USER MOD reduce.3.24.130724 H: found=0, std=0, add=453, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 454 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 Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -0.966 K(o=-0.97,f=-2.1!) USER MOD Single : A 146 ASN : amide:sc= -2.11! X(o=-2.1!,f=-1.7) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -0.319 X(o=-0.32,f=-0.31) USER MOD Single : A 171 ASN : amide:sc= -0.989 K(o=-0.99,f=-1.9!) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl 174:sc= -0.0516 (180deg=-0.162) USER MOD Single : A 186 TYR OH : rot -86:sc= 1.33 USER MOD Single : A 189 LYS NZ :NH3+ 134:sc= -0.504 (180deg=-2.97!) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 134 3.797 -0.984 -1.338 1.00 0.00 N ATOM 2 CA ALA A 134 2.425 -0.643 -1.671 1.00 0.00 C ATOM 3 C ALA A 134 2.355 0.827 -2.090 1.00 0.00 C ATOM 4 O ALA A 134 1.393 1.249 -2.729 1.00 0.00 O ATOM 5 CB ALA A 134 1.518 -0.952 -0.477 1.00 0.00 C ATOM 0 HA ALA A 134 2.075 -1.242 -2.512 1.00 0.00 H new ATOM 0 HB1 ALA A 134 0.488 -0.696 -0.727 1.00 0.00 H new ATOM 0 HB2 ALA A 134 1.580 -2.014 -0.238 1.00 0.00 H new ATOM 0 HB3 ALA A 134 1.839 -0.366 0.385 1.00 0.00 H new ATOM 11 N GLU A 135 3.388 1.566 -1.712 1.00 0.00 N ATOM 12 CA GLU A 135 3.456 2.979 -2.041 1.00 0.00 C ATOM 13 C GLU A 135 4.645 3.632 -1.332 1.00 0.00 C ATOM 14 O GLU A 135 5.335 4.469 -1.911 1.00 0.00 O ATOM 15 CB GLU A 135 2.149 3.689 -1.686 1.00 0.00 C ATOM 16 CG GLU A 135 2.332 5.208 -1.681 1.00 0.00 C ATOM 17 CD GLU A 135 1.047 5.917 -2.110 1.00 0.00 C ATOM 18 OE1 GLU A 135 0.524 5.545 -3.183 1.00 0.00 O ATOM 19 OE2 GLU A 135 0.615 6.815 -1.356 1.00 0.00 O ATOM 0 H GLU A 135 4.184 1.213 -1.181 1.00 0.00 H new ATOM 0 HA GLU A 135 3.602 3.075 -3.117 1.00 0.00 H new ATOM 0 HB2 GLU A 135 1.376 3.415 -2.404 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.806 3.358 -0.706 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.619 5.540 -0.683 1.00 0.00 H new ATOM 0 HG3 GLU A 135 3.145 5.482 -2.354 1.00 0.00 H new ATOM 26 N TYR A 136 4.847 3.224 -0.087 1.00 0.00 N ATOM 27 CA TYR A 136 5.939 3.759 0.708 1.00 0.00 C ATOM 28 C TYR A 136 6.509 2.692 1.644 1.00 0.00 C ATOM 29 O TYR A 136 5.836 2.255 2.576 1.00 0.00 O ATOM 30 CB TYR A 136 5.337 4.888 1.547 1.00 0.00 C ATOM 31 CG TYR A 136 5.815 6.284 1.147 1.00 0.00 C ATOM 32 CD1 TYR A 136 5.330 6.877 -0.002 1.00 0.00 C ATOM 33 CD2 TYR A 136 6.733 6.952 1.932 1.00 0.00 C ATOM 34 CE1 TYR A 136 5.780 8.192 -0.378 1.00 0.00 C ATOM 35 CE2 TYR A 136 7.184 8.266 1.554 1.00 0.00 C ATOM 36 CZ TYR A 136 6.684 8.821 0.418 1.00 0.00 C ATOM 37 OH TYR A 136 7.110 10.064 0.062 1.00 0.00 O ATOM 0 H TYR A 136 4.273 2.529 0.390 1.00 0.00 H new ATOM 0 HA TYR A 136 6.749 4.103 0.065 1.00 0.00 H new ATOM 0 HB2 TYR A 136 4.251 4.849 1.463 1.00 0.00 H new ATOM 0 HB3 TYR A 136 5.582 4.718 2.595 1.00 0.00 H new ATOM 0 HD1 TYR A 136 4.613 6.355 -0.618 1.00 0.00 H new ATOM 0 HD2 TYR A 136 7.113 6.489 2.830 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.407 8.668 -1.273 1.00 0.00 H new ATOM 0 HE2 TYR A 136 7.903 8.799 2.159 1.00 0.00 H new ATOM 0 HH TYR A 136 7.754 10.391 0.724 1.00 0.00 H new ATOM 47 N VAL A 137 7.745 2.304 1.365 1.00 0.00 N ATOM 48 CA VAL A 137 8.413 1.297 2.170 1.00 0.00 C ATOM 49 C VAL A 137 9.826 1.777 2.510 1.00 0.00 C ATOM 50 O VAL A 137 10.489 2.402 1.685 1.00 0.00 O ATOM 51 CB VAL A 137 8.399 -0.049 1.443 1.00 0.00 C ATOM 52 CG1 VAL A 137 6.970 -0.461 1.081 1.00 0.00 C ATOM 53 CG2 VAL A 137 9.289 -0.011 0.200 1.00 0.00 C ATOM 0 H VAL A 137 8.301 2.670 0.592 1.00 0.00 H new ATOM 0 HA VAL A 137 7.884 1.149 3.111 1.00 0.00 H new ATOM 0 HB VAL A 137 8.804 -0.800 2.121 1.00 0.00 H new ATOM 0 HG11 VAL A 137 6.988 -1.421 0.565 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.375 -0.549 1.990 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.528 0.293 0.429 1.00 0.00 H new ATOM 0 HG21 VAL A 137 9.261 -0.980 -0.298 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.928 0.758 -0.483 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.314 0.216 0.493 1.00 0.00 H new ATOM 63 N ARG A 138 10.245 1.464 3.728 1.00 0.00 N ATOM 64 CA ARG A 138 11.567 1.857 4.187 1.00 0.00 C ATOM 65 C ARG A 138 12.425 0.618 4.454 1.00 0.00 C ATOM 66 O ARG A 138 11.922 -0.504 4.441 1.00 0.00 O ATOM 67 CB ARG A 138 11.480 2.693 5.465 1.00 0.00 C ATOM 68 CG ARG A 138 11.428 1.797 6.704 1.00 0.00 C ATOM 69 CD ARG A 138 10.438 2.343 7.734 1.00 0.00 C ATOM 70 NE ARG A 138 9.132 2.610 7.090 1.00 0.00 N ATOM 71 CZ ARG A 138 8.051 3.060 7.741 1.00 0.00 C ATOM 72 NH1 ARG A 138 8.112 3.297 9.058 1.00 0.00 N ATOM 73 NH2 ARG A 138 6.908 3.273 7.074 1.00 0.00 N ATOM 0 H ARG A 138 9.693 0.944 4.410 1.00 0.00 H new ATOM 0 HA ARG A 138 12.025 2.460 3.403 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.342 3.358 5.528 1.00 0.00 H new ATOM 0 HB3 ARG A 138 10.592 3.324 5.431 1.00 0.00 H new ATOM 0 HG2 ARG A 138 11.137 0.787 6.415 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.421 1.728 7.149 1.00 0.00 H new ATOM 0 HD2 ARG A 138 10.313 1.626 8.545 1.00 0.00 H new ATOM 0 HD3 ARG A 138 10.829 3.260 8.176 1.00 0.00 H new ATOM 0 HE ARG A 138 9.050 2.441 6.087 1.00 0.00 H new ATOM 0 HH11 ARG A 138 8.982 3.135 9.566 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.289 3.640 9.553 1.00 0.00 H new ATOM 0 HH21 ARG A 138 6.861 3.092 6.071 1.00 0.00 H new ATOM 0 HH22 ARG A 138 6.085 3.616 7.569 1.00 0.00 H new ATOM 87 N ALA A 139 13.705 0.863 4.689 1.00 0.00 N ATOM 88 CA ALA A 139 14.638 -0.218 4.958 1.00 0.00 C ATOM 89 C ALA A 139 15.325 0.030 6.302 1.00 0.00 C ATOM 90 O ALA A 139 15.715 1.156 6.606 1.00 0.00 O ATOM 91 CB ALA A 139 15.637 -0.328 3.804 1.00 0.00 C ATOM 0 H ALA A 139 14.119 1.795 4.699 1.00 0.00 H new ATOM 0 HA ALA A 139 14.113 -1.171 5.027 1.00 0.00 H new ATOM 0 HB1 ALA A 139 16.337 -1.139 4.005 1.00 0.00 H new ATOM 0 HB2 ALA A 139 15.101 -0.533 2.877 1.00 0.00 H new ATOM 0 HB3 ALA A 139 16.185 0.609 3.707 1.00 0.00 H new ATOM 97 N LEU A 140 15.452 -1.041 7.072 1.00 0.00 N ATOM 98 CA LEU A 140 16.085 -0.955 8.377 1.00 0.00 C ATOM 99 C LEU A 140 17.102 -2.088 8.521 1.00 0.00 C ATOM 100 O LEU A 140 17.451 -2.475 9.636 1.00 0.00 O ATOM 101 CB LEU A 140 15.029 -0.930 9.483 1.00 0.00 C ATOM 102 CG LEU A 140 13.572 -0.873 9.020 1.00 0.00 C ATOM 103 CD1 LEU A 140 13.163 -2.176 8.331 1.00 0.00 C ATOM 104 CD2 LEU A 140 12.640 -0.521 10.182 1.00 0.00 C ATOM 0 H LEU A 140 15.127 -1.973 6.817 1.00 0.00 H new ATOM 0 HA LEU A 140 16.636 -0.019 8.474 1.00 0.00 H new ATOM 0 HB2 LEU A 140 15.158 -1.818 10.101 1.00 0.00 H new ATOM 0 HB3 LEU A 140 15.220 -0.067 10.121 1.00 0.00 H new ATOM 0 HG LEU A 140 13.480 -0.077 8.281 1.00 0.00 H new ATOM 0 HD11 LEU A 140 12.123 -2.108 8.012 1.00 0.00 H new ATOM 0 HD12 LEU A 140 13.799 -2.343 7.462 1.00 0.00 H new ATOM 0 HD13 LEU A 140 13.275 -3.007 9.028 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.611 -0.487 9.825 1.00 0.00 H new ATOM 0 HD22 LEU A 140 12.729 -1.277 10.962 1.00 0.00 H new ATOM 0 HD23 LEU A 140 12.916 0.452 10.588 1.00 0.00 H new ATOM 116 N PHE A 141 17.549 -2.589 7.379 1.00 0.00 N ATOM 117 CA PHE A 141 18.519 -3.671 7.365 1.00 0.00 C ATOM 118 C PHE A 141 19.562 -3.457 6.266 1.00 0.00 C ATOM 119 O PHE A 141 20.502 -4.240 6.137 1.00 0.00 O ATOM 120 CB PHE A 141 17.748 -4.960 7.075 1.00 0.00 C ATOM 121 CG PHE A 141 18.189 -6.153 7.924 1.00 0.00 C ATOM 122 CD1 PHE A 141 19.314 -6.844 7.594 1.00 0.00 C ATOM 123 CD2 PHE A 141 17.458 -6.524 9.010 1.00 0.00 C ATOM 124 CE1 PHE A 141 19.723 -7.952 8.382 1.00 0.00 C ATOM 125 CE2 PHE A 141 17.869 -7.632 9.797 1.00 0.00 C ATOM 126 CZ PHE A 141 18.992 -8.323 9.466 1.00 0.00 C ATOM 0 H PHE A 141 17.257 -2.266 6.457 1.00 0.00 H new ATOM 0 HA PHE A 141 19.040 -3.715 8.321 1.00 0.00 H new ATOM 0 HB2 PHE A 141 16.686 -4.781 7.242 1.00 0.00 H new ATOM 0 HB3 PHE A 141 17.867 -5.213 6.021 1.00 0.00 H new ATOM 0 HD1 PHE A 141 19.896 -6.550 6.733 1.00 0.00 H new ATOM 0 HD2 PHE A 141 16.565 -5.976 9.273 1.00 0.00 H new ATOM 0 HE1 PHE A 141 20.616 -8.500 8.120 1.00 0.00 H new ATOM 0 HE2 PHE A 141 17.289 -7.926 10.659 1.00 0.00 H new ATOM 0 HZ PHE A 141 19.303 -9.167 10.064 1.00 0.00 H new ATOM 136 N ASP A 142 19.361 -2.393 5.502 1.00 0.00 N ATOM 137 CA ASP A 142 20.272 -2.067 4.419 1.00 0.00 C ATOM 138 C ASP A 142 20.472 -3.301 3.536 1.00 0.00 C ATOM 139 O ASP A 142 20.105 -4.409 3.922 1.00 0.00 O ATOM 140 CB ASP A 142 21.641 -1.645 4.958 1.00 0.00 C ATOM 141 CG ASP A 142 21.674 -1.321 6.453 1.00 0.00 C ATOM 142 OD1 ASP A 142 21.609 -2.287 7.244 1.00 0.00 O ATOM 143 OD2 ASP A 142 21.765 -0.116 6.771 1.00 0.00 O ATOM 0 H ASP A 142 18.580 -1.746 5.612 1.00 0.00 H new ATOM 0 HA ASP A 142 19.838 -1.244 3.851 1.00 0.00 H new ATOM 0 HB2 ASP A 142 22.355 -2.444 4.759 1.00 0.00 H new ATOM 0 HB3 ASP A 142 21.979 -0.769 4.404 1.00 0.00 H new ATOM 148 N PHE A 143 21.052 -3.067 2.369 1.00 0.00 N ATOM 149 CA PHE A 143 21.305 -4.145 1.429 1.00 0.00 C ATOM 150 C PHE A 143 22.348 -3.733 0.388 1.00 0.00 C ATOM 151 O PHE A 143 23.347 -4.424 0.197 1.00 0.00 O ATOM 152 CB PHE A 143 19.982 -4.440 0.719 1.00 0.00 C ATOM 153 CG PHE A 143 20.140 -4.843 -0.748 1.00 0.00 C ATOM 154 CD1 PHE A 143 20.770 -6.004 -1.070 1.00 0.00 C ATOM 155 CD2 PHE A 143 19.650 -4.040 -1.730 1.00 0.00 C ATOM 156 CE1 PHE A 143 20.916 -6.379 -2.433 1.00 0.00 C ATOM 157 CE2 PHE A 143 19.796 -4.414 -3.093 1.00 0.00 C ATOM 158 CZ PHE A 143 20.426 -5.576 -3.415 1.00 0.00 C ATOM 0 H PHE A 143 21.354 -2.146 2.052 1.00 0.00 H new ATOM 0 HA PHE A 143 21.686 -5.018 1.959 1.00 0.00 H new ATOM 0 HB2 PHE A 143 19.466 -5.239 1.251 1.00 0.00 H new ATOM 0 HB3 PHE A 143 19.346 -3.557 0.776 1.00 0.00 H new ATOM 0 HD1 PHE A 143 21.160 -6.641 -0.290 1.00 0.00 H new ATOM 0 HD2 PHE A 143 19.150 -3.118 -1.474 1.00 0.00 H new ATOM 0 HE1 PHE A 143 21.416 -7.301 -2.689 1.00 0.00 H new ATOM 0 HE2 PHE A 143 19.407 -3.776 -3.873 1.00 0.00 H new ATOM 0 HZ PHE A 143 20.537 -5.861 -4.451 1.00 0.00 H new ATOM 168 N ASN A 144 22.079 -2.608 -0.258 1.00 0.00 N ATOM 169 CA ASN A 144 22.981 -2.094 -1.275 1.00 0.00 C ATOM 170 C ASN A 144 23.347 -3.222 -2.243 1.00 0.00 C ATOM 171 O ASN A 144 22.727 -3.368 -3.295 1.00 0.00 O ATOM 172 CB ASN A 144 24.275 -1.571 -0.650 1.00 0.00 C ATOM 173 CG ASN A 144 25.347 -1.339 -1.717 1.00 0.00 C ATOM 174 OD1 ASN A 144 26.254 -2.132 -1.905 1.00 0.00 O ATOM 175 ND2 ASN A 144 25.190 -0.211 -2.405 1.00 0.00 N ATOM 0 H ASN A 144 21.249 -2.038 -0.097 1.00 0.00 H new ATOM 0 HA ASN A 144 22.475 -1.279 -1.793 1.00 0.00 H new ATOM 0 HB2 ASN A 144 24.076 -0.639 -0.121 1.00 0.00 H new ATOM 0 HB3 ASN A 144 24.641 -2.285 0.088 1.00 0.00 H new ATOM 0 HD21 ASN A 144 25.852 0.034 -3.141 1.00 0.00 H new ATOM 0 HD22 ASN A 144 24.407 0.409 -2.196 1.00 0.00 H new ATOM 182 N GLY A 145 24.353 -3.992 -1.852 1.00 0.00 N ATOM 183 CA GLY A 145 24.807 -5.101 -2.672 1.00 0.00 C ATOM 184 C GLY A 145 25.550 -4.599 -3.912 1.00 0.00 C ATOM 185 O GLY A 145 26.701 -4.965 -4.141 1.00 0.00 O ATOM 0 H GLY A 145 24.865 -3.869 -0.979 1.00 0.00 H new ATOM 0 HA2 GLY A 145 25.463 -5.746 -2.087 1.00 0.00 H new ATOM 0 HA3 GLY A 145 23.953 -5.707 -2.976 1.00 0.00 H new ATOM 189 N ASN A 146 24.859 -3.769 -4.679 1.00 0.00 N ATOM 190 CA ASN A 146 25.438 -3.214 -5.890 1.00 0.00 C ATOM 191 C ASN A 146 24.315 -2.813 -6.850 1.00 0.00 C ATOM 192 O ASN A 146 24.539 -2.051 -7.789 1.00 0.00 O ATOM 193 CB ASN A 146 26.323 -4.240 -6.600 1.00 0.00 C ATOM 194 CG ASN A 146 27.805 -3.922 -6.395 1.00 0.00 C ATOM 195 OD1 ASN A 146 28.277 -2.831 -6.674 1.00 0.00 O ATOM 196 ND2 ASN A 146 28.511 -4.931 -5.893 1.00 0.00 N ATOM 0 H ASN A 146 23.904 -3.468 -4.485 1.00 0.00 H new ATOM 0 HA ASN A 146 26.042 -2.351 -5.609 1.00 0.00 H new ATOM 0 HB2 ASN A 146 26.106 -5.238 -6.219 1.00 0.00 H new ATOM 0 HB3 ASN A 146 26.093 -4.248 -7.665 1.00 0.00 H new ATOM 0 HD21 ASN A 146 29.510 -4.818 -5.719 1.00 0.00 H new ATOM 0 HD22 ASN A 146 28.054 -5.818 -5.682 1.00 0.00 H new ATOM 203 N ASP A 147 23.132 -3.345 -6.581 1.00 0.00 N ATOM 204 CA ASP A 147 21.975 -3.053 -7.409 1.00 0.00 C ATOM 205 C ASP A 147 22.145 -3.727 -8.772 1.00 0.00 C ATOM 206 O ASP A 147 21.761 -3.166 -9.798 1.00 0.00 O ATOM 207 CB ASP A 147 21.829 -1.548 -7.640 1.00 0.00 C ATOM 208 CG ASP A 147 22.124 -1.081 -9.066 1.00 0.00 C ATOM 209 OD1 ASP A 147 23.326 -0.938 -9.380 1.00 0.00 O ATOM 210 OD2 ASP A 147 21.141 -0.877 -9.812 1.00 0.00 O ATOM 0 H ASP A 147 22.950 -3.977 -5.801 1.00 0.00 H new ATOM 0 HA ASP A 147 21.089 -3.426 -6.895 1.00 0.00 H new ATOM 0 HB2 ASP A 147 20.812 -1.253 -7.380 1.00 0.00 H new ATOM 0 HB3 ASP A 147 22.498 -1.024 -6.957 1.00 0.00 H new ATOM 215 N GLU A 148 22.722 -4.918 -8.740 1.00 0.00 N ATOM 216 CA GLU A 148 22.948 -5.674 -9.961 1.00 0.00 C ATOM 217 C GLU A 148 21.613 -6.095 -10.579 1.00 0.00 C ATOM 218 O GLU A 148 21.566 -6.518 -11.734 1.00 0.00 O ATOM 219 CB GLU A 148 23.837 -6.891 -9.696 1.00 0.00 C ATOM 220 CG GLU A 148 25.309 -6.561 -9.952 1.00 0.00 C ATOM 221 CD GLU A 148 26.222 -7.389 -9.045 1.00 0.00 C ATOM 222 OE1 GLU A 148 25.967 -8.608 -8.944 1.00 0.00 O ATOM 223 OE2 GLU A 148 27.155 -6.782 -8.474 1.00 0.00 O ATOM 0 H GLU A 148 23.040 -5.379 -7.888 1.00 0.00 H new ATOM 0 HA GLU A 148 23.469 -5.032 -10.671 1.00 0.00 H new ATOM 0 HB2 GLU A 148 23.709 -7.222 -8.665 1.00 0.00 H new ATOM 0 HB3 GLU A 148 23.529 -7.717 -10.337 1.00 0.00 H new ATOM 0 HG2 GLU A 148 25.553 -6.757 -10.996 1.00 0.00 H new ATOM 0 HG3 GLU A 148 25.483 -5.499 -9.778 1.00 0.00 H new ATOM 230 N GLU A 149 20.562 -5.963 -9.784 1.00 0.00 N ATOM 231 CA GLU A 149 19.230 -6.324 -10.240 1.00 0.00 C ATOM 232 C GLU A 149 18.217 -6.159 -9.104 1.00 0.00 C ATOM 233 O GLU A 149 17.241 -6.902 -9.027 1.00 0.00 O ATOM 234 CB GLU A 149 19.207 -7.751 -10.793 1.00 0.00 C ATOM 235 CG GLU A 149 17.795 -8.148 -11.225 1.00 0.00 C ATOM 236 CD GLU A 149 17.837 -9.147 -12.385 1.00 0.00 C ATOM 237 OE1 GLU A 149 18.459 -8.798 -13.411 1.00 0.00 O ATOM 238 OE2 GLU A 149 17.246 -10.235 -12.218 1.00 0.00 O ATOM 0 H GLU A 149 20.605 -5.611 -8.827 1.00 0.00 H new ATOM 0 HA GLU A 149 18.950 -5.651 -11.051 1.00 0.00 H new ATOM 0 HB2 GLU A 149 19.886 -7.827 -11.642 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.568 -8.445 -10.034 1.00 0.00 H new ATOM 0 HG2 GLU A 149 17.263 -8.587 -10.381 1.00 0.00 H new ATOM 0 HG3 GLU A 149 17.239 -7.260 -11.525 1.00 0.00 H new ATOM 245 N ASP A 150 18.487 -5.183 -8.252 1.00 0.00 N ATOM 246 CA ASP A 150 17.612 -4.912 -7.123 1.00 0.00 C ATOM 247 C ASP A 150 17.761 -3.447 -6.708 1.00 0.00 C ATOM 248 O ASP A 150 18.612 -2.732 -7.235 1.00 0.00 O ATOM 249 CB ASP A 150 17.979 -5.783 -5.920 1.00 0.00 C ATOM 250 CG ASP A 150 18.111 -7.278 -6.221 1.00 0.00 C ATOM 251 OD1 ASP A 150 18.901 -7.605 -7.134 1.00 0.00 O ATOM 252 OD2 ASP A 150 17.421 -8.059 -5.531 1.00 0.00 O ATOM 0 H ASP A 150 19.299 -4.569 -8.320 1.00 0.00 H new ATOM 0 HA ASP A 150 16.589 -5.132 -7.429 1.00 0.00 H new ATOM 0 HB2 ASP A 150 18.922 -5.426 -5.506 1.00 0.00 H new ATOM 0 HB3 ASP A 150 17.221 -5.648 -5.148 1.00 0.00 H new ATOM 257 N LEU A 151 16.920 -3.043 -5.767 1.00 0.00 N ATOM 258 CA LEU A 151 16.946 -1.676 -5.276 1.00 0.00 C ATOM 259 C LEU A 151 17.795 -1.613 -4.004 1.00 0.00 C ATOM 260 O LEU A 151 17.447 -2.216 -2.991 1.00 0.00 O ATOM 261 CB LEU A 151 15.524 -1.145 -5.092 1.00 0.00 C ATOM 262 CG LEU A 151 15.402 0.239 -4.450 1.00 0.00 C ATOM 263 CD1 LEU A 151 16.416 1.214 -5.053 1.00 0.00 C ATOM 264 CD2 LEU A 151 13.970 0.766 -4.551 1.00 0.00 C ATOM 0 H LEU A 151 16.216 -3.639 -5.332 1.00 0.00 H new ATOM 0 HA LEU A 151 17.415 -1.017 -6.007 1.00 0.00 H new ATOM 0 HB2 LEU A 151 15.040 -1.115 -6.068 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.968 -1.857 -4.482 1.00 0.00 H new ATOM 0 HG LEU A 151 15.636 0.146 -3.390 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.308 2.190 -4.580 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.426 0.839 -4.885 1.00 0.00 H new ATOM 0 HD13 LEU A 151 16.237 1.309 -6.124 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.911 1.751 -4.087 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.683 0.841 -5.600 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.294 0.082 -4.038 1.00 0.00 H new ATOM 276 N PRO A 152 18.922 -0.857 -4.102 1.00 0.00 N ATOM 277 CA PRO A 152 19.823 -0.707 -2.972 1.00 0.00 C ATOM 278 C PRO A 152 19.236 0.242 -1.925 1.00 0.00 C ATOM 279 O PRO A 152 18.880 1.376 -2.240 1.00 0.00 O ATOM 280 CB PRO A 152 21.124 -0.198 -3.572 1.00 0.00 C ATOM 281 CG PRO A 152 20.764 0.358 -4.939 1.00 0.00 C ATOM 282 CD PRO A 152 19.366 -0.129 -5.287 1.00 0.00 C ATOM 0 HA PRO A 152 19.986 -1.642 -2.436 1.00 0.00 H new ATOM 0 HB2 PRO A 152 21.569 0.572 -2.942 1.00 0.00 H new ATOM 0 HB3 PRO A 152 21.855 -1.002 -3.658 1.00 0.00 H new ATOM 0 HG2 PRO A 152 20.797 1.447 -4.929 1.00 0.00 H new ATOM 0 HG3 PRO A 152 21.482 0.024 -5.688 1.00 0.00 H new ATOM 0 HD2 PRO A 152 18.701 0.705 -5.512 1.00 0.00 H new ATOM 0 HD3 PRO A 152 19.378 -0.773 -6.166 1.00 0.00 H new ATOM 290 N PHE A 153 19.153 -0.258 -0.700 1.00 0.00 N ATOM 291 CA PHE A 153 18.615 0.530 0.395 1.00 0.00 C ATOM 292 C PHE A 153 19.529 0.462 1.621 1.00 0.00 C ATOM 293 O PHE A 153 20.547 -0.228 1.602 1.00 0.00 O ATOM 294 CB PHE A 153 17.255 -0.071 0.753 1.00 0.00 C ATOM 295 CG PHE A 153 17.304 -1.561 1.100 1.00 0.00 C ATOM 296 CD1 PHE A 153 17.703 -1.958 2.337 1.00 0.00 C ATOM 297 CD2 PHE A 153 16.951 -2.487 0.168 1.00 0.00 C ATOM 298 CE1 PHE A 153 17.749 -3.340 2.658 1.00 0.00 C ATOM 299 CE2 PHE A 153 16.998 -3.869 0.489 1.00 0.00 C ATOM 300 CZ PHE A 153 17.395 -4.267 1.727 1.00 0.00 C ATOM 0 H PHE A 153 19.450 -1.199 -0.442 1.00 0.00 H new ATOM 0 HA PHE A 153 18.532 1.575 0.095 1.00 0.00 H new ATOM 0 HB2 PHE A 153 16.840 0.475 1.600 1.00 0.00 H new ATOM 0 HB3 PHE A 153 16.573 0.074 -0.085 1.00 0.00 H new ATOM 0 HD1 PHE A 153 17.985 -1.222 3.076 1.00 0.00 H new ATOM 0 HD2 PHE A 153 16.635 -2.171 -0.815 1.00 0.00 H new ATOM 0 HE1 PHE A 153 18.065 -3.656 3.641 1.00 0.00 H new ATOM 0 HE2 PHE A 153 16.718 -4.605 -0.251 1.00 0.00 H new ATOM 0 HZ PHE A 153 17.429 -5.318 1.971 1.00 0.00 H new ATOM 310 N LYS A 154 19.132 1.186 2.656 1.00 0.00 N ATOM 311 CA LYS A 154 19.903 1.216 3.888 1.00 0.00 C ATOM 312 C LYS A 154 19.001 0.817 5.058 1.00 0.00 C ATOM 313 O LYS A 154 17.837 0.471 4.860 1.00 0.00 O ATOM 314 CB LYS A 154 20.575 2.579 4.066 1.00 0.00 C ATOM 315 CG LYS A 154 21.910 2.633 3.321 1.00 0.00 C ATOM 316 CD LYS A 154 22.250 4.068 2.912 1.00 0.00 C ATOM 317 CE LYS A 154 23.525 4.548 3.610 1.00 0.00 C ATOM 318 NZ LYS A 154 23.192 5.484 4.708 1.00 0.00 N ATOM 0 H LYS A 154 18.287 1.757 2.668 1.00 0.00 H new ATOM 0 HA LYS A 154 20.714 0.489 3.848 1.00 0.00 H new ATOM 0 HB2 LYS A 154 19.916 3.365 3.696 1.00 0.00 H new ATOM 0 HB3 LYS A 154 20.738 2.773 5.126 1.00 0.00 H new ATOM 0 HG2 LYS A 154 22.701 2.234 3.956 1.00 0.00 H new ATOM 0 HG3 LYS A 154 21.862 2.000 2.435 1.00 0.00 H new ATOM 0 HD2 LYS A 154 22.381 4.121 1.831 1.00 0.00 H new ATOM 0 HD3 LYS A 154 21.421 4.729 3.166 1.00 0.00 H new ATOM 0 HE2 LYS A 154 24.074 3.694 4.006 1.00 0.00 H new ATOM 0 HE3 LYS A 154 24.178 5.040 2.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 24.067 5.801 5.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 22.688 6.307 4.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 22.587 5.002 5.403 1.00 0.00 H new ATOM 332 N LYS A 155 19.572 0.878 6.252 1.00 0.00 N ATOM 333 CA LYS A 155 18.835 0.527 7.454 1.00 0.00 C ATOM 334 C LYS A 155 18.010 1.733 7.910 1.00 0.00 C ATOM 335 O LYS A 155 17.955 2.036 9.101 1.00 0.00 O ATOM 336 CB LYS A 155 19.784 -0.010 8.527 1.00 0.00 C ATOM 337 CG LYS A 155 20.831 1.037 8.908 1.00 0.00 C ATOM 338 CD LYS A 155 20.418 1.791 10.174 1.00 0.00 C ATOM 339 CE LYS A 155 20.272 3.288 9.898 1.00 0.00 C ATOM 340 NZ LYS A 155 21.076 4.074 10.859 1.00 0.00 N ATOM 0 H LYS A 155 20.537 1.166 6.413 1.00 0.00 H new ATOM 0 HA LYS A 155 18.133 -0.282 7.249 1.00 0.00 H new ATOM 0 HB2 LYS A 155 19.214 -0.297 9.411 1.00 0.00 H new ATOM 0 HB3 LYS A 155 20.280 -0.909 8.161 1.00 0.00 H new ATOM 0 HG2 LYS A 155 21.794 0.552 9.067 1.00 0.00 H new ATOM 0 HG3 LYS A 155 20.961 1.742 8.087 1.00 0.00 H new ATOM 0 HD2 LYS A 155 19.474 1.393 10.547 1.00 0.00 H new ATOM 0 HD3 LYS A 155 21.162 1.632 10.955 1.00 0.00 H new ATOM 0 HE2 LYS A 155 20.593 3.509 8.880 1.00 0.00 H new ATOM 0 HE3 LYS A 155 19.223 3.576 9.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 20.965 5.088 10.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 20.751 3.876 11.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 22.078 3.811 10.770 1.00 0.00 H new ATOM 354 N GLY A 156 17.390 2.387 6.939 1.00 0.00 N ATOM 355 CA GLY A 156 16.571 3.552 7.227 1.00 0.00 C ATOM 356 C GLY A 156 16.339 4.385 5.965 1.00 0.00 C ATOM 357 O GLY A 156 16.352 5.614 6.017 1.00 0.00 O ATOM 0 H GLY A 156 17.438 2.132 5.952 1.00 0.00 H new ATOM 0 HA2 GLY A 156 15.613 3.235 7.639 1.00 0.00 H new ATOM 0 HA3 GLY A 156 17.057 4.164 7.987 1.00 0.00 H new ATOM 361 N ASP A 157 16.135 3.683 4.860 1.00 0.00 N ATOM 362 CA ASP A 157 15.901 4.341 3.587 1.00 0.00 C ATOM 363 C ASP A 157 14.401 4.339 3.283 1.00 0.00 C ATOM 364 O ASP A 157 13.663 3.496 3.790 1.00 0.00 O ATOM 365 CB ASP A 157 16.615 3.609 2.449 1.00 0.00 C ATOM 366 CG ASP A 157 16.461 4.253 1.069 1.00 0.00 C ATOM 367 OD1 ASP A 157 16.983 5.376 0.905 1.00 0.00 O ATOM 368 OD2 ASP A 157 15.824 3.606 0.209 1.00 0.00 O ATOM 0 H ASP A 157 16.127 2.664 4.821 1.00 0.00 H new ATOM 0 HA ASP A 157 16.285 5.359 3.659 1.00 0.00 H new ATOM 0 HB2 ASP A 157 17.677 3.546 2.687 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.238 2.588 2.401 1.00 0.00 H new ATOM 373 N ILE A 158 13.996 5.293 2.458 1.00 0.00 N ATOM 374 CA ILE A 158 12.597 5.411 2.081 1.00 0.00 C ATOM 375 C ILE A 158 12.463 5.221 0.568 1.00 0.00 C ATOM 376 O ILE A 158 13.170 5.864 -0.206 1.00 0.00 O ATOM 377 CB ILE A 158 12.016 6.732 2.588 1.00 0.00 C ATOM 378 CG1 ILE A 158 11.268 6.530 3.909 1.00 0.00 C ATOM 379 CG2 ILE A 158 11.133 7.388 1.524 1.00 0.00 C ATOM 380 CD1 ILE A 158 12.236 6.172 5.038 1.00 0.00 C ATOM 0 H ILE A 158 14.611 5.991 2.040 1.00 0.00 H new ATOM 0 HA ILE A 158 12.007 4.626 2.555 1.00 0.00 H new ATOM 0 HB ILE A 158 12.842 7.415 2.786 1.00 0.00 H new ATOM 0 HG12 ILE A 158 10.724 7.439 4.166 1.00 0.00 H new ATOM 0 HG13 ILE A 158 10.528 5.738 3.795 1.00 0.00 H new ATOM 0 HG21 ILE A 158 10.733 8.325 1.911 1.00 0.00 H new ATOM 0 HG22 ILE A 158 11.726 7.587 0.631 1.00 0.00 H new ATOM 0 HG23 ILE A 158 10.310 6.719 1.271 1.00 0.00 H new ATOM 0 HD11 ILE A 158 11.679 6.034 5.965 1.00 0.00 H new ATOM 0 HD12 ILE A 158 12.760 5.249 4.789 1.00 0.00 H new ATOM 0 HD13 ILE A 158 12.959 6.977 5.166 1.00 0.00 H new ATOM 392 N LEU A 159 11.551 4.336 0.194 1.00 0.00 N ATOM 393 CA LEU A 159 11.315 4.055 -1.212 1.00 0.00 C ATOM 394 C LEU A 159 9.829 3.762 -1.426 1.00 0.00 C ATOM 395 O LEU A 159 9.214 3.043 -0.640 1.00 0.00 O ATOM 396 CB LEU A 159 12.239 2.935 -1.695 1.00 0.00 C ATOM 397 CG LEU A 159 13.654 2.935 -1.116 1.00 0.00 C ATOM 398 CD1 LEU A 159 13.710 2.150 0.196 1.00 0.00 C ATOM 399 CD2 LEU A 159 14.666 2.414 -2.138 1.00 0.00 C ATOM 0 H LEU A 159 10.967 3.804 0.840 1.00 0.00 H new ATOM 0 HA LEU A 159 11.559 4.925 -1.822 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.772 1.979 -1.459 1.00 0.00 H new ATOM 0 HB3 LEU A 159 12.312 2.995 -2.781 1.00 0.00 H new ATOM 0 HG LEU A 159 13.928 3.965 -0.888 1.00 0.00 H new ATOM 0 HD11 LEU A 159 14.728 2.166 0.586 1.00 0.00 H new ATOM 0 HD12 LEU A 159 13.036 2.605 0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 159 13.406 1.119 0.016 1.00 0.00 H new ATOM 0 HD21 LEU A 159 15.664 2.425 -1.700 1.00 0.00 H new ATOM 0 HD22 LEU A 159 14.405 1.394 -2.421 1.00 0.00 H new ATOM 0 HD23 LEU A 159 14.651 3.051 -3.022 1.00 0.00 H new ATOM 411 N ARG A 160 9.294 4.335 -2.495 1.00 0.00 N ATOM 412 CA ARG A 160 7.892 4.145 -2.823 1.00 0.00 C ATOM 413 C ARG A 160 7.720 2.927 -3.732 1.00 0.00 C ATOM 414 O ARG A 160 8.596 2.621 -4.539 1.00 0.00 O ATOM 415 CB ARG A 160 7.317 5.379 -3.521 1.00 0.00 C ATOM 416 CG ARG A 160 7.982 5.599 -4.881 1.00 0.00 C ATOM 417 CD ARG A 160 7.665 6.993 -5.427 1.00 0.00 C ATOM 418 NE ARG A 160 6.359 6.980 -6.122 1.00 0.00 N ATOM 419 CZ ARG A 160 5.838 8.035 -6.763 1.00 0.00 C ATOM 420 NH1 ARG A 160 6.511 9.194 -6.802 1.00 0.00 N ATOM 421 NH2 ARG A 160 4.646 7.931 -7.366 1.00 0.00 N ATOM 0 H ARG A 160 9.807 4.931 -3.145 1.00 0.00 H new ATOM 0 HA ARG A 160 7.352 3.985 -1.890 1.00 0.00 H new ATOM 0 HB2 ARG A 160 6.242 5.259 -3.653 1.00 0.00 H new ATOM 0 HB3 ARG A 160 7.465 6.258 -2.894 1.00 0.00 H new ATOM 0 HG2 ARG A 160 9.061 5.478 -4.786 1.00 0.00 H new ATOM 0 HG3 ARG A 160 7.637 4.842 -5.585 1.00 0.00 H new ATOM 0 HD2 ARG A 160 7.645 7.716 -4.611 1.00 0.00 H new ATOM 0 HD3 ARG A 160 8.449 7.310 -6.115 1.00 0.00 H new ATOM 0 HE ARG A 160 5.821 6.113 -6.113 1.00 0.00 H new ATOM 0 HH11 ARG A 160 7.419 9.272 -6.344 1.00 0.00 H new ATOM 0 HH12 ARG A 160 6.115 9.998 -7.290 1.00 0.00 H new ATOM 0 HH21 ARG A 160 4.135 7.049 -7.337 1.00 0.00 H new ATOM 0 HH22 ARG A 160 4.249 8.734 -7.854 1.00 0.00 H new ATOM 435 N ILE A 161 6.584 2.264 -3.571 1.00 0.00 N ATOM 436 CA ILE A 161 6.286 1.086 -4.367 1.00 0.00 C ATOM 437 C ILE A 161 5.525 1.505 -5.626 1.00 0.00 C ATOM 438 O ILE A 161 4.428 2.057 -5.538 1.00 0.00 O ATOM 439 CB ILE A 161 5.551 0.041 -3.525 1.00 0.00 C ATOM 440 CG1 ILE A 161 6.434 -1.184 -3.279 1.00 0.00 C ATOM 441 CG2 ILE A 161 4.212 -0.336 -4.162 1.00 0.00 C ATOM 442 CD1 ILE A 161 7.516 -0.882 -2.242 1.00 0.00 C ATOM 0 H ILE A 161 5.859 2.521 -2.901 1.00 0.00 H new ATOM 0 HA ILE A 161 7.208 0.606 -4.695 1.00 0.00 H new ATOM 0 HB ILE A 161 5.331 0.481 -2.552 1.00 0.00 H new ATOM 0 HG12 ILE A 161 5.819 -2.016 -2.936 1.00 0.00 H new ATOM 0 HG13 ILE A 161 6.899 -1.495 -4.215 1.00 0.00 H new ATOM 0 HG21 ILE A 161 3.711 -1.080 -3.543 1.00 0.00 H new ATOM 0 HG22 ILE A 161 3.584 0.552 -4.242 1.00 0.00 H new ATOM 0 HG23 ILE A 161 4.385 -0.748 -5.156 1.00 0.00 H new ATOM 0 HD11 ILE A 161 8.129 -1.770 -2.087 1.00 0.00 H new ATOM 0 HD12 ILE A 161 8.144 -0.065 -2.599 1.00 0.00 H new ATOM 0 HD13 ILE A 161 7.048 -0.595 -1.301 1.00 0.00 H new ATOM 454 N ARG A 162 6.135 1.228 -6.769 1.00 0.00 N ATOM 455 CA ARG A 162 5.529 1.571 -8.044 1.00 0.00 C ATOM 456 C ARG A 162 4.892 0.333 -8.678 1.00 0.00 C ATOM 457 O ARG A 162 3.774 0.398 -9.187 1.00 0.00 O ATOM 458 CB ARG A 162 6.566 2.152 -9.008 1.00 0.00 C ATOM 459 CG ARG A 162 7.361 1.041 -9.694 1.00 0.00 C ATOM 460 CD ARG A 162 8.424 1.623 -10.628 1.00 0.00 C ATOM 461 NE ARG A 162 8.580 0.758 -11.819 1.00 0.00 N ATOM 462 CZ ARG A 162 7.797 0.826 -12.905 1.00 0.00 C ATOM 463 NH1 ARG A 162 6.800 1.718 -12.956 1.00 0.00 N ATOM 464 NH2 ARG A 162 8.013 0.001 -13.938 1.00 0.00 N ATOM 0 H ARG A 162 7.043 0.770 -6.839 1.00 0.00 H new ATOM 0 HA ARG A 162 4.763 2.323 -7.856 1.00 0.00 H new ATOM 0 HB2 ARG A 162 6.066 2.763 -9.759 1.00 0.00 H new ATOM 0 HB3 ARG A 162 7.246 2.808 -8.464 1.00 0.00 H new ATOM 0 HG2 ARG A 162 7.838 0.413 -8.942 1.00 0.00 H new ATOM 0 HG3 ARG A 162 6.684 0.402 -10.261 1.00 0.00 H new ATOM 0 HD2 ARG A 162 8.139 2.630 -10.934 1.00 0.00 H new ATOM 0 HD3 ARG A 162 9.375 1.707 -10.102 1.00 0.00 H new ATOM 0 HE ARG A 162 9.330 0.067 -11.813 1.00 0.00 H new ATOM 0 HH11 ARG A 162 6.636 2.346 -12.169 1.00 0.00 H new ATOM 0 HH12 ARG A 162 6.204 1.770 -13.782 1.00 0.00 H new ATOM 0 HH21 ARG A 162 8.773 -0.678 -13.898 1.00 0.00 H new ATOM 0 HH22 ARG A 162 7.418 0.052 -14.765 1.00 0.00 H new ATOM 478 N ASP A 163 5.630 -0.766 -8.626 1.00 0.00 N ATOM 479 CA ASP A 163 5.150 -2.017 -9.189 1.00 0.00 C ATOM 480 C ASP A 163 5.763 -3.187 -8.416 1.00 0.00 C ATOM 481 O ASP A 163 6.644 -2.990 -7.581 1.00 0.00 O ATOM 482 CB ASP A 163 5.561 -2.154 -10.657 1.00 0.00 C ATOM 483 CG ASP A 163 4.867 -3.283 -11.419 1.00 0.00 C ATOM 484 OD1 ASP A 163 3.718 -3.600 -11.043 1.00 0.00 O ATOM 485 OD2 ASP A 163 5.500 -3.804 -12.363 1.00 0.00 O ATOM 0 H ASP A 163 6.557 -0.816 -8.203 1.00 0.00 H new ATOM 0 HA ASP A 163 4.062 -2.024 -9.116 1.00 0.00 H new ATOM 0 HB2 ASP A 163 5.355 -1.212 -11.166 1.00 0.00 H new ATOM 0 HB3 ASP A 163 6.638 -2.313 -10.704 1.00 0.00 H new ATOM 490 N LYS A 164 5.271 -4.378 -8.722 1.00 0.00 N ATOM 491 CA LYS A 164 5.760 -5.581 -8.066 1.00 0.00 C ATOM 492 C LYS A 164 5.971 -6.676 -9.112 1.00 0.00 C ATOM 493 O LYS A 164 5.042 -7.045 -9.827 1.00 0.00 O ATOM 494 CB LYS A 164 4.821 -5.988 -6.930 1.00 0.00 C ATOM 495 CG LYS A 164 4.576 -4.818 -5.974 1.00 0.00 C ATOM 496 CD LYS A 164 3.102 -4.405 -5.981 1.00 0.00 C ATOM 497 CE LYS A 164 2.935 -2.969 -5.478 1.00 0.00 C ATOM 498 NZ LYS A 164 1.587 -2.457 -5.814 1.00 0.00 N ATOM 0 H LYS A 164 4.539 -4.537 -9.415 1.00 0.00 H new ATOM 0 HA LYS A 164 6.727 -5.396 -7.599 1.00 0.00 H new ATOM 0 HB2 LYS A 164 3.872 -6.330 -7.343 1.00 0.00 H new ATOM 0 HB3 LYS A 164 5.250 -6.826 -6.382 1.00 0.00 H new ATOM 0 HG2 LYS A 164 4.874 -5.100 -4.964 1.00 0.00 H new ATOM 0 HG3 LYS A 164 5.197 -3.970 -6.264 1.00 0.00 H new ATOM 0 HD2 LYS A 164 2.701 -4.490 -6.991 1.00 0.00 H new ATOM 0 HD3 LYS A 164 2.527 -5.084 -5.352 1.00 0.00 H new ATOM 0 HE2 LYS A 164 3.085 -2.935 -4.399 1.00 0.00 H new ATOM 0 HE3 LYS A 164 3.696 -2.329 -5.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 1.489 -1.482 -5.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 1.458 -2.471 -6.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 0.866 -3.058 -5.366 1.00 0.00 H new ATOM 512 N PRO A 165 7.234 -7.180 -9.170 1.00 0.00 N ATOM 513 CA PRO A 165 7.579 -8.226 -10.116 1.00 0.00 C ATOM 514 C PRO A 165 7.024 -9.578 -9.666 1.00 0.00 C ATOM 515 O PRO A 165 6.418 -10.300 -10.457 1.00 0.00 O ATOM 516 CB PRO A 165 9.097 -8.202 -10.191 1.00 0.00 C ATOM 517 CG PRO A 165 9.565 -7.467 -8.946 1.00 0.00 C ATOM 518 CD PRO A 165 8.361 -6.767 -8.339 1.00 0.00 C ATOM 0 HA PRO A 165 7.142 -8.063 -11.101 1.00 0.00 H new ATOM 0 HB2 PRO A 165 9.502 -9.213 -10.223 1.00 0.00 H new ATOM 0 HB3 PRO A 165 9.435 -7.694 -11.094 1.00 0.00 H new ATOM 0 HG2 PRO A 165 10.001 -8.165 -8.232 1.00 0.00 H new ATOM 0 HG3 PRO A 165 10.340 -6.744 -9.198 1.00 0.00 H new ATOM 0 HD2 PRO A 165 8.215 -7.060 -7.299 1.00 0.00 H new ATOM 0 HD3 PRO A 165 8.485 -5.684 -8.350 1.00 0.00 H new ATOM 526 N GLU A 166 7.251 -9.882 -8.396 1.00 0.00 N ATOM 527 CA GLU A 166 6.780 -11.134 -7.830 1.00 0.00 C ATOM 528 C GLU A 166 5.891 -10.868 -6.613 1.00 0.00 C ATOM 529 O GLU A 166 4.717 -10.531 -6.760 1.00 0.00 O ATOM 530 CB GLU A 166 7.954 -12.045 -7.462 1.00 0.00 C ATOM 531 CG GLU A 166 8.673 -12.547 -8.716 1.00 0.00 C ATOM 532 CD GLU A 166 9.756 -11.560 -9.158 1.00 0.00 C ATOM 533 OE1 GLU A 166 10.324 -10.902 -8.260 1.00 0.00 O ATOM 534 OE2 GLU A 166 9.992 -11.487 -10.383 1.00 0.00 O ATOM 0 H GLU A 166 7.755 -9.282 -7.743 1.00 0.00 H new ATOM 0 HA GLU A 166 6.184 -11.648 -8.584 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.656 -11.502 -6.829 1.00 0.00 H new ATOM 0 HB3 GLU A 166 7.592 -12.894 -6.882 1.00 0.00 H new ATOM 0 HG2 GLU A 166 9.122 -13.520 -8.517 1.00 0.00 H new ATOM 0 HG3 GLU A 166 7.952 -12.687 -9.522 1.00 0.00 H new ATOM 541 N GLU A 167 6.485 -11.027 -5.440 1.00 0.00 N ATOM 542 CA GLU A 167 5.762 -10.807 -4.199 1.00 0.00 C ATOM 543 C GLU A 167 6.720 -10.342 -3.101 1.00 0.00 C ATOM 544 O GLU A 167 6.644 -9.200 -2.650 1.00 0.00 O ATOM 545 CB GLU A 167 5.010 -12.069 -3.772 1.00 0.00 C ATOM 546 CG GLU A 167 3.497 -11.841 -3.793 1.00 0.00 C ATOM 547 CD GLU A 167 3.010 -11.271 -2.460 1.00 0.00 C ATOM 548 OE1 GLU A 167 3.529 -11.734 -1.420 1.00 0.00 O ATOM 549 OE2 GLU A 167 2.130 -10.386 -2.509 1.00 0.00 O ATOM 0 H GLU A 167 7.459 -11.306 -5.322 1.00 0.00 H new ATOM 0 HA GLU A 167 5.024 -10.022 -4.366 1.00 0.00 H new ATOM 0 HB2 GLU A 167 5.266 -12.892 -4.439 1.00 0.00 H new ATOM 0 HB3 GLU A 167 5.323 -12.361 -2.770 1.00 0.00 H new ATOM 0 HG2 GLU A 167 3.240 -11.156 -4.601 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.987 -12.782 -3.998 1.00 0.00 H new ATOM 556 N GLN A 168 7.600 -11.249 -2.704 1.00 0.00 N ATOM 557 CA GLN A 168 8.572 -10.946 -1.668 1.00 0.00 C ATOM 558 C GLN A 168 9.357 -9.683 -2.030 1.00 0.00 C ATOM 559 O GLN A 168 9.669 -8.871 -1.160 1.00 0.00 O ATOM 560 CB GLN A 168 9.513 -12.130 -1.436 1.00 0.00 C ATOM 561 CG GLN A 168 10.669 -12.116 -2.439 1.00 0.00 C ATOM 562 CD GLN A 168 11.685 -13.214 -2.120 1.00 0.00 C ATOM 563 OE1 GLN A 168 11.831 -14.188 -2.840 1.00 0.00 O ATOM 564 NE2 GLN A 168 12.376 -13.004 -1.003 1.00 0.00 N ATOM 0 H GLN A 168 7.660 -12.195 -3.082 1.00 0.00 H new ATOM 0 HA GLN A 168 8.037 -10.763 -0.736 1.00 0.00 H new ATOM 0 HB2 GLN A 168 9.907 -12.092 -0.421 1.00 0.00 H new ATOM 0 HB3 GLN A 168 8.958 -13.064 -1.528 1.00 0.00 H new ATOM 0 HG2 GLN A 168 10.281 -12.256 -3.448 1.00 0.00 H new ATOM 0 HG3 GLN A 168 11.161 -11.143 -2.419 1.00 0.00 H new ATOM 0 HE21 GLN A 168 12.204 -12.167 -0.446 1.00 0.00 H new ATOM 0 HE22 GLN A 168 13.078 -13.680 -0.703 1.00 0.00 H new ATOM 573 N TRP A 169 9.654 -9.557 -3.315 1.00 0.00 N ATOM 574 CA TRP A 169 10.396 -8.408 -3.803 1.00 0.00 C ATOM 575 C TRP A 169 9.404 -7.451 -4.468 1.00 0.00 C ATOM 576 O TRP A 169 8.624 -7.861 -5.326 1.00 0.00 O ATOM 577 CB TRP A 169 11.527 -8.842 -4.737 1.00 0.00 C ATOM 578 CG TRP A 169 12.747 -9.415 -4.013 1.00 0.00 C ATOM 579 CD1 TRP A 169 13.008 -10.698 -3.726 1.00 0.00 C ATOM 580 CD2 TRP A 169 13.868 -8.669 -3.493 1.00 0.00 C ATOM 581 NE1 TRP A 169 14.210 -10.832 -3.061 1.00 0.00 N ATOM 582 CE2 TRP A 169 14.749 -9.560 -2.916 1.00 0.00 C ATOM 583 CE3 TRP A 169 14.128 -7.288 -3.511 1.00 0.00 C ATOM 584 CZ2 TRP A 169 15.950 -9.168 -2.312 1.00 0.00 C ATOM 585 CZ3 TRP A 169 15.332 -6.912 -2.903 1.00 0.00 C ATOM 586 CH2 TRP A 169 16.231 -7.796 -2.317 1.00 0.00 C ATOM 0 H TRP A 169 9.394 -10.233 -4.033 1.00 0.00 H new ATOM 0 HA TRP A 169 10.883 -7.886 -2.980 1.00 0.00 H new ATOM 0 HB2 TRP A 169 11.144 -9.591 -5.431 1.00 0.00 H new ATOM 0 HB3 TRP A 169 11.841 -7.985 -5.334 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.360 -11.523 -3.983 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.626 -11.705 -2.736 1.00 0.00 H new ATOM 0 HE3 TRP A 169 13.453 -6.574 -3.958 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.623 -9.885 -1.866 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 15.580 -5.861 -2.888 1.00 0.00 H new ATOM 0 HH2 TRP A 169 17.141 -7.427 -1.868 1.00 0.00 H new ATOM 597 N TRP A 170 9.467 -6.198 -4.047 1.00 0.00 N ATOM 598 CA TRP A 170 8.584 -5.181 -4.592 1.00 0.00 C ATOM 599 C TRP A 170 9.445 -4.153 -5.330 1.00 0.00 C ATOM 600 O TRP A 170 10.527 -3.798 -4.866 1.00 0.00 O ATOM 601 CB TRP A 170 7.720 -4.558 -3.492 1.00 0.00 C ATOM 602 CG TRP A 170 6.587 -5.462 -3.005 1.00 0.00 C ATOM 603 CD1 TRP A 170 6.093 -6.558 -3.597 1.00 0.00 C ATOM 604 CD2 TRP A 170 5.821 -5.303 -1.792 1.00 0.00 C ATOM 605 NE1 TRP A 170 5.069 -7.115 -2.857 1.00 0.00 N ATOM 606 CE2 TRP A 170 4.898 -6.327 -1.725 1.00 0.00 C ATOM 607 CE3 TRP A 170 5.906 -4.325 -0.784 1.00 0.00 C ATOM 608 CZ2 TRP A 170 3.991 -6.472 -0.669 1.00 0.00 C ATOM 609 CZ3 TRP A 170 4.991 -4.485 0.263 1.00 0.00 C ATOM 610 CH2 TRP A 170 4.056 -5.510 0.346 1.00 0.00 C ATOM 0 H TRP A 170 10.116 -5.863 -3.335 1.00 0.00 H new ATOM 0 HA TRP A 170 7.882 -5.620 -5.301 1.00 0.00 H new ATOM 0 HB2 TRP A 170 8.357 -4.302 -2.645 1.00 0.00 H new ATOM 0 HB3 TRP A 170 7.294 -3.626 -3.863 1.00 0.00 H new ATOM 0 HD1 TRP A 170 6.451 -6.956 -4.535 1.00 0.00 H new ATOM 0 HE1 TRP A 170 4.536 -7.951 -3.097 1.00 0.00 H new ATOM 0 HE3 TRP A 170 6.620 -3.516 -0.816 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 3.279 -7.283 -0.639 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 5.013 -3.760 1.063 1.00 0.00 H new ATOM 0 HH2 TRP A 170 3.383 -5.564 1.189 1.00 0.00 H new ATOM 621 N ASN A 171 8.930 -3.705 -6.466 1.00 0.00 N ATOM 622 CA ASN A 171 9.639 -2.725 -7.272 1.00 0.00 C ATOM 623 C ASN A 171 9.270 -1.318 -6.799 1.00 0.00 C ATOM 624 O ASN A 171 8.227 -0.786 -7.176 1.00 0.00 O ATOM 625 CB ASN A 171 9.252 -2.843 -8.747 1.00 0.00 C ATOM 626 CG ASN A 171 10.467 -2.623 -9.652 1.00 0.00 C ATOM 627 OD1 ASN A 171 11.426 -1.959 -9.296 1.00 0.00 O ATOM 628 ND2 ASN A 171 10.372 -3.218 -10.838 1.00 0.00 N ATOM 0 H ASN A 171 8.032 -4.002 -6.847 1.00 0.00 H new ATOM 0 HA ASN A 171 10.708 -2.908 -7.162 1.00 0.00 H new ATOM 0 HB2 ASN A 171 8.826 -3.828 -8.937 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.480 -2.111 -8.984 1.00 0.00 H new ATOM 0 HD21 ASN A 171 11.131 -3.133 -11.514 1.00 0.00 H new ATOM 0 HD22 ASN A 171 9.540 -3.760 -11.072 1.00 0.00 H new ATOM 635 N ALA A 172 10.146 -0.756 -5.978 1.00 0.00 N ATOM 636 CA ALA A 172 9.925 0.580 -5.448 1.00 0.00 C ATOM 637 C ALA A 172 11.001 1.522 -5.989 1.00 0.00 C ATOM 638 O ALA A 172 12.013 1.072 -6.526 1.00 0.00 O ATOM 639 CB ALA A 172 9.910 0.526 -3.920 1.00 0.00 C ATOM 0 H ALA A 172 11.010 -1.201 -5.667 1.00 0.00 H new ATOM 0 HA ALA A 172 8.958 0.966 -5.769 1.00 0.00 H new ATOM 0 HB1 ALA A 172 9.744 1.527 -3.522 1.00 0.00 H new ATOM 0 HB2 ALA A 172 9.109 -0.134 -3.587 1.00 0.00 H new ATOM 0 HB3 ALA A 172 10.866 0.146 -3.560 1.00 0.00 H new ATOM 645 N GLU A 173 10.748 2.812 -5.828 1.00 0.00 N ATOM 646 CA GLU A 173 11.683 3.823 -6.294 1.00 0.00 C ATOM 647 C GLU A 173 12.381 4.487 -5.106 1.00 0.00 C ATOM 648 O GLU A 173 11.732 4.865 -4.132 1.00 0.00 O ATOM 649 CB GLU A 173 10.978 4.863 -7.167 1.00 0.00 C ATOM 650 CG GLU A 173 11.385 4.713 -8.635 1.00 0.00 C ATOM 651 CD GLU A 173 10.748 5.807 -9.494 1.00 0.00 C ATOM 652 OE1 GLU A 173 10.648 6.944 -8.983 1.00 0.00 O ATOM 653 OE2 GLU A 173 10.375 5.482 -10.642 1.00 0.00 O ATOM 0 H GLU A 173 9.909 3.181 -5.381 1.00 0.00 H new ATOM 0 HA GLU A 173 12.439 3.335 -6.909 1.00 0.00 H new ATOM 0 HB2 GLU A 173 9.898 4.751 -7.072 1.00 0.00 H new ATOM 0 HB3 GLU A 173 11.226 5.865 -6.818 1.00 0.00 H new ATOM 0 HG2 GLU A 173 12.470 4.763 -8.722 1.00 0.00 H new ATOM 0 HG3 GLU A 173 11.080 3.733 -9.003 1.00 0.00 H new ATOM 660 N ASP A 174 13.695 4.609 -5.225 1.00 0.00 N ATOM 661 CA ASP A 174 14.489 5.222 -4.172 1.00 0.00 C ATOM 662 C ASP A 174 14.255 6.734 -4.179 1.00 0.00 C ATOM 663 O ASP A 174 13.797 7.291 -5.175 1.00 0.00 O ATOM 664 CB ASP A 174 15.981 4.972 -4.392 1.00 0.00 C ATOM 665 CG ASP A 174 16.784 4.689 -3.120 1.00 0.00 C ATOM 666 OD1 ASP A 174 16.723 5.543 -2.210 1.00 0.00 O ATOM 667 OD2 ASP A 174 17.439 3.625 -3.088 1.00 0.00 O ATOM 0 H ASP A 174 14.230 4.294 -6.034 1.00 0.00 H new ATOM 0 HA ASP A 174 14.187 4.783 -3.221 1.00 0.00 H new ATOM 0 HB2 ASP A 174 16.096 4.128 -5.072 1.00 0.00 H new ATOM 0 HB3 ASP A 174 16.410 5.842 -4.889 1.00 0.00 H new ATOM 672 N SER A 175 14.584 7.356 -3.056 1.00 0.00 N ATOM 673 CA SER A 175 14.417 8.793 -2.920 1.00 0.00 C ATOM 674 C SER A 175 15.064 9.509 -4.107 1.00 0.00 C ATOM 675 O SER A 175 14.726 10.654 -4.406 1.00 0.00 O ATOM 676 CB SER A 175 15.017 9.295 -1.605 1.00 0.00 C ATOM 677 OG SER A 175 16.417 9.531 -1.713 1.00 0.00 O ATOM 0 H SER A 175 14.965 6.891 -2.232 1.00 0.00 H new ATOM 0 HA SER A 175 13.350 9.014 -2.908 1.00 0.00 H new ATOM 0 HB2 SER A 175 14.516 10.216 -1.306 1.00 0.00 H new ATOM 0 HB3 SER A 175 14.832 8.562 -0.819 1.00 0.00 H new ATOM 0 HG SER A 175 16.762 9.852 -0.854 1.00 0.00 H new ATOM 683 N GLU A 176 15.985 8.807 -4.750 1.00 0.00 N ATOM 684 CA GLU A 176 16.684 9.362 -5.898 1.00 0.00 C ATOM 685 C GLU A 176 15.847 9.183 -7.166 1.00 0.00 C ATOM 686 O GLU A 176 15.936 9.988 -8.091 1.00 0.00 O ATOM 687 CB GLU A 176 18.065 8.727 -6.058 1.00 0.00 C ATOM 688 CG GLU A 176 18.857 8.797 -4.751 1.00 0.00 C ATOM 689 CD GLU A 176 19.971 9.842 -4.838 1.00 0.00 C ATOM 690 OE1 GLU A 176 19.743 10.857 -5.530 1.00 0.00 O ATOM 691 OE2 GLU A 176 21.024 9.601 -4.210 1.00 0.00 O ATOM 0 H GLU A 176 16.264 7.859 -4.498 1.00 0.00 H new ATOM 0 HA GLU A 176 16.829 10.429 -5.730 1.00 0.00 H new ATOM 0 HB2 GLU A 176 17.957 7.687 -6.366 1.00 0.00 H new ATOM 0 HB3 GLU A 176 18.615 9.239 -6.848 1.00 0.00 H new ATOM 0 HG2 GLU A 176 18.186 9.044 -3.928 1.00 0.00 H new ATOM 0 HG3 GLU A 176 19.287 7.820 -4.530 1.00 0.00 H new ATOM 698 N GLY A 177 15.053 8.122 -7.168 1.00 0.00 N ATOM 699 CA GLY A 177 14.202 7.827 -8.307 1.00 0.00 C ATOM 700 C GLY A 177 14.695 6.587 -9.054 1.00 0.00 C ATOM 701 O GLY A 177 14.539 6.486 -10.270 1.00 0.00 O ATOM 0 H GLY A 177 14.982 7.456 -6.398 1.00 0.00 H new ATOM 0 HA2 GLY A 177 13.178 7.669 -7.969 1.00 0.00 H new ATOM 0 HA3 GLY A 177 14.186 8.681 -8.984 1.00 0.00 H new ATOM 705 N LYS A 178 15.282 5.672 -8.295 1.00 0.00 N ATOM 706 CA LYS A 178 15.801 4.443 -8.871 1.00 0.00 C ATOM 707 C LYS A 178 14.745 3.343 -8.747 1.00 0.00 C ATOM 708 O LYS A 178 14.357 2.971 -7.640 1.00 0.00 O ATOM 709 CB LYS A 178 17.145 4.080 -8.237 1.00 0.00 C ATOM 710 CG LYS A 178 18.215 5.115 -8.591 1.00 0.00 C ATOM 711 CD LYS A 178 19.324 4.488 -9.438 1.00 0.00 C ATOM 712 CE LYS A 178 20.674 4.567 -8.719 1.00 0.00 C ATOM 713 NZ LYS A 178 20.783 3.497 -7.703 1.00 0.00 N ATOM 0 H LYS A 178 15.409 5.758 -7.287 1.00 0.00 H new ATOM 0 HA LYS A 178 16.002 4.575 -9.934 1.00 0.00 H new ATOM 0 HB2 LYS A 178 17.036 4.020 -7.154 1.00 0.00 H new ATOM 0 HB3 LYS A 178 17.459 3.095 -8.581 1.00 0.00 H new ATOM 0 HG2 LYS A 178 17.760 5.942 -9.136 1.00 0.00 H new ATOM 0 HG3 LYS A 178 18.641 5.530 -7.678 1.00 0.00 H new ATOM 0 HD2 LYS A 178 19.081 3.447 -9.649 1.00 0.00 H new ATOM 0 HD3 LYS A 178 19.388 5.001 -10.397 1.00 0.00 H new ATOM 0 HE2 LYS A 178 21.484 4.474 -9.442 1.00 0.00 H new ATOM 0 HE3 LYS A 178 20.783 5.541 -8.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 21.704 3.565 -7.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 20.021 3.604 -7.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 20.701 2.569 -8.166 1.00 0.00 H new ATOM 727 N ARG A 179 14.309 2.851 -9.897 1.00 0.00 N ATOM 728 CA ARG A 179 13.307 1.801 -9.931 1.00 0.00 C ATOM 729 C ARG A 179 13.972 0.428 -9.815 1.00 0.00 C ATOM 730 O ARG A 179 14.625 -0.031 -10.751 1.00 0.00 O ATOM 731 CB ARG A 179 12.494 1.858 -11.227 1.00 0.00 C ATOM 732 CG ARG A 179 12.267 3.305 -11.669 1.00 0.00 C ATOM 733 CD ARG A 179 11.292 3.372 -12.846 1.00 0.00 C ATOM 734 NE ARG A 179 9.939 3.730 -12.363 1.00 0.00 N ATOM 735 CZ ARG A 179 8.929 4.097 -13.162 1.00 0.00 C ATOM 736 NH1 ARG A 179 9.111 4.157 -14.488 1.00 0.00 N ATOM 737 NH2 ARG A 179 7.736 4.404 -12.635 1.00 0.00 N ATOM 0 H ARG A 179 14.632 3.161 -10.813 1.00 0.00 H new ATOM 0 HA ARG A 179 12.636 1.956 -9.086 1.00 0.00 H new ATOM 0 HB2 ARG A 179 13.016 1.312 -12.012 1.00 0.00 H new ATOM 0 HB3 ARG A 179 11.534 1.364 -11.080 1.00 0.00 H new ATOM 0 HG2 ARG A 179 11.876 3.887 -10.834 1.00 0.00 H new ATOM 0 HG3 ARG A 179 13.218 3.756 -11.954 1.00 0.00 H new ATOM 0 HD2 ARG A 179 11.635 4.110 -13.572 1.00 0.00 H new ATOM 0 HD3 ARG A 179 11.262 2.411 -13.359 1.00 0.00 H new ATOM 0 HE ARG A 179 9.765 3.695 -11.359 1.00 0.00 H new ATOM 0 HH11 ARG A 179 10.019 3.923 -14.889 1.00 0.00 H new ATOM 0 HH12 ARG A 179 8.341 4.437 -15.096 1.00 0.00 H new ATOM 0 HH21 ARG A 179 7.597 4.358 -11.626 1.00 0.00 H new ATOM 0 HH22 ARG A 179 6.966 4.684 -13.243 1.00 0.00 H new ATOM 751 N GLY A 180 13.782 -0.189 -8.658 1.00 0.00 N ATOM 752 CA GLY A 180 14.356 -1.501 -8.407 1.00 0.00 C ATOM 753 C GLY A 180 13.498 -2.293 -7.417 1.00 0.00 C ATOM 754 O GLY A 180 12.535 -1.766 -6.865 1.00 0.00 O ATOM 0 H GLY A 180 13.239 0.195 -7.884 1.00 0.00 H new ATOM 0 HA2 GLY A 180 14.439 -2.051 -9.344 1.00 0.00 H new ATOM 0 HA3 GLY A 180 15.366 -1.391 -8.012 1.00 0.00 H new ATOM 758 N MET A 181 13.881 -3.547 -7.226 1.00 0.00 N ATOM 759 CA MET A 181 13.160 -4.418 -6.312 1.00 0.00 C ATOM 760 C MET A 181 13.700 -4.285 -4.888 1.00 0.00 C ATOM 761 O MET A 181 14.895 -4.068 -4.689 1.00 0.00 O ATOM 762 CB MET A 181 13.295 -5.869 -6.777 1.00 0.00 C ATOM 763 CG MET A 181 12.321 -6.173 -7.917 1.00 0.00 C ATOM 764 SD MET A 181 13.035 -7.374 -9.027 1.00 0.00 S ATOM 765 CE MET A 181 13.154 -8.778 -7.931 1.00 0.00 C ATOM 0 H MET A 181 14.680 -3.981 -7.688 1.00 0.00 H new ATOM 0 HA MET A 181 12.110 -4.124 -6.311 1.00 0.00 H new ATOM 0 HB2 MET A 181 14.317 -6.055 -7.108 1.00 0.00 H new ATOM 0 HB3 MET A 181 13.103 -6.542 -5.941 1.00 0.00 H new ATOM 0 HG2 MET A 181 11.382 -6.552 -7.513 1.00 0.00 H new ATOM 0 HG3 MET A 181 12.087 -5.257 -8.460 1.00 0.00 H new ATOM 0 HE1 MET A 181 13.483 -9.652 -8.493 1.00 0.00 H new ATOM 0 HE2 MET A 181 13.874 -8.563 -7.141 1.00 0.00 H new ATOM 0 HE3 MET A 181 12.178 -8.978 -7.488 1.00 0.00 H new ATOM 775 N ILE A 182 12.794 -4.422 -3.930 1.00 0.00 N ATOM 776 CA ILE A 182 13.164 -4.321 -2.528 1.00 0.00 C ATOM 777 C ILE A 182 12.421 -5.394 -1.731 1.00 0.00 C ATOM 778 O ILE A 182 11.319 -5.795 -2.099 1.00 0.00 O ATOM 779 CB ILE A 182 12.930 -2.898 -2.014 1.00 0.00 C ATOM 780 CG1 ILE A 182 14.096 -2.433 -1.139 1.00 0.00 C ATOM 781 CG2 ILE A 182 11.588 -2.794 -1.286 1.00 0.00 C ATOM 782 CD1 ILE A 182 14.488 -0.992 -1.472 1.00 0.00 C ATOM 0 H ILE A 182 11.804 -4.602 -4.098 1.00 0.00 H new ATOM 0 HA ILE A 182 14.230 -4.510 -2.400 1.00 0.00 H new ATOM 0 HB ILE A 182 12.884 -2.226 -2.871 1.00 0.00 H new ATOM 0 HG12 ILE A 182 13.818 -2.505 -0.088 1.00 0.00 H new ATOM 0 HG13 ILE A 182 14.952 -3.091 -1.288 1.00 0.00 H new ATOM 0 HG21 ILE A 182 11.445 -1.774 -0.930 1.00 0.00 H new ATOM 0 HG22 ILE A 182 10.781 -3.056 -1.971 1.00 0.00 H new ATOM 0 HG23 ILE A 182 11.580 -3.478 -0.438 1.00 0.00 H new ATOM 0 HD11 ILE A 182 15.319 -0.685 -0.837 1.00 0.00 H new ATOM 0 HD12 ILE A 182 14.788 -0.929 -2.518 1.00 0.00 H new ATOM 0 HD13 ILE A 182 13.636 -0.334 -1.299 1.00 0.00 H new ATOM 794 N PRO A 183 13.072 -5.839 -0.622 1.00 0.00 N ATOM 795 CA PRO A 183 12.485 -6.858 0.232 1.00 0.00 C ATOM 796 C PRO A 183 11.356 -6.274 1.085 1.00 0.00 C ATOM 797 O PRO A 183 11.494 -5.186 1.642 1.00 0.00 O ATOM 798 CB PRO A 183 13.641 -7.391 1.061 1.00 0.00 C ATOM 799 CG PRO A 183 14.735 -6.338 0.975 1.00 0.00 C ATOM 800 CD PRO A 183 14.378 -5.385 -0.154 1.00 0.00 C ATOM 0 HA PRO A 183 12.015 -7.662 -0.334 1.00 0.00 H new ATOM 0 HB2 PRO A 183 13.337 -7.555 2.095 1.00 0.00 H new ATOM 0 HB3 PRO A 183 13.990 -8.349 0.675 1.00 0.00 H new ATOM 0 HG2 PRO A 183 14.820 -5.798 1.918 1.00 0.00 H new ATOM 0 HG3 PRO A 183 15.701 -6.806 0.788 1.00 0.00 H new ATOM 0 HD2 PRO A 183 14.337 -4.354 0.196 1.00 0.00 H new ATOM 0 HD3 PRO A 183 15.119 -5.421 -0.952 1.00 0.00 H new ATOM 808 N VAL A 184 10.267 -7.024 1.162 1.00 0.00 N ATOM 809 CA VAL A 184 9.116 -6.596 1.938 1.00 0.00 C ATOM 810 C VAL A 184 9.465 -6.640 3.427 1.00 0.00 C ATOM 811 O VAL A 184 9.033 -5.782 4.196 1.00 0.00 O ATOM 812 CB VAL A 184 7.897 -7.451 1.584 1.00 0.00 C ATOM 813 CG1 VAL A 184 6.755 -7.214 2.573 1.00 0.00 C ATOM 814 CG2 VAL A 184 7.442 -7.188 0.147 1.00 0.00 C ATOM 0 H VAL A 184 10.157 -7.926 0.699 1.00 0.00 H new ATOM 0 HA VAL A 184 8.854 -5.566 1.695 1.00 0.00 H new ATOM 0 HB VAL A 184 8.190 -8.498 1.656 1.00 0.00 H new ATOM 0 HG11 VAL A 184 5.901 -7.834 2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 184 7.084 -7.475 3.579 1.00 0.00 H new ATOM 0 HG13 VAL A 184 6.464 -6.164 2.548 1.00 0.00 H new ATOM 0 HG21 VAL A 184 6.574 -7.808 -0.079 1.00 0.00 H new ATOM 0 HG22 VAL A 184 7.176 -6.137 0.036 1.00 0.00 H new ATOM 0 HG23 VAL A 184 8.251 -7.432 -0.541 1.00 0.00 H new ATOM 824 N PRO A 185 10.266 -7.674 3.799 1.00 0.00 N ATOM 825 CA PRO A 185 10.678 -7.842 5.182 1.00 0.00 C ATOM 826 C PRO A 185 11.758 -6.825 5.559 1.00 0.00 C ATOM 827 O PRO A 185 11.506 -5.907 6.338 1.00 0.00 O ATOM 828 CB PRO A 185 11.158 -9.280 5.279 1.00 0.00 C ATOM 829 CG PRO A 185 11.432 -9.725 3.851 1.00 0.00 C ATOM 830 CD PRO A 185 10.797 -8.708 2.916 1.00 0.00 C ATOM 0 HA PRO A 185 9.867 -7.659 5.887 1.00 0.00 H new ATOM 0 HB2 PRO A 185 12.058 -9.351 5.890 1.00 0.00 H new ATOM 0 HB3 PRO A 185 10.404 -9.913 5.747 1.00 0.00 H new ATOM 0 HG2 PRO A 185 12.505 -9.791 3.671 1.00 0.00 H new ATOM 0 HG3 PRO A 185 11.017 -10.717 3.674 1.00 0.00 H new ATOM 0 HD2 PRO A 185 11.530 -8.297 2.221 1.00 0.00 H new ATOM 0 HD3 PRO A 185 10.007 -9.160 2.316 1.00 0.00 H new ATOM 838 N TYR A 186 12.937 -7.024 4.988 1.00 0.00 N ATOM 839 CA TYR A 186 14.056 -6.136 5.255 1.00 0.00 C ATOM 840 C TYR A 186 13.615 -4.672 5.219 1.00 0.00 C ATOM 841 O TYR A 186 14.307 -3.799 5.741 1.00 0.00 O ATOM 842 CB TYR A 186 15.065 -6.379 4.130 1.00 0.00 C ATOM 843 CG TYR A 186 16.298 -7.176 4.561 1.00 0.00 C ATOM 844 CD1 TYR A 186 16.148 -8.403 5.174 1.00 0.00 C ATOM 845 CD2 TYR A 186 17.561 -6.666 4.338 1.00 0.00 C ATOM 846 CE1 TYR A 186 17.309 -9.151 5.581 1.00 0.00 C ATOM 847 CE2 TYR A 186 18.722 -7.415 4.745 1.00 0.00 C ATOM 848 CZ TYR A 186 18.538 -8.621 5.346 1.00 0.00 C ATOM 849 OH TYR A 186 19.635 -9.327 5.729 1.00 0.00 O ATOM 0 H TYR A 186 13.142 -7.786 4.342 1.00 0.00 H new ATOM 0 HA TYR A 186 14.474 -6.332 6.242 1.00 0.00 H new ATOM 0 HB2 TYR A 186 14.568 -6.910 3.318 1.00 0.00 H new ATOM 0 HB3 TYR A 186 15.388 -5.417 3.731 1.00 0.00 H new ATOM 0 HD1 TYR A 186 15.160 -8.802 5.349 1.00 0.00 H new ATOM 0 HD2 TYR A 186 17.679 -5.706 3.858 1.00 0.00 H new ATOM 0 HE1 TYR A 186 17.205 -10.112 6.062 1.00 0.00 H new ATOM 0 HE2 TYR A 186 19.716 -7.028 4.577 1.00 0.00 H new ATOM 0 HH TYR A 186 19.843 -9.125 6.665 1.00 0.00 H new ATOM 859 N VAL A 187 12.466 -4.448 4.600 1.00 0.00 N ATOM 860 CA VAL A 187 11.924 -3.104 4.490 1.00 0.00 C ATOM 861 C VAL A 187 10.580 -3.039 5.219 1.00 0.00 C ATOM 862 O VAL A 187 9.969 -4.071 5.493 1.00 0.00 O ATOM 863 CB VAL A 187 11.825 -2.698 3.018 1.00 0.00 C ATOM 864 CG1 VAL A 187 12.980 -3.291 2.208 1.00 0.00 C ATOM 865 CG2 VAL A 187 10.475 -3.106 2.426 1.00 0.00 C ATOM 0 H VAL A 187 11.895 -5.175 4.169 1.00 0.00 H new ATOM 0 HA VAL A 187 12.589 -2.384 4.968 1.00 0.00 H new ATOM 0 HB VAL A 187 11.900 -1.612 2.964 1.00 0.00 H new ATOM 0 HG11 VAL A 187 12.887 -2.988 1.165 1.00 0.00 H new ATOM 0 HG12 VAL A 187 13.928 -2.930 2.607 1.00 0.00 H new ATOM 0 HG13 VAL A 187 12.950 -4.379 2.274 1.00 0.00 H new ATOM 0 HG21 VAL A 187 10.431 -2.806 1.379 1.00 0.00 H new ATOM 0 HG22 VAL A 187 10.358 -4.187 2.499 1.00 0.00 H new ATOM 0 HG23 VAL A 187 9.673 -2.616 2.978 1.00 0.00 H new ATOM 875 N GLU A 188 10.161 -1.817 5.513 1.00 0.00 N ATOM 876 CA GLU A 188 8.901 -1.605 6.205 1.00 0.00 C ATOM 877 C GLU A 188 7.919 -0.856 5.302 1.00 0.00 C ATOM 878 O GLU A 188 8.181 -0.670 4.115 1.00 0.00 O ATOM 879 CB GLU A 188 9.119 -0.854 7.521 1.00 0.00 C ATOM 880 CG GLU A 188 10.179 -1.546 8.379 1.00 0.00 C ATOM 881 CD GLU A 188 9.530 -2.390 9.479 1.00 0.00 C ATOM 882 OE1 GLU A 188 8.424 -2.910 9.216 1.00 0.00 O ATOM 883 OE2 GLU A 188 10.154 -2.494 10.557 1.00 0.00 O ATOM 0 H GLU A 188 10.671 -0.964 5.285 1.00 0.00 H new ATOM 0 HA GLU A 188 8.472 -2.578 6.446 1.00 0.00 H new ATOM 0 HB2 GLU A 188 9.427 0.170 7.312 1.00 0.00 H new ATOM 0 HB3 GLU A 188 8.180 -0.798 8.072 1.00 0.00 H new ATOM 0 HG2 GLU A 188 10.804 -2.180 7.750 1.00 0.00 H new ATOM 0 HG3 GLU A 188 10.833 -0.799 8.828 1.00 0.00 H new ATOM 890 N LYS A 189 6.809 -0.446 5.899 1.00 0.00 N ATOM 891 CA LYS A 189 5.787 0.278 5.164 1.00 0.00 C ATOM 892 C LYS A 189 5.255 1.421 6.030 1.00 0.00 C ATOM 893 O LYS A 189 5.319 1.357 7.257 1.00 0.00 O ATOM 894 CB LYS A 189 4.699 -0.681 4.675 1.00 0.00 C ATOM 895 CG LYS A 189 5.220 -1.572 3.545 1.00 0.00 C ATOM 896 CD LYS A 189 4.347 -1.441 2.296 1.00 0.00 C ATOM 897 CE LYS A 189 3.031 -2.202 2.465 1.00 0.00 C ATOM 898 NZ LYS A 189 1.919 -1.261 2.727 1.00 0.00 N ATOM 0 H LYS A 189 6.596 -0.602 6.884 1.00 0.00 H new ATOM 0 HA LYS A 189 6.210 0.729 4.266 1.00 0.00 H new ATOM 0 HB2 LYS A 189 4.357 -1.301 5.503 1.00 0.00 H new ATOM 0 HB3 LYS A 189 3.837 -0.112 4.326 1.00 0.00 H new ATOM 0 HG2 LYS A 189 6.247 -1.298 3.305 1.00 0.00 H new ATOM 0 HG3 LYS A 189 5.236 -2.611 3.874 1.00 0.00 H new ATOM 0 HD2 LYS A 189 4.140 -0.389 2.101 1.00 0.00 H new ATOM 0 HD3 LYS A 189 4.885 -1.826 1.430 1.00 0.00 H new ATOM 0 HE2 LYS A 189 2.821 -2.781 1.566 1.00 0.00 H new ATOM 0 HE3 LYS A 189 3.117 -2.911 3.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 1.105 -1.511 2.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 1.645 -1.318 3.729 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 2.225 -0.292 2.506 1.00 0.00 H new ATOM 912 N TYR A 190 4.743 2.442 5.357 1.00 0.00 N ATOM 913 CA TYR A 190 4.201 3.599 6.051 1.00 0.00 C ATOM 914 C TYR A 190 2.724 3.799 5.708 1.00 0.00 C ATOM 915 O TYR A 190 2.386 4.136 4.574 1.00 0.00 O ATOM 916 CB TYR A 190 4.998 4.803 5.547 1.00 0.00 C ATOM 917 CG TYR A 190 4.169 6.081 5.402 1.00 0.00 C ATOM 918 CD1 TYR A 190 3.659 6.704 6.524 1.00 0.00 C ATOM 919 CD2 TYR A 190 3.932 6.611 4.150 1.00 0.00 C ATOM 920 CE1 TYR A 190 2.878 7.906 6.387 1.00 0.00 C ATOM 921 CE2 TYR A 190 3.151 7.813 4.013 1.00 0.00 C ATOM 922 CZ TYR A 190 2.663 8.402 5.139 1.00 0.00 C ATOM 923 OH TYR A 190 1.926 9.537 5.009 1.00 0.00 O ATOM 0 H TYR A 190 4.692 2.492 4.340 1.00 0.00 H new ATOM 0 HA TYR A 190 4.276 3.471 7.131 1.00 0.00 H new ATOM 0 HB2 TYR A 190 5.823 4.993 6.234 1.00 0.00 H new ATOM 0 HB3 TYR A 190 5.438 4.556 4.581 1.00 0.00 H new ATOM 0 HD1 TYR A 190 3.846 6.290 7.504 1.00 0.00 H new ATOM 0 HD2 TYR A 190 4.332 6.124 3.273 1.00 0.00 H new ATOM 0 HE1 TYR A 190 2.472 8.403 7.256 1.00 0.00 H new ATOM 0 HE2 TYR A 190 2.957 8.238 3.039 1.00 0.00 H new ATOM 0 HH TYR A 190 1.856 9.775 4.061 1.00 0.00 H new ATOM 933 N GLY A 191 1.882 3.585 6.709 1.00 0.00 N ATOM 934 CA GLY A 191 0.450 3.739 6.528 1.00 0.00 C ATOM 935 C GLY A 191 -0.062 2.833 5.407 1.00 0.00 C ATOM 936 O GLY A 191 -0.727 3.297 4.483 1.00 0.00 O ATOM 0 H GLY A 191 2.165 3.306 7.648 1.00 0.00 H new ATOM 0 HA2 GLY A 191 -0.065 3.499 7.458 1.00 0.00 H new ATOM 0 HA3 GLY A 191 0.219 4.778 6.294 1.00 0.00 H new TER 940 GLY A 191