.00 C ATOM 1240 C PHE A 87 5.950 -19.247 14.616 1.00 0.00 C ATOM 1241 O PHE A 87 5.799 -20.444 14.468 1.00 0.00 O ATOM 1242 CB PHE A 87 4.486 -18.207 12.809 1.00 0.00 C ATOM 1243 CG PHE A 87 4.354 -16.823 12.225 1.00 0.00 C ATOM 1244 CD1 PHE A 87 4.611 -15.724 13.045 1.00 0.00 C ATOM 1245 CD2 PHE A 87 4.036 -16.630 10.876 1.00 0.00 C ATOM 1246 CE1 PHE A 87 4.548 -14.431 12.532 1.00 0.00 C ATOM 1247 CE2 PHE A 87 3.981 -15.329 10.355 1.00 0.00 C ATOM 1248 CZ PHE A 87 4.238 -14.231 11.189 1.00 0.00 C ATOM 0 H PHE A 87 6.408 -19.207 11.615 1.00 0.00 H new ATOM 0 HA PHE A 87 6.123 -17.307 13.914 1.00 0.00 H new ATOM 0 HB2 PHE A 87 4.387 -18.968 12.035 1.00 0.00 H new ATOM 0 HB3 PHE A 87 3.704 -18.396 13.544 1.00 0.00 H new ATOM 0 HD1 PHE A 87 4.860 -15.877 14.085 1.00 0.00 H new ATOM 0 HD2 PHE A 87 3.834 -17.479 10.239 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.739 -13.584 13.175 1.00 0.00 H new ATOM 0 HE2 PHE A 87 3.741 -15.173 9.314 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.195 -13.229 10.789 1.00 0.00 H new ATOM 1258 N LYS A 88 6.217 -18.712 15.778 1.00 0.00 N ATOM 1259 CA LYS A 88 6.354 -19.541 17.003 1.00 0.00 C ATOM 1260 C LYS A 88 5.140 -19.360 17.913 1.00 0.00 C ATOM 1261 O LYS A 88 5.072 -18.428 18.690 1.00 0.00 O ATOM 1262 CB LYS A 88 7.597 -18.972 17.682 1.00 0.00 C ATOM 1263 CG LYS A 88 8.313 -20.072 18.466 1.00 0.00 C ATOM 1264 CD LYS A 88 7.558 -20.347 19.769 1.00 0.00 C ATOM 1265 CE LYS A 88 7.502 -19.071 20.612 1.00 0.00 C ATOM 1266 NZ LYS A 88 7.330 -19.544 22.015 1.00 0.00 N ATOM 0 H LYS A 88 6.348 -17.712 15.928 1.00 0.00 H new ATOM 0 HA LYS A 88 6.428 -20.606 16.784 1.00 0.00 H new ATOM 0 HB2 LYS A 88 8.269 -18.550 16.935 1.00 0.00 H new ATOM 0 HB3 LYS A 88 7.316 -18.160 18.353 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.370 -20.981 17.868 1.00 0.00 H new ATOM 0 HG3 LYS A 88 9.337 -19.770 18.684 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.548 -20.694 19.549 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.054 -21.142 20.327 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.414 -18.485 20.502 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.674 -18.432 20.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.283 -18.725 22.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 6.450 -20.093 22.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 8.137 -20.144 22.280 1.00 0.00 H new ATOM 1280 N CYS A 89 4.186 -20.239 17.837 1.00 0.00 N ATOM 1281 CA CYS A 89 2.996 -20.098 18.717 1.00 0.00 C ATOM 1282 C CYS A 89 3.445 -19.808 20.149 1.00 0.00 C ATOM 1283 O CYS A 89 4.390 -20.395 20.637 1.00 0.00 O ATOM 1284 CB CYS A 89 2.279 -21.442 18.637 1.00 0.00 C ATOM 1285 SG CYS A 89 0.527 -21.148 18.319 1.00 0.00 S ATOM 0 H CYS A 89 4.176 -21.043 17.210 1.00 0.00 H new ATOM 0 HA CYS A 89 2.345 -19.278 18.412 1.00 0.00 H new ATOM 0 HB2 CYS A 89 2.709 -22.053 17.843 1.00 0.00 H new ATOM 0 HB3 CYS A 89 2.406 -21.994 19.568 1.00 0.00 H new ATOM 1290 N LYS A 90 2.791 -18.897 20.822 1.00 0.00 N ATOM 1291 CA LYS A 90 3.196 -18.564 22.220 1.00 0.00 C ATOM 1292 C LYS A 90 3.000 -19.765 23.161 1.00 0.00 C ATOM 1293 O LYS A 90 2.321 -19.676 24.165 1.00 0.00 O ATOM 1294 CB LYS A 90 2.288 -17.410 22.634 1.00 0.00 C ATOM 1295 CG LYS A 90 3.155 -16.234 23.081 1.00 0.00 C ATOM 1296 CD LYS A 90 2.682 -15.734 24.447 1.00 0.00 C ATOM 1297 CE LYS A 90 3.401 -16.513 25.551 1.00 0.00 C ATOM 1298 NZ LYS A 90 3.192 -15.710 26.788 1.00 0.00 N ATOM 0 H LYS A 90 1.995 -18.370 20.464 1.00 0.00 H new ATOM 0 HA LYS A 90 4.252 -18.301 22.277 1.00 0.00 H new ATOM 0 HB2 LYS A 90 1.651 -17.114 21.800 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.628 -17.721 23.444 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.200 -16.541 23.137 1.00 0.00 H new ATOM 0 HG3 LYS A 90 3.098 -15.429 22.349 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.886 -14.668 24.547 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.604 -15.862 24.540 1.00 0.00 H new ATOM 0 HE2 LYS A 90 2.990 -17.517 25.658 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.462 -16.625 25.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.657 -16.181 27.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.600 -14.762 26.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.173 -15.626 26.979 1.00 0.00 H new ATOM 1312 N TYR A 91 3.614 -20.872 22.854 1.00 0.00 N ATOM 1313 CA TYR A 91 3.507 -22.081 23.732 1.00 0.00 C ATOM 1314 C TYR A 91 2.056 -22.552 23.918 1.00 0.00 C ATOM 1315 O TYR A 91 1.156 -21.771 24.145 1.00 0.00 O ATOM 1316 CB TYR A 91 4.081 -21.633 25.074 1.00 0.00 C ATOM 1317 CG TYR A 91 5.122 -22.627 25.533 1.00 0.00 C ATOM 1318 CD1 TYR A 91 4.842 -23.998 25.492 1.00 0.00 C ATOM 1319 CD2 TYR A 91 6.367 -22.181 25.995 1.00 0.00 C ATOM 1320 CE1 TYR A 91 5.805 -24.922 25.913 1.00 0.00 C ATOM 1321 CE2 TYR A 91 7.330 -23.106 26.416 1.00 0.00 C ATOM 1322 CZ TYR A 91 7.049 -24.477 26.375 1.00 0.00 C ATOM 1323 OH TYR A 91 7.997 -25.390 26.789 1.00 0.00 O ATOM 0 H TYR A 91 4.193 -20.997 22.024 1.00 0.00 H new ATOM 0 HA TYR A 91 4.036 -22.926 23.291 1.00 0.00 H new ATOM 0 HB2 TYR A 91 4.526 -20.642 24.979 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.285 -21.556 25.815 1.00 0.00 H new ATOM 0 HD1 TYR A 91 3.883 -24.343 25.135 1.00 0.00 H new ATOM 0 HD2 TYR A 91 6.584 -21.123 26.026 1.00 0.00 H new ATOM 0 HE1 TYR A 91 5.588 -25.980 25.881 1.00 0.00 H new ATOM 0 HE2 TYR A 91 8.290 -22.762 26.772 1.00 0.00 H new ATOM 0 HH TYR A 91 8.804 -24.915 27.078 1.00 0.00 H new ATOM 1333 N GLY A 92 1.848 -23.845 23.862 1.00 0.00 N ATOM 1334 CA GLY A 92 0.483 -24.420 24.073 1.00 0.00 C ATOM 1335 C GLY A 92 -0.529 -23.836 23.086 1.00 0.00 C ATOM 1336 O GLY A 92 -1.555 -23.319 23.481 1.00 0.00 O ATOM 0 H GLY A 92 2.576 -24.535 23.677 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.521 -25.503 23.958 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.156 -24.219 25.093 1.00 0.00 H new ATOM 1340 N TYR A 93 -0.264 -23.931 21.810 1.00 0.00 N ATOM 1341 CA TYR A 93 -1.225 -23.390 20.801 1.00 0.00 C ATOM 1342 C TYR A 93 -0.944 -23.989 19.423 1.00 0.00 C ATOM 1343 O TYR A 93 0.099 -24.561 19.182 1.00 0.00 O ATOM 1344 CB TYR A 93 -0.971 -21.890 20.782 1.00 0.00 C ATOM 1345 CG TYR A 93 -1.523 -21.257 22.034 1.00 0.00 C ATOM 1346 CD1 TYR A 93 -2.875 -21.410 22.357 1.00 0.00 C ATOM 1347 CD2 TYR A 93 -0.680 -20.521 22.874 1.00 0.00 C ATOM 1348 CE1 TYR A 93 -3.385 -20.827 23.521 1.00 0.00 C ATOM 1349 CE2 TYR A 93 -1.190 -19.938 24.039 1.00 0.00 C ATOM 1350 CZ TYR A 93 -2.543 -20.090 24.363 1.00 0.00 C ATOM 1351 OH TYR A 93 -3.047 -19.514 25.510 1.00 0.00 O ATOM 0 H TYR A 93 0.576 -24.360 21.422 1.00 0.00 H new ATOM 0 HA TYR A 93 -2.258 -23.631 21.050 1.00 0.00 H new ATOM 0 HB2 TYR A 93 0.099 -21.695 20.707 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -1.438 -21.445 19.903 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -3.525 -21.978 21.708 1.00 0.00 H new ATOM 0 HD2 TYR A 93 0.364 -20.403 22.623 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -4.429 -20.945 23.771 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -0.540 -19.371 24.688 1.00 0.00 H new ATOM 0 HH TYR A 93 -2.330 -19.040 25.980 1.00 0.00 H new ATOM 1361 N LYS A 94 -1.867 -23.852 18.513 1.00 0.00 N ATOM 1362 CA LYS A 94 -1.655 -24.403 17.146 1.00 0.00 C ATOM 1363 C LYS A 94 -1.798 -23.285 16.114 1.00 0.00 C ATOM 1364 O LYS A 94 -2.887 -22.849 15.807 1.00 0.00 O ATOM 1365 CB LYS A 94 -2.752 -25.451 16.963 1.00 0.00 C ATOM 1366 CG LYS A 94 -2.152 -26.712 16.340 1.00 0.00 C ATOM 1367 CD LYS A 94 -3.259 -27.518 15.657 1.00 0.00 C ATOM 1368 CE LYS A 94 -4.420 -27.718 16.634 1.00 0.00 C ATOM 1369 NZ LYS A 94 -3.850 -28.520 17.753 1.00 0.00 N ATOM 0 H LYS A 94 -2.760 -23.381 18.657 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.663 -24.836 17.018 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -3.207 -25.689 17.925 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.543 -25.058 16.324 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.383 -26.443 15.616 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.669 -27.316 17.108 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.606 -26.997 14.765 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.873 -28.484 15.332 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -4.805 -26.762 16.990 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.251 -28.239 16.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.621 -28.981 18.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.210 -29.245 17.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.321 -27.895 18.394 1.00 0.00 H new ATOM 1383 N LEU A 95 -0.709 -22.810 15.584 1.00 0.00 N ATOM 1384 CA LEU A 95 -0.790 -21.712 14.579 1.00 0.00 C ATOM 1385 C LEU A 95 -1.863 -22.021 13.536 1.00 0.00 C ATOM 1386 O LEU A 95 -1.612 -22.681 12.547 1.00 0.00 O ATOM 1387 CB LEU A 95 0.592 -21.670 13.925 1.00 0.00 C ATOM 1388 CG LEU A 95 1.626 -21.165 14.933 1.00 0.00 C ATOM 1389 CD1 LEU A 95 2.940 -21.927 14.743 1.00 0.00 C ATOM 1390 CD2 LEU A 95 1.868 -19.671 14.710 1.00 0.00 C ATOM 0 H LEU A 95 0.234 -23.132 15.801 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.057 -20.759 15.035 1.00 0.00 H new ATOM 0 HB2 LEU A 95 0.869 -22.664 13.573 1.00 0.00 H new ATOM 0 HB3 LEU A 95 0.572 -21.017 13.052 1.00 0.00 H new ATOM 0 HG LEU A 95 1.255 -21.327 15.945 1.00 0.00 H new ATOM 0 HD11 LEU A 95 3.677 -21.567 15.461 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.769 -22.992 14.901 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.311 -21.766 13.731 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.605 -19.311 15.428 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.239 -19.510 13.698 1.00 0.00 H new ATOM 0 HD23 LEU A 95 0.933 -19.127 14.845 1.00 0.00 H new ATOM 1402 N SER A 96 -3.056 -21.540 13.745 1.00 0.00 N ATOM 1403 CA SER A 96 -4.142 -21.797 12.760 1.00 0.00 C ATOM 1404 C SER A 96 -3.888 -20.983 11.489 1.00 0.00 C ATOM 1405 O SER A 96 -4.399 -19.893 11.327 1.00 0.00 O ATOM 1406 CB SER A 96 -5.423 -21.333 13.452 1.00 0.00 C ATOM 1407 OG SER A 96 -6.255 -20.673 12.507 1.00 0.00 O ATOM 0 H SER A 96 -3.326 -20.981 14.554 1.00 0.00 H new ATOM 0 HA SER A 96 -4.201 -22.845 12.465 1.00 0.00 H new ATOM 0 HB2 SER A 96 -5.947 -22.186 13.882 1.00 0.00 H new ATOM 0 HB3 SER A 96 -5.182 -20.660 14.275 1.00 0.00 H new ATOM 0 HG SER A 96 -5.834 -19.832 12.232 1.00 0.00 H new ATOM 1413 N GLY A 97 -3.096 -21.499 10.589 1.00 0.00 N ATOM 1414 CA GLY A 97 -2.811 -20.749 9.334 1.00 0.00 C ATOM 1415 C GLY A 97 -1.500 -21.242 8.718 1.00 0.00 C ATOM 1416 O GLY A 97 -1.487 -22.137 7.896 1.00 0.00 O ATOM 0 H GLY A 97 -2.635 -22.405 10.669 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -3.629 -20.884 8.626 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.745 -19.682 9.545 1.00 0.00 H new ATOM 1420 N SER A 98 -0.396 -20.660 9.100 1.00 0.00 N ATOM 1421 CA SER A 98 0.910 -21.093 8.525 1.00 0.00 C ATOM 1422 C SER A 98 2.072 -20.642 9.418 1.00 0.00 C ATOM 1423 O SER A 98 2.180 -19.486 9.776 1.00 0.00 O ATOM 1424 CB SER A 98 0.979 -20.400 7.169 1.00 0.00 C ATOM 1425 OG SER A 98 1.118 -21.380 6.148 1.00 0.00 O ATOM 0 H SER A 98 -0.341 -19.905 9.784 1.00 0.00 H new ATOM 0 HA SER A 98 0.986 -22.177 8.443 1.00 0.00 H new ATOM 0 HB2 SER A 98 0.078 -19.810 7.003 1.00 0.00 H new ATOM 0 HB3 SER A 98 1.822 -19.709 7.143 1.00 0.00 H new ATOM 0 HG SER A 98 0.359 -21.319 5.531 1.00 0.00 H new ATOM 1431 N SER A 99 2.942 -21.548 9.778 1.00 0.00 N ATOM 1432 CA SER A 99 4.099 -21.177 10.646 1.00 0.00 C ATOM 1433 C SER A 99 5.087 -20.296 9.879 1.00 0.00 C ATOM 1434 O SER A 99 5.144 -19.098 10.068 1.00 0.00 O ATOM 1435 CB SER A 99 4.752 -22.508 11.020 1.00 0.00 C ATOM 1436 OG SER A 99 4.639 -22.710 12.423 1.00 0.00 O ATOM 0 H SER A 99 2.902 -22.531 9.508 1.00 0.00 H new ATOM 0 HA SER A 99 3.787 -20.609 11.523 1.00 0.00 H new ATOM 0 HB2 SER A 99 4.271 -23.326 10.484 1.00 0.00 H new ATOM 0 HB3 SER A 99 5.801 -22.507 10.725 1.00 0.00 H new ATOM 0 HG SER A 99 3.905 -23.333 12.606 1.00 0.00 H new ATOM 1442 N SER A 100 5.872 -20.883 9.024 1.00 0.00 N ATOM 1443 CA SER A 100 6.867 -20.083 8.252 1.00 0.00 C ATOM 1444 C SER A 100 6.175 -19.274 7.151 1.00 0.00 C ATOM 1445 O SER A 100 5.763 -19.806 6.139 1.00 0.00 O ATOM 1446 CB SER A 100 7.816 -21.114 7.644 1.00 0.00 C ATOM 1447 OG SER A 100 7.183 -21.738 6.534 1.00 0.00 O ATOM 0 H SER A 100 5.870 -21.883 8.824 1.00 0.00 H new ATOM 0 HA SER A 100 7.390 -19.364 8.883 1.00 0.00 H new ATOM 0 HB2 SER A 100 8.740 -20.632 7.326 1.00 0.00 H new ATOM 0 HB3 SER A 100 8.086 -21.861 8.390 1.00 0.00 H new ATOM 0 HG SER A 100 6.249 -21.447 6.484 1.00 0.00 H new ATOM 1453 N SER A 101 6.054 -17.987 7.340 1.00 0.00 N ATOM 1454 CA SER A 101 5.399 -17.135 6.306 1.00 0.00 C ATOM 1455 C SER A 101 6.417 -16.178 5.695 1.00 0.00 C ATOM 1456 O SER A 101 7.491 -15.975 6.227 1.00 0.00 O ATOM 1457 CB SER A 101 4.315 -16.359 7.051 1.00 0.00 C ATOM 1458 OG SER A 101 3.294 -17.257 7.465 1.00 0.00 O ATOM 0 H SER A 101 6.381 -17.488 8.168 1.00 0.00 H new ATOM 0 HA SER A 101 4.984 -17.726 5.489 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.743 -15.854 7.917 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.896 -15.587 6.406 1.00 0.00 H new ATOM 0 HG SER A 101 2.472 -16.756 7.650 1.00 0.00 H new ATOM 1464 N THR A 102 6.094 -15.591 4.578 1.00 0.00 N ATOM 1465 CA THR A 102 7.053 -14.654 3.938 1.00 0.00 C ATOM 1466 C THR A 102 6.344 -13.394 3.446 1.00 0.00 C ATOM 1467 O THR A 102 5.240 -13.439 2.941 1.00 0.00 O ATOM 1468 CB THR A 102 7.640 -15.431 2.763 1.00 0.00 C ATOM 1469 OG1 THR A 102 7.584 -16.822 3.043 1.00 0.00 O ATOM 1470 CG2 THR A 102 9.093 -15.005 2.555 1.00 0.00 C ATOM 0 H THR A 102 5.211 -15.719 4.083 1.00 0.00 H new ATOM 0 HA THR A 102 7.820 -14.321 4.637 1.00 0.00 H new ATOM 0 HB THR A 102 7.067 -15.223 1.859 1.00 0.00 H new ATOM 0 HG1 THR A 102 7.959 -17.323 2.289 1.00 0.00 H new ATOM 0 HG21 THR A 102 9.518 -15.557 1.717 1.00 0.00 H new ATOM 0 HG22 THR A 102 9.132 -13.937 2.343 1.00 0.00 H new ATOM 0 HG23 THR A 102 9.667 -15.217 3.457 1.00 0.00 H new ATOM 1478 N CYS A 103 6.988 -12.272 3.582 1.00 0.00 N ATOM 1479 CA CYS A 103 6.388 -10.994 3.118 1.00 0.00 C ATOM 1480 C CYS A 103 6.396 -10.967 1.583 1.00 0.00 C ATOM 1481 O CYS A 103 7.320 -10.490 0.967 1.00 0.00 O ATOM 1482 CB CYS A 103 7.306 -9.924 3.720 1.00 0.00 C ATOM 1483 SG CYS A 103 7.252 -8.414 2.730 1.00 0.00 S ATOM 0 H CYS A 103 7.915 -12.185 3.999 1.00 0.00 H new ATOM 0 HA CYS A 103 5.352 -10.846 3.421 1.00 0.00 H new ATOM 0 HB2 CYS A 103 6.999 -9.706 4.743 1.00 0.00 H new ATOM 0 HB3 CYS A 103 8.329 -10.298 3.767 1.00 0.00 H new ATOM 1488 N SER A 104 5.381 -11.506 0.968 1.00 0.00 N ATOM 1489 CA SER A 104 5.339 -11.552 -0.526 1.00 0.00 C ATOM 1490 C SER A 104 5.327 -10.164 -1.155 1.00 0.00 C ATOM 1491 O SER A 104 5.353 -9.157 -0.475 1.00 0.00 O ATOM 1492 CB SER A 104 4.056 -12.309 -0.863 1.00 0.00 C ATOM 1493 OG SER A 104 4.367 -13.410 -1.707 1.00 0.00 O ATOM 0 H SER A 104 4.574 -11.919 1.435 1.00 0.00 H new ATOM 0 HA SER A 104 6.231 -12.037 -0.924 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.577 -12.661 0.051 1.00 0.00 H new ATOM 0 HB3 SER A 104 3.348 -11.645 -1.359 1.00 0.00 H new ATOM 0 HG SER A 104 3.545 -13.899 -1.923 1.00 0.00 H new ATOM 1499 N PRO A 105 5.324 -10.182 -2.463 1.00 0.00 N ATOM 1500 CA PRO A 105 5.352 -8.937 -3.253 1.00 0.00 C ATOM 1501 C PRO A 105 3.982 -8.274 -3.332 1.00 0.00 C ATOM 1502 O PRO A 105 3.576 -7.789 -4.370 1.00 0.00 O ATOM 1503 CB PRO A 105 5.800 -9.391 -4.628 1.00 0.00 C ATOM 1504 CG PRO A 105 5.419 -10.836 -4.720 1.00 0.00 C ATOM 1505 CD PRO A 105 5.293 -11.372 -3.316 1.00 0.00 C ATOM 0 HA PRO A 105 6.008 -8.190 -2.807 1.00 0.00 H new ATOM 0 HB2 PRO A 105 5.315 -8.807 -5.411 1.00 0.00 H new ATOM 0 HB3 PRO A 105 6.875 -9.261 -4.753 1.00 0.00 H new ATOM 0 HG2 PRO A 105 4.477 -10.949 -5.257 1.00 0.00 H new ATOM 0 HG3 PRO A 105 6.172 -11.395 -5.276 1.00 0.00 H new ATOM 0 HD2 PRO A 105 4.365 -11.929 -3.186 1.00 0.00 H new ATOM 0 HD3 PRO A 105 6.110 -12.053 -3.077 1.00 0.00 H new ATOM 1513 N GLY A 106 3.279 -8.225 -2.249 1.00 0.00 N ATOM 1514 CA GLY A 106 1.953 -7.569 -2.262 1.00 0.00 C ATOM 1515 C GLY A 106 1.793 -6.794 -0.961 1.00 0.00 C ATOM 1516 O GLY A 106 0.704 -6.421 -0.572 1.00 0.00 O ATOM 0 H GLY A 106 3.565 -8.612 -1.350 1.00 0.00 H new ATOM 0 HA2 GLY A 106 1.869 -6.898 -3.117 1.00 0.00 H new ATOM 0 HA3 GLY A 106 1.162 -8.312 -2.361 1.00 0.00 H new ATOM 1520 N ASN A 107 2.882 -6.558 -0.280 1.00 0.00 N ATOM 1521 CA ASN A 107 2.810 -5.812 1.009 1.00 0.00 C ATOM 1522 C ASN A 107 1.982 -6.606 2.019 1.00 0.00 C ATOM 1523 O ASN A 107 0.995 -6.126 2.541 1.00 0.00 O ATOM 1524 CB ASN A 107 2.121 -4.488 0.672 1.00 0.00 C ATOM 1525 CG ASN A 107 2.753 -3.887 -0.584 1.00 0.00 C ATOM 1526 OD1 ASN A 107 3.886 -3.452 -0.559 1.00 0.00 O ATOM 1527 ND2 ASN A 107 2.063 -3.845 -1.690 1.00 0.00 N ATOM 0 H ASN A 107 3.818 -6.850 -0.561 1.00 0.00 H new ATOM 0 HA ASN A 107 3.793 -5.651 1.451 1.00 0.00 H new ATOM 0 HB2 ASN A 107 1.055 -4.651 0.513 1.00 0.00 H new ATOM 0 HB3 ASN A 107 2.216 -3.794 1.507 1.00 0.00 H new ATOM 0 HD21 ASN A 107 2.475 -3.447 -2.534 1.00 0.00 H new ATOM 0 HD22 ASN A 107 1.111 -4.210 -1.711 1.00 0.00 H new ATOM 1534 N THR A 108 2.370 -7.820 2.292 1.00 0.00 N ATOM 1535 CA THR A 108 1.596 -8.644 3.262 1.00 0.00 C ATOM 1536 C THR A 108 2.453 -9.790 3.791 1.00 0.00 C ATOM 1537 O THR A 108 3.665 -9.747 3.738 1.00 0.00 O ATOM 1538 CB THR A 108 0.417 -9.184 2.457 1.00 0.00 C ATOM 1539 OG1 THR A 108 0.732 -9.143 1.072 1.00 0.00 O ATOM 1540 CG2 THR A 108 -0.811 -8.323 2.730 1.00 0.00 C ATOM 0 H THR A 108 3.187 -8.277 1.887 1.00 0.00 H new ATOM 0 HA THR A 108 1.274 -8.068 4.130 1.00 0.00 H new ATOM 0 HB THR A 108 0.212 -10.214 2.749 1.00 0.00 H new ATOM 0 HG1 THR A 108 -0.024 -9.491 0.554 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.657 -8.704 2.158 1.00 0.00 H new ATOM 0 HG22 THR A 108 -1.049 -8.355 3.793 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.607 -7.294 2.435 1.00 0.00 H new ATOM 1548 N TRP A 109 1.832 -10.813 4.309 1.00 0.00 N ATOM 1549 CA TRP A 109 2.611 -11.959 4.848 1.00 0.00 C ATOM 1550 C TRP A 109 1.979 -13.285 4.417 1.00 0.00 C ATOM 1551 O TRP A 109 1.113 -13.821 5.079 1.00 0.00 O ATOM 1552 CB TRP A 109 2.561 -11.776 6.359 1.00 0.00 C ATOM 1553 CG TRP A 109 3.688 -10.882 6.759 1.00 0.00 C ATOM 1554 CD1 TRP A 109 3.563 -9.640 7.286 1.00 0.00 C ATOM 1555 CD2 TRP A 109 5.115 -11.143 6.660 1.00 0.00 C ATOM 1556 NE1 TRP A 109 4.827 -9.123 7.507 1.00 0.00 N ATOM 1557 CE2 TRP A 109 5.816 -10.016 7.146 1.00 0.00 C ATOM 1558 CE3 TRP A 109 5.861 -12.242 6.204 1.00 0.00 C ATOM 1559 CZ2 TRP A 109 7.210 -9.980 7.177 1.00 0.00 C ATOM 1560 CZ3 TRP A 109 7.262 -12.211 6.235 1.00 0.00 C ATOM 1561 CH2 TRP A 109 7.937 -11.084 6.721 1.00 0.00 C ATOM 0 H TRP A 109 0.819 -10.904 4.382 1.00 0.00 H new ATOM 0 HA TRP A 109 3.637 -11.985 4.480 1.00 0.00 H new ATOM 0 HB2 TRP A 109 1.607 -11.342 6.658 1.00 0.00 H new ATOM 0 HB3 TRP A 109 2.644 -12.740 6.861 1.00 0.00 H new ATOM 0 HD1 TRP A 109 2.631 -9.137 7.498 1.00 0.00 H new ATOM 0 HE1 TRP A 109 5.006 -8.195 7.890 1.00 0.00 H new ATOM 0 HE3 TRP A 109 5.352 -13.117 5.827 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 7.724 -9.106 7.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 7.825 -13.062 5.882 1.00 0.00 H new ATOM 0 HH2 TRP A 109 9.017 -11.068 6.743 1.00 0.00 H new ATOM 1572 N LYS A 110 2.414 -13.813 3.303 1.00 0.00 N ATOM 1573 CA LYS A 110 1.851 -15.101 2.810 1.00 0.00 C ATOM 1574 C LYS A 110 2.802 -16.258 3.153 1.00 0.00 C ATOM 1575 O LYS A 110 4.001 -16.068 3.203 1.00 0.00 O ATOM 1576 CB LYS A 110 1.743 -14.922 1.296 1.00 0.00 C ATOM 1577 CG LYS A 110 0.898 -13.682 0.990 1.00 0.00 C ATOM 1578 CD LYS A 110 -0.382 -14.103 0.266 1.00 0.00 C ATOM 1579 CE LYS A 110 -1.248 -12.871 -0.010 1.00 0.00 C ATOM 1580 NZ LYS A 110 -2.516 -13.412 -0.573 1.00 0.00 N ATOM 0 H LYS A 110 3.138 -13.404 2.712 1.00 0.00 H new ATOM 0 HA LYS A 110 0.889 -15.339 3.263 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.736 -14.816 0.859 1.00 0.00 H new ATOM 0 HB3 LYS A 110 1.290 -15.805 0.846 1.00 0.00 H new ATOM 0 HG2 LYS A 110 0.651 -13.160 1.914 1.00 0.00 H new ATOM 0 HG3 LYS A 110 1.465 -12.985 0.373 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -0.134 -14.602 -0.671 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -0.935 -14.820 0.873 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.431 -12.304 0.903 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -0.761 -12.195 -0.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -3.163 -12.627 -0.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -2.311 -13.941 -1.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.961 -14.047 0.120 1.00 0.00 H new ATOM 1594 N PRO A 111 2.246 -17.426 3.375 1.00 0.00 N ATOM 1595 CA PRO A 111 0.772 -17.624 3.306 1.00 0.00 C ATOM 1596 C PRO A 111 0.070 -16.948 4.491 1.00 0.00 C ATOM 1597 O PRO A 111 0.704 -16.418 5.380 1.00 0.00 O ATOM 1598 CB PRO A 111 0.611 -19.141 3.372 1.00 0.00 C ATOM 1599 CG PRO A 111 1.841 -19.625 4.068 1.00 0.00 C ATOM 1600 CD PRO A 111 2.948 -18.672 3.707 1.00 0.00 C ATOM 0 HA PRO A 111 0.328 -17.188 2.411 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -0.289 -19.420 3.920 1.00 0.00 H new ATOM 0 HB3 PRO A 111 0.524 -19.573 2.375 1.00 0.00 H new ATOM 0 HG2 PRO A 111 1.690 -19.651 5.147 1.00 0.00 H new ATOM 0 HG3 PRO A 111 2.088 -20.640 3.756 1.00 0.00 H new ATOM 0 HD2 PRO A 111 3.641 -18.531 4.537 1.00 0.00 H new ATOM 0 HD3 PRO A 111 3.532 -19.039 2.863 1.00 0.00 H new ATOM 1608 N GLU A 112 -1.237 -16.952 4.486 1.00 0.00 N ATOM 1609 CA GLU A 112 -2.017 -16.300 5.584 1.00 0.00 C ATOM 1610 C GLU A 112 -1.297 -16.403 6.934 1.00 0.00 C ATOM 1611 O GLU A 112 -0.863 -17.462 7.342 1.00 0.00 O ATOM 1612 CB GLU A 112 -3.337 -17.069 5.628 1.00 0.00 C ATOM 1613 CG GLU A 112 -4.506 -16.082 5.630 1.00 0.00 C ATOM 1614 CD GLU A 112 -4.922 -15.782 4.189 1.00 0.00 C ATOM 1615 OE1 GLU A 112 -4.046 -15.520 3.382 1.00 0.00 O ATOM 1616 OE2 GLU A 112 -6.111 -15.822 3.917 1.00 0.00 O ATOM 0 H GLU A 112 -1.806 -17.385 3.759 1.00 0.00 H new ATOM 0 HA GLU A 112 -2.152 -15.234 5.398 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -3.411 -17.734 4.768 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -3.375 -17.695 6.519 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.347 -16.499 6.183 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -4.217 -15.161 6.136 1.00 0.00 H new ATOM 1623 N LEU A 113 -1.184 -15.302 7.632 1.00 0.00 N ATOM 1624 CA LEU A 113 -0.511 -15.313 8.966 1.00 0.00 C ATOM 1625 C LEU A 113 -1.148 -16.378 9.859 1.00 0.00 C ATOM 1626 O LEU A 113 -2.354 -16.528 9.887 1.00 0.00 O ATOM 1627 CB LEU A 113 -0.761 -13.914 9.533 1.00 0.00 C ATOM 1628 CG LEU A 113 0.570 -13.226 9.861 1.00 0.00 C ATOM 1629 CD1 LEU A 113 1.582 -13.461 8.735 1.00 0.00 C ATOM 1630 CD2 LEU A 113 0.329 -11.722 10.015 1.00 0.00 C ATOM 0 H LEU A 113 -1.531 -14.391 7.333 1.00 0.00 H new ATOM 0 HA LEU A 113 0.552 -15.545 8.902 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.319 -13.316 8.812 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -1.374 -13.983 10.432 1.00 0.00 H new ATOM 0 HG LEU A 113 0.968 -13.641 10.787 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.522 -12.967 8.982 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.754 -14.531 8.618 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.191 -13.053 7.803 1.00 0.00 H new ATOM 0 HD21 LEU A 113 1.270 -11.225 10.248 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.072 -11.321 9.084 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -0.383 -11.548 10.822 1.00 0.00 H new ATOM 1642 N PRO A 114 -0.307 -17.087 10.556 1.00 0.00 N ATOM 1643 CA PRO A 114 -0.781 -18.163 11.460 1.00 0.00 C ATOM 1644 C PRO A 114 -1.525 -17.581 12.666 1.00 0.00 C ATOM 1645 O PRO A 114 -1.224 -16.503 13.138 1.00 0.00 O ATOM 1646 CB PRO A 114 0.508 -18.860 11.889 1.00 0.00 C ATOM 1647 CG PRO A 114 1.580 -17.834 11.714 1.00 0.00 C ATOM 1648 CD PRO A 114 1.153 -16.954 10.571 1.00 0.00 C ATOM 0 HA PRO A 114 -1.489 -18.840 10.981 1.00 0.00 H new ATOM 0 HB2 PRO A 114 0.449 -19.196 12.924 1.00 0.00 H new ATOM 0 HB3 PRO A 114 0.702 -19.742 11.278 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.709 -17.250 12.625 1.00 0.00 H new ATOM 0 HG3 PRO A 114 2.538 -18.308 11.501 1.00 0.00 H new ATOM 0 HD2 PRO A 114 1.459 -15.919 10.726 1.00 0.00 H new ATOM 0 HD3 PRO A 114 1.594 -17.279 9.629 1.00 0.00 H new ATOM 1656 N LYS A 115 -2.501 -18.293 13.162 1.00 0.00 N ATOM 1657 CA LYS A 115 -3.276 -17.794 14.334 1.00 0.00 C ATOM 1658 C LYS A 115 -3.074 -18.715 15.533 1.00 0.00 C ATOM 1659 O LYS A 115 -3.784 -19.679 15.706 1.00 0.00 O ATOM 1660 CB LYS A 115 -4.736 -17.821 13.882 1.00 0.00 C ATOM 1661 CG LYS A 115 -5.617 -17.175 14.953 1.00 0.00 C ATOM 1662 CD LYS A 115 -6.748 -16.395 14.280 1.00 0.00 C ATOM 1663 CE LYS A 115 -7.480 -17.303 13.288 1.00 0.00 C ATOM 1664 NZ LYS A 115 -8.740 -17.691 13.981 1.00 0.00 N ATOM 0 H LYS A 115 -2.796 -19.202 12.805 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.960 -16.797 14.642 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -4.845 -17.288 12.937 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -5.054 -18.849 13.707 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.030 -17.941 15.610 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.021 -16.508 15.576 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.445 -16.024 15.032 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -6.345 -15.525 13.762 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.688 -16.781 12.354 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.881 -18.179 13.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -9.298 -18.315 13.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.511 -18.192 14.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -9.292 -16.838 14.201 1.00 0.00 H new ATOM 1678 N CYS A 116 -2.117 -18.422 16.368 1.00 0.00 N ATOM 1679 CA CYS A 116 -1.880 -19.284 17.559 1.00 0.00 C ATOM 1680 C CYS A 116 -3.198 -19.566 18.272 1.00 0.00 C ATOM 1681 O CYS A 116 -3.754 -18.715 18.937 1.00 0.00 O ATOM 1682 CB CYS A 116 -0.951 -18.460 18.444 1.00 0.00 C ATOM 1683 SG CYS A 116 0.092 -19.535 19.459 1.00 0.00 S ATOM 0 H CYS A 116 -1.489 -17.623 16.277 1.00 0.00 H new ATOM 0 HA CYS A 116 -1.451 -20.252 17.302 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -0.325 -17.819 17.824 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -1.540 -17.805 19.086 1.00 0.00 H new ATOM 1688 N VAL A 117 -3.701 -20.758 18.138 1.00 0.00 N ATOM 1689 CA VAL A 117 -4.985 -21.097 18.808 1.00 0.00 C ATOM 1690 C VAL A 117 -4.806 -22.284 19.726 1.00 0.00 C ATOM 1691 O VAL A 117 -3.745 -22.872 19.805 1.00 0.00 O ATOM 1692 CB VAL A 117 -5.961 -21.448 17.691 1.00 0.00 C ATOM 1693 CG1 VAL A 117 -6.575 -20.166 17.177 1.00 0.00 C ATOM 1694 CG2 VAL A 117 -5.236 -22.157 16.544 1.00 0.00 C ATOM 0 H VAL A 117 -3.280 -21.512 17.595 1.00 0.00 H new ATOM 0 HA VAL A 117 -5.345 -20.266 19.415 1.00 0.00 H new ATOM 0 HB VAL A 117 -6.730 -22.117 18.078 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.278 -20.395 16.376 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.101 -19.664 17.989 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.789 -19.514 16.795 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.950 -22.399 15.757 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.462 -21.503 16.143 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.779 -23.075 16.914 1.00 0.00 H new ATOM 1704 N ARG A 118 -5.838 -22.652 20.421 1.00 0.00 N ATOM 1705 CA ARG A 118 -5.710 -23.811 21.324 1.00 0.00 C ATOM 1706 C ARG A 118 -6.766 -24.867 20.989 1.00 0.00 C ATOM 1707 O ARG A 118 -7.673 -25.045 21.787 1.00 0.00 O ATOM 1708 CB ARG A 118 -5.917 -23.255 22.733 1.00 0.00 C ATOM 1709 CG ARG A 118 -7.200 -22.423 22.773 1.00 0.00 C ATOM 1710 CD ARG A 118 -7.673 -22.282 24.222 1.00 0.00 C ATOM 1711 NE ARG A 118 -9.079 -21.803 24.121 1.00 0.00 N ATOM 1712 CZ ARG A 118 -10.066 -22.650 24.233 1.00 0.00 C ATOM 1713 NH1 ARG A 118 -9.882 -23.908 23.939 1.00 0.00 N ATOM 1714 NH2 ARG A 118 -11.236 -22.239 24.638 1.00 0.00 N ATOM 1715 OXT ARG A 118 -6.651 -25.481 19.941 1.00 0.00 O ATOM 0 H ARG A 118 -6.754 -22.204 20.402 1.00 0.00 H new ATOM 0 HA ARG A 118 -4.740 -24.300 21.228 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -5.979 -24.072 23.452 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -5.064 -22.641 23.021 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -7.021 -21.439 22.340 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -7.974 -22.900 22.172 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -7.617 -23.234 24.750 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -7.053 -21.575 24.773 1.00 0.00 H new ATOM 0 HE ARG A 118 -9.271 -20.814 23.964 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -8.967 -24.229 23.622 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -10.653 -24.570 24.026 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -11.380 -21.256 24.867 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -12.007 -22.901 24.725 1.00 0.00 H new TER 1729 ARG A 118