USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 694 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 45 LYS NZ :NH3+ -142:sc= 1.29 (180deg=-0.22) USER MOD Set 1.2: A 59 MET CE :methyl 154:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -175:sc= 2.23 (180deg=2) USER MOD Single : A 25 LYS NZ :NH3+ -172:sc= 1.3 (180deg=1.26) USER MOD Single : A 29 GLN : amide:sc= 0.641 K(o=0.64,f=-0.026) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -138:sc= 0.601 USER MOD Single : A 35 HIS : no HD1:sc= -0.0376 X(o=-0.038,f=-0.055) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 144:sc= 0 (180deg=-0.642) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.137 USER MOD Single : A 43 HIS : no HD1:sc= -0.0224 X(o=-0.022,f=-0.092) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 163:sc= 1.92 (180deg=1.71) USER MOD Single : A 50 SER OG : rot 49:sc= 1.13 USER MOD Single : A 51 TYR OH : rot -140:sc= -0.0432 USER MOD Single : A 52 CYS SG : rot 60:sc= -0.861! USER MOD Single : A 53 GLN : amide:sc= -1.58! C(o=-1.6!,f=-4.3!) USER MOD Single : A 55 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.31) USER MOD Single : A 60 ASN : amide:sc= -0.0892 X(o=-0.089,f=-0.58) USER MOD Single : A 61 SER OG : rot -87:sc= 1.32 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 75 HIS : no HD1:sc= 0.714 K(o=0.71,f=-5.8!) USER MOD Single : A 76 THR OG1 : rot 74:sc= 1.25 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 172:sc= 0.958 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= -0.0366 K(o=-0.037,f=-1.2!) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.0238 USER MOD Single : B 357 ASN : amide:sc= -0.0273 K(o=-0.027,f=-1.2) USER MOD Single : B 358 ASN : amide:sc= -0.0169 K(o=-0.017,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 2.865 6.173 9.489 1.00 10.00 N ATOM 2 CA TYR A 21 3.008 5.284 8.316 1.00 10.00 C ATOM 3 C TYR A 21 1.652 4.723 7.907 1.00 10.00 C ATOM 4 O TYR A 21 0.781 4.520 8.751 1.00 10.00 O ATOM 5 CB TYR A 21 3.962 4.131 8.635 1.00 10.00 C ATOM 6 CG TYR A 21 5.426 4.449 8.406 1.00 10.00 C ATOM 7 CD1 TYR A 21 6.023 4.212 7.175 1.00 10.00 C ATOM 8 CD2 TYR A 21 6.210 4.980 9.422 1.00 10.00 C ATOM 9 CE1 TYR A 21 7.360 4.490 6.963 1.00 10.00 C ATOM 10 CE2 TYR A 21 7.546 5.262 9.218 1.00 10.00 C ATOM 11 CZ TYR A 21 8.116 5.018 7.986 1.00 10.00 C ATOM 12 OH TYR A 21 9.449 5.294 7.782 1.00 10.00 O ATOM 0 HA TYR A 21 3.416 5.869 7.492 1.00 10.00 H new ATOM 0 HB2 TYR A 21 3.825 3.839 9.676 1.00 10.00 H new ATOM 0 HB3 TYR A 21 3.690 3.270 8.024 1.00 10.00 H new ATOM 0 HD1 TYR A 21 5.432 3.803 6.369 1.00 10.00 H new ATOM 0 HD2 TYR A 21 5.767 5.176 10.387 1.00 10.00 H new ATOM 0 HE1 TYR A 21 7.809 4.294 6.001 1.00 10.00 H new ATOM 0 HE2 TYR A 21 8.142 5.672 10.020 1.00 10.00 H new ATOM 0 HH TYR A 21 9.836 5.663 8.603 1.00 10.00 H new ATOM 22 N ILE A 22 1.481 4.475 6.616 1.00 10.00 N ATOM 23 CA ILE A 22 0.235 3.927 6.094 1.00 10.00 C ATOM 24 C ILE A 22 0.469 2.502 5.614 1.00 10.00 C ATOM 25 O ILE A 22 1.280 2.269 4.719 1.00 10.00 O ATOM 26 CB ILE A 22 -0.319 4.779 4.927 1.00 10.00 C ATOM 27 CG1 ILE A 22 -0.603 6.212 5.391 1.00 10.00 C ATOM 28 CG2 ILE A 22 -1.574 4.147 4.342 1.00 10.00 C ATOM 29 CD1 ILE A 22 -1.708 6.315 6.420 1.00 10.00 C ATOM 0 H ILE A 22 2.194 4.646 5.906 1.00 10.00 H new ATOM 0 HA ILE A 22 -0.500 3.938 6.898 1.00 10.00 H new ATOM 0 HB ILE A 22 0.439 4.815 4.145 1.00 10.00 H new ATOM 0 HG12 ILE A 22 0.310 6.636 5.809 1.00 10.00 H new ATOM 0 HG13 ILE A 22 -0.869 6.818 4.525 1.00 10.00 H new ATOM 0 HG21 ILE A 22 -1.945 4.764 3.524 1.00 10.00 H new ATOM 0 HG22 ILE A 22 -1.339 3.151 3.968 1.00 10.00 H new ATOM 0 HG23 ILE A 22 -2.339 4.073 5.115 1.00 10.00 H new ATOM 0 HD11 ILE A 22 -1.850 7.359 6.698 1.00 10.00 H new ATOM 0 HD12 ILE A 22 -2.634 5.922 6.000 1.00 10.00 H new ATOM 0 HD13 ILE A 22 -1.437 5.738 7.304 1.00 10.00 H new ATOM 41 N LYS A 23 -0.224 1.553 6.214 1.00 10.00 N ATOM 42 CA LYS A 23 -0.061 0.157 5.847 1.00 10.00 C ATOM 43 C LYS A 23 -1.182 -0.317 4.925 1.00 10.00 C ATOM 44 O LYS A 23 -2.326 -0.487 5.349 1.00 10.00 O ATOM 45 CB LYS A 23 -0.009 -0.714 7.101 1.00 10.00 C ATOM 46 CG LYS A 23 0.216 -2.189 6.817 1.00 10.00 C ATOM 47 CD LYS A 23 -0.268 -3.052 7.971 1.00 10.00 C ATOM 48 CE LYS A 23 -1.678 -3.576 7.736 1.00 10.00 C ATOM 49 NZ LYS A 23 -2.646 -2.497 7.402 1.00 10.00 N ATOM 0 H LYS A 23 -0.904 1.721 6.956 1.00 10.00 H new ATOM 0 HA LYS A 23 0.879 0.064 5.303 1.00 10.00 H new ATOM 0 HB2 LYS A 23 0.789 -0.353 7.749 1.00 10.00 H new ATOM 0 HB3 LYS A 23 -0.943 -0.598 7.651 1.00 10.00 H new ATOM 0 HG2 LYS A 23 -0.309 -2.470 5.904 1.00 10.00 H new ATOM 0 HG3 LYS A 23 1.277 -2.371 6.644 1.00 10.00 H new ATOM 0 HD2 LYS A 23 0.413 -3.892 8.107 1.00 10.00 H new ATOM 0 HD3 LYS A 23 -0.246 -2.471 8.893 1.00 10.00 H new ATOM 0 HE2 LYS A 23 -1.659 -4.305 6.926 1.00 10.00 H new ATOM 0 HE3 LYS A 23 -2.019 -4.100 8.629 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 -3.603 -2.898 7.336 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 -2.626 -1.770 8.145 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 -2.387 -2.068 6.491 1.00 10.00 H new ATOM 63 N LEU A 24 -0.841 -0.537 3.666 1.00 10.00 N ATOM 64 CA LEU A 24 -1.803 -1.004 2.681 1.00 10.00 C ATOM 65 C LEU A 24 -1.788 -2.525 2.636 1.00 10.00 C ATOM 66 O LEU A 24 -0.747 -3.145 2.861 1.00 10.00 O ATOM 67 CB LEU A 24 -1.464 -0.444 1.298 1.00 10.00 C ATOM 68 CG LEU A 24 -1.213 1.064 1.245 1.00 10.00 C ATOM 69 CD1 LEU A 24 -0.628 1.460 -0.099 1.00 10.00 C ATOM 70 CD2 LEU A 24 -2.498 1.831 1.507 1.00 10.00 C ATOM 0 H LEU A 24 0.101 -0.399 3.300 1.00 10.00 H new ATOM 0 HA LEU A 24 -2.796 -0.657 2.966 1.00 10.00 H new ATOM 0 HB2 LEU A 24 -0.577 -0.956 0.925 1.00 10.00 H new ATOM 0 HB3 LEU A 24 -2.281 -0.684 0.617 1.00 10.00 H new ATOM 0 HG LEU A 24 -0.495 1.317 2.025 1.00 10.00 H new ATOM 0 HD11 LEU A 24 -0.456 2.536 -0.118 1.00 10.00 H new ATOM 0 HD12 LEU A 24 0.317 0.939 -0.252 1.00 10.00 H new ATOM 0 HD13 LEU A 24 -1.324 1.190 -0.893 1.00 10.00 H new ATOM 0 HD21 LEU A 24 -2.298 2.902 1.465 1.00 10.00 H new ATOM 0 HD22 LEU A 24 -3.238 1.570 0.750 1.00 10.00 H new ATOM 0 HD23 LEU A 24 -2.881 1.572 2.494 1.00 10.00 H new ATOM 82 N LYS A 25 -2.934 -3.122 2.357 1.00 10.00 N ATOM 83 CA LYS A 25 -3.029 -4.570 2.282 1.00 10.00 C ATOM 84 C LYS A 25 -3.128 -5.019 0.834 1.00 10.00 C ATOM 85 O LYS A 25 -4.171 -4.871 0.191 1.00 10.00 O ATOM 86 CB LYS A 25 -4.226 -5.093 3.079 1.00 10.00 C ATOM 87 CG LYS A 25 -3.888 -5.434 4.522 1.00 10.00 C ATOM 88 CD LYS A 25 -5.019 -6.188 5.206 1.00 10.00 C ATOM 89 CE LYS A 25 -4.966 -7.679 4.907 1.00 10.00 C ATOM 90 NZ LYS A 25 -5.960 -8.449 5.707 1.00 10.00 N ATOM 0 H LYS A 25 -3.809 -2.629 2.179 1.00 10.00 H new ATOM 0 HA LYS A 25 -2.123 -4.986 2.723 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -5.017 -4.343 3.066 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -4.621 -5.981 2.586 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -2.981 -6.037 4.550 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -3.678 -4.517 5.072 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -4.961 -6.031 6.283 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -5.976 -5.785 4.876 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -5.152 -7.842 3.845 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -3.964 -8.054 5.116 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -5.798 -9.468 5.574 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -5.855 -8.210 6.714 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -6.921 -8.207 5.392 1.00 10.00 H new ATOM 104 N VAL A 26 -2.031 -5.546 0.322 1.00 10.00 N ATOM 105 CA VAL A 26 -1.980 -6.028 -1.047 1.00 10.00 C ATOM 106 C VAL A 26 -2.433 -7.478 -1.088 1.00 10.00 C ATOM 107 O VAL A 26 -1.912 -8.315 -0.352 1.00 10.00 O ATOM 108 CB VAL A 26 -0.559 -5.923 -1.645 1.00 10.00 C ATOM 109 CG1 VAL A 26 -0.605 -6.041 -3.162 1.00 10.00 C ATOM 110 CG2 VAL A 26 0.118 -4.626 -1.230 1.00 10.00 C ATOM 0 H VAL A 26 -1.157 -5.652 0.838 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.643 -5.402 -1.644 1.00 10.00 H new ATOM 0 HB VAL A 26 0.031 -6.750 -1.251 1.00 10.00 H new ATOM 0 HG11 VAL A 26 0.405 -5.965 -3.564 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -1.034 -7.004 -3.439 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -1.220 -5.239 -3.571 1.00 10.00 H new ATOM 0 HG21 VAL A 26 1.116 -4.581 -1.666 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.471 -3.779 -1.583 1.00 10.00 H new ATOM 0 HG23 VAL A 26 0.195 -4.587 -0.143 1.00 10.00 H new ATOM 120 N ILE A 27 -3.412 -7.771 -1.923 1.00 10.00 N ATOM 121 CA ILE A 27 -3.919 -9.129 -2.035 1.00 10.00 C ATOM 122 C ILE A 27 -3.318 -9.826 -3.247 1.00 10.00 C ATOM 123 O ILE A 27 -3.528 -9.406 -4.388 1.00 10.00 O ATOM 124 CB ILE A 27 -5.462 -9.164 -2.129 1.00 10.00 C ATOM 125 CG1 ILE A 27 -6.098 -8.459 -0.922 1.00 10.00 C ATOM 126 CG2 ILE A 27 -5.961 -10.601 -2.228 1.00 10.00 C ATOM 127 CD1 ILE A 27 -5.731 -9.074 0.417 1.00 10.00 C ATOM 0 H ILE A 27 -3.871 -7.093 -2.531 1.00 10.00 H new ATOM 0 HA ILE A 27 -3.623 -9.656 -1.128 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.758 -8.631 -3.033 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -5.795 -7.412 -0.925 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -7.182 -8.477 -1.034 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -7.049 -10.605 -2.293 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -5.543 -11.071 -3.118 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -5.649 -11.156 -1.344 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -6.220 -8.519 1.218 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -6.059 -10.113 0.442 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -4.650 -9.031 0.553 1.00 10.00 H new ATOM 139 N GLY A 28 -2.552 -10.875 -2.991 1.00 10.00 N ATOM 140 CA GLY A 28 -1.934 -11.618 -4.066 1.00 10.00 C ATOM 141 C GLY A 28 -2.859 -12.684 -4.623 1.00 10.00 C ATOM 142 O GLY A 28 -3.900 -12.976 -4.030 1.00 10.00 O ATOM 0 H GLY A 28 -2.347 -11.225 -2.055 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -1.649 -10.932 -4.864 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -1.018 -12.085 -3.704 1.00 10.00 H new ATOM 146 N GLN A 29 -2.473 -13.279 -5.747 1.00 10.00 N ATOM 147 CA GLN A 29 -3.276 -14.316 -6.395 1.00 10.00 C ATOM 148 C GLN A 29 -3.489 -15.519 -5.472 1.00 10.00 C ATOM 149 O GLN A 29 -4.544 -16.157 -5.498 1.00 10.00 O ATOM 150 CB GLN A 29 -2.605 -14.764 -7.700 1.00 10.00 C ATOM 151 CG GLN A 29 -3.379 -15.837 -8.456 1.00 10.00 C ATOM 152 CD GLN A 29 -4.761 -15.380 -8.890 1.00 10.00 C ATOM 153 OE1 GLN A 29 -4.939 -14.836 -9.981 1.00 10.00 O ATOM 154 NE2 GLN A 29 -5.753 -15.608 -8.042 1.00 10.00 N ATOM 0 H GLN A 29 -1.603 -13.060 -6.233 1.00 10.00 H new ATOM 0 HA GLN A 29 -4.254 -13.890 -6.620 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -2.478 -13.897 -8.348 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -1.608 -15.141 -7.473 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -2.809 -16.136 -9.336 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -3.476 -16.720 -7.824 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -5.565 -16.061 -7.148 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -6.704 -15.330 -8.283 1.00 10.00 H new ATOM 163 N ASP A 30 -2.497 -15.807 -4.639 1.00 10.00 N ATOM 164 CA ASP A 30 -2.571 -16.937 -3.714 1.00 10.00 C ATOM 165 C ASP A 30 -3.255 -16.547 -2.404 1.00 10.00 C ATOM 166 O ASP A 30 -3.055 -17.191 -1.373 1.00 10.00 O ATOM 167 CB ASP A 30 -1.166 -17.488 -3.433 1.00 10.00 C ATOM 168 CG ASP A 30 -0.250 -16.475 -2.774 1.00 10.00 C ATOM 169 OD1 ASP A 30 0.174 -15.515 -3.456 1.00 10.00 O ATOM 170 OD2 ASP A 30 0.060 -16.637 -1.577 1.00 10.00 O ATOM 0 H ASP A 30 -1.629 -15.274 -4.583 1.00 10.00 H new ATOM 0 HA ASP A 30 -3.172 -17.713 -4.187 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -1.248 -18.366 -2.792 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -0.718 -17.819 -4.370 1.00 10.00 H new ATOM 175 N SER A 31 -4.071 -15.494 -2.459 1.00 10.00 N ATOM 176 CA SER A 31 -4.800 -15.002 -1.292 1.00 10.00 C ATOM 177 C SER A 31 -3.838 -14.554 -0.192 1.00 10.00 C ATOM 178 O SER A 31 -4.131 -14.669 1.000 1.00 10.00 O ATOM 179 CB SER A 31 -5.758 -16.078 -0.770 1.00 10.00 C ATOM 180 OG SER A 31 -6.767 -16.372 -1.727 1.00 10.00 O ATOM 0 H SER A 31 -4.244 -14.960 -3.311 1.00 10.00 H new ATOM 0 HA SER A 31 -5.385 -14.134 -1.597 1.00 10.00 H new ATOM 0 HB2 SER A 31 -5.199 -16.984 -0.536 1.00 10.00 H new ATOM 0 HB3 SER A 31 -6.220 -15.739 0.158 1.00 10.00 H new ATOM 0 HG SER A 31 -7.364 -17.062 -1.371 1.00 10.00 H new ATOM 186 N SER A 32 -2.687 -14.049 -0.606 1.00 10.00 N ATOM 187 CA SER A 32 -1.683 -13.569 0.322 1.00 10.00 C ATOM 188 C SER A 32 -1.986 -12.129 0.706 1.00 10.00 C ATOM 189 O SER A 32 -2.398 -11.333 -0.139 1.00 10.00 O ATOM 190 CB SER A 32 -0.302 -13.666 -0.323 1.00 10.00 C ATOM 191 OG SER A 32 -0.401 -13.553 -1.735 1.00 10.00 O ATOM 0 H SER A 32 -2.426 -13.962 -1.588 1.00 10.00 H new ATOM 0 HA SER A 32 -1.696 -14.183 1.223 1.00 10.00 H new ATOM 0 HB2 SER A 32 0.343 -12.878 0.066 1.00 10.00 H new ATOM 0 HB3 SER A 32 0.162 -14.617 -0.060 1.00 10.00 H new ATOM 0 HG SER A 32 0.194 -14.206 -2.158 1.00 10.00 H new ATOM 197 N GLU A 33 -1.793 -11.802 1.970 1.00 10.00 N ATOM 198 CA GLU A 33 -2.053 -10.462 2.453 1.00 10.00 C ATOM 199 C GLU A 33 -0.742 -9.741 2.739 1.00 10.00 C ATOM 200 O GLU A 33 -0.149 -9.899 3.806 1.00 10.00 O ATOM 201 CB GLU A 33 -2.915 -10.520 3.710 1.00 10.00 C ATOM 202 CG GLU A 33 -4.189 -11.330 3.526 1.00 10.00 C ATOM 203 CD GLU A 33 -4.724 -11.877 4.830 1.00 10.00 C ATOM 204 OE1 GLU A 33 -5.352 -11.101 5.585 1.00 10.00 O ATOM 205 OE2 GLU A 33 -4.530 -13.085 5.100 1.00 10.00 O ATOM 0 H GLU A 33 -1.456 -12.450 2.682 1.00 10.00 H new ATOM 0 HA GLU A 33 -2.591 -9.907 1.685 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.332 -10.952 4.523 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -3.177 -9.505 4.010 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -4.949 -10.703 3.060 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.994 -12.156 2.842 1.00 10.00 H new ATOM 212 N ILE A 34 -0.290 -8.954 1.778 1.00 10.00 N ATOM 213 CA ILE A 34 0.961 -8.225 1.924 1.00 10.00 C ATOM 214 C ILE A 34 0.744 -6.937 2.707 1.00 10.00 C ATOM 215 O ILE A 34 -0.128 -6.135 2.371 1.00 10.00 O ATOM 216 CB ILE A 34 1.601 -7.865 0.562 1.00 10.00 C ATOM 217 CG1 ILE A 34 1.188 -8.854 -0.546 1.00 10.00 C ATOM 218 CG2 ILE A 34 3.119 -7.812 0.699 1.00 10.00 C ATOM 219 CD1 ILE A 34 1.680 -10.272 -0.347 1.00 10.00 C ATOM 0 H ILE A 34 -0.768 -8.803 0.890 1.00 10.00 H new ATOM 0 HA ILE A 34 1.638 -8.889 2.461 1.00 10.00 H new ATOM 0 HB ILE A 34 1.233 -6.882 0.268 1.00 10.00 H new ATOM 0 HG12 ILE A 34 0.100 -8.868 -0.614 1.00 10.00 H new ATOM 0 HG13 ILE A 34 1.562 -8.485 -1.501 1.00 10.00 H new ATOM 0 HG21 ILE A 34 3.563 -7.558 -0.264 1.00 10.00 H new ATOM 0 HG22 ILE A 34 3.392 -7.056 1.435 1.00 10.00 H new ATOM 0 HG23 ILE A 34 3.489 -8.784 1.024 1.00 10.00 H new ATOM 0 HD11 ILE A 34 1.341 -10.894 -1.175 1.00 10.00 H new ATOM 0 HD12 ILE A 34 2.769 -10.278 -0.311 1.00 10.00 H new ATOM 0 HD13 ILE A 34 1.284 -10.666 0.589 1.00 10.00 H new ATOM 231 N HIS A 35 1.535 -6.743 3.750 1.00 10.00 N ATOM 232 CA HIS A 35 1.440 -5.549 4.571 1.00 10.00 C ATOM 233 C HIS A 35 2.475 -4.533 4.099 1.00 10.00 C ATOM 234 O HIS A 35 3.610 -4.506 4.584 1.00 10.00 O ATOM 235 CB HIS A 35 1.658 -5.887 6.055 1.00 10.00 C ATOM 236 CG HIS A 35 0.469 -6.514 6.726 1.00 10.00 C ATOM 237 ND1 HIS A 35 0.428 -6.688 8.088 1.00 10.00 N ATOM 238 CD2 HIS A 35 -0.689 -6.973 6.189 1.00 10.00 C ATOM 239 CE1 HIS A 35 -0.741 -7.244 8.350 1.00 10.00 C ATOM 240 NE2 HIS A 35 -1.453 -7.437 7.231 1.00 10.00 N ATOM 0 H HIS A 35 2.254 -7.402 4.048 1.00 10.00 H new ATOM 0 HA HIS A 35 0.441 -5.125 4.469 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.508 -6.564 6.141 1.00 10.00 H new ATOM 0 HB3 HIS A 35 1.923 -4.974 6.589 1.00 10.00 H new ATOM 0 HD2 HIS A 35 -0.958 -6.973 5.143 1.00 10.00 H new ATOM 0 HE1 HIS A 35 -1.080 -7.509 9.340 1.00 10.00 H new ATOM 0 HE2 HIS A 35 -2.384 -7.849 7.166 1.00 10.00 H new ATOM 248 N PHE A 36 2.086 -3.720 3.127 1.00 10.00 N ATOM 249 CA PHE A 36 2.976 -2.715 2.571 1.00 10.00 C ATOM 250 C PHE A 36 2.891 -1.428 3.379 1.00 10.00 C ATOM 251 O PHE A 36 1.904 -0.697 3.292 1.00 10.00 O ATOM 252 CB PHE A 36 2.614 -2.436 1.110 1.00 10.00 C ATOM 253 CG PHE A 36 3.803 -2.265 0.200 1.00 10.00 C ATOM 254 CD1 PHE A 36 5.037 -1.882 0.704 1.00 10.00 C ATOM 255 CD2 PHE A 36 3.681 -2.484 -1.163 1.00 10.00 C ATOM 256 CE1 PHE A 36 6.125 -1.728 -0.134 1.00 10.00 C ATOM 257 CE2 PHE A 36 4.766 -2.331 -2.004 1.00 10.00 C ATOM 258 CZ PHE A 36 5.988 -1.951 -1.490 1.00 10.00 C ATOM 0 H PHE A 36 1.157 -3.738 2.707 1.00 10.00 H new ATOM 0 HA PHE A 36 3.997 -3.094 2.617 1.00 10.00 H new ATOM 0 HB2 PHE A 36 2.000 -3.256 0.737 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.003 -1.534 1.065 1.00 10.00 H new ATOM 0 HD1 PHE A 36 5.149 -1.702 1.763 1.00 10.00 H new ATOM 0 HD2 PHE A 36 2.726 -2.778 -1.573 1.00 10.00 H new ATOM 0 HE1 PHE A 36 7.082 -1.433 0.271 1.00 10.00 H new ATOM 0 HE2 PHE A 36 4.657 -2.509 -3.064 1.00 10.00 H new ATOM 0 HZ PHE A 36 6.836 -1.828 -2.147 1.00 10.00 H new ATOM 268 N LYS A 37 3.918 -1.155 4.167 1.00 10.00 N ATOM 269 CA LYS A 37 3.940 0.042 4.988 1.00 10.00 C ATOM 270 C LYS A 37 4.621 1.188 4.251 1.00 10.00 C ATOM 271 O LYS A 37 5.845 1.214 4.113 1.00 10.00 O ATOM 272 CB LYS A 37 4.651 -0.231 6.313 1.00 10.00 C ATOM 273 CG LYS A 37 4.360 0.815 7.376 1.00 10.00 C ATOM 274 CD LYS A 37 4.912 0.411 8.734 1.00 10.00 C ATOM 275 CE LYS A 37 4.228 -0.838 9.268 1.00 10.00 C ATOM 276 NZ LYS A 37 4.311 -0.924 10.748 1.00 10.00 N ATOM 0 H LYS A 37 4.745 -1.745 4.255 1.00 10.00 H new ATOM 0 HA LYS A 37 2.910 0.330 5.197 1.00 10.00 H new ATOM 0 HB2 LYS A 37 4.350 -1.210 6.684 1.00 10.00 H new ATOM 0 HB3 LYS A 37 5.726 -0.273 6.139 1.00 10.00 H new ATOM 0 HG2 LYS A 37 4.795 1.768 7.076 1.00 10.00 H new ATOM 0 HG3 LYS A 37 3.283 0.966 7.452 1.00 10.00 H new ATOM 0 HD2 LYS A 37 5.984 0.233 8.653 1.00 10.00 H new ATOM 0 HD3 LYS A 37 4.778 1.230 9.440 1.00 10.00 H new ATOM 0 HE2 LYS A 37 3.182 -0.838 8.962 1.00 10.00 H new ATOM 0 HE3 LYS A 37 4.689 -1.722 8.826 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 3.833 -1.789 11.073 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 5.309 -0.950 11.039 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 3.849 -0.094 11.170 1.00 10.00 H new ATOM 290 N VAL A 38 3.818 2.124 3.769 1.00 10.00 N ATOM 291 CA VAL A 38 4.326 3.278 3.046 1.00 10.00 C ATOM 292 C VAL A 38 4.302 4.514 3.942 1.00 10.00 C ATOM 293 O VAL A 38 3.682 4.507 5.007 1.00 10.00 O ATOM 294 CB VAL A 38 3.511 3.555 1.757 1.00 10.00 C ATOM 295 CG1 VAL A 38 3.343 2.284 0.939 1.00 10.00 C ATOM 296 CG2 VAL A 38 2.153 4.163 2.081 1.00 10.00 C ATOM 0 H VAL A 38 2.803 2.105 3.867 1.00 10.00 H new ATOM 0 HA VAL A 38 5.352 3.054 2.755 1.00 10.00 H new ATOM 0 HB VAL A 38 4.070 4.277 1.162 1.00 10.00 H new ATOM 0 HG11 VAL A 38 2.768 2.504 0.039 1.00 10.00 H new ATOM 0 HG12 VAL A 38 4.324 1.900 0.658 1.00 10.00 H new ATOM 0 HG13 VAL A 38 2.817 1.536 1.532 1.00 10.00 H new ATOM 0 HG21 VAL A 38 1.606 4.345 1.156 1.00 10.00 H new ATOM 0 HG22 VAL A 38 1.586 3.475 2.708 1.00 10.00 H new ATOM 0 HG23 VAL A 38 2.293 5.105 2.611 1.00 10.00 H new ATOM 306 N LYS A 39 4.971 5.572 3.515 1.00 10.00 N ATOM 307 CA LYS A 39 5.014 6.802 4.285 1.00 10.00 C ATOM 308 C LYS A 39 4.367 7.937 3.499 1.00 10.00 C ATOM 309 O LYS A 39 4.577 8.062 2.290 1.00 10.00 O ATOM 310 CB LYS A 39 6.462 7.154 4.639 1.00 10.00 C ATOM 311 CG LYS A 39 6.595 8.164 5.766 1.00 10.00 C ATOM 312 CD LYS A 39 8.056 8.457 6.071 1.00 10.00 C ATOM 313 CE LYS A 39 8.215 9.711 6.908 1.00 10.00 C ATOM 314 NZ LYS A 39 9.621 10.195 6.908 1.00 10.00 N ATOM 0 H LYS A 39 5.492 5.603 2.639 1.00 10.00 H new ATOM 0 HA LYS A 39 4.456 6.658 5.210 1.00 10.00 H new ATOM 0 HB2 LYS A 39 6.989 6.242 4.919 1.00 10.00 H new ATOM 0 HB3 LYS A 39 6.957 7.548 3.751 1.00 10.00 H new ATOM 0 HG2 LYS A 39 6.085 9.088 5.492 1.00 10.00 H new ATOM 0 HG3 LYS A 39 6.103 7.782 6.661 1.00 10.00 H new ATOM 0 HD2 LYS A 39 8.494 7.610 6.598 1.00 10.00 H new ATOM 0 HD3 LYS A 39 8.607 8.571 5.137 1.00 10.00 H new ATOM 0 HE2 LYS A 39 7.561 10.492 6.521 1.00 10.00 H new ATOM 0 HE3 LYS A 39 7.899 9.508 7.931 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 9.693 11.054 7.490 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 10.242 9.458 7.300 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 9.913 10.412 5.934 1.00 10.00 H new ATOM 328 N MET A 40 3.575 8.750 4.186 1.00 10.00 N ATOM 329 CA MET A 40 2.892 9.872 3.554 1.00 10.00 C ATOM 330 C MET A 40 3.871 11.015 3.277 1.00 10.00 C ATOM 331 O MET A 40 3.904 12.013 4.001 1.00 10.00 O ATOM 332 CB MET A 40 1.732 10.354 4.435 1.00 10.00 C ATOM 333 CG MET A 40 0.905 11.472 3.813 1.00 10.00 C ATOM 334 SD MET A 40 0.209 11.022 2.210 1.00 10.00 S ATOM 335 CE MET A 40 -1.057 9.852 2.704 1.00 10.00 C ATOM 0 H MET A 40 3.389 8.653 5.184 1.00 10.00 H new ATOM 0 HA MET A 40 2.486 9.536 2.600 1.00 10.00 H new ATOM 0 HB2 MET A 40 1.078 9.509 4.651 1.00 10.00 H new ATOM 0 HB3 MET A 40 2.132 10.699 5.388 1.00 10.00 H new ATOM 0 HG2 MET A 40 0.096 11.740 4.493 1.00 10.00 H new ATOM 0 HG3 MET A 40 1.530 12.358 3.697 1.00 10.00 H new ATOM 0 HE1 MET A 40 -1.925 9.960 2.054 1.00 10.00 H new ATOM 0 HE2 MET A 40 -0.667 8.838 2.623 1.00 10.00 H new ATOM 0 HE3 MET A 40 -1.350 10.047 3.736 1.00 10.00 H new ATOM 345 N THR A 41 4.680 10.835 2.238 1.00 10.00 N ATOM 346 CA THR A 41 5.672 11.823 1.822 1.00 10.00 C ATOM 347 C THR A 41 6.551 11.250 0.711 1.00 10.00 C ATOM 348 O THR A 41 7.040 11.981 -0.148 1.00 10.00 O ATOM 349 CB THR A 41 6.563 12.293 3.002 1.00 10.00 C ATOM 350 OG1 THR A 41 7.486 13.305 2.570 1.00 10.00 O ATOM 351 CG2 THR A 41 7.334 11.135 3.616 1.00 10.00 C ATOM 0 H THR A 41 4.667 9.996 1.658 1.00 10.00 H new ATOM 0 HA THR A 41 5.126 12.691 1.453 1.00 10.00 H new ATOM 0 HB THR A 41 5.899 12.708 3.760 1.00 10.00 H new ATOM 0 HG1 THR A 41 8.038 13.590 3.328 1.00 10.00 H new ATOM 0 HG21 THR A 41 7.947 11.502 4.439 1.00 10.00 H new ATOM 0 HG22 THR A 41 6.633 10.389 3.990 1.00 10.00 H new ATOM 0 HG23 THR A 41 7.975 10.683 2.859 1.00 10.00 H new ATOM 359 N THR A 42 6.742 9.938 0.734 1.00 10.00 N ATOM 360 CA THR A 42 7.550 9.266 -0.266 1.00 10.00 C ATOM 361 C THR A 42 6.721 8.976 -1.512 1.00 10.00 C ATOM 362 O THR A 42 5.517 8.712 -1.422 1.00 10.00 O ATOM 363 CB THR A 42 8.112 7.952 0.298 1.00 10.00 C ATOM 364 OG1 THR A 42 8.223 8.063 1.721 1.00 10.00 O ATOM 365 CG2 THR A 42 9.478 7.639 -0.300 1.00 10.00 C ATOM 0 H THR A 42 6.345 9.318 1.440 1.00 10.00 H new ATOM 0 HA THR A 42 8.378 9.922 -0.535 1.00 10.00 H new ATOM 0 HB THR A 42 7.433 7.140 0.036 1.00 10.00 H new ATOM 0 HG1 THR A 42 8.580 7.227 2.088 1.00 10.00 H new ATOM 0 HG21 THR A 42 9.852 6.704 0.117 1.00 10.00 H new ATOM 0 HG22 THR A 42 9.388 7.544 -1.382 1.00 10.00 H new ATOM 0 HG23 THR A 42 10.172 8.445 -0.063 1.00 10.00 H new ATOM 373 N HIS A 43 7.362 9.039 -2.666 1.00 10.00 N ATOM 374 CA HIS A 43 6.688 8.789 -3.932 1.00 10.00 C ATOM 375 C HIS A 43 6.470 7.295 -4.125 1.00 10.00 C ATOM 376 O HIS A 43 7.290 6.480 -3.697 1.00 10.00 O ATOM 377 CB HIS A 43 7.509 9.353 -5.098 1.00 10.00 C ATOM 378 CG HIS A 43 8.006 10.747 -4.860 1.00 10.00 C ATOM 379 ND1 HIS A 43 9.306 10.987 -4.480 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.338 11.924 -4.921 1.00 10.00 C ATOM 381 CE1 HIS A 43 9.398 12.297 -4.318 1.00 10.00 C ATOM 382 NE2 HIS A 43 8.232 12.905 -4.574 1.00 10.00 N ATOM 0 H HIS A 43 8.353 9.262 -2.754 1.00 10.00 H new ATOM 0 HA HIS A 43 5.720 9.289 -3.912 1.00 10.00 H new ATOM 0 HB2 HIS A 43 8.361 8.699 -5.282 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.898 9.343 -6.001 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.302 12.063 -5.191 1.00 10.00 H new ATOM 0 HE1 HIS A 43 10.299 12.811 -4.017 1.00 10.00 H new ATOM 0 HE2 HIS A 43 8.045 13.906 -4.521 1.00 10.00 H new ATOM 390 N LEU A 44 5.375 6.935 -4.787 1.00 10.00 N ATOM 391 CA LEU A 44 5.057 5.532 -5.035 1.00 10.00 C ATOM 392 C LEU A 44 6.043 4.924 -6.028 1.00 10.00 C ATOM 393 O LEU A 44 6.040 3.716 -6.264 1.00 10.00 O ATOM 394 CB LEU A 44 3.618 5.385 -5.535 1.00 10.00 C ATOM 395 CG LEU A 44 2.545 5.521 -4.449 1.00 10.00 C ATOM 396 CD1 LEU A 44 1.165 5.633 -5.070 1.00 10.00 C ATOM 397 CD2 LEU A 44 2.604 4.343 -3.488 1.00 10.00 C ATOM 0 H LEU A 44 4.693 7.595 -5.161 1.00 10.00 H new ATOM 0 HA LEU A 44 5.146 4.989 -4.094 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.436 6.137 -6.303 1.00 10.00 H new ATOM 0 HB3 LEU A 44 3.511 4.411 -6.012 1.00 10.00 H new ATOM 0 HG LEU A 44 2.742 6.434 -3.887 1.00 10.00 H new ATOM 0 HD11 LEU A 44 0.418 5.729 -4.282 1.00 10.00 H new ATOM 0 HD12 LEU A 44 1.126 6.511 -5.715 1.00 10.00 H new ATOM 0 HD13 LEU A 44 0.958 4.740 -5.660 1.00 10.00 H new ATOM 0 HD21 LEU A 44 1.835 4.458 -2.724 1.00 10.00 H new ATOM 0 HD22 LEU A 44 2.435 3.417 -4.037 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.585 4.310 -3.013 1.00 10.00 H new ATOM 409 N LYS A 45 6.889 5.778 -6.593 1.00 10.00 N ATOM 410 CA LYS A 45 7.911 5.360 -7.540 1.00 10.00 C ATOM 411 C LYS A 45 8.803 4.287 -6.916 1.00 10.00 C ATOM 412 O LYS A 45 8.978 3.203 -7.477 1.00 10.00 O ATOM 413 CB LYS A 45 8.751 6.576 -7.954 1.00 10.00 C ATOM 414 CG LYS A 45 10.086 6.226 -8.589 1.00 10.00 C ATOM 415 CD LYS A 45 9.908 5.571 -9.945 1.00 10.00 C ATOM 416 CE LYS A 45 11.133 4.767 -10.337 1.00 10.00 C ATOM 417 NZ LYS A 45 10.935 4.044 -11.619 1.00 10.00 N ATOM 0 H LYS A 45 6.884 6.781 -6.406 1.00 10.00 H new ATOM 0 HA LYS A 45 7.432 4.938 -8.423 1.00 10.00 H new ATOM 0 HB2 LYS A 45 8.175 7.179 -8.656 1.00 10.00 H new ATOM 0 HB3 LYS A 45 8.931 7.195 -7.075 1.00 10.00 H new ATOM 0 HG2 LYS A 45 10.685 7.130 -8.697 1.00 10.00 H new ATOM 0 HG3 LYS A 45 10.637 5.555 -7.930 1.00 10.00 H new ATOM 0 HD2 LYS A 45 9.035 4.919 -9.924 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.717 6.336 -10.698 1.00 10.00 H new ATOM 0 HE2 LYS A 45 11.991 5.433 -10.425 1.00 10.00 H new ATOM 0 HE3 LYS A 45 11.365 4.051 -9.549 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 11.387 3.109 -11.564 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 9.917 3.927 -11.798 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.362 4.589 -12.395 1.00 10.00 H new ATOM 431 N LYS A 46 9.334 4.589 -5.738 1.00 10.00 N ATOM 432 CA LYS A 46 10.209 3.665 -5.032 1.00 10.00 C ATOM 433 C LYS A 46 9.422 2.463 -4.519 1.00 10.00 C ATOM 434 O LYS A 46 9.936 1.348 -4.466 1.00 10.00 O ATOM 435 CB LYS A 46 10.910 4.385 -3.875 1.00 10.00 C ATOM 436 CG LYS A 46 11.757 3.471 -2.999 1.00 10.00 C ATOM 437 CD LYS A 46 12.993 4.181 -2.463 1.00 10.00 C ATOM 438 CE LYS A 46 12.628 5.298 -1.500 1.00 10.00 C ATOM 439 NZ LYS A 46 13.801 5.768 -0.720 1.00 10.00 N ATOM 0 H LYS A 46 9.172 5.470 -5.251 1.00 10.00 H new ATOM 0 HA LYS A 46 10.966 3.302 -5.727 1.00 10.00 H new ATOM 0 HB2 LYS A 46 11.545 5.172 -4.282 1.00 10.00 H new ATOM 0 HB3 LYS A 46 10.158 4.871 -3.254 1.00 10.00 H new ATOM 0 HG2 LYS A 46 11.156 3.109 -2.165 1.00 10.00 H new ATOM 0 HG3 LYS A 46 12.062 2.597 -3.575 1.00 10.00 H new ATOM 0 HD2 LYS A 46 13.636 3.460 -1.957 1.00 10.00 H new ATOM 0 HD3 LYS A 46 13.566 4.591 -3.295 1.00 10.00 H new ATOM 0 HE2 LYS A 46 12.206 6.134 -2.058 1.00 10.00 H new ATOM 0 HE3 LYS A 46 11.855 4.948 -0.816 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 13.507 6.530 -0.076 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 14.189 4.978 -0.167 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 14.529 6.126 -1.370 1.00 10.00 H new ATOM 453 N LEU A 47 8.167 2.693 -4.161 1.00 10.00 N ATOM 454 CA LEU A 47 7.309 1.629 -3.651 1.00 10.00 C ATOM 455 C LEU A 47 7.070 0.561 -4.714 1.00 10.00 C ATOM 456 O LEU A 47 7.068 -0.634 -4.414 1.00 10.00 O ATOM 457 CB LEU A 47 5.968 2.198 -3.166 1.00 10.00 C ATOM 458 CG LEU A 47 5.950 2.721 -1.724 1.00 10.00 C ATOM 459 CD1 LEU A 47 6.514 1.686 -0.767 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.719 4.027 -1.606 1.00 10.00 C ATOM 0 H LEU A 47 7.718 3.607 -4.214 1.00 10.00 H new ATOM 0 HA LEU A 47 7.820 1.167 -2.806 1.00 10.00 H new ATOM 0 HB2 LEU A 47 5.677 3.011 -3.831 1.00 10.00 H new ATOM 0 HB3 LEU A 47 5.209 1.421 -3.261 1.00 10.00 H new ATOM 0 HG LEU A 47 4.912 2.912 -1.453 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.491 2.079 0.249 1.00 10.00 H new ATOM 0 HD12 LEU A 47 5.914 0.778 -0.818 1.00 10.00 H new ATOM 0 HD13 LEU A 47 7.543 1.457 -1.044 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.690 4.375 -0.573 1.00 10.00 H new ATOM 0 HD22 LEU A 47 7.755 3.868 -1.906 1.00 10.00 H new ATOM 0 HD23 LEU A 47 6.265 4.777 -2.254 1.00 10.00 H new ATOM 472 N LYS A 48 6.891 0.997 -5.956 1.00 10.00 N ATOM 473 CA LYS A 48 6.647 0.083 -7.066 1.00 10.00 C ATOM 474 C LYS A 48 7.820 -0.873 -7.278 1.00 10.00 C ATOM 475 O LYS A 48 7.621 -2.074 -7.464 1.00 10.00 O ATOM 476 CB LYS A 48 6.367 0.866 -8.354 1.00 10.00 C ATOM 477 CG LYS A 48 5.001 1.539 -8.376 1.00 10.00 C ATOM 478 CD LYS A 48 4.758 2.289 -9.680 1.00 10.00 C ATOM 479 CE LYS A 48 4.571 1.338 -10.853 1.00 10.00 C ATOM 480 NZ LYS A 48 4.259 2.062 -12.116 1.00 10.00 N ATOM 0 H LYS A 48 6.910 1.982 -6.220 1.00 10.00 H new ATOM 0 HA LYS A 48 5.771 -0.513 -6.812 1.00 10.00 H new ATOM 0 HB2 LYS A 48 7.138 1.625 -8.482 1.00 10.00 H new ATOM 0 HB3 LYS A 48 6.442 0.188 -9.204 1.00 10.00 H new ATOM 0 HG2 LYS A 48 4.224 0.787 -8.239 1.00 10.00 H new ATOM 0 HG3 LYS A 48 4.924 2.233 -7.539 1.00 10.00 H new ATOM 0 HD2 LYS A 48 3.874 2.918 -9.578 1.00 10.00 H new ATOM 0 HD3 LYS A 48 5.600 2.952 -9.880 1.00 10.00 H new ATOM 0 HE2 LYS A 48 5.477 0.747 -10.988 1.00 10.00 H new ATOM 0 HE3 LYS A 48 3.766 0.639 -10.628 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 4.422 1.431 -12.927 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 3.264 2.364 -12.106 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 4.873 2.897 -12.198 1.00 10.00 H new ATOM 494 N GLU A 49 9.039 -0.349 -7.235 1.00 10.00 N ATOM 495 CA GLU A 49 10.222 -1.179 -7.439 1.00 10.00 C ATOM 496 C GLU A 49 10.532 -2.021 -6.201 1.00 10.00 C ATOM 497 O GLU A 49 11.076 -3.120 -6.314 1.00 10.00 O ATOM 498 CB GLU A 49 11.432 -0.323 -7.835 1.00 10.00 C ATOM 499 CG GLU A 49 11.658 0.882 -6.941 1.00 10.00 C ATOM 500 CD GLU A 49 12.836 1.721 -7.389 1.00 10.00 C ATOM 501 OE1 GLU A 49 13.971 1.436 -6.960 1.00 10.00 O ATOM 502 OE2 GLU A 49 12.633 2.668 -8.175 1.00 10.00 O ATOM 0 H GLU A 49 9.235 0.637 -7.063 1.00 10.00 H new ATOM 0 HA GLU A 49 10.007 -1.863 -8.260 1.00 10.00 H new ATOM 0 HB2 GLU A 49 12.326 -0.947 -7.819 1.00 10.00 H new ATOM 0 HB3 GLU A 49 11.301 0.019 -8.862 1.00 10.00 H new ATOM 0 HG2 GLU A 49 10.759 1.498 -6.933 1.00 10.00 H new ATOM 0 HG3 GLU A 49 11.823 0.546 -5.918 1.00 10.00 H new ATOM 509 N SER A 50 10.159 -1.523 -5.023 1.00 10.00 N ATOM 510 CA SER A 50 10.403 -2.247 -3.778 1.00 10.00 C ATOM 511 C SER A 50 9.641 -3.571 -3.756 1.00 10.00 C ATOM 512 O SER A 50 10.152 -4.589 -3.284 1.00 10.00 O ATOM 513 CB SER A 50 10.007 -1.390 -2.575 1.00 10.00 C ATOM 514 OG SER A 50 10.780 -0.206 -2.523 1.00 10.00 O ATOM 0 H SER A 50 9.689 -0.625 -4.905 1.00 10.00 H new ATOM 0 HA SER A 50 11.469 -2.465 -3.719 1.00 10.00 H new ATOM 0 HB2 SER A 50 8.949 -1.136 -2.637 1.00 10.00 H new ATOM 0 HB3 SER A 50 10.145 -1.960 -1.656 1.00 10.00 H new ATOM 0 HG SER A 50 10.774 0.227 -3.402 1.00 10.00 H new ATOM 520 N TYR A 51 8.418 -3.560 -4.278 1.00 10.00 N ATOM 521 CA TYR A 51 7.606 -4.769 -4.325 1.00 10.00 C ATOM 522 C TYR A 51 8.231 -5.776 -5.280 1.00 10.00 C ATOM 523 O TYR A 51 8.189 -6.984 -5.043 1.00 10.00 O ATOM 524 CB TYR A 51 6.176 -4.450 -4.761 1.00 10.00 C ATOM 525 CG TYR A 51 5.212 -5.597 -4.550 1.00 10.00 C ATOM 526 CD1 TYR A 51 4.740 -5.909 -3.281 1.00 10.00 C ATOM 527 CD2 TYR A 51 4.775 -6.370 -5.619 1.00 10.00 C ATOM 528 CE1 TYR A 51 3.862 -6.956 -3.084 1.00 10.00 C ATOM 529 CE2 TYR A 51 3.895 -7.418 -5.428 1.00 10.00 C ATOM 530 CZ TYR A 51 3.445 -7.708 -4.160 1.00 10.00 C ATOM 531 OH TYR A 51 2.573 -8.752 -3.967 1.00 10.00 O ATOM 0 H TYR A 51 7.971 -2.732 -4.672 1.00 10.00 H new ATOM 0 HA TYR A 51 7.569 -5.198 -3.323 1.00 10.00 H new ATOM 0 HB2 TYR A 51 5.821 -3.581 -4.208 1.00 10.00 H new ATOM 0 HB3 TYR A 51 6.178 -4.177 -5.816 1.00 10.00 H new ATOM 0 HD1 TYR A 51 5.065 -5.323 -2.434 1.00 10.00 H new ATOM 0 HD2 TYR A 51 5.129 -6.148 -6.615 1.00 10.00 H new ATOM 0 HE1 TYR A 51 3.504 -7.184 -2.091 1.00 10.00 H new ATOM 0 HE2 TYR A 51 3.562 -8.007 -6.270 1.00 10.00 H new ATOM 0 HH TYR A 51 2.834 -9.506 -4.536 1.00 10.00 H new ATOM 541 N CYS A 52 8.824 -5.263 -6.352 1.00 10.00 N ATOM 542 CA CYS A 52 9.476 -6.102 -7.344 1.00 10.00 C ATOM 543 C CYS A 52 10.634 -6.861 -6.702 1.00 10.00 C ATOM 544 O CYS A 52 10.835 -8.048 -6.960 1.00 10.00 O ATOM 545 CB CYS A 52 9.979 -5.248 -8.511 1.00 10.00 C ATOM 546 SG CYS A 52 8.706 -4.209 -9.270 1.00 10.00 S ATOM 0 H CYS A 52 8.865 -4.264 -6.555 1.00 10.00 H new ATOM 0 HA CYS A 52 8.754 -6.822 -7.729 1.00 10.00 H new ATOM 0 HB2 CYS A 52 10.790 -4.611 -8.158 1.00 10.00 H new ATOM 0 HB3 CYS A 52 10.399 -5.905 -9.273 1.00 10.00 H new ATOM 0 HG CYS A 52 8.226 -3.391 -8.381 1.00 10.00 H new ATOM 552 N GLN A 53 11.371 -6.169 -5.838 1.00 10.00 N ATOM 553 CA GLN A 53 12.504 -6.757 -5.137 1.00 10.00 C ATOM 554 C GLN A 53 12.038 -7.877 -4.212 1.00 10.00 C ATOM 555 O GLN A 53 12.668 -8.932 -4.129 1.00 10.00 O ATOM 556 CB GLN A 53 13.240 -5.682 -4.333 1.00 10.00 C ATOM 557 CG GLN A 53 13.880 -4.605 -5.197 1.00 10.00 C ATOM 558 CD GLN A 53 14.210 -3.345 -4.422 1.00 10.00 C ATOM 559 OE1 GLN A 53 13.533 -2.996 -3.454 1.00 10.00 O ATOM 560 NE2 GLN A 53 15.262 -2.657 -4.836 1.00 10.00 N ATOM 0 H GLN A 53 11.200 -5.191 -5.606 1.00 10.00 H new ATOM 0 HA GLN A 53 13.187 -7.179 -5.874 1.00 10.00 H new ATOM 0 HB2 GLN A 53 12.539 -5.213 -3.643 1.00 10.00 H new ATOM 0 HB3 GLN A 53 14.012 -6.158 -3.729 1.00 10.00 H new ATOM 0 HG2 GLN A 53 14.792 -5.000 -5.644 1.00 10.00 H new ATOM 0 HG3 GLN A 53 13.206 -4.355 -6.016 1.00 10.00 H new ATOM 0 HE21 GLN A 53 15.797 -2.979 -5.642 1.00 10.00 H new ATOM 0 HE22 GLN A 53 15.538 -1.804 -4.349 1.00 10.00 H new ATOM 569 N ARG A 54 10.918 -7.649 -3.533 1.00 10.00 N ATOM 570 CA ARG A 54 10.362 -8.640 -2.617 1.00 10.00 C ATOM 571 C ARG A 54 9.877 -9.869 -3.382 1.00 10.00 C ATOM 572 O ARG A 54 9.940 -10.991 -2.882 1.00 10.00 O ATOM 573 CB ARG A 54 9.209 -8.034 -1.806 1.00 10.00 C ATOM 574 CG ARG A 54 8.685 -8.943 -0.700 1.00 10.00 C ATOM 575 CD ARG A 54 9.742 -9.193 0.362 1.00 10.00 C ATOM 576 NE ARG A 54 9.243 -10.011 1.469 1.00 10.00 N ATOM 577 CZ ARG A 54 9.979 -10.918 2.111 1.00 10.00 C ATOM 578 NH1 ARG A 54 11.238 -11.137 1.745 1.00 10.00 N ATOM 579 NH2 ARG A 54 9.458 -11.598 3.123 1.00 10.00 N ATOM 0 H ARG A 54 10.377 -6.787 -3.600 1.00 10.00 H new ATOM 0 HA ARG A 54 11.150 -8.948 -1.930 1.00 10.00 H new ATOM 0 HB2 ARG A 54 9.543 -7.096 -1.363 1.00 10.00 H new ATOM 0 HB3 ARG A 54 8.389 -7.793 -2.483 1.00 10.00 H new ATOM 0 HG2 ARG A 54 7.806 -8.490 -0.241 1.00 10.00 H new ATOM 0 HG3 ARG A 54 8.366 -9.893 -1.129 1.00 10.00 H new ATOM 0 HD2 ARG A 54 10.600 -9.688 -0.093 1.00 10.00 H new ATOM 0 HD3 ARG A 54 10.095 -8.238 0.751 1.00 10.00 H new ATOM 0 HE ARG A 54 8.276 -9.879 1.766 1.00 10.00 H new ATOM 0 HH11 ARG A 54 11.643 -10.610 0.971 1.00 10.00 H new ATOM 0 HH12 ARG A 54 11.799 -11.832 2.238 1.00 10.00 H new ATOM 0 HH21 ARG A 54 8.494 -11.427 3.410 1.00 10.00 H new ATOM 0 HH22 ARG A 54 10.021 -12.292 3.615 1.00 10.00 H new ATOM 593 N GLN A 55 9.403 -9.651 -4.602 1.00 10.00 N ATOM 594 CA GLN A 55 8.911 -10.740 -5.438 1.00 10.00 C ATOM 595 C GLN A 55 10.053 -11.410 -6.197 1.00 10.00 C ATOM 596 O GLN A 55 9.878 -12.478 -6.785 1.00 10.00 O ATOM 597 CB GLN A 55 7.865 -10.222 -6.424 1.00 10.00 C ATOM 598 CG GLN A 55 6.514 -9.933 -5.788 1.00 10.00 C ATOM 599 CD GLN A 55 5.884 -11.165 -5.166 1.00 10.00 C ATOM 600 OE1 GLN A 55 6.046 -11.430 -3.976 1.00 10.00 O ATOM 601 NE2 GLN A 55 5.163 -11.930 -5.970 1.00 10.00 N ATOM 0 H GLN A 55 9.349 -8.729 -5.035 1.00 10.00 H new ATOM 0 HA GLN A 55 8.451 -11.482 -4.785 1.00 10.00 H new ATOM 0 HB2 GLN A 55 8.239 -9.311 -6.891 1.00 10.00 H new ATOM 0 HB3 GLN A 55 7.733 -10.956 -7.219 1.00 10.00 H new ATOM 0 HG2 GLN A 55 6.634 -9.166 -5.023 1.00 10.00 H new ATOM 0 HG3 GLN A 55 5.841 -9.528 -6.543 1.00 10.00 H new ATOM 0 HE21 GLN A 55 5.052 -11.676 -6.952 1.00 10.00 H new ATOM 0 HE22 GLN A 55 4.718 -12.773 -5.608 1.00 10.00 H new ATOM 610 N GLY A 56 11.218 -10.775 -6.181 1.00 10.00 N ATOM 611 CA GLY A 56 12.374 -11.318 -6.868 1.00 10.00 C ATOM 612 C GLY A 56 12.249 -11.212 -8.373 1.00 10.00 C ATOM 613 O GLY A 56 12.750 -12.062 -9.110 1.00 10.00 O ATOM 0 H GLY A 56 11.383 -9.890 -5.702 1.00 10.00 H new ATOM 0 HA2 GLY A 56 13.270 -10.789 -6.542 1.00 10.00 H new ATOM 0 HA3 GLY A 56 12.502 -12.364 -6.589 1.00 10.00 H new ATOM 617 N VAL A 57 11.580 -10.165 -8.829 1.00 10.00 N ATOM 618 CA VAL A 57 11.373 -9.942 -10.253 1.00 10.00 C ATOM 619 C VAL A 57 11.729 -8.508 -10.627 1.00 10.00 C ATOM 620 O VAL A 57 11.698 -7.618 -9.778 1.00 10.00 O ATOM 621 CB VAL A 57 9.906 -10.220 -10.664 1.00 10.00 C ATOM 622 CG1 VAL A 57 9.595 -11.707 -10.586 1.00 10.00 C ATOM 623 CG2 VAL A 57 8.943 -9.424 -9.795 1.00 10.00 C ATOM 0 H VAL A 57 11.168 -9.451 -8.229 1.00 10.00 H new ATOM 0 HA VAL A 57 12.024 -10.635 -10.785 1.00 10.00 H new ATOM 0 HB VAL A 57 9.778 -9.900 -11.698 1.00 10.00 H new ATOM 0 HG11 VAL A 57 8.559 -11.878 -10.879 1.00 10.00 H new ATOM 0 HG12 VAL A 57 10.257 -12.253 -11.258 1.00 10.00 H new ATOM 0 HG13 VAL A 57 9.746 -12.057 -9.565 1.00 10.00 H new ATOM 0 HG21 VAL A 57 7.918 -9.634 -10.101 1.00 10.00 H new ATOM 0 HG22 VAL A 57 9.076 -9.708 -8.751 1.00 10.00 H new ATOM 0 HG23 VAL A 57 9.145 -8.359 -9.910 1.00 10.00 H new ATOM 633 N PRO A 58 12.098 -8.269 -11.894 1.00 10.00 N ATOM 634 CA PRO A 58 12.437 -6.925 -12.375 1.00 10.00 C ATOM 635 C PRO A 58 11.231 -5.986 -12.317 1.00 10.00 C ATOM 636 O PRO A 58 10.091 -6.434 -12.196 1.00 10.00 O ATOM 637 CB PRO A 58 12.865 -7.160 -13.827 1.00 10.00 C ATOM 638 CG PRO A 58 12.246 -8.460 -14.205 1.00 10.00 C ATOM 639 CD PRO A 58 12.232 -9.284 -12.954 1.00 10.00 C ATOM 0 HA PRO A 58 13.208 -6.450 -11.768 1.00 10.00 H new ATOM 0 HB2 PRO A 58 12.520 -6.355 -14.476 1.00 10.00 H new ATOM 0 HB3 PRO A 58 13.951 -7.199 -13.917 1.00 10.00 H new ATOM 0 HG2 PRO A 58 11.236 -8.315 -14.589 1.00 10.00 H new ATOM 0 HG3 PRO A 58 12.819 -8.952 -14.991 1.00 10.00 H new ATOM 0 HD2 PRO A 58 11.402 -9.990 -12.945 1.00 10.00 H new ATOM 0 HD3 PRO A 58 13.147 -9.866 -12.843 1.00 10.00 H new ATOM 647 N MET A 59 11.477 -4.690 -12.415 1.00 10.00 N ATOM 648 CA MET A 59 10.398 -3.708 -12.357 1.00 10.00 C ATOM 649 C MET A 59 9.569 -3.731 -13.641 1.00 10.00 C ATOM 650 O MET A 59 10.037 -4.205 -14.676 1.00 10.00 O ATOM 651 CB MET A 59 10.963 -2.302 -12.125 1.00 10.00 C ATOM 652 CG MET A 59 9.941 -1.319 -11.574 1.00 10.00 C ATOM 653 SD MET A 59 10.513 0.389 -11.614 1.00 10.00 S ATOM 654 CE MET A 59 9.171 1.206 -10.753 1.00 10.00 C ATOM 0 H MET A 59 12.408 -4.291 -12.535 1.00 10.00 H new ATOM 0 HA MET A 59 9.750 -3.971 -11.521 1.00 10.00 H new ATOM 0 HB2 MET A 59 11.803 -2.366 -11.433 1.00 10.00 H new ATOM 0 HB3 MET A 59 11.355 -1.917 -13.066 1.00 10.00 H new ATOM 0 HG2 MET A 59 9.019 -1.401 -12.150 1.00 10.00 H new ATOM 0 HG3 MET A 59 9.700 -1.592 -10.546 1.00 10.00 H new ATOM 0 HE1 MET A 59 9.540 2.122 -10.290 1.00 10.00 H new ATOM 0 HE2 MET A 59 8.380 1.451 -11.462 1.00 10.00 H new ATOM 0 HE3 MET A 59 8.776 0.544 -9.983 1.00 10.00 H new ATOM 664 N ASN A 60 8.327 -3.243 -13.543 1.00 10.00 N ATOM 665 CA ASN A 60 7.393 -3.163 -14.678 1.00 10.00 C ATOM 666 C ASN A 60 6.814 -4.531 -15.039 1.00 10.00 C ATOM 667 O ASN A 60 6.088 -4.668 -16.022 1.00 10.00 O ATOM 668 CB ASN A 60 8.059 -2.529 -15.908 1.00 10.00 C ATOM 669 CG ASN A 60 7.055 -1.938 -16.883 1.00 10.00 C ATOM 670 OD1 ASN A 60 6.084 -1.289 -16.485 1.00 10.00 O ATOM 671 ND2 ASN A 60 7.280 -2.166 -18.169 1.00 10.00 N ATOM 0 H ASN A 60 7.937 -2.890 -12.669 1.00 10.00 H new ATOM 0 HA ASN A 60 6.570 -2.523 -14.360 1.00 10.00 H new ATOM 0 HB2 ASN A 60 8.745 -1.747 -15.581 1.00 10.00 H new ATOM 0 HB3 ASN A 60 8.656 -3.283 -16.421 1.00 10.00 H new ATOM 0 HD21 ASN A 60 6.638 -1.800 -18.872 1.00 10.00 H new ATOM 0 HD22 ASN A 60 8.095 -2.708 -18.456 1.00 10.00 H new ATOM 678 N SER A 61 7.130 -5.543 -14.243 1.00 10.00 N ATOM 679 CA SER A 61 6.617 -6.883 -14.492 1.00 10.00 C ATOM 680 C SER A 61 5.253 -7.048 -13.832 1.00 10.00 C ATOM 681 O SER A 61 4.415 -7.838 -14.277 1.00 10.00 O ATOM 682 CB SER A 61 7.590 -7.932 -13.950 1.00 10.00 C ATOM 683 OG SER A 61 7.857 -7.710 -12.576 1.00 10.00 O ATOM 0 H SER A 61 7.734 -5.463 -13.425 1.00 10.00 H new ATOM 0 HA SER A 61 6.512 -7.025 -15.568 1.00 10.00 H new ATOM 0 HB2 SER A 61 7.170 -8.929 -14.087 1.00 10.00 H new ATOM 0 HB3 SER A 61 8.521 -7.898 -14.516 1.00 10.00 H new ATOM 0 HG SER A 61 8.605 -7.084 -12.485 1.00 10.00 H new ATOM 689 N LEU A 62 5.034 -6.275 -12.779 1.00 10.00 N ATOM 690 CA LEU A 62 3.793 -6.325 -12.032 1.00 10.00 C ATOM 691 C LEU A 62 3.067 -4.991 -12.107 1.00 10.00 C ATOM 692 O LEU A 62 3.693 -3.928 -12.104 1.00 10.00 O ATOM 693 CB LEU A 62 4.076 -6.683 -10.573 1.00 10.00 C ATOM 694 CG LEU A 62 4.829 -8.000 -10.363 1.00 10.00 C ATOM 695 CD1 LEU A 62 5.287 -8.125 -8.920 1.00 10.00 C ATOM 696 CD2 LEU A 62 3.953 -9.183 -10.750 1.00 10.00 C ATOM 0 H LEU A 62 5.710 -5.600 -12.422 1.00 10.00 H new ATOM 0 HA LEU A 62 3.155 -7.091 -12.473 1.00 10.00 H new ATOM 0 HB2 LEU A 62 4.654 -5.876 -10.122 1.00 10.00 H new ATOM 0 HB3 LEU A 62 3.128 -6.735 -10.037 1.00 10.00 H new ATOM 0 HG LEU A 62 5.710 -8.000 -11.005 1.00 10.00 H new ATOM 0 HD11 LEU A 62 5.820 -9.066 -8.788 1.00 10.00 H new ATOM 0 HD12 LEU A 62 5.950 -7.295 -8.675 1.00 10.00 H new ATOM 0 HD13 LEU A 62 4.420 -8.103 -8.260 1.00 10.00 H new ATOM 0 HD21 LEU A 62 4.504 -10.110 -10.594 1.00 10.00 H new ATOM 0 HD22 LEU A 62 3.054 -9.187 -10.133 1.00 10.00 H new ATOM 0 HD23 LEU A 62 3.672 -9.100 -11.800 1.00 10.00 H new ATOM 708 N ARG A 63 1.750 -5.053 -12.177 1.00 10.00 N ATOM 709 CA ARG A 63 0.931 -3.856 -12.247 1.00 10.00 C ATOM 710 C ARG A 63 0.058 -3.740 -11.004 1.00 10.00 C ATOM 711 O ARG A 63 -0.639 -4.684 -10.628 1.00 10.00 O ATOM 712 CB ARG A 63 0.062 -3.863 -13.511 1.00 10.00 C ATOM 713 CG ARG A 63 -0.849 -5.076 -13.639 1.00 10.00 C ATOM 714 CD ARG A 63 -1.704 -4.998 -14.892 1.00 10.00 C ATOM 715 NE ARG A 63 -2.632 -6.125 -15.003 1.00 10.00 N ATOM 716 CZ ARG A 63 -2.622 -7.011 -16.002 1.00 10.00 C ATOM 717 NH1 ARG A 63 -1.730 -6.920 -16.982 1.00 10.00 N ATOM 718 NH2 ARG A 63 -3.512 -7.994 -16.020 1.00 10.00 N ATOM 0 H ARG A 63 1.222 -5.925 -12.187 1.00 10.00 H new ATOM 0 HA ARG A 63 1.592 -2.991 -12.293 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -0.550 -2.961 -13.522 1.00 10.00 H new ATOM 0 HB3 ARG A 63 0.712 -3.818 -14.385 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -0.247 -5.984 -13.664 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -1.492 -5.144 -12.762 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -2.268 -4.065 -14.887 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -1.058 -4.975 -15.769 1.00 10.00 H new ATOM 0 HE ARG A 63 -3.331 -6.241 -14.270 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -1.042 -6.167 -16.977 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -1.733 -7.603 -17.739 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -4.201 -8.072 -15.272 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -3.507 -8.672 -16.782 1.00 10.00 H new ATOM 732 N PHE A 64 0.123 -2.587 -10.359 1.00 10.00 N ATOM 733 CA PHE A 64 -0.663 -2.334 -9.161 1.00 10.00 C ATOM 734 C PHE A 64 -2.003 -1.725 -9.536 1.00 10.00 C ATOM 735 O PHE A 64 -2.052 -0.673 -10.175 1.00 10.00 O ATOM 736 CB PHE A 64 0.083 -1.388 -8.217 1.00 10.00 C ATOM 737 CG PHE A 64 1.072 -2.076 -7.325 1.00 10.00 C ATOM 738 CD1 PHE A 64 2.431 -1.971 -7.565 1.00 10.00 C ATOM 739 CD2 PHE A 64 0.639 -2.824 -6.245 1.00 10.00 C ATOM 740 CE1 PHE A 64 3.342 -2.600 -6.741 1.00 10.00 C ATOM 741 CE2 PHE A 64 1.543 -3.456 -5.417 1.00 10.00 C ATOM 742 CZ PHE A 64 2.897 -3.345 -5.666 1.00 10.00 C ATOM 0 H PHE A 64 0.715 -1.807 -10.646 1.00 10.00 H new ATOM 0 HA PHE A 64 -0.826 -3.284 -8.651 1.00 10.00 H new ATOM 0 HB2 PHE A 64 0.604 -0.636 -8.809 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -0.643 -0.860 -7.599 1.00 10.00 H new ATOM 0 HD1 PHE A 64 2.782 -1.391 -8.406 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -0.419 -2.914 -6.048 1.00 10.00 H new ATOM 0 HE1 PHE A 64 4.400 -2.510 -6.936 1.00 10.00 H new ATOM 0 HE2 PHE A 64 1.193 -4.036 -4.576 1.00 10.00 H new ATOM 0 HZ PHE A 64 3.607 -3.840 -5.021 1.00 10.00 H new ATOM 752 N LEU A 65 -3.083 -2.384 -9.149 1.00 10.00 N ATOM 753 CA LEU A 65 -4.415 -1.895 -9.451 1.00 10.00 C ATOM 754 C LEU A 65 -5.091 -1.364 -8.195 1.00 10.00 C ATOM 755 O LEU A 65 -5.414 -2.121 -7.276 1.00 10.00 O ATOM 756 CB LEU A 65 -5.268 -2.992 -10.094 1.00 10.00 C ATOM 757 CG LEU A 65 -4.831 -3.418 -11.501 1.00 10.00 C ATOM 758 CD1 LEU A 65 -5.799 -4.438 -12.076 1.00 10.00 C ATOM 759 CD2 LEU A 65 -4.723 -2.209 -12.422 1.00 10.00 C ATOM 0 H LEU A 65 -3.062 -3.259 -8.625 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.318 -1.076 -10.164 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.254 -3.868 -9.446 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -6.301 -2.647 -10.141 1.00 10.00 H new ATOM 0 HG LEU A 65 -3.847 -3.880 -11.425 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -5.472 -4.728 -13.075 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -5.825 -5.318 -11.433 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -6.796 -4.001 -12.133 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -4.412 -2.534 -13.415 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -5.692 -1.715 -12.489 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -3.987 -1.511 -12.022 1.00 10.00 H new ATOM 771 N PHE A 66 -5.281 -0.058 -8.163 1.00 10.00 N ATOM 772 CA PHE A 66 -5.920 0.607 -7.043 1.00 10.00 C ATOM 773 C PHE A 66 -7.146 1.354 -7.544 1.00 10.00 C ATOM 774 O PHE A 66 -7.038 2.196 -8.436 1.00 10.00 O ATOM 775 CB PHE A 66 -4.947 1.579 -6.369 1.00 10.00 C ATOM 776 CG PHE A 66 -5.472 2.159 -5.087 1.00 10.00 C ATOM 777 CD1 PHE A 66 -5.649 1.354 -3.972 1.00 10.00 C ATOM 778 CD2 PHE A 66 -5.787 3.505 -4.996 1.00 10.00 C ATOM 779 CE1 PHE A 66 -6.125 1.883 -2.789 1.00 10.00 C ATOM 780 CE2 PHE A 66 -6.265 4.039 -3.814 1.00 10.00 C ATOM 781 CZ PHE A 66 -6.436 3.227 -2.711 1.00 10.00 C ATOM 0 H PHE A 66 -4.996 0.572 -8.913 1.00 10.00 H new ATOM 0 HA PHE A 66 -6.220 -0.137 -6.306 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -4.010 1.061 -6.167 1.00 10.00 H new ATOM 0 HB3 PHE A 66 -4.720 2.391 -7.060 1.00 10.00 H new ATOM 0 HD1 PHE A 66 -5.412 0.302 -4.030 1.00 10.00 H new ATOM 0 HD2 PHE A 66 -5.658 4.144 -5.857 1.00 10.00 H new ATOM 0 HE1 PHE A 66 -6.254 1.247 -1.926 1.00 10.00 H new ATOM 0 HE2 PHE A 66 -6.504 5.090 -3.754 1.00 10.00 H new ATOM 0 HZ PHE A 66 -6.813 3.642 -1.788 1.00 10.00 H new ATOM 791 N GLU A 67 -8.309 1.019 -6.988 1.00 10.00 N ATOM 792 CA GLU A 67 -9.571 1.645 -7.384 1.00 10.00 C ATOM 793 C GLU A 67 -9.894 1.346 -8.847 1.00 10.00 C ATOM 794 O GLU A 67 -10.695 2.037 -9.473 1.00 10.00 O ATOM 795 CB GLU A 67 -9.527 3.158 -7.142 1.00 10.00 C ATOM 796 CG GLU A 67 -9.555 3.534 -5.671 1.00 10.00 C ATOM 797 CD GLU A 67 -10.900 3.275 -5.029 1.00 10.00 C ATOM 798 OE1 GLU A 67 -11.223 2.098 -4.756 1.00 10.00 O ATOM 799 OE2 GLU A 67 -11.640 4.247 -4.785 1.00 10.00 O ATOM 0 H GLU A 67 -8.404 0.313 -6.258 1.00 10.00 H new ATOM 0 HA GLU A 67 -10.363 1.221 -6.767 1.00 10.00 H new ATOM 0 HB2 GLU A 67 -8.624 3.565 -7.596 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -10.375 3.624 -7.645 1.00 10.00 H new ATOM 0 HG2 GLU A 67 -8.789 2.968 -5.141 1.00 10.00 H new ATOM 0 HG3 GLU A 67 -9.303 4.589 -5.565 1.00 10.00 H new ATOM 806 N GLY A 68 -9.266 0.307 -9.385 1.00 10.00 N ATOM 807 CA GLY A 68 -9.501 -0.073 -10.763 1.00 10.00 C ATOM 808 C GLY A 68 -8.445 0.467 -11.703 1.00 10.00 C ATOM 809 O GLY A 68 -8.238 -0.074 -12.791 1.00 10.00 O ATOM 0 H GLY A 68 -8.596 -0.280 -8.888 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -9.527 -1.160 -10.837 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -10.480 0.291 -11.075 1.00 10.00 H new ATOM 813 N GLN A 69 -7.761 1.520 -11.278 1.00 10.00 N ATOM 814 CA GLN A 69 -6.728 2.143 -12.095 1.00 10.00 C ATOM 815 C GLN A 69 -5.348 1.651 -11.682 1.00 10.00 C ATOM 816 O GLN A 69 -5.176 1.119 -10.589 1.00 10.00 O ATOM 817 CB GLN A 69 -6.805 3.664 -11.970 1.00 10.00 C ATOM 818 CG GLN A 69 -8.173 4.224 -12.313 1.00 10.00 C ATOM 819 CD GLN A 69 -8.172 5.732 -12.436 1.00 10.00 C ATOM 820 OE1 GLN A 69 -7.422 6.428 -11.750 1.00 10.00 O ATOM 821 NE2 GLN A 69 -9.019 6.250 -13.306 1.00 10.00 N ATOM 0 H GLN A 69 -7.903 1.962 -10.370 1.00 10.00 H new ATOM 0 HA GLN A 69 -6.896 1.865 -13.135 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -6.547 3.952 -10.951 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -6.060 4.114 -12.626 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -8.515 3.787 -13.251 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -8.886 3.927 -11.544 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -9.623 5.639 -13.855 1.00 10.00 H new ATOM 0 HE22 GLN A 69 -9.069 7.261 -13.429 1.00 10.00 H new ATOM 830 N ARG A 70 -4.369 1.823 -12.560 1.00 10.00 N ATOM 831 CA ARG A 70 -3.010 1.387 -12.268 1.00 10.00 C ATOM 832 C ARG A 70 -2.181 2.541 -11.714 1.00 10.00 C ATOM 833 O ARG A 70 -2.338 3.691 -12.127 1.00 10.00 O ATOM 834 CB ARG A 70 -2.342 0.788 -13.510 1.00 10.00 C ATOM 835 CG ARG A 70 -2.257 1.738 -14.692 1.00 10.00 C ATOM 836 CD ARG A 70 -1.804 1.017 -15.951 1.00 10.00 C ATOM 837 NE ARG A 70 -0.428 0.531 -15.848 1.00 10.00 N ATOM 838 CZ ARG A 70 -0.008 -0.624 -16.363 1.00 10.00 C ATOM 839 NH1 ARG A 70 -0.848 -1.419 -17.014 1.00 10.00 N ATOM 840 NH2 ARG A 70 1.259 -0.986 -16.233 1.00 10.00 N ATOM 0 H ARG A 70 -4.489 2.258 -13.475 1.00 10.00 H new ATOM 0 HA ARG A 70 -3.065 0.607 -11.508 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -1.335 0.463 -13.246 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -2.895 -0.101 -13.812 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -3.231 2.196 -14.864 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.561 2.545 -14.463 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -2.470 0.176 -16.145 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -1.886 1.692 -16.803 1.00 10.00 H new ATOM 0 HE ARG A 70 0.250 1.110 -15.353 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -1.825 -1.148 -17.124 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -0.516 -2.301 -17.404 1.00 10.00 H new ATOM 0 HH21 ARG A 70 1.914 -0.381 -15.738 1.00 10.00 H new ATOM 0 HH22 ARG A 70 1.580 -1.870 -16.627 1.00 10.00 H new ATOM 854 N ILE A 71 -1.308 2.219 -10.772 1.00 10.00 N ATOM 855 CA ILE A 71 -0.451 3.209 -10.132 1.00 10.00 C ATOM 856 C ILE A 71 0.732 3.596 -11.021 1.00 10.00 C ATOM 857 O ILE A 71 1.483 2.737 -11.497 1.00 10.00 O ATOM 858 CB ILE A 71 0.080 2.683 -8.778 1.00 10.00 C ATOM 859 CG1 ILE A 71 -1.085 2.354 -7.836 1.00 10.00 C ATOM 860 CG2 ILE A 71 1.021 3.693 -8.133 1.00 10.00 C ATOM 861 CD1 ILE A 71 -1.977 3.536 -7.519 1.00 10.00 C ATOM 0 H ILE A 71 -1.173 1.268 -10.429 1.00 10.00 H new ATOM 0 HA ILE A 71 -1.063 4.096 -9.964 1.00 10.00 H new ATOM 0 HB ILE A 71 0.643 1.769 -8.966 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.690 1.566 -8.285 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.683 1.956 -6.904 1.00 10.00 H new ATOM 0 HG21 ILE A 71 1.381 3.300 -7.182 1.00 10.00 H new ATOM 0 HG22 ILE A 71 1.868 3.875 -8.794 1.00 10.00 H new ATOM 0 HG23 ILE A 71 0.488 4.628 -7.960 1.00 10.00 H new ATOM 0 HD11 ILE A 71 -2.775 3.220 -6.848 1.00 10.00 H new ATOM 0 HD12 ILE A 71 -1.388 4.318 -7.039 1.00 10.00 H new ATOM 0 HD13 ILE A 71 -2.410 3.923 -8.441 1.00 10.00 H new ATOM 873 N ALA A 72 0.896 4.893 -11.230 1.00 10.00 N ATOM 874 CA ALA A 72 1.983 5.407 -12.046 1.00 10.00 C ATOM 875 C ALA A 72 3.213 5.675 -11.183 1.00 10.00 C ATOM 876 O ALA A 72 3.123 5.710 -9.956 1.00 10.00 O ATOM 877 CB ALA A 72 1.549 6.674 -12.764 1.00 10.00 C ATOM 0 H ALA A 72 0.285 5.612 -10.843 1.00 10.00 H new ATOM 0 HA ALA A 72 2.243 4.658 -12.794 1.00 10.00 H new ATOM 0 HB1 ALA A 72 2.373 7.048 -13.372 1.00 10.00 H new ATOM 0 HB2 ALA A 72 0.696 6.454 -13.406 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.267 7.429 -12.031 1.00 10.00 H new ATOM 883 N ASP A 73 4.358 5.880 -11.825 1.00 10.00 N ATOM 884 CA ASP A 73 5.610 6.132 -11.106 1.00 10.00 C ATOM 885 C ASP A 73 5.637 7.534 -10.503 1.00 10.00 C ATOM 886 O ASP A 73 6.481 7.839 -9.665 1.00 10.00 O ATOM 887 CB ASP A 73 6.819 5.952 -12.033 1.00 10.00 C ATOM 888 CG ASP A 73 7.130 4.495 -12.327 1.00 10.00 C ATOM 889 OD1 ASP A 73 6.198 3.744 -12.689 1.00 10.00 O ATOM 890 OD2 ASP A 73 8.314 4.101 -12.221 1.00 10.00 O ATOM 0 H ASP A 73 4.449 5.877 -12.841 1.00 10.00 H new ATOM 0 HA ASP A 73 5.666 5.404 -10.297 1.00 10.00 H new ATOM 0 HB2 ASP A 73 6.631 6.474 -12.971 1.00 10.00 H new ATOM 0 HB3 ASP A 73 7.692 6.419 -11.577 1.00 10.00 H new ATOM 895 N ASN A 74 4.714 8.383 -10.930 1.00 10.00 N ATOM 896 CA ASN A 74 4.647 9.753 -10.430 1.00 10.00 C ATOM 897 C ASN A 74 3.479 9.932 -9.462 1.00 10.00 C ATOM 898 O ASN A 74 3.141 11.053 -9.083 1.00 10.00 O ATOM 899 CB ASN A 74 4.518 10.737 -11.598 1.00 10.00 C ATOM 900 CG ASN A 74 3.175 10.646 -12.300 1.00 10.00 C ATOM 901 OD1 ASN A 74 2.932 9.728 -13.086 1.00 10.00 O ATOM 902 ND2 ASN A 74 2.290 11.592 -12.022 1.00 10.00 N ATOM 0 H ASN A 74 4.001 8.150 -11.621 1.00 10.00 H new ATOM 0 HA ASN A 74 5.570 9.959 -9.889 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.661 11.752 -11.229 1.00 10.00 H new ATOM 0 HB3 ASN A 74 5.313 10.544 -12.318 1.00 10.00 H new ATOM 0 HD21 ASN A 74 1.371 11.576 -12.464 1.00 10.00 H new ATOM 0 HD22 ASN A 74 2.528 12.336 -11.366 1.00 10.00 H new ATOM 909 N HIS A 75 2.871 8.824 -9.062 1.00 10.00 N ATOM 910 CA HIS A 75 1.744 8.866 -8.141 1.00 10.00 C ATOM 911 C HIS A 75 2.219 8.945 -6.695 1.00 10.00 C ATOM 912 O HIS A 75 3.292 8.440 -6.347 1.00 10.00 O ATOM 913 CB HIS A 75 0.855 7.631 -8.322 1.00 10.00 C ATOM 914 CG HIS A 75 -0.337 7.863 -9.199 1.00 10.00 C ATOM 915 ND1 HIS A 75 -0.829 6.872 -10.017 1.00 10.00 N ATOM 916 CD2 HIS A 75 -1.109 8.969 -9.331 1.00 10.00 C ATOM 917 CE1 HIS A 75 -1.884 7.391 -10.619 1.00 10.00 C ATOM 918 NE2 HIS A 75 -2.090 8.658 -10.236 1.00 10.00 N ATOM 0 H HIS A 75 3.139 7.886 -9.360 1.00 10.00 H new ATOM 0 HA HIS A 75 1.166 9.762 -8.368 1.00 10.00 H new ATOM 0 HB2 HIS A 75 1.453 6.824 -8.745 1.00 10.00 H new ATOM 0 HB3 HIS A 75 0.513 7.295 -7.343 1.00 10.00 H new ATOM 0 HD2 HIS A 75 -0.977 9.912 -8.822 1.00 10.00 H new ATOM 0 HE1 HIS A 75 -2.502 6.861 -11.329 1.00 10.00 H new ATOM 0 HE2 HIS A 75 -2.836 9.275 -10.557 1.00 10.00 H new ATOM 926 N THR A 76 1.427 9.597 -5.861 1.00 10.00 N ATOM 927 CA THR A 76 1.742 9.730 -4.452 1.00 10.00 C ATOM 928 C THR A 76 0.533 9.314 -3.612 1.00 10.00 C ATOM 929 O THR A 76 -0.604 9.508 -4.035 1.00 10.00 O ATOM 930 CB THR A 76 2.150 11.177 -4.103 1.00 10.00 C ATOM 931 OG1 THR A 76 2.068 12.013 -5.266 1.00 10.00 O ATOM 932 CG2 THR A 76 3.567 11.224 -3.553 1.00 10.00 C ATOM 0 H THR A 76 0.554 10.045 -6.140 1.00 10.00 H new ATOM 0 HA THR A 76 2.586 9.078 -4.229 1.00 10.00 H new ATOM 0 HB THR A 76 1.461 11.542 -3.341 1.00 10.00 H new ATOM 0 HG1 THR A 76 1.127 12.195 -5.472 1.00 10.00 H new ATOM 0 HG21 THR A 76 3.831 12.254 -3.315 1.00 10.00 H new ATOM 0 HG22 THR A 76 3.627 10.616 -2.650 1.00 10.00 H new ATOM 0 HG23 THR A 76 4.260 10.835 -4.299 1.00 10.00 H new ATOM 940 N PRO A 77 0.753 8.745 -2.410 1.00 10.00 N ATOM 941 CA PRO A 77 -0.342 8.303 -1.524 1.00 10.00 C ATOM 942 C PRO A 77 -1.213 9.463 -1.033 1.00 10.00 C ATOM 943 O PRO A 77 -2.241 9.255 -0.391 1.00 10.00 O ATOM 944 CB PRO A 77 0.385 7.653 -0.339 1.00 10.00 C ATOM 945 CG PRO A 77 1.770 7.390 -0.820 1.00 10.00 C ATOM 946 CD PRO A 77 2.073 8.465 -1.819 1.00 10.00 C ATOM 0 HA PRO A 77 -1.026 7.633 -2.045 1.00 10.00 H new ATOM 0 HB2 PRO A 77 0.389 8.312 0.529 1.00 10.00 H new ATOM 0 HB3 PRO A 77 -0.107 6.729 -0.035 1.00 10.00 H new ATOM 0 HG2 PRO A 77 2.481 7.414 0.006 1.00 10.00 H new ATOM 0 HG3 PRO A 77 1.844 6.402 -1.275 1.00 10.00 H new ATOM 0 HD2 PRO A 77 2.499 9.349 -1.345 1.00 10.00 H new ATOM 0 HD3 PRO A 77 2.789 8.129 -2.569 1.00 10.00 H new ATOM 954 N LYS A 78 -0.792 10.681 -1.347 1.00 10.00 N ATOM 955 CA LYS A 78 -1.515 11.878 -0.946 1.00 10.00 C ATOM 956 C LYS A 78 -2.768 12.070 -1.800 1.00 10.00 C ATOM 957 O LYS A 78 -3.751 12.658 -1.352 1.00 10.00 O ATOM 958 CB LYS A 78 -0.602 13.104 -1.066 1.00 10.00 C ATOM 959 CG LYS A 78 -1.227 14.395 -0.557 1.00 10.00 C ATOM 960 CD LYS A 78 -1.168 14.501 0.960 1.00 10.00 C ATOM 961 CE LYS A 78 0.245 14.781 1.448 1.00 10.00 C ATOM 962 NZ LYS A 78 0.261 15.258 2.856 1.00 10.00 N ATOM 0 H LYS A 78 0.055 10.865 -1.884 1.00 10.00 H new ATOM 0 HA LYS A 78 -1.825 11.762 0.092 1.00 10.00 H new ATOM 0 HB2 LYS A 78 0.317 12.915 -0.512 1.00 10.00 H new ATOM 0 HB3 LYS A 78 -0.323 13.235 -2.111 1.00 10.00 H new ATOM 0 HG2 LYS A 78 -0.710 15.246 -1.000 1.00 10.00 H new ATOM 0 HG3 LYS A 78 -2.266 14.448 -0.883 1.00 10.00 H new ATOM 0 HD2 LYS A 78 -1.834 15.296 1.296 1.00 10.00 H new ATOM 0 HD3 LYS A 78 -1.530 13.574 1.404 1.00 10.00 H new ATOM 0 HE2 LYS A 78 0.844 13.874 1.365 1.00 10.00 H new ATOM 0 HE3 LYS A 78 0.709 15.529 0.806 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 1.242 15.437 3.151 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 -0.289 16.137 2.931 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 -0.159 14.533 3.473 1.00 10.00 H new ATOM 976 N GLU A 79 -2.733 11.558 -3.024 1.00 10.00 N ATOM 977 CA GLU A 79 -3.863 11.690 -3.933 1.00 10.00 C ATOM 978 C GLU A 79 -4.562 10.347 -4.117 1.00 10.00 C ATOM 979 O GLU A 79 -4.210 9.368 -3.452 1.00 10.00 O ATOM 980 CB GLU A 79 -3.401 12.249 -5.281 1.00 10.00 C ATOM 981 CG GLU A 79 -2.361 11.391 -5.977 1.00 10.00 C ATOM 982 CD GLU A 79 -1.334 12.220 -6.712 1.00 10.00 C ATOM 983 OE1 GLU A 79 -1.720 13.225 -7.354 1.00 10.00 O ATOM 984 OE2 GLU A 79 -0.138 11.877 -6.648 1.00 10.00 O ATOM 0 H GLU A 79 -1.937 11.049 -3.409 1.00 10.00 H new ATOM 0 HA GLU A 79 -4.577 12.389 -3.498 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -4.266 12.356 -5.935 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -2.991 13.247 -5.128 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -1.859 10.763 -5.241 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -2.857 10.722 -6.681 1.00 10.00 H new ATOM 991 N LEU A 80 -5.555 10.322 -5.014 1.00 10.00 N ATOM 992 CA LEU A 80 -6.341 9.119 -5.314 1.00 10.00 C ATOM 993 C LEU A 80 -7.286 8.783 -4.161 1.00 10.00 C ATOM 994 O LEU A 80 -8.503 8.734 -4.334 1.00 10.00 O ATOM 995 CB LEU A 80 -5.436 7.914 -5.625 1.00 10.00 C ATOM 996 CG LEU A 80 -4.584 8.040 -6.891 1.00 10.00 C ATOM 997 CD1 LEU A 80 -3.446 7.031 -6.867 1.00 10.00 C ATOM 998 CD2 LEU A 80 -5.441 7.844 -8.131 1.00 10.00 C ATOM 0 H LEU A 80 -5.837 11.140 -5.555 1.00 10.00 H new ATOM 0 HA LEU A 80 -6.934 9.334 -6.203 1.00 10.00 H new ATOM 0 HB2 LEU A 80 -4.772 7.751 -4.776 1.00 10.00 H new ATOM 0 HB3 LEU A 80 -6.061 7.026 -5.716 1.00 10.00 H new ATOM 0 HG LEU A 80 -4.157 9.043 -6.922 1.00 10.00 H new ATOM 0 HD11 LEU A 80 -2.850 7.133 -7.774 1.00 10.00 H new ATOM 0 HD12 LEU A 80 -2.816 7.213 -5.996 1.00 10.00 H new ATOM 0 HD13 LEU A 80 -3.855 6.022 -6.814 1.00 10.00 H new ATOM 0 HD21 LEU A 80 -4.819 7.937 -9.021 1.00 10.00 H new ATOM 0 HD22 LEU A 80 -5.895 6.853 -8.107 1.00 10.00 H new ATOM 0 HD23 LEU A 80 -6.225 8.601 -8.155 1.00 10.00 H new ATOM 1010 N GLY A 81 -6.722 8.572 -2.984 1.00 10.00 N ATOM 1011 CA GLY A 81 -7.516 8.244 -1.820 1.00 10.00 C ATOM 1012 C GLY A 81 -6.989 7.018 -1.112 1.00 10.00 C ATOM 1013 O GLY A 81 -7.685 6.008 -1.003 1.00 10.00 O ATOM 0 H GLY A 81 -5.718 8.623 -2.813 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -7.519 9.089 -1.131 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -8.550 8.074 -2.121 1.00 10.00 H new ATOM 1017 N MET A 82 -5.755 7.103 -0.641 1.00 10.00 N ATOM 1018 CA MET A 82 -5.128 5.991 0.056 1.00 10.00 C ATOM 1019 C MET A 82 -5.230 6.176 1.561 1.00 10.00 C ATOM 1020 O MET A 82 -4.855 7.218 2.097 1.00 10.00 O ATOM 1021 CB MET A 82 -3.662 5.856 -0.361 1.00 10.00 C ATOM 1022 CG MET A 82 -3.470 5.099 -1.663 1.00 10.00 C ATOM 1023 SD MET A 82 -1.744 5.010 -2.175 1.00 10.00 S ATOM 1024 CE MET A 82 -1.855 3.825 -3.512 1.00 10.00 C ATOM 0 H MET A 82 -5.167 7.932 -0.729 1.00 10.00 H new ATOM 0 HA MET A 82 -5.655 5.077 -0.217 1.00 10.00 H new ATOM 0 HB2 MET A 82 -3.228 6.851 -0.461 1.00 10.00 H new ATOM 0 HB3 MET A 82 -3.113 5.347 0.431 1.00 10.00 H new ATOM 0 HG2 MET A 82 -3.863 4.089 -1.551 1.00 10.00 H new ATOM 0 HG3 MET A 82 -4.052 5.582 -2.448 1.00 10.00 H new ATOM 0 HE1 MET A 82 -0.864 3.661 -3.936 1.00 10.00 H new ATOM 0 HE2 MET A 82 -2.247 2.882 -3.131 1.00 10.00 H new ATOM 0 HE3 MET A 82 -2.521 4.209 -4.284 1.00 10.00 H new ATOM 1034 N GLU A 83 -5.763 5.170 2.232 1.00 10.00 N ATOM 1035 CA GLU A 83 -5.919 5.212 3.676 1.00 10.00 C ATOM 1036 C GLU A 83 -5.354 3.944 4.308 1.00 10.00 C ATOM 1037 O GLU A 83 -4.958 3.014 3.606 1.00 10.00 O ATOM 1038 CB GLU A 83 -7.400 5.369 4.039 1.00 10.00 C ATOM 1039 CG GLU A 83 -7.710 6.633 4.823 1.00 10.00 C ATOM 1040 CD GLU A 83 -7.492 6.466 6.313 1.00 10.00 C ATOM 1041 OE1 GLU A 83 -6.348 6.202 6.730 1.00 10.00 O ATOM 1042 OE2 GLU A 83 -8.466 6.601 7.081 1.00 10.00 O ATOM 0 H GLU A 83 -6.097 4.310 1.797 1.00 10.00 H new ATOM 0 HA GLU A 83 -5.367 6.068 4.063 1.00 10.00 H new ATOM 0 HB2 GLU A 83 -7.991 5.367 3.123 1.00 10.00 H new ATOM 0 HB3 GLU A 83 -7.715 4.504 4.623 1.00 10.00 H new ATOM 0 HG2 GLU A 83 -7.082 7.446 4.457 1.00 10.00 H new ATOM 0 HG3 GLU A 83 -8.745 6.923 4.642 1.00 10.00 H new ATOM 1049 N GLU A 84 -5.310 3.919 5.631 1.00 10.00 N ATOM 1050 CA GLU A 84 -4.805 2.764 6.358 1.00 10.00 C ATOM 1051 C GLU A 84 -5.734 1.571 6.145 1.00 10.00 C ATOM 1052 O GLU A 84 -6.958 1.728 6.138 1.00 10.00 O ATOM 1053 CB GLU A 84 -4.686 3.101 7.851 1.00 10.00 C ATOM 1054 CG GLU A 84 -4.311 1.921 8.738 1.00 10.00 C ATOM 1055 CD GLU A 84 -2.986 1.294 8.358 1.00 10.00 C ATOM 1056 OE1 GLU A 84 -1.985 2.030 8.239 1.00 10.00 O ATOM 1057 OE2 GLU A 84 -2.939 0.058 8.194 1.00 10.00 O ATOM 0 H GLU A 84 -5.619 4.688 6.225 1.00 10.00 H new ATOM 0 HA GLU A 84 -3.816 2.503 5.982 1.00 10.00 H new ATOM 0 HB2 GLU A 84 -3.938 3.884 7.975 1.00 10.00 H new ATOM 0 HB3 GLU A 84 -5.636 3.510 8.195 1.00 10.00 H new ATOM 0 HG2 GLU A 84 -4.266 2.253 9.775 1.00 10.00 H new ATOM 0 HG3 GLU A 84 -5.095 1.166 8.679 1.00 10.00 H new ATOM 1064 N GLU A 85 -5.138 0.393 5.945 1.00 10.00 N ATOM 1065 CA GLU A 85 -5.886 -0.845 5.726 1.00 10.00 C ATOM 1066 C GLU A 85 -6.589 -0.843 4.371 1.00 10.00 C ATOM 1067 O GLU A 85 -7.602 -1.521 4.187 1.00 10.00 O ATOM 1068 CB GLU A 85 -6.901 -1.077 6.852 1.00 10.00 C ATOM 1069 CG GLU A 85 -6.385 -1.979 7.957 1.00 10.00 C ATOM 1070 CD GLU A 85 -6.105 -3.382 7.464 1.00 10.00 C ATOM 1071 OE1 GLU A 85 -4.926 -3.696 7.212 1.00 10.00 O ATOM 1072 OE2 GLU A 85 -7.066 -4.171 7.327 1.00 10.00 O ATOM 0 H GLU A 85 -4.125 0.272 5.931 1.00 10.00 H new ATOM 0 HA GLU A 85 -5.167 -1.664 5.730 1.00 10.00 H new ATOM 0 HB2 GLU A 85 -7.182 -0.115 7.281 1.00 10.00 H new ATOM 0 HB3 GLU A 85 -7.806 -1.514 6.430 1.00 10.00 H new ATOM 0 HG2 GLU A 85 -5.473 -1.554 8.375 1.00 10.00 H new ATOM 0 HG3 GLU A 85 -7.117 -2.018 8.764 1.00 10.00 H new ATOM 1079 N ASP A 86 -6.047 -0.082 3.425 1.00 10.00 N ATOM 1080 CA ASP A 86 -6.620 -0.013 2.085 1.00 10.00 C ATOM 1081 C ASP A 86 -6.303 -1.288 1.322 1.00 10.00 C ATOM 1082 O ASP A 86 -5.238 -1.881 1.504 1.00 10.00 O ATOM 1083 CB ASP A 86 -6.082 1.197 1.318 1.00 10.00 C ATOM 1084 CG ASP A 86 -7.187 2.008 0.674 1.00 10.00 C ATOM 1085 OD1 ASP A 86 -8.045 1.419 -0.014 1.00 10.00 O ATOM 1086 OD2 ASP A 86 -7.212 3.241 0.865 1.00 10.00 O ATOM 0 H ASP A 86 -5.216 0.493 3.560 1.00 10.00 H new ATOM 0 HA ASP A 86 -7.700 0.096 2.181 1.00 10.00 H new ATOM 0 HB2 ASP A 86 -5.517 1.834 1.999 1.00 10.00 H new ATOM 0 HB3 ASP A 86 -5.388 0.858 0.549 1.00 10.00 H new ATOM 1091 N VAL A 87 -7.221 -1.706 0.465 1.00 10.00 N ATOM 1092 CA VAL A 87 -7.040 -2.924 -0.311 1.00 10.00 C ATOM 1093 C VAL A 87 -6.566 -2.611 -1.724 1.00 10.00 C ATOM 1094 O VAL A 87 -7.187 -1.827 -2.443 1.00 10.00 O ATOM 1095 CB VAL A 87 -8.345 -3.746 -0.386 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -8.115 -5.067 -1.105 1.00 10.00 C ATOM 1097 CG2 VAL A 87 -8.909 -3.986 1.008 1.00 10.00 C ATOM 0 H VAL A 87 -8.100 -1.220 0.289 1.00 10.00 H new ATOM 0 HA VAL A 87 -6.279 -3.513 0.201 1.00 10.00 H new ATOM 0 HB VAL A 87 -9.074 -3.172 -0.958 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -9.049 -5.627 -1.145 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -7.765 -4.873 -2.119 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -7.366 -5.648 -0.567 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -9.828 -4.567 0.934 1.00 10.00 H new ATOM 0 HG22 VAL A 87 -8.181 -4.534 1.606 1.00 10.00 H new ATOM 0 HG23 VAL A 87 -9.122 -3.029 1.484 1.00 10.00 H new ATOM 1107 N ILE A 88 -5.464 -3.228 -2.115 1.00 10.00 N ATOM 1108 CA ILE A 88 -4.901 -3.033 -3.438 1.00 10.00 C ATOM 1109 C ILE A 88 -4.498 -4.383 -4.030 1.00 10.00 C ATOM 1110 O ILE A 88 -4.051 -5.278 -3.309 1.00 10.00 O ATOM 1111 CB ILE A 88 -3.688 -2.068 -3.392 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -3.113 -1.841 -4.794 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -2.611 -2.591 -2.449 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -2.121 -0.697 -4.866 1.00 10.00 C ATOM 0 H ILE A 88 -4.938 -3.874 -1.527 1.00 10.00 H new ATOM 0 HA ILE A 88 -5.658 -2.578 -4.076 1.00 10.00 H new ATOM 0 HB ILE A 88 -4.039 -1.110 -3.010 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.625 -2.756 -5.130 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -3.932 -1.645 -5.486 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -1.771 -1.896 -2.435 1.00 10.00 H new ATOM 0 HG22 ILE A 88 -3.022 -2.685 -1.444 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -2.269 -3.567 -2.793 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.756 -0.596 -5.888 1.00 10.00 H new ATOM 0 HD12 ILE A 88 -2.610 0.228 -4.562 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -1.282 -0.900 -4.200 1.00 10.00 H new ATOM 1126 N GLU A 89 -4.690 -4.542 -5.333 1.00 10.00 N ATOM 1127 CA GLU A 89 -4.352 -5.789 -6.002 1.00 10.00 C ATOM 1128 C GLU A 89 -3.153 -5.603 -6.921 1.00 10.00 C ATOM 1129 O GLU A 89 -2.890 -4.501 -7.407 1.00 10.00 O ATOM 1130 CB GLU A 89 -5.543 -6.300 -6.817 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.804 -6.537 -6.002 1.00 10.00 C ATOM 1132 CD GLU A 89 -7.862 -7.302 -6.775 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -8.029 -7.042 -7.989 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -8.536 -8.167 -6.172 1.00 10.00 O ATOM 0 H GLU A 89 -5.077 -3.824 -5.946 1.00 10.00 H new ATOM 0 HA GLU A 89 -4.100 -6.521 -5.235 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.764 -5.581 -7.605 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -5.260 -7.232 -7.306 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.549 -7.089 -5.098 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -7.213 -5.578 -5.685 1.00 10.00 H new ATOM 1141 N VAL A 90 -2.427 -6.685 -7.152 1.00 10.00 N ATOM 1142 CA VAL A 90 -1.267 -6.657 -8.023 1.00 10.00 C ATOM 1143 C VAL A 90 -1.330 -7.830 -8.999 1.00 10.00 C ATOM 1144 O VAL A 90 -1.563 -8.974 -8.606 1.00 10.00 O ATOM 1145 CB VAL A 90 0.059 -6.684 -7.222 1.00 10.00 C ATOM 1146 CG1 VAL A 90 0.165 -7.933 -6.356 1.00 10.00 C ATOM 1147 CG2 VAL A 90 1.253 -6.566 -8.159 1.00 10.00 C ATOM 0 H VAL A 90 -2.624 -7.599 -6.744 1.00 10.00 H new ATOM 0 HA VAL A 90 -1.285 -5.720 -8.580 1.00 10.00 H new ATOM 0 HB VAL A 90 0.061 -5.824 -6.553 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.108 -7.918 -5.809 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -0.664 -7.957 -5.649 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.128 -8.819 -6.989 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.175 -6.587 -7.578 1.00 10.00 H new ATOM 0 HG22 VAL A 90 1.248 -7.399 -8.862 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.192 -5.627 -8.709 1.00 10.00 H new ATOM 1157 N TYR A 91 -1.160 -7.534 -10.277 1.00 10.00 N ATOM 1158 CA TYR A 91 -1.206 -8.558 -11.308 1.00 10.00 C ATOM 1159 C TYR A 91 0.060 -8.526 -12.145 1.00 10.00 C ATOM 1160 O TYR A 91 0.818 -7.560 -12.095 1.00 10.00 O ATOM 1161 CB TYR A 91 -2.432 -8.364 -12.206 1.00 10.00 C ATOM 1162 CG TYR A 91 -3.748 -8.615 -11.502 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -4.347 -9.868 -11.535 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -4.391 -7.599 -10.805 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -5.548 -10.101 -10.893 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -5.591 -7.825 -10.160 1.00 10.00 C ATOM 1167 CZ TYR A 91 -6.167 -9.076 -10.208 1.00 10.00 C ATOM 1168 OH TYR A 91 -7.363 -9.303 -9.566 1.00 10.00 O ATOM 0 H TYR A 91 -0.989 -6.591 -10.626 1.00 10.00 H new ATOM 0 HA TYR A 91 -1.281 -9.530 -10.820 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -2.428 -7.347 -12.597 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -2.354 -9.035 -13.062 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -3.866 -10.673 -12.071 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -3.945 -6.616 -10.767 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -6.000 -11.081 -10.927 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -6.076 -7.025 -9.620 1.00 10.00 H new ATOM 0 HH TYR A 91 -7.602 -8.517 -9.032 1.00 10.00 H new ATOM 1178 N GLN A 92 0.284 -9.580 -12.910 1.00 10.00 N ATOM 1179 CA GLN A 92 1.462 -9.668 -13.758 1.00 10.00 C ATOM 1180 C GLN A 92 1.161 -9.102 -15.142 1.00 10.00 C ATOM 1181 O GLN A 92 0.135 -9.422 -15.741 1.00 10.00 O ATOM 1182 CB GLN A 92 1.927 -11.123 -13.861 1.00 10.00 C ATOM 1183 CG GLN A 92 3.176 -11.317 -14.704 1.00 10.00 C ATOM 1184 CD GLN A 92 3.698 -12.736 -14.638 1.00 10.00 C ATOM 1185 OE1 GLN A 92 4.548 -13.060 -13.811 1.00 10.00 O ATOM 1186 NE2 GLN A 92 3.188 -13.595 -15.505 1.00 10.00 N ATOM 0 H GLN A 92 -0.335 -10.389 -12.962 1.00 10.00 H new ATOM 0 HA GLN A 92 2.263 -9.078 -13.313 1.00 10.00 H new ATOM 0 HB2 GLN A 92 2.116 -11.505 -12.858 1.00 10.00 H new ATOM 0 HB3 GLN A 92 1.120 -11.722 -14.283 1.00 10.00 H new ATOM 0 HG2 GLN A 92 2.956 -11.061 -15.740 1.00 10.00 H new ATOM 0 HG3 GLN A 92 3.952 -10.631 -14.364 1.00 10.00 H new ATOM 0 HE21 GLN A 92 2.484 -13.286 -16.175 1.00 10.00 H new ATOM 0 HE22 GLN A 92 3.499 -14.567 -15.503 1.00 10.00 H new ATOM 1195 N GLU A 93 2.052 -8.259 -15.641 1.00 10.00 N ATOM 1196 CA GLU A 93 1.877 -7.644 -16.950 1.00 10.00 C ATOM 1197 C GLU A 93 2.213 -8.632 -18.062 1.00 10.00 C ATOM 1198 O GLU A 93 3.015 -9.549 -17.872 1.00 10.00 O ATOM 1199 CB GLU A 93 2.760 -6.402 -17.070 1.00 10.00 C ATOM 1200 CG GLU A 93 2.208 -5.188 -16.342 1.00 10.00 C ATOM 1201 CD GLU A 93 1.171 -4.441 -17.156 1.00 10.00 C ATOM 1202 OE1 GLU A 93 0.097 -5.014 -17.447 1.00 10.00 O ATOM 1203 OE2 GLU A 93 1.422 -3.272 -17.509 1.00 10.00 O ATOM 0 H GLU A 93 2.907 -7.984 -15.158 1.00 10.00 H new ATOM 0 HA GLU A 93 0.832 -7.351 -17.053 1.00 10.00 H new ATOM 0 HB2 GLU A 93 3.750 -6.632 -16.676 1.00 10.00 H new ATOM 0 HB3 GLU A 93 2.885 -6.156 -18.125 1.00 10.00 H new ATOM 0 HG2 GLU A 93 1.764 -5.506 -15.399 1.00 10.00 H new ATOM 0 HG3 GLU A 93 3.028 -4.512 -16.097 1.00 10.00 H new ATOM 1210 N GLN A 94 1.598 -8.437 -19.223 1.00 10.00 N ATOM 1211 CA GLN A 94 1.828 -9.304 -20.371 1.00 10.00 C ATOM 1212 C GLN A 94 3.158 -8.952 -21.034 1.00 10.00 C ATOM 1213 O GLN A 94 3.686 -9.709 -21.855 1.00 10.00 O ATOM 1214 CB GLN A 94 0.680 -9.163 -21.373 1.00 10.00 C ATOM 1215 CG GLN A 94 0.572 -10.325 -22.347 1.00 10.00 C ATOM 1216 CD GLN A 94 -0.326 -10.017 -23.530 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -0.431 -8.868 -23.965 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -0.976 -11.039 -24.062 1.00 10.00 N ATOM 0 H GLN A 94 0.933 -7.682 -19.394 1.00 10.00 H new ATOM 0 HA GLN A 94 1.870 -10.339 -20.032 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -0.258 -9.071 -20.826 1.00 10.00 H new ATOM 0 HB3 GLN A 94 0.813 -8.239 -21.936 1.00 10.00 H new ATOM 0 HG2 GLN A 94 1.567 -10.584 -22.709 1.00 10.00 H new ATOM 0 HG3 GLN A 94 0.187 -11.199 -21.822 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -0.862 -11.975 -23.672 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -1.591 -10.891 -24.862 1.00 10.00 H new ATOM 1227 N THR A 95 3.690 -7.791 -20.669 1.00 10.00 N ATOM 1228 CA THR A 95 4.956 -7.316 -21.204 1.00 10.00 C ATOM 1229 C THR A 95 6.120 -8.137 -20.648 1.00 10.00 C ATOM 1230 O THR A 95 7.027 -8.526 -21.380 1.00 10.00 O ATOM 1231 CB THR A 95 5.169 -5.831 -20.860 1.00 10.00 C ATOM 1232 OG1 THR A 95 4.956 -5.631 -19.456 1.00 10.00 O ATOM 1233 CG2 THR A 95 4.213 -4.945 -21.651 1.00 10.00 C ATOM 0 H THR A 95 3.257 -7.157 -19.997 1.00 10.00 H new ATOM 0 HA THR A 95 4.923 -7.431 -22.287 1.00 10.00 H new ATOM 0 HB THR A 95 6.191 -5.558 -21.125 1.00 10.00 H new ATOM 0 HG1 THR A 95 5.093 -4.686 -19.236 1.00 10.00 H new ATOM 0 HG21 THR A 95 4.384 -3.901 -21.389 1.00 10.00 H new ATOM 0 HG22 THR A 95 4.386 -5.085 -22.718 1.00 10.00 H new ATOM 0 HG23 THR A 95 3.184 -5.215 -21.412 1.00 10.00 H new ATOM 1241 N GLY A 96 6.077 -8.399 -19.346 1.00 10.00 N ATOM 1242 CA GLY A 96 7.123 -9.173 -18.705 1.00 10.00 C ATOM 1243 C GLY A 96 8.085 -8.303 -17.922 1.00 10.00 C ATOM 1244 O GLY A 96 8.838 -8.796 -17.079 1.00 10.00 O ATOM 0 H GLY A 96 5.333 -8.088 -18.721 1.00 10.00 H new ATOM 0 HA2 GLY A 96 6.672 -9.905 -18.035 1.00 10.00 H new ATOM 0 HA3 GLY A 96 7.675 -9.731 -19.462 1.00 10.00 H new ATOM 1248 N GLY A 97 8.054 -7.006 -18.193 1.00 10.00 N ATOM 1249 CA GLY A 97 8.933 -6.083 -17.513 1.00 10.00 C ATOM 1250 C GLY A 97 9.435 -5.011 -18.450 1.00 10.00 C ATOM 1251 O GLY A 97 10.599 -4.586 -18.311 1.00 10.00 O ATOM 0 H GLY A 97 7.431 -6.576 -18.877 1.00 10.00 H new ATOM 0 HA2 GLY A 97 8.404 -5.621 -16.679 1.00 10.00 H new ATOM 0 HA3 GLY A 97 9.779 -6.626 -17.092 1.00 10.00 H new ATOM 1256 N ASN B 357 -4.874 -16.037 5.439 1.00 10.00 N ATOM 1257 CA ASN B 357 -4.220 -15.653 6.714 1.00 10.00 C ATOM 1258 C ASN B 357 -2.699 -15.652 6.566 1.00 10.00 C ATOM 1259 O ASN B 357 -1.983 -16.233 7.378 1.00 10.00 O ATOM 1260 CB ASN B 357 -4.644 -16.601 7.854 1.00 10.00 C ATOM 1261 CG ASN B 357 -4.346 -16.043 9.237 1.00 10.00 C ATOM 1262 OD1 ASN B 357 -3.742 -14.984 9.390 1.00 10.00 O ATOM 1263 ND2 ASN B 357 -4.774 -16.762 10.258 1.00 10.00 N ATOM 0 HA ASN B 357 -4.543 -14.643 6.965 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -5.712 -16.802 7.773 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -4.130 -17.555 7.735 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -4.607 -16.443 11.212 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -5.272 -17.637 10.093 1.00 10.00 H new ATOM 1270 N ASN B 358 -2.203 -15.018 5.509 1.00 10.00 N ATOM 1271 CA ASN B 358 -0.761 -14.930 5.292 1.00 10.00 C ATOM 1272 C ASN B 358 -0.368 -13.469 5.262 1.00 10.00 C ATOM 1273 O ASN B 358 -0.892 -12.706 4.457 1.00 10.00 O ATOM 1274 CB ASN B 358 -0.375 -15.592 3.957 1.00 10.00 C ATOM 1275 CG ASN B 358 1.126 -15.589 3.691 1.00 10.00 C ATOM 1276 OD1 ASN B 358 1.938 -15.569 4.617 1.00 10.00 O ATOM 1277 ND2 ASN B 358 1.502 -15.632 2.418 1.00 10.00 N ATOM 0 H ASN B 358 -2.770 -14.561 4.795 1.00 10.00 H new ATOM 0 HA ASN B 358 -0.241 -15.448 6.098 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -0.735 -16.621 3.953 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -0.882 -15.074 3.143 1.00 10.00 H new ATOM 0 HD21 ASN B 358 2.494 -15.650 2.179 1.00 10.00 H new ATOM 0 HD22 ASN B 358 0.799 -15.647 1.679 1.00 10.00 H new ATOM 1284 N ARG B 359 0.549 -13.071 6.126 1.00 10.00 N ATOM 1285 CA ARG B 359 0.974 -11.688 6.141 1.00 10.00 C ATOM 1286 C ARG B 359 2.480 -11.557 6.017 1.00 10.00 C ATOM 1287 O ARG B 359 3.241 -12.185 6.758 1.00 10.00 O ATOM 1288 CB ARG B 359 0.463 -10.955 7.391 1.00 10.00 C ATOM 1289 CG ARG B 359 1.050 -11.436 8.713 1.00 10.00 C ATOM 1290 CD ARG B 359 0.728 -10.457 9.836 1.00 10.00 C ATOM 1291 NE ARG B 359 1.281 -10.866 11.124 1.00 10.00 N ATOM 1292 CZ ARG B 359 1.452 -10.037 12.151 1.00 10.00 C ATOM 1293 NH1 ARG B 359 1.135 -8.752 12.031 1.00 10.00 N ATOM 1294 NH2 ARG B 359 1.943 -10.488 13.297 1.00 10.00 N ATOM 0 H ARG B 359 1.004 -13.673 6.812 1.00 10.00 H new ATOM 0 HA ARG B 359 0.530 -11.212 5.267 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.678 -9.892 7.282 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.621 -11.058 7.435 1.00 10.00 H new ATOM 0 HG2 ARG B 359 0.650 -12.420 8.957 1.00 10.00 H new ATOM 0 HG3 ARG B 359 2.130 -11.545 8.618 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.117 -9.473 9.576 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -0.354 -10.358 9.926 1.00 10.00 H new ATOM 0 HE ARG B 359 1.552 -11.842 11.243 1.00 10.00 H new ATOM 0 HH11 ARG B 359 0.760 -8.399 11.151 1.00 10.00 H new ATOM 0 HH12 ARG B 359 1.267 -8.118 12.819 1.00 10.00 H new ATOM 0 HH21 ARG B 359 2.191 -11.473 13.393 1.00 10.00 H new ATOM 0 HH22 ARG B 359 2.073 -9.850 14.082 1.00 10.00 H new ATOM 1308 N ASP B 360 2.898 -10.746 5.067 1.00 10.00 N ATOM 1309 CA ASP B 360 4.303 -10.457 4.850 1.00 10.00 C ATOM 1310 C ASP B 360 4.458 -8.955 5.009 1.00 10.00 C ATOM 1311 O ASP B 360 3.699 -8.200 4.400 1.00 10.00 O ATOM 1312 CB ASP B 360 4.766 -10.919 3.464 1.00 10.00 C ATOM 1313 CG ASP B 360 6.238 -10.650 3.227 1.00 10.00 C ATOM 1314 OD1 ASP B 360 6.578 -9.960 2.247 1.00 10.00 O ATOM 1315 OD2 ASP B 360 7.065 -11.142 4.022 1.00 10.00 O ATOM 0 H ASP B 360 2.271 -10.266 4.421 1.00 10.00 H new ATOM 0 HA ASP B 360 4.924 -10.995 5.566 1.00 10.00 H new ATOM 0 HB2 ASP B 360 4.573 -11.986 3.357 1.00 10.00 H new ATOM 0 HB3 ASP B 360 4.179 -10.410 2.700 1.00 10.00 H new ATOM 1320 N PRO B 361 5.422 -8.474 5.800 1.00 10.00 N ATOM 1321 CA PRO B 361 5.580 -7.054 6.024 1.00 10.00 C ATOM 1322 C PRO B 361 6.799 -6.451 5.340 1.00 10.00 C ATOM 1323 O PRO B 361 7.923 -6.938 5.457 1.00 10.00 O ATOM 1324 CB PRO B 361 5.782 -7.022 7.546 1.00 10.00 C ATOM 1325 CG PRO B 361 6.384 -8.356 7.906 1.00 10.00 C ATOM 1326 CD PRO B 361 6.325 -9.233 6.670 1.00 10.00 C ATOM 0 HA PRO B 361 4.742 -6.479 5.630 1.00 10.00 H new ATOM 0 HB2 PRO B 361 6.441 -6.204 7.836 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.835 -6.867 8.063 1.00 10.00 H new ATOM 0 HG2 PRO B 361 7.414 -8.234 8.240 1.00 10.00 H new ATOM 0 HG3 PRO B 361 5.835 -8.815 8.728 1.00 10.00 H new ATOM 0 HD2 PRO B 361 7.308 -9.369 6.219 1.00 10.00 H new ATOM 0 HD3 PRO B 361 5.937 -10.227 6.893 1.00 10.00 H new ATOM 1334 N ILE B 362 6.540 -5.370 4.615 1.00 10.00 N ATOM 1335 CA ILE B 362 7.570 -4.656 3.891 1.00 10.00 C ATOM 1336 C ILE B 362 7.669 -3.229 4.402 1.00 10.00 C ATOM 1337 O ILE B 362 6.660 -2.539 4.558 1.00 10.00 O ATOM 1338 CB ILE B 362 7.294 -4.623 2.375 1.00 10.00 C ATOM 1339 CG1 ILE B 362 6.952 -6.026 1.870 1.00 10.00 C ATOM 1340 CG2 ILE B 362 8.494 -4.051 1.629 1.00 10.00 C ATOM 1341 CD1 ILE B 362 6.323 -6.021 0.499 1.00 10.00 C ATOM 0 H ILE B 362 5.608 -4.968 4.516 1.00 10.00 H new ATOM 0 HA ILE B 362 8.507 -5.187 4.058 1.00 10.00 H new ATOM 0 HB ILE B 362 6.439 -3.974 2.186 1.00 10.00 H new ATOM 0 HG12 ILE B 362 7.860 -6.629 1.845 1.00 10.00 H new ATOM 0 HG13 ILE B 362 6.271 -6.504 2.574 1.00 10.00 H new ATOM 0 HG21 ILE B 362 8.283 -4.034 0.560 1.00 10.00 H new ATOM 0 HG22 ILE B 362 8.688 -3.036 1.976 1.00 10.00 H new ATOM 0 HG23 ILE B 362 9.369 -4.673 1.817 1.00 10.00 H new ATOM 0 HD11 ILE B 362 6.103 -7.045 0.196 1.00 10.00 H new ATOM 0 HD12 ILE B 362 5.399 -5.444 0.525 1.00 10.00 H new ATOM 0 HD13 ILE B 362 7.012 -5.571 -0.216 1.00 10.00 H new ATOM 1353 N VAL B 363 8.885 -2.795 4.672 1.00 10.00 N ATOM 1354 CA VAL B 363 9.120 -1.457 5.163 1.00 10.00 C ATOM 1355 C VAL B 363 9.963 -0.690 4.160 1.00 10.00 C ATOM 1356 O VAL B 363 10.947 -1.206 3.624 1.00 10.00 O ATOM 1357 CB VAL B 363 9.784 -1.440 6.554 1.00 10.00 C ATOM 1358 CG1 VAL B 363 9.726 -0.040 7.146 1.00 10.00 C ATOM 1359 CG2 VAL B 363 9.107 -2.444 7.478 1.00 10.00 C ATOM 0 H VAL B 363 9.729 -3.356 4.558 1.00 10.00 H new ATOM 0 HA VAL B 363 8.150 -0.974 5.279 1.00 10.00 H new ATOM 0 HB VAL B 363 10.830 -1.727 6.447 1.00 10.00 H new ATOM 0 HG11 VAL B 363 10.198 -0.041 8.128 1.00 10.00 H new ATOM 0 HG12 VAL B 363 10.252 0.654 6.491 1.00 10.00 H new ATOM 0 HG13 VAL B 363 8.686 0.271 7.243 1.00 10.00 H new ATOM 0 HG21 VAL B 363 9.587 -2.420 8.456 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.053 -2.187 7.585 1.00 10.00 H new ATOM 0 HG23 VAL B 363 9.195 -3.445 7.055 1.00 10.00 H new ATOM 1369 N ILE B 364 9.562 0.537 3.924 1.00 10.00 N ATOM 1370 CA ILE B 364 10.195 1.405 2.955 1.00 10.00 C ATOM 1371 C ILE B 364 10.887 2.572 3.641 1.00 10.00 C ATOM 1372 O ILE B 364 10.456 3.044 4.693 1.00 10.00 O ATOM 1373 CB ILE B 364 9.211 1.922 1.874 1.00 10.00 C ATOM 1374 CG1 ILE B 364 9.992 2.436 0.654 1.00 10.00 C ATOM 1375 CG2 ILE B 364 8.294 3.013 2.424 1.00 10.00 C ATOM 1376 CD1 ILE B 364 11.021 1.451 0.130 1.00 10.00 C ATOM 0 H ILE B 364 8.774 0.969 4.407 1.00 10.00 H new ATOM 0 HA ILE B 364 10.942 0.799 2.442 1.00 10.00 H new ATOM 0 HB ILE B 364 8.579 1.089 1.567 1.00 10.00 H new ATOM 0 HG12 ILE B 364 9.288 2.672 -0.144 1.00 10.00 H new ATOM 0 HG13 ILE B 364 10.495 3.366 0.921 1.00 10.00 H new ATOM 0 HG21 ILE B 364 7.618 3.351 1.638 1.00 10.00 H new ATOM 0 HG22 ILE B 364 7.713 2.615 3.256 1.00 10.00 H new ATOM 0 HG23 ILE B 364 8.896 3.853 2.771 1.00 10.00 H new ATOM 0 HD11 ILE B 364 11.532 1.882 -0.731 1.00 10.00 H new ATOM 0 HD12 ILE B 364 11.748 1.233 0.913 1.00 10.00 H new ATOM 0 HD13 ILE B 364 10.523 0.529 -0.169 1.00 10.00 H new