USER MOD reduce.3.24.130724 H: found=0, std=0, add=453, rem=0, adj=8 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= -3.18! C(o=-3.2!,f=-2.8!) USER MOD Single : A 146 ASN : amide:sc= -1.56! C(o=-1.6!,f=-1.1!) 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+ -154:sc= -1.19! (180deg=-1.75!) USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 ASN : amide:sc= -0.689 K(o=-0.69,f=-3.3!) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ -155:sc= -0.0787 (180deg=-0.297) USER MOD Single : A 181 MET CE :methyl 142:sc= -0.271 (180deg=-2.05!) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ 162:sc=-0.00148 (180deg=-0.0606) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 134 1.014 0.952 -0.472 1.00 0.00 N ATOM 2 CA ALA A 134 1.796 0.962 -1.696 1.00 0.00 C ATOM 3 C ALA A 134 2.062 2.409 -2.116 1.00 0.00 C ATOM 4 O ALA A 134 1.190 3.065 -2.684 1.00 0.00 O ATOM 5 CB ALA A 134 1.062 0.167 -2.778 1.00 0.00 C ATOM 0 HA ALA A 134 2.762 0.482 -1.537 1.00 0.00 H new ATOM 0 HB1 ALA A 134 1.649 0.175 -3.696 1.00 0.00 H new ATOM 0 HB2 ALA A 134 0.925 -0.861 -2.444 1.00 0.00 H new ATOM 0 HB3 ALA A 134 0.089 0.621 -2.966 1.00 0.00 H new ATOM 11 N GLU A 135 3.270 2.866 -1.819 1.00 0.00 N ATOM 12 CA GLU A 135 3.661 4.223 -2.159 1.00 0.00 C ATOM 13 C GLU A 135 4.989 4.577 -1.487 1.00 0.00 C ATOM 14 O GLU A 135 5.877 5.145 -2.121 1.00 0.00 O ATOM 15 CB GLU A 135 2.567 5.222 -1.770 1.00 0.00 C ATOM 16 CG GLU A 135 2.046 4.942 -0.360 1.00 0.00 C ATOM 17 CD GLU A 135 0.898 5.889 -0.002 1.00 0.00 C ATOM 18 OE1 GLU A 135 1.210 7.024 0.422 1.00 0.00 O ATOM 19 OE2 GLU A 135 -0.264 5.459 -0.161 1.00 0.00 O ATOM 0 H GLU A 135 3.991 2.320 -1.347 1.00 0.00 H new ATOM 0 HA GLU A 135 3.795 4.282 -3.239 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.961 6.237 -1.821 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.745 5.163 -2.484 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.705 3.909 -0.293 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.856 5.057 0.360 1.00 0.00 H new ATOM 26 N TYR A 136 5.084 4.225 -0.214 1.00 0.00 N ATOM 27 CA TYR A 136 6.289 4.498 0.550 1.00 0.00 C ATOM 28 C TYR A 136 6.685 3.289 1.400 1.00 0.00 C ATOM 29 O TYR A 136 5.826 2.619 1.970 1.00 0.00 O ATOM 30 CB TYR A 136 5.946 5.667 1.476 1.00 0.00 C ATOM 31 CG TYR A 136 6.031 7.039 0.804 1.00 0.00 C ATOM 32 CD1 TYR A 136 5.009 7.469 -0.019 1.00 0.00 C ATOM 33 CD2 TYR A 136 7.129 7.846 1.020 1.00 0.00 C ATOM 34 CE1 TYR A 136 5.089 8.760 -0.652 1.00 0.00 C ATOM 35 CE2 TYR A 136 7.208 9.137 0.387 1.00 0.00 C ATOM 36 CZ TYR A 136 6.184 9.530 -0.417 1.00 0.00 C ATOM 37 OH TYR A 136 6.259 10.749 -1.016 1.00 0.00 O ATOM 0 H TYR A 136 4.346 3.753 0.308 1.00 0.00 H new ATOM 0 HA TYR A 136 7.122 4.723 -0.116 1.00 0.00 H new ATOM 0 HB2 TYR A 136 4.937 5.526 1.864 1.00 0.00 H new ATOM 0 HB3 TYR A 136 6.622 5.650 2.331 1.00 0.00 H new ATOM 0 HD1 TYR A 136 4.150 6.837 -0.188 1.00 0.00 H new ATOM 0 HD2 TYR A 136 7.929 7.510 1.663 1.00 0.00 H new ATOM 0 HE1 TYR A 136 4.297 9.108 -1.299 1.00 0.00 H new ATOM 0 HE2 TYR A 136 8.062 9.779 0.547 1.00 0.00 H new ATOM 0 HH TYR A 136 7.095 11.190 -0.757 1.00 0.00 H new ATOM 47 N VAL A 137 7.987 3.048 1.459 1.00 0.00 N ATOM 48 CA VAL A 137 8.507 1.931 2.229 1.00 0.00 C ATOM 49 C VAL A 137 9.649 2.422 3.121 1.00 0.00 C ATOM 50 O VAL A 137 10.208 3.492 2.888 1.00 0.00 O ATOM 51 CB VAL A 137 8.925 0.797 1.292 1.00 0.00 C ATOM 52 CG1 VAL A 137 7.738 -0.116 0.972 1.00 0.00 C ATOM 53 CG2 VAL A 137 9.552 1.348 0.010 1.00 0.00 C ATOM 0 H VAL A 137 8.697 3.607 0.986 1.00 0.00 H new ATOM 0 HA VAL A 137 7.735 1.525 2.882 1.00 0.00 H new ATOM 0 HB VAL A 137 9.679 0.200 1.805 1.00 0.00 H new ATOM 0 HG11 VAL A 137 8.062 -0.914 0.304 1.00 0.00 H new ATOM 0 HG12 VAL A 137 7.353 -0.550 1.895 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.952 0.465 0.489 1.00 0.00 H new ATOM 0 HG21 VAL A 137 9.840 0.521 -0.639 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.829 1.979 -0.507 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.434 1.937 0.261 1.00 0.00 H new ATOM 63 N ARG A 138 9.963 1.614 4.124 1.00 0.00 N ATOM 64 CA ARG A 138 11.030 1.951 5.051 1.00 0.00 C ATOM 65 C ARG A 138 11.992 0.772 5.206 1.00 0.00 C ATOM 66 O ARG A 138 11.623 -0.267 5.749 1.00 0.00 O ATOM 67 CB ARG A 138 10.468 2.326 6.424 1.00 0.00 C ATOM 68 CG ARG A 138 11.594 2.551 7.434 1.00 0.00 C ATOM 69 CD ARG A 138 12.317 3.871 7.164 1.00 0.00 C ATOM 70 NE ARG A 138 11.377 4.854 6.581 1.00 0.00 N ATOM 71 CZ ARG A 138 10.712 5.773 7.294 1.00 0.00 C ATOM 72 NH1 ARG A 138 10.881 5.840 8.622 1.00 0.00 N ATOM 73 NH2 ARG A 138 9.879 6.624 6.680 1.00 0.00 N ATOM 0 H ARG A 138 9.497 0.727 4.315 1.00 0.00 H new ATOM 0 HA ARG A 138 11.565 2.809 4.643 1.00 0.00 H new ATOM 0 HB2 ARG A 138 9.865 3.230 6.339 1.00 0.00 H new ATOM 0 HB3 ARG A 138 9.808 1.534 6.780 1.00 0.00 H new ATOM 0 HG2 ARG A 138 11.185 2.556 8.444 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.304 1.726 7.382 1.00 0.00 H new ATOM 0 HD2 ARG A 138 12.736 4.262 8.091 1.00 0.00 H new ATOM 0 HD3 ARG A 138 13.151 3.705 6.483 1.00 0.00 H new ATOM 0 HE ARG A 138 11.226 4.830 5.573 1.00 0.00 H new ATOM 0 HH11 ARG A 138 11.515 5.192 9.089 1.00 0.00 H new ATOM 0 HH12 ARG A 138 10.375 6.539 9.166 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.751 6.572 5.669 1.00 0.00 H new ATOM 0 HH22 ARG A 138 9.373 7.323 7.223 1.00 0.00 H new ATOM 87 N ALA A 139 13.208 0.974 4.718 1.00 0.00 N ATOM 88 CA ALA A 139 14.226 -0.060 4.795 1.00 0.00 C ATOM 89 C ALA A 139 14.909 0.005 6.162 1.00 0.00 C ATOM 90 O ALA A 139 15.543 1.004 6.497 1.00 0.00 O ATOM 91 CB ALA A 139 15.214 0.110 3.640 1.00 0.00 C ATOM 0 H ALA A 139 13.511 1.838 4.268 1.00 0.00 H new ATOM 0 HA ALA A 139 13.778 -1.049 4.697 1.00 0.00 H new ATOM 0 HB1 ALA A 139 15.978 -0.665 3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.683 0.027 2.692 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.686 1.090 3.707 1.00 0.00 H new ATOM 97 N LEU A 140 14.757 -1.074 6.916 1.00 0.00 N ATOM 98 CA LEU A 140 15.352 -1.152 8.240 1.00 0.00 C ATOM 99 C LEU A 140 16.179 -2.435 8.347 1.00 0.00 C ATOM 100 O LEU A 140 16.386 -2.955 9.442 1.00 0.00 O ATOM 101 CB LEU A 140 14.276 -1.023 9.319 1.00 0.00 C ATOM 102 CG LEU A 140 12.833 -0.926 8.820 1.00 0.00 C ATOM 103 CD1 LEU A 140 12.385 -2.243 8.181 1.00 0.00 C ATOM 104 CD2 LEU A 140 11.892 -0.486 9.943 1.00 0.00 C ATOM 0 H LEU A 140 14.231 -1.901 6.636 1.00 0.00 H new ATOM 0 HA LEU A 140 16.034 -0.317 8.401 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.352 -1.883 9.984 1.00 0.00 H new ATOM 0 HB3 LEU A 140 14.493 -0.137 9.916 1.00 0.00 H new ATOM 0 HG LEU A 140 12.790 -0.160 8.046 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.356 -2.148 7.835 1.00 0.00 H new ATOM 0 HD12 LEU A 140 13.032 -2.476 7.336 1.00 0.00 H new ATOM 0 HD13 LEU A 140 12.447 -3.044 8.917 1.00 0.00 H new ATOM 0 HD21 LEU A 140 10.873 -0.425 9.561 1.00 0.00 H new ATOM 0 HD22 LEU A 140 11.932 -1.211 10.756 1.00 0.00 H new ATOM 0 HD23 LEU A 140 12.200 0.492 10.313 1.00 0.00 H new ATOM 116 N PHE A 141 16.632 -2.908 7.195 1.00 0.00 N ATOM 117 CA PHE A 141 17.432 -4.120 7.145 1.00 0.00 C ATOM 118 C PHE A 141 18.666 -3.926 6.261 1.00 0.00 C ATOM 119 O PHE A 141 19.605 -4.718 6.318 1.00 0.00 O ATOM 120 CB PHE A 141 16.551 -5.213 6.539 1.00 0.00 C ATOM 121 CG PHE A 141 16.319 -6.410 7.463 1.00 0.00 C ATOM 122 CD1 PHE A 141 17.271 -7.376 7.576 1.00 0.00 C ATOM 123 CD2 PHE A 141 15.162 -6.509 8.172 1.00 0.00 C ATOM 124 CE1 PHE A 141 17.055 -8.487 8.435 1.00 0.00 C ATOM 125 CE2 PHE A 141 14.948 -7.620 9.030 1.00 0.00 C ATOM 126 CZ PHE A 141 15.899 -8.585 9.143 1.00 0.00 C ATOM 0 H PHE A 141 16.460 -2.473 6.288 1.00 0.00 H new ATOM 0 HA PHE A 141 17.773 -4.382 8.146 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.586 -4.781 6.272 1.00 0.00 H new ATOM 0 HB3 PHE A 141 17.010 -5.564 5.615 1.00 0.00 H new ATOM 0 HD1 PHE A 141 18.190 -7.298 7.013 1.00 0.00 H new ATOM 0 HD2 PHE A 141 14.406 -5.743 8.082 1.00 0.00 H new ATOM 0 HE1 PHE A 141 17.810 -9.254 8.525 1.00 0.00 H new ATOM 0 HE2 PHE A 141 14.030 -7.698 9.593 1.00 0.00 H new ATOM 0 HZ PHE A 141 15.736 -9.430 9.796 1.00 0.00 H new ATOM 136 N ASP A 142 18.623 -2.868 5.465 1.00 0.00 N ATOM 137 CA ASP A 142 19.726 -2.561 4.570 1.00 0.00 C ATOM 138 C ASP A 142 20.033 -3.786 3.706 1.00 0.00 C ATOM 139 O ASP A 142 19.639 -4.902 4.042 1.00 0.00 O ATOM 140 CB ASP A 142 20.991 -2.208 5.355 1.00 0.00 C ATOM 141 CG ASP A 142 22.293 -2.302 4.559 1.00 0.00 C ATOM 142 OD1 ASP A 142 22.813 -3.434 4.454 1.00 0.00 O ATOM 143 OD2 ASP A 142 22.741 -1.241 4.074 1.00 0.00 O ATOM 0 H ASP A 142 17.842 -2.213 5.421 1.00 0.00 H new ATOM 0 HA ASP A 142 19.434 -1.710 3.955 1.00 0.00 H new ATOM 0 HB2 ASP A 142 20.890 -1.193 5.740 1.00 0.00 H new ATOM 0 HB3 ASP A 142 21.062 -2.870 6.218 1.00 0.00 H new ATOM 148 N PHE A 143 20.733 -3.536 2.609 1.00 0.00 N ATOM 149 CA PHE A 143 21.098 -4.606 1.694 1.00 0.00 C ATOM 150 C PHE A 143 22.555 -4.471 1.248 1.00 0.00 C ATOM 151 O PHE A 143 23.433 -5.159 1.767 1.00 0.00 O ATOM 152 CB PHE A 143 20.188 -4.477 0.472 1.00 0.00 C ATOM 153 CG PHE A 143 20.316 -5.632 -0.524 1.00 0.00 C ATOM 154 CD1 PHE A 143 21.453 -5.774 -1.257 1.00 0.00 C ATOM 155 CD2 PHE A 143 19.295 -6.516 -0.674 1.00 0.00 C ATOM 156 CE1 PHE A 143 21.572 -6.846 -2.181 1.00 0.00 C ATOM 157 CE2 PHE A 143 19.414 -7.588 -1.599 1.00 0.00 C ATOM 158 CZ PHE A 143 20.550 -7.730 -2.332 1.00 0.00 C ATOM 0 H PHE A 143 21.057 -2.609 2.333 1.00 0.00 H new ATOM 0 HA PHE A 143 20.985 -5.572 2.185 1.00 0.00 H new ATOM 0 HB2 PHE A 143 19.153 -4.413 0.808 1.00 0.00 H new ATOM 0 HB3 PHE A 143 20.415 -3.542 -0.040 1.00 0.00 H new ATOM 0 HD1 PHE A 143 22.265 -5.072 -1.136 1.00 0.00 H new ATOM 0 HD2 PHE A 143 18.393 -6.404 -0.090 1.00 0.00 H new ATOM 0 HE1 PHE A 143 22.474 -6.959 -2.764 1.00 0.00 H new ATOM 0 HE2 PHE A 143 18.602 -8.290 -1.720 1.00 0.00 H new ATOM 0 HZ PHE A 143 20.641 -8.545 -3.035 1.00 0.00 H new ATOM 168 N ASN A 144 22.767 -3.582 0.289 1.00 0.00 N ATOM 169 CA ASN A 144 24.103 -3.349 -0.233 1.00 0.00 C ATOM 170 C ASN A 144 24.012 -3.022 -1.725 1.00 0.00 C ATOM 171 O ASN A 144 23.242 -3.644 -2.456 1.00 0.00 O ATOM 172 CB ASN A 144 24.981 -4.593 -0.075 1.00 0.00 C ATOM 173 CG ASN A 144 25.835 -4.503 1.191 1.00 0.00 C ATOM 174 OD1 ASN A 144 26.442 -3.488 1.491 1.00 0.00 O ATOM 175 ND2 ASN A 144 25.847 -5.619 1.916 1.00 0.00 N ATOM 0 H ASN A 144 22.036 -3.014 -0.140 1.00 0.00 H new ATOM 0 HA ASN A 144 24.544 -2.523 0.325 1.00 0.00 H new ATOM 0 HB2 ASN A 144 24.353 -5.483 -0.032 1.00 0.00 H new ATOM 0 HB3 ASN A 144 25.626 -4.700 -0.947 1.00 0.00 H new ATOM 0 HD21 ASN A 144 26.387 -5.660 2.780 1.00 0.00 H new ATOM 0 HD22 ASN A 144 25.316 -6.433 1.607 1.00 0.00 H new ATOM 182 N GLY A 145 24.810 -2.046 -2.134 1.00 0.00 N ATOM 183 CA GLY A 145 24.829 -1.628 -3.525 1.00 0.00 C ATOM 184 C GLY A 145 25.182 -2.799 -4.444 1.00 0.00 C ATOM 185 O GLY A 145 26.177 -3.488 -4.223 1.00 0.00 O ATOM 0 H GLY A 145 25.448 -1.533 -1.526 1.00 0.00 H new ATOM 0 HA2 GLY A 145 23.854 -1.225 -3.801 1.00 0.00 H new ATOM 0 HA3 GLY A 145 25.555 -0.825 -3.657 1.00 0.00 H new ATOM 189 N ASN A 146 24.348 -2.988 -5.456 1.00 0.00 N ATOM 190 CA ASN A 146 24.560 -4.064 -6.410 1.00 0.00 C ATOM 191 C ASN A 146 23.759 -3.777 -7.681 1.00 0.00 C ATOM 192 O ASN A 146 24.266 -3.944 -8.789 1.00 0.00 O ATOM 193 CB ASN A 146 24.085 -5.404 -5.843 1.00 0.00 C ATOM 194 CG ASN A 146 22.560 -5.442 -5.731 1.00 0.00 C ATOM 195 OD1 ASN A 146 21.960 -4.838 -4.858 1.00 0.00 O ATOM 196 ND2 ASN A 146 21.967 -6.183 -6.664 1.00 0.00 N ATOM 0 H ASN A 146 23.524 -2.414 -5.636 1.00 0.00 H new ATOM 0 HA ASN A 146 25.627 -4.121 -6.623 1.00 0.00 H new ATOM 0 HB2 ASN A 146 24.426 -6.216 -6.485 1.00 0.00 H new ATOM 0 HB3 ASN A 146 24.530 -5.566 -4.861 1.00 0.00 H new ATOM 0 HD21 ASN A 146 20.951 -6.271 -6.676 1.00 0.00 H new ATOM 0 HD22 ASN A 146 22.529 -6.663 -7.367 1.00 0.00 H new ATOM 203 N ASP A 147 22.521 -3.351 -7.478 1.00 0.00 N ATOM 204 CA ASP A 147 21.644 -3.040 -8.595 1.00 0.00 C ATOM 205 C ASP A 147 21.759 -4.142 -9.650 1.00 0.00 C ATOM 206 O ASP A 147 22.409 -5.161 -9.421 1.00 0.00 O ATOM 207 CB ASP A 147 22.037 -1.715 -9.251 1.00 0.00 C ATOM 208 CG ASP A 147 23.419 -1.704 -9.908 1.00 0.00 C ATOM 209 OD1 ASP A 147 23.510 -2.209 -11.049 1.00 0.00 O ATOM 210 OD2 ASP A 147 24.354 -1.191 -9.256 1.00 0.00 O ATOM 0 H ASP A 147 22.104 -3.214 -6.557 1.00 0.00 H new ATOM 0 HA ASP A 147 20.626 -2.966 -8.214 1.00 0.00 H new ATOM 0 HB2 ASP A 147 21.291 -1.465 -10.005 1.00 0.00 H new ATOM 0 HB3 ASP A 147 22.004 -0.929 -8.496 1.00 0.00 H new ATOM 215 N GLU A 148 21.116 -3.901 -10.784 1.00 0.00 N ATOM 216 CA GLU A 148 21.138 -4.861 -11.875 1.00 0.00 C ATOM 217 C GLU A 148 20.278 -6.077 -11.528 1.00 0.00 C ATOM 218 O GLU A 148 20.213 -7.035 -12.298 1.00 0.00 O ATOM 219 CB GLU A 148 22.572 -5.279 -12.208 1.00 0.00 C ATOM 220 CG GLU A 148 22.787 -5.340 -13.723 1.00 0.00 C ATOM 221 CD GLU A 148 22.758 -3.939 -14.337 1.00 0.00 C ATOM 222 OE1 GLU A 148 21.634 -3.423 -14.521 1.00 0.00 O ATOM 223 OE2 GLU A 148 23.860 -3.416 -14.609 1.00 0.00 O ATOM 0 H GLU A 148 20.577 -3.055 -10.971 1.00 0.00 H new ATOM 0 HA GLU A 148 20.719 -4.385 -12.762 1.00 0.00 H new ATOM 0 HB2 GLU A 148 23.273 -4.571 -11.766 1.00 0.00 H new ATOM 0 HB3 GLU A 148 22.782 -6.254 -11.768 1.00 0.00 H new ATOM 0 HG2 GLU A 148 23.743 -5.816 -13.939 1.00 0.00 H new ATOM 0 HG3 GLU A 148 22.013 -5.957 -14.179 1.00 0.00 H new ATOM 230 N GLU A 149 19.641 -6.002 -10.369 1.00 0.00 N ATOM 231 CA GLU A 149 18.788 -7.085 -9.912 1.00 0.00 C ATOM 232 C GLU A 149 17.829 -6.583 -8.830 1.00 0.00 C ATOM 233 O GLU A 149 16.631 -6.864 -8.880 1.00 0.00 O ATOM 234 CB GLU A 149 19.623 -8.262 -9.402 1.00 0.00 C ATOM 235 CG GLU A 149 18.743 -9.286 -8.682 1.00 0.00 C ATOM 236 CD GLU A 149 19.569 -10.488 -8.219 1.00 0.00 C ATOM 237 OE1 GLU A 149 20.761 -10.273 -7.912 1.00 0.00 O ATOM 238 OE2 GLU A 149 18.989 -11.595 -8.184 1.00 0.00 O ATOM 0 H GLU A 149 19.699 -5.207 -9.732 1.00 0.00 H new ATOM 0 HA GLU A 149 18.198 -7.440 -10.757 1.00 0.00 H new ATOM 0 HB2 GLU A 149 20.134 -8.740 -10.238 1.00 0.00 H new ATOM 0 HB3 GLU A 149 20.394 -7.898 -8.723 1.00 0.00 H new ATOM 0 HG2 GLU A 149 18.262 -8.818 -7.823 1.00 0.00 H new ATOM 0 HG3 GLU A 149 17.948 -9.621 -9.349 1.00 0.00 H new ATOM 245 N ASP A 150 18.390 -5.853 -7.878 1.00 0.00 N ATOM 246 CA ASP A 150 17.598 -5.311 -6.786 1.00 0.00 C ATOM 247 C ASP A 150 18.139 -3.931 -6.407 1.00 0.00 C ATOM 248 O ASP A 150 19.317 -3.643 -6.615 1.00 0.00 O ATOM 249 CB ASP A 150 17.680 -6.207 -5.550 1.00 0.00 C ATOM 250 CG ASP A 150 17.558 -7.707 -5.828 1.00 0.00 C ATOM 251 OD1 ASP A 150 16.432 -8.130 -6.171 1.00 0.00 O ATOM 252 OD2 ASP A 150 18.592 -8.395 -5.692 1.00 0.00 O ATOM 0 H ASP A 150 19.383 -5.624 -7.840 1.00 0.00 H new ATOM 0 HA ASP A 150 16.562 -5.249 -7.118 1.00 0.00 H new ATOM 0 HB2 ASP A 150 18.630 -6.022 -5.048 1.00 0.00 H new ATOM 0 HB3 ASP A 150 16.891 -5.916 -4.856 1.00 0.00 H new ATOM 257 N LEU A 151 17.253 -3.114 -5.857 1.00 0.00 N ATOM 258 CA LEU A 151 17.627 -1.771 -5.446 1.00 0.00 C ATOM 259 C LEU A 151 18.265 -1.827 -4.057 1.00 0.00 C ATOM 260 O LEU A 151 17.656 -2.320 -3.109 1.00 0.00 O ATOM 261 CB LEU A 151 16.424 -0.830 -5.531 1.00 0.00 C ATOM 262 CG LEU A 151 16.486 0.421 -4.654 1.00 0.00 C ATOM 263 CD1 LEU A 151 17.757 1.225 -4.936 1.00 0.00 C ATOM 264 CD2 LEU A 151 15.223 1.269 -4.817 1.00 0.00 C ATOM 0 H LEU A 151 16.277 -3.356 -5.686 1.00 0.00 H new ATOM 0 HA LEU A 151 18.374 -1.359 -6.125 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.306 -0.516 -6.568 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.529 -1.392 -5.264 1.00 0.00 H new ATOM 0 HG LEU A 151 16.529 0.106 -3.612 1.00 0.00 H new ATOM 0 HD11 LEU A 151 17.777 2.110 -4.299 1.00 0.00 H new ATOM 0 HD12 LEU A 151 18.631 0.608 -4.728 1.00 0.00 H new ATOM 0 HD13 LEU A 151 17.770 1.531 -5.982 1.00 0.00 H new ATOM 0 HD21 LEU A 151 15.293 2.152 -4.182 1.00 0.00 H new ATOM 0 HD22 LEU A 151 15.123 1.577 -5.858 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.351 0.683 -4.527 1.00 0.00 H new ATOM 276 N PRO A 152 19.518 -1.300 -3.979 1.00 0.00 N ATOM 277 CA PRO A 152 20.245 -1.285 -2.721 1.00 0.00 C ATOM 278 C PRO A 152 19.696 -0.209 -1.782 1.00 0.00 C ATOM 279 O PRO A 152 18.964 0.681 -2.213 1.00 0.00 O ATOM 280 CB PRO A 152 21.696 -1.051 -3.110 1.00 0.00 C ATOM 281 CG PRO A 152 21.663 -0.482 -4.519 1.00 0.00 C ATOM 282 CD PRO A 152 20.269 -0.708 -5.081 1.00 0.00 C ATOM 0 HA PRO A 152 20.140 -2.215 -2.163 1.00 0.00 H new ATOM 0 HB2 PRO A 152 22.178 -0.358 -2.420 1.00 0.00 H new ATOM 0 HB3 PRO A 152 22.264 -1.981 -3.077 1.00 0.00 H new ATOM 0 HG2 PRO A 152 21.902 0.581 -4.507 1.00 0.00 H new ATOM 0 HG3 PRO A 152 22.410 -0.969 -5.145 1.00 0.00 H new ATOM 0 HD2 PRO A 152 19.818 0.228 -5.410 1.00 0.00 H new ATOM 0 HD3 PRO A 152 20.293 -1.371 -5.946 1.00 0.00 H new ATOM 290 N PHE A 153 20.071 -0.326 -0.517 1.00 0.00 N ATOM 291 CA PHE A 153 19.625 0.627 0.486 1.00 0.00 C ATOM 292 C PHE A 153 20.174 0.264 1.868 1.00 0.00 C ATOM 293 O PHE A 153 20.886 -0.728 2.016 1.00 0.00 O ATOM 294 CB PHE A 153 18.098 0.555 0.523 1.00 0.00 C ATOM 295 CG PHE A 153 17.545 -0.858 0.714 1.00 0.00 C ATOM 296 CD1 PHE A 153 17.499 -1.408 1.958 1.00 0.00 C ATOM 297 CD2 PHE A 153 17.099 -1.565 -0.358 1.00 0.00 C ATOM 298 CE1 PHE A 153 16.986 -2.719 2.136 1.00 0.00 C ATOM 299 CE2 PHE A 153 16.586 -2.878 -0.180 1.00 0.00 C ATOM 300 CZ PHE A 153 16.540 -3.427 1.063 1.00 0.00 C ATOM 0 H PHE A 153 20.678 -1.065 -0.163 1.00 0.00 H new ATOM 0 HA PHE A 153 19.979 1.627 0.234 1.00 0.00 H new ATOM 0 HB2 PHE A 153 17.734 1.189 1.332 1.00 0.00 H new ATOM 0 HB3 PHE A 153 17.703 0.966 -0.406 1.00 0.00 H new ATOM 0 HD1 PHE A 153 17.853 -0.847 2.810 1.00 0.00 H new ATOM 0 HD2 PHE A 153 17.135 -1.129 -1.345 1.00 0.00 H new ATOM 0 HE1 PHE A 153 16.950 -3.155 3.123 1.00 0.00 H new ATOM 0 HE2 PHE A 153 16.233 -3.440 -1.032 1.00 0.00 H new ATOM 0 HZ PHE A 153 16.150 -4.425 1.199 1.00 0.00 H new ATOM 310 N LYS A 154 19.822 1.088 2.844 1.00 0.00 N ATOM 311 CA LYS A 154 20.271 0.867 4.208 1.00 0.00 C ATOM 312 C LYS A 154 19.067 0.515 5.085 1.00 0.00 C ATOM 313 O LYS A 154 17.945 0.412 4.592 1.00 0.00 O ATOM 314 CB LYS A 154 21.068 2.072 4.712 1.00 0.00 C ATOM 315 CG LYS A 154 22.486 2.071 4.139 1.00 0.00 C ATOM 316 CD LYS A 154 22.936 3.490 3.784 1.00 0.00 C ATOM 317 CE LYS A 154 24.372 3.741 4.246 1.00 0.00 C ATOM 318 NZ LYS A 154 24.685 5.188 4.203 1.00 0.00 N ATOM 0 H LYS A 154 19.231 1.910 2.717 1.00 0.00 H new ATOM 0 HA LYS A 154 20.957 0.021 4.251 1.00 0.00 H new ATOM 0 HB2 LYS A 154 20.559 2.993 4.429 1.00 0.00 H new ATOM 0 HB3 LYS A 154 21.112 2.053 5.801 1.00 0.00 H new ATOM 0 HG2 LYS A 154 23.175 1.638 4.865 1.00 0.00 H new ATOM 0 HG3 LYS A 154 22.522 1.441 3.250 1.00 0.00 H new ATOM 0 HD2 LYS A 154 22.866 3.639 2.707 1.00 0.00 H new ATOM 0 HD3 LYS A 154 22.268 4.214 4.250 1.00 0.00 H new ATOM 0 HE2 LYS A 154 24.505 3.364 5.260 1.00 0.00 H new ATOM 0 HE3 LYS A 154 25.066 3.194 3.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 25.664 5.341 4.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 24.577 5.538 3.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 24.034 5.703 4.830 1.00 0.00 H new ATOM 332 N LYS A 155 19.342 0.340 6.369 1.00 0.00 N ATOM 333 CA LYS A 155 18.296 0.001 7.319 1.00 0.00 C ATOM 334 C LYS A 155 17.767 1.283 7.966 1.00 0.00 C ATOM 335 O LYS A 155 18.118 1.601 9.101 1.00 0.00 O ATOM 336 CB LYS A 155 18.803 -1.033 8.327 1.00 0.00 C ATOM 337 CG LYS A 155 20.295 -0.845 8.602 1.00 0.00 C ATOM 338 CD LYS A 155 20.541 0.384 9.481 1.00 0.00 C ATOM 339 CE LYS A 155 20.919 1.598 8.632 1.00 0.00 C ATOM 340 NZ LYS A 155 21.608 2.615 9.458 1.00 0.00 N ATOM 0 H LYS A 155 20.274 0.427 6.774 1.00 0.00 H new ATOM 0 HA LYS A 155 17.455 -0.470 6.809 1.00 0.00 H new ATOM 0 HB2 LYS A 155 18.244 -0.943 9.258 1.00 0.00 H new ATOM 0 HB3 LYS A 155 18.624 -2.038 7.944 1.00 0.00 H new ATOM 0 HG2 LYS A 155 20.692 -1.733 9.093 1.00 0.00 H new ATOM 0 HG3 LYS A 155 20.831 -0.735 7.659 1.00 0.00 H new ATOM 0 HD2 LYS A 155 19.645 0.606 10.061 1.00 0.00 H new ATOM 0 HD3 LYS A 155 21.338 0.172 10.194 1.00 0.00 H new ATOM 0 HE2 LYS A 155 21.566 1.288 7.812 1.00 0.00 H new ATOM 0 HE3 LYS A 155 20.023 2.030 8.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 21.858 3.432 8.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 20.978 2.923 10.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 22.473 2.205 9.864 1.00 0.00 H new ATOM 354 N GLY A 156 16.931 1.985 7.215 1.00 0.00 N ATOM 355 CA GLY A 156 16.349 3.225 7.701 1.00 0.00 C ATOM 356 C GLY A 156 16.157 4.225 6.559 1.00 0.00 C ATOM 357 O GLY A 156 16.026 5.425 6.795 1.00 0.00 O ATOM 0 H GLY A 156 16.643 1.719 6.273 1.00 0.00 H new ATOM 0 HA2 GLY A 156 15.389 3.019 8.174 1.00 0.00 H new ATOM 0 HA3 GLY A 156 16.994 3.659 8.465 1.00 0.00 H new ATOM 361 N ASP A 157 16.146 3.694 5.346 1.00 0.00 N ATOM 362 CA ASP A 157 15.972 4.524 4.167 1.00 0.00 C ATOM 363 C ASP A 157 14.485 4.603 3.818 1.00 0.00 C ATOM 364 O ASP A 157 13.687 3.797 4.298 1.00 0.00 O ATOM 365 CB ASP A 157 16.710 3.935 2.963 1.00 0.00 C ATOM 366 CG ASP A 157 16.609 4.756 1.677 1.00 0.00 C ATOM 367 OD1 ASP A 157 15.565 4.632 1.002 1.00 0.00 O ATOM 368 OD2 ASP A 157 17.581 5.492 1.396 1.00 0.00 O ATOM 0 H ASP A 157 16.255 2.698 5.154 1.00 0.00 H new ATOM 0 HA ASP A 157 16.376 5.512 4.389 1.00 0.00 H new ATOM 0 HB2 ASP A 157 17.763 3.821 3.222 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.319 2.936 2.770 1.00 0.00 H new ATOM 373 N ILE A 158 14.155 5.580 2.986 1.00 0.00 N ATOM 374 CA ILE A 158 12.776 5.773 2.568 1.00 0.00 C ATOM 375 C ILE A 158 12.680 5.600 1.050 1.00 0.00 C ATOM 376 O ILE A 158 13.428 6.227 0.301 1.00 0.00 O ATOM 377 CB ILE A 158 12.249 7.119 3.068 1.00 0.00 C ATOM 378 CG1 ILE A 158 13.183 7.717 4.122 1.00 0.00 C ATOM 379 CG2 ILE A 158 10.814 6.989 3.583 1.00 0.00 C ATOM 380 CD1 ILE A 158 13.015 7.010 5.469 1.00 0.00 C ATOM 0 H ILE A 158 14.818 6.246 2.590 1.00 0.00 H new ATOM 0 HA ILE A 158 12.131 5.018 3.017 1.00 0.00 H new ATOM 0 HB ILE A 158 12.228 7.811 2.226 1.00 0.00 H new ATOM 0 HG12 ILE A 158 14.217 7.630 3.788 1.00 0.00 H new ATOM 0 HG13 ILE A 158 12.974 8.781 4.237 1.00 0.00 H new ATOM 0 HG21 ILE A 158 10.463 7.960 3.933 1.00 0.00 H new ATOM 0 HG22 ILE A 158 10.169 6.639 2.777 1.00 0.00 H new ATOM 0 HG23 ILE A 158 10.786 6.275 4.406 1.00 0.00 H new ATOM 0 HD11 ILE A 158 13.690 7.455 6.200 1.00 0.00 H new ATOM 0 HD12 ILE A 158 11.986 7.120 5.812 1.00 0.00 H new ATOM 0 HD13 ILE A 158 13.249 5.951 5.356 1.00 0.00 H new ATOM 392 N LEU A 159 11.751 4.749 0.642 1.00 0.00 N ATOM 393 CA LEU A 159 11.547 4.486 -0.772 1.00 0.00 C ATOM 394 C LEU A 159 10.051 4.554 -1.088 1.00 0.00 C ATOM 395 O LEU A 159 9.246 4.907 -0.227 1.00 0.00 O ATOM 396 CB LEU A 159 12.199 3.160 -1.170 1.00 0.00 C ATOM 397 CG LEU A 159 13.431 2.750 -0.363 1.00 0.00 C ATOM 398 CD1 LEU A 159 13.222 1.389 0.305 1.00 0.00 C ATOM 399 CD2 LEU A 159 14.690 2.773 -1.232 1.00 0.00 C ATOM 0 H LEU A 159 11.131 4.233 1.266 1.00 0.00 H new ATOM 0 HA LEU A 159 12.037 5.250 -1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.453 2.370 -1.083 1.00 0.00 H new ATOM 0 HB3 LEU A 159 12.481 3.218 -2.221 1.00 0.00 H new ATOM 0 HG LEU A 159 13.575 3.481 0.432 1.00 0.00 H new ATOM 0 HD11 LEU A 159 14.113 1.121 0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 159 12.366 1.441 0.978 1.00 0.00 H new ATOM 0 HD13 LEU A 159 13.038 0.633 -0.459 1.00 0.00 H new ATOM 0 HD21 LEU A 159 15.551 2.477 -0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 159 14.571 2.078 -2.064 1.00 0.00 H new ATOM 0 HD23 LEU A 159 14.846 3.780 -1.620 1.00 0.00 H new ATOM 411 N ARG A 160 9.723 4.212 -2.326 1.00 0.00 N ATOM 412 CA ARG A 160 8.339 4.231 -2.766 1.00 0.00 C ATOM 413 C ARG A 160 8.004 2.941 -3.517 1.00 0.00 C ATOM 414 O ARG A 160 8.873 2.342 -4.148 1.00 0.00 O ATOM 415 CB ARG A 160 8.067 5.430 -3.678 1.00 0.00 C ATOM 416 CG ARG A 160 8.875 5.328 -4.973 1.00 0.00 C ATOM 417 CD ARG A 160 8.705 6.587 -5.826 1.00 0.00 C ATOM 418 NE ARG A 160 9.820 7.526 -5.572 1.00 0.00 N ATOM 419 CZ ARG A 160 9.793 8.491 -4.642 1.00 0.00 C ATOM 420 NH1 ARG A 160 8.707 8.649 -3.872 1.00 0.00 N ATOM 421 NH2 ARG A 160 10.851 9.296 -4.481 1.00 0.00 N ATOM 0 H ARG A 160 10.393 3.920 -3.038 1.00 0.00 H new ATOM 0 HA ARG A 160 7.710 4.314 -1.880 1.00 0.00 H new ATOM 0 HB2 ARG A 160 7.004 5.480 -3.912 1.00 0.00 H new ATOM 0 HB3 ARG A 160 8.323 6.353 -3.157 1.00 0.00 H new ATOM 0 HG2 ARG A 160 9.929 5.184 -4.738 1.00 0.00 H new ATOM 0 HG3 ARG A 160 8.552 4.454 -5.539 1.00 0.00 H new ATOM 0 HD2 ARG A 160 8.678 6.319 -6.882 1.00 0.00 H new ATOM 0 HD3 ARG A 160 7.754 7.067 -5.594 1.00 0.00 H new ATOM 0 HE ARG A 160 10.662 7.433 -6.140 1.00 0.00 H new ATOM 0 HH11 ARG A 160 7.902 8.035 -3.994 1.00 0.00 H new ATOM 0 HH12 ARG A 160 8.686 9.383 -3.164 1.00 0.00 H new ATOM 0 HH21 ARG A 160 11.678 9.175 -5.066 1.00 0.00 H new ATOM 0 HH22 ARG A 160 10.830 10.030 -3.773 1.00 0.00 H new ATOM 435 N ILE A 161 6.740 2.552 -3.424 1.00 0.00 N ATOM 436 CA ILE A 161 6.279 1.344 -4.087 1.00 0.00 C ATOM 437 C ILE A 161 5.701 1.708 -5.456 1.00 0.00 C ATOM 438 O ILE A 161 4.699 2.415 -5.542 1.00 0.00 O ATOM 439 CB ILE A 161 5.304 0.579 -3.191 1.00 0.00 C ATOM 440 CG1 ILE A 161 5.896 -0.762 -2.755 1.00 0.00 C ATOM 441 CG2 ILE A 161 3.946 0.412 -3.876 1.00 0.00 C ATOM 442 CD1 ILE A 161 7.345 -0.597 -2.291 1.00 0.00 C ATOM 0 H ILE A 161 6.022 3.052 -2.900 1.00 0.00 H new ATOM 0 HA ILE A 161 7.113 0.664 -4.263 1.00 0.00 H new ATOM 0 HB ILE A 161 5.138 1.166 -2.287 1.00 0.00 H new ATOM 0 HG12 ILE A 161 5.297 -1.182 -1.947 1.00 0.00 H new ATOM 0 HG13 ILE A 161 5.854 -1.469 -3.584 1.00 0.00 H new ATOM 0 HG21 ILE A 161 3.271 -0.135 -3.218 1.00 0.00 H new ATOM 0 HG22 ILE A 161 3.525 1.394 -4.093 1.00 0.00 H new ATOM 0 HG23 ILE A 161 4.073 -0.142 -4.806 1.00 0.00 H new ATOM 0 HD11 ILE A 161 7.742 -1.565 -1.986 1.00 0.00 H new ATOM 0 HD12 ILE A 161 7.946 -0.199 -3.109 1.00 0.00 H new ATOM 0 HD13 ILE A 161 7.381 0.091 -1.447 1.00 0.00 H new ATOM 454 N ARG A 162 6.358 1.208 -6.493 1.00 0.00 N ATOM 455 CA ARG A 162 5.921 1.471 -7.853 1.00 0.00 C ATOM 456 C ARG A 162 5.057 0.317 -8.366 1.00 0.00 C ATOM 457 O ARG A 162 3.929 0.531 -8.809 1.00 0.00 O ATOM 458 CB ARG A 162 7.117 1.660 -8.789 1.00 0.00 C ATOM 459 CG ARG A 162 6.660 1.777 -10.245 1.00 0.00 C ATOM 460 CD ARG A 162 7.458 0.833 -11.147 1.00 0.00 C ATOM 461 NE ARG A 162 6.539 0.086 -12.035 1.00 0.00 N ATOM 462 CZ ARG A 162 6.929 -0.581 -13.130 1.00 0.00 C ATOM 463 NH1 ARG A 162 8.223 -0.599 -13.478 1.00 0.00 N ATOM 464 NH2 ARG A 162 6.026 -1.231 -13.877 1.00 0.00 N ATOM 0 H ARG A 162 7.190 0.622 -6.418 1.00 0.00 H new ATOM 0 HA ARG A 162 5.335 2.390 -7.841 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.669 2.556 -8.504 1.00 0.00 H new ATOM 0 HB3 ARG A 162 7.801 0.818 -8.685 1.00 0.00 H new ATOM 0 HG2 ARG A 162 5.598 1.543 -10.317 1.00 0.00 H new ATOM 0 HG3 ARG A 162 6.784 2.804 -10.587 1.00 0.00 H new ATOM 0 HD2 ARG A 162 8.171 1.402 -11.743 1.00 0.00 H new ATOM 0 HD3 ARG A 162 8.036 0.137 -10.539 1.00 0.00 H new ATOM 0 HE ARG A 162 5.547 0.078 -11.799 1.00 0.00 H new ATOM 0 HH11 ARG A 162 8.911 -0.105 -12.909 1.00 0.00 H new ATOM 0 HH12 ARG A 162 8.520 -1.107 -14.311 1.00 0.00 H new ATOM 0 HH21 ARG A 162 5.041 -1.218 -13.612 1.00 0.00 H new ATOM 0 HH22 ARG A 162 6.324 -1.738 -14.710 1.00 0.00 H new ATOM 478 N ASP A 163 5.619 -0.880 -8.290 1.00 0.00 N ATOM 479 CA ASP A 163 4.914 -2.068 -8.741 1.00 0.00 C ATOM 480 C ASP A 163 5.400 -3.279 -7.942 1.00 0.00 C ATOM 481 O ASP A 163 6.334 -3.169 -7.149 1.00 0.00 O ATOM 482 CB ASP A 163 5.184 -2.339 -10.222 1.00 0.00 C ATOM 483 CG ASP A 163 3.987 -2.118 -11.149 1.00 0.00 C ATOM 484 OD1 ASP A 163 3.230 -1.160 -10.879 1.00 0.00 O ATOM 485 OD2 ASP A 163 3.857 -2.911 -12.107 1.00 0.00 O ATOM 0 H ASP A 163 6.555 -1.053 -7.923 1.00 0.00 H new ATOM 0 HA ASP A 163 3.847 -1.903 -8.593 1.00 0.00 H new ATOM 0 HB2 ASP A 163 6.002 -1.697 -10.550 1.00 0.00 H new ATOM 0 HB3 ASP A 163 5.524 -3.369 -10.331 1.00 0.00 H new ATOM 490 N LYS A 164 4.745 -4.406 -8.178 1.00 0.00 N ATOM 491 CA LYS A 164 5.099 -5.636 -7.491 1.00 0.00 C ATOM 492 C LYS A 164 5.317 -6.746 -8.520 1.00 0.00 C ATOM 493 O LYS A 164 4.357 -7.331 -9.020 1.00 0.00 O ATOM 494 CB LYS A 164 4.050 -5.977 -6.430 1.00 0.00 C ATOM 495 CG LYS A 164 3.297 -4.724 -5.981 1.00 0.00 C ATOM 496 CD LYS A 164 3.363 -4.559 -4.461 1.00 0.00 C ATOM 497 CE LYS A 164 4.211 -3.345 -4.077 1.00 0.00 C ATOM 498 NZ LYS A 164 5.613 -3.534 -4.511 1.00 0.00 N ATOM 0 H LYS A 164 3.970 -4.493 -8.836 1.00 0.00 H new ATOM 0 HA LYS A 164 6.038 -5.514 -6.951 1.00 0.00 H new ATOM 0 HB2 LYS A 164 3.345 -6.705 -6.831 1.00 0.00 H new ATOM 0 HB3 LYS A 164 4.534 -6.442 -5.571 1.00 0.00 H new ATOM 0 HG2 LYS A 164 3.725 -3.846 -6.465 1.00 0.00 H new ATOM 0 HG3 LYS A 164 2.256 -4.788 -6.299 1.00 0.00 H new ATOM 0 HD2 LYS A 164 2.356 -4.445 -4.060 1.00 0.00 H new ATOM 0 HD3 LYS A 164 3.785 -5.458 -4.012 1.00 0.00 H new ATOM 0 HE2 LYS A 164 3.800 -2.447 -4.537 1.00 0.00 H new ATOM 0 HE3 LYS A 164 4.175 -3.196 -2.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 6.243 -2.974 -3.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 5.866 -4.540 -4.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 5.716 -3.221 -5.498 1.00 0.00 H new ATOM 512 N PRO A 165 6.618 -7.010 -8.814 1.00 0.00 N ATOM 513 CA PRO A 165 6.975 -8.040 -9.776 1.00 0.00 C ATOM 514 C PRO A 165 6.790 -9.436 -9.176 1.00 0.00 C ATOM 515 O PRO A 165 6.355 -10.358 -9.864 1.00 0.00 O ATOM 516 CB PRO A 165 8.415 -7.742 -10.156 1.00 0.00 C ATOM 517 CG PRO A 165 8.959 -6.845 -9.056 1.00 0.00 C ATOM 518 CD PRO A 165 7.780 -6.337 -8.242 1.00 0.00 C ATOM 0 HA PRO A 165 6.336 -8.032 -10.659 1.00 0.00 H new ATOM 0 HB2 PRO A 165 8.996 -8.661 -10.234 1.00 0.00 H new ATOM 0 HB3 PRO A 165 8.469 -7.247 -11.126 1.00 0.00 H new ATOM 0 HG2 PRO A 165 9.652 -7.397 -8.421 1.00 0.00 H new ATOM 0 HG3 PRO A 165 9.515 -6.011 -9.484 1.00 0.00 H new ATOM 0 HD2 PRO A 165 7.896 -6.577 -7.185 1.00 0.00 H new ATOM 0 HD3 PRO A 165 7.686 -5.254 -8.315 1.00 0.00 H new ATOM 526 N GLU A 166 7.131 -9.547 -7.902 1.00 0.00 N ATOM 527 CA GLU A 166 7.009 -10.815 -7.202 1.00 0.00 C ATOM 528 C GLU A 166 6.364 -10.605 -5.830 1.00 0.00 C ATOM 529 O GLU A 166 5.795 -9.547 -5.564 1.00 0.00 O ATOM 530 CB GLU A 166 8.371 -11.500 -7.068 1.00 0.00 C ATOM 531 CG GLU A 166 9.191 -11.344 -8.349 1.00 0.00 C ATOM 532 CD GLU A 166 9.971 -12.623 -8.660 1.00 0.00 C ATOM 533 OE1 GLU A 166 9.328 -13.695 -8.651 1.00 0.00 O ATOM 534 OE2 GLU A 166 11.192 -12.501 -8.899 1.00 0.00 O ATOM 0 H GLU A 166 7.492 -8.780 -7.335 1.00 0.00 H new ATOM 0 HA GLU A 166 6.365 -11.470 -7.788 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.917 -11.071 -6.228 1.00 0.00 H new ATOM 0 HB3 GLU A 166 8.230 -12.558 -6.849 1.00 0.00 H new ATOM 0 HG2 GLU A 166 8.529 -11.106 -9.182 1.00 0.00 H new ATOM 0 HG3 GLU A 166 9.883 -10.509 -8.243 1.00 0.00 H new ATOM 541 N GLU A 167 6.472 -11.629 -4.997 1.00 0.00 N ATOM 542 CA GLU A 167 5.906 -11.570 -3.661 1.00 0.00 C ATOM 543 C GLU A 167 6.957 -11.084 -2.660 1.00 0.00 C ATOM 544 O GLU A 167 6.876 -9.960 -2.167 1.00 0.00 O ATOM 545 CB GLU A 167 5.340 -12.930 -3.245 1.00 0.00 C ATOM 546 CG GLU A 167 3.838 -13.006 -3.523 1.00 0.00 C ATOM 547 CD GLU A 167 3.442 -14.403 -4.007 1.00 0.00 C ATOM 548 OE1 GLU A 167 4.080 -15.369 -3.537 1.00 0.00 O ATOM 549 OE2 GLU A 167 2.509 -14.472 -4.838 1.00 0.00 O ATOM 0 H GLU A 167 6.944 -12.505 -5.222 1.00 0.00 H new ATOM 0 HA GLU A 167 5.082 -10.857 -3.668 1.00 0.00 H new ATOM 0 HB2 GLU A 167 5.855 -13.723 -3.787 1.00 0.00 H new ATOM 0 HB3 GLU A 167 5.526 -13.096 -2.184 1.00 0.00 H new ATOM 0 HG2 GLU A 167 3.284 -12.760 -2.617 1.00 0.00 H new ATOM 0 HG3 GLU A 167 3.565 -12.265 -4.275 1.00 0.00 H new ATOM 556 N GLN A 168 7.919 -11.953 -2.391 1.00 0.00 N ATOM 557 CA GLN A 168 8.984 -11.628 -1.459 1.00 0.00 C ATOM 558 C GLN A 168 9.786 -10.428 -1.968 1.00 0.00 C ATOM 559 O GLN A 168 10.364 -9.682 -1.178 1.00 0.00 O ATOM 560 CB GLN A 168 9.894 -12.834 -1.221 1.00 0.00 C ATOM 561 CG GLN A 168 10.845 -13.045 -2.401 1.00 0.00 C ATOM 562 CD GLN A 168 10.926 -14.525 -2.781 1.00 0.00 C ATOM 563 OE1 GLN A 168 10.111 -15.049 -3.522 1.00 0.00 O ATOM 564 NE2 GLN A 168 11.954 -15.168 -2.233 1.00 0.00 N ATOM 0 H GLN A 168 7.983 -12.884 -2.803 1.00 0.00 H new ATOM 0 HA GLN A 168 8.534 -11.361 -0.503 1.00 0.00 H new ATOM 0 HB2 GLN A 168 10.470 -12.685 -0.308 1.00 0.00 H new ATOM 0 HB3 GLN A 168 9.288 -13.728 -1.073 1.00 0.00 H new ATOM 0 HG2 GLN A 168 10.502 -12.464 -3.257 1.00 0.00 H new ATOM 0 HG3 GLN A 168 11.838 -12.677 -2.143 1.00 0.00 H new ATOM 0 HE21 GLN A 168 12.600 -14.669 -1.621 1.00 0.00 H new ATOM 0 HE22 GLN A 168 12.096 -16.160 -2.425 1.00 0.00 H new ATOM 573 N TRP A 169 9.797 -10.280 -3.285 1.00 0.00 N ATOM 574 CA TRP A 169 10.518 -9.183 -3.908 1.00 0.00 C ATOM 575 C TRP A 169 9.491 -8.188 -4.449 1.00 0.00 C ATOM 576 O TRP A 169 8.480 -8.585 -5.027 1.00 0.00 O ATOM 577 CB TRP A 169 11.475 -9.700 -4.986 1.00 0.00 C ATOM 578 CG TRP A 169 12.881 -10.014 -4.471 1.00 0.00 C ATOM 579 CD1 TRP A 169 13.417 -11.217 -4.216 1.00 0.00 C ATOM 580 CD2 TRP A 169 13.915 -9.058 -4.156 1.00 0.00 C ATOM 581 NE1 TRP A 169 14.715 -11.105 -3.763 1.00 0.00 N ATOM 582 CE2 TRP A 169 15.028 -9.752 -3.725 1.00 0.00 C ATOM 583 CE3 TRP A 169 13.911 -7.655 -4.234 1.00 0.00 C ATOM 584 CZ2 TRP A 169 16.218 -9.125 -3.337 1.00 0.00 C ATOM 585 CZ3 TRP A 169 15.109 -7.044 -3.843 1.00 0.00 C ATOM 586 CH2 TRP A 169 16.237 -7.727 -3.406 1.00 0.00 C ATOM 0 H TRP A 169 9.318 -10.901 -3.937 1.00 0.00 H new ATOM 0 HA TRP A 169 11.147 -8.671 -3.179 1.00 0.00 H new ATOM 0 HB2 TRP A 169 11.052 -10.601 -5.431 1.00 0.00 H new ATOM 0 HB3 TRP A 169 11.548 -8.957 -5.780 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.898 -12.155 -4.349 1.00 0.00 H new ATOM 0 HE1 TRP A 169 15.332 -11.875 -3.503 1.00 0.00 H new ATOM 0 HE3 TRP A 169 13.052 -7.092 -4.569 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 17.076 -9.690 -3.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 15.159 -5.966 -3.884 1.00 0.00 H new ATOM 0 HH2 TRP A 169 17.125 -7.182 -3.121 1.00 0.00 H new ATOM 597 N TRP A 170 9.784 -6.913 -4.242 1.00 0.00 N ATOM 598 CA TRP A 170 8.898 -5.857 -4.702 1.00 0.00 C ATOM 599 C TRP A 170 9.704 -4.922 -5.607 1.00 0.00 C ATOM 600 O TRP A 170 10.915 -5.087 -5.754 1.00 0.00 O ATOM 601 CB TRP A 170 8.250 -5.133 -3.520 1.00 0.00 C ATOM 602 CG TRP A 170 6.933 -5.758 -3.053 1.00 0.00 C ATOM 603 CD1 TRP A 170 6.341 -6.870 -3.509 1.00 0.00 C ATOM 604 CD2 TRP A 170 6.066 -5.258 -2.014 1.00 0.00 C ATOM 605 NE1 TRP A 170 5.160 -7.124 -2.842 1.00 0.00 N ATOM 606 CE2 TRP A 170 4.987 -6.112 -1.905 1.00 0.00 C ATOM 607 CE3 TRP A 170 6.188 -4.123 -1.194 1.00 0.00 C ATOM 608 CZ2 TRP A 170 3.948 -5.920 -0.986 1.00 0.00 C ATOM 609 CZ3 TRP A 170 5.142 -3.946 -0.281 1.00 0.00 C ATOM 610 CH2 TRP A 170 4.048 -4.796 -0.158 1.00 0.00 C ATOM 0 H TRP A 170 10.623 -6.587 -3.762 1.00 0.00 H new ATOM 0 HA TRP A 170 8.071 -6.271 -5.279 1.00 0.00 H new ATOM 0 HB2 TRP A 170 8.951 -5.122 -2.685 1.00 0.00 H new ATOM 0 HB3 TRP A 170 8.069 -4.095 -3.798 1.00 0.00 H new ATOM 0 HD1 TRP A 170 6.738 -7.490 -4.299 1.00 0.00 H new ATOM 0 HE1 TRP A 170 4.530 -7.909 -3.006 1.00 0.00 H new ATOM 0 HE3 TRP A 170 7.023 -3.441 -1.263 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 3.114 -6.603 -0.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 5.188 -3.089 0.374 1.00 0.00 H new ATOM 0 HH2 TRP A 170 3.280 -4.590 0.573 1.00 0.00 H new ATOM 621 N ASN A 171 9.001 -3.961 -6.188 1.00 0.00 N ATOM 622 CA ASN A 171 9.637 -3.001 -7.074 1.00 0.00 C ATOM 623 C ASN A 171 9.340 -1.584 -6.579 1.00 0.00 C ATOM 624 O ASN A 171 8.290 -1.022 -6.890 1.00 0.00 O ATOM 625 CB ASN A 171 9.100 -3.128 -8.500 1.00 0.00 C ATOM 626 CG ASN A 171 9.796 -2.139 -9.438 1.00 0.00 C ATOM 627 OD1 ASN A 171 10.593 -1.311 -9.028 1.00 0.00 O ATOM 628 ND2 ASN A 171 9.451 -2.272 -10.716 1.00 0.00 N ATOM 0 H ASN A 171 7.998 -3.827 -6.063 1.00 0.00 H new ATOM 0 HA ASN A 171 10.709 -3.200 -7.075 1.00 0.00 H new ATOM 0 HB2 ASN A 171 9.252 -4.145 -8.860 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.025 -2.945 -8.505 1.00 0.00 H new ATOM 0 HD21 ASN A 171 9.860 -1.659 -11.421 1.00 0.00 H new ATOM 0 HD22 ASN A 171 8.777 -2.987 -10.991 1.00 0.00 H new ATOM 635 N ALA A 172 10.282 -1.045 -5.819 1.00 0.00 N ATOM 636 CA ALA A 172 10.134 0.295 -5.280 1.00 0.00 C ATOM 637 C ALA A 172 11.117 1.234 -5.981 1.00 0.00 C ATOM 638 O ALA A 172 12.013 0.782 -6.693 1.00 0.00 O ATOM 639 CB ALA A 172 10.340 0.262 -3.764 1.00 0.00 C ATOM 0 H ALA A 172 11.151 -1.513 -5.564 1.00 0.00 H new ATOM 0 HA ALA A 172 9.128 0.673 -5.464 1.00 0.00 H new ATOM 0 HB1 ALA A 172 10.229 1.268 -3.360 1.00 0.00 H new ATOM 0 HB2 ALA A 172 9.598 -0.395 -3.310 1.00 0.00 H new ATOM 0 HB3 ALA A 172 11.340 -0.110 -3.541 1.00 0.00 H new ATOM 645 N GLU A 173 10.916 2.525 -5.757 1.00 0.00 N ATOM 646 CA GLU A 173 11.774 3.531 -6.359 1.00 0.00 C ATOM 647 C GLU A 173 12.585 4.252 -5.279 1.00 0.00 C ATOM 648 O GLU A 173 12.064 4.559 -4.209 1.00 0.00 O ATOM 649 CB GLU A 173 10.957 4.525 -7.186 1.00 0.00 C ATOM 650 CG GLU A 173 11.203 4.325 -8.682 1.00 0.00 C ATOM 651 CD GLU A 173 10.320 5.260 -9.512 1.00 0.00 C ATOM 652 OE1 GLU A 173 9.202 5.557 -9.037 1.00 0.00 O ATOM 653 OE2 GLU A 173 10.783 5.657 -10.603 1.00 0.00 O ATOM 0 H GLU A 173 10.172 2.897 -5.167 1.00 0.00 H new ATOM 0 HA GLU A 173 12.468 3.031 -7.035 1.00 0.00 H new ATOM 0 HB2 GLU A 173 9.896 4.400 -6.968 1.00 0.00 H new ATOM 0 HB3 GLU A 173 11.222 5.544 -6.903 1.00 0.00 H new ATOM 0 HG2 GLU A 173 12.252 4.512 -8.910 1.00 0.00 H new ATOM 0 HG3 GLU A 173 10.998 3.289 -8.953 1.00 0.00 H new ATOM 660 N ASP A 174 13.847 4.501 -5.599 1.00 0.00 N ATOM 661 CA ASP A 174 14.734 5.179 -4.669 1.00 0.00 C ATOM 662 C ASP A 174 14.435 6.680 -4.689 1.00 0.00 C ATOM 663 O ASP A 174 13.816 7.181 -5.628 1.00 0.00 O ATOM 664 CB ASP A 174 16.200 4.984 -5.065 1.00 0.00 C ATOM 665 CG ASP A 174 17.200 5.098 -3.914 1.00 0.00 C ATOM 666 OD1 ASP A 174 17.246 6.190 -3.307 1.00 0.00 O ATOM 667 OD2 ASP A 174 17.897 4.090 -3.666 1.00 0.00 O ATOM 0 H ASP A 174 14.276 4.245 -6.489 1.00 0.00 H new ATOM 0 HA ASP A 174 14.569 4.758 -3.677 1.00 0.00 H new ATOM 0 HB2 ASP A 174 16.309 4.002 -5.525 1.00 0.00 H new ATOM 0 HB3 ASP A 174 16.457 5.722 -5.824 1.00 0.00 H new ATOM 672 N SER A 175 14.888 7.355 -3.643 1.00 0.00 N ATOM 673 CA SER A 175 14.677 8.787 -3.529 1.00 0.00 C ATOM 674 C SER A 175 15.137 9.488 -4.809 1.00 0.00 C ATOM 675 O SER A 175 14.727 10.614 -5.087 1.00 0.00 O ATOM 676 CB SER A 175 15.415 9.358 -2.317 1.00 0.00 C ATOM 677 OG SER A 175 14.516 9.781 -1.295 1.00 0.00 O ATOM 0 H SER A 175 15.400 6.936 -2.867 1.00 0.00 H new ATOM 0 HA SER A 175 13.611 8.965 -3.388 1.00 0.00 H new ATOM 0 HB2 SER A 175 16.091 8.603 -1.915 1.00 0.00 H new ATOM 0 HB3 SER A 175 16.030 10.202 -2.631 1.00 0.00 H new ATOM 0 HG SER A 175 15.026 10.138 -0.538 1.00 0.00 H new ATOM 683 N GLU A 176 15.984 8.793 -5.554 1.00 0.00 N ATOM 684 CA GLU A 176 16.506 9.335 -6.798 1.00 0.00 C ATOM 685 C GLU A 176 15.473 9.184 -7.917 1.00 0.00 C ATOM 686 O GLU A 176 15.470 9.957 -8.872 1.00 0.00 O ATOM 687 CB GLU A 176 17.827 8.663 -7.177 1.00 0.00 C ATOM 688 CG GLU A 176 18.887 8.889 -6.097 1.00 0.00 C ATOM 689 CD GLU A 176 19.838 7.694 -6.005 1.00 0.00 C ATOM 690 OE1 GLU A 176 19.321 6.557 -5.980 1.00 0.00 O ATOM 691 OE2 GLU A 176 21.062 7.946 -5.962 1.00 0.00 O ATOM 0 H GLU A 176 16.322 7.859 -5.320 1.00 0.00 H new ATOM 0 HA GLU A 176 16.705 10.397 -6.654 1.00 0.00 H new ATOM 0 HB2 GLU A 176 17.668 7.594 -7.317 1.00 0.00 H new ATOM 0 HB3 GLU A 176 18.181 9.060 -8.128 1.00 0.00 H new ATOM 0 HG2 GLU A 176 19.453 9.793 -6.322 1.00 0.00 H new ATOM 0 HG3 GLU A 176 18.402 9.048 -5.134 1.00 0.00 H new ATOM 698 N GLY A 177 14.620 8.182 -7.759 1.00 0.00 N ATOM 699 CA GLY A 177 13.584 7.919 -8.744 1.00 0.00 C ATOM 700 C GLY A 177 13.963 6.735 -9.635 1.00 0.00 C ATOM 701 O GLY A 177 13.508 6.640 -10.774 1.00 0.00 O ATOM 0 H GLY A 177 14.625 7.543 -6.964 1.00 0.00 H new ATOM 0 HA2 GLY A 177 12.641 7.711 -8.239 1.00 0.00 H new ATOM 0 HA3 GLY A 177 13.428 8.806 -9.358 1.00 0.00 H new ATOM 705 N LYS A 178 14.791 5.861 -9.083 1.00 0.00 N ATOM 706 CA LYS A 178 15.236 4.686 -9.813 1.00 0.00 C ATOM 707 C LYS A 178 14.328 3.504 -9.471 1.00 0.00 C ATOM 708 O LYS A 178 14.105 3.207 -8.298 1.00 0.00 O ATOM 709 CB LYS A 178 16.719 4.420 -9.547 1.00 0.00 C ATOM 710 CG LYS A 178 16.997 4.321 -8.046 1.00 0.00 C ATOM 711 CD LYS A 178 17.800 3.059 -7.719 1.00 0.00 C ATOM 712 CE LYS A 178 17.159 1.822 -8.351 1.00 0.00 C ATOM 713 NZ LYS A 178 18.056 1.239 -9.374 1.00 0.00 N ATOM 0 H LYS A 178 15.166 5.943 -8.138 1.00 0.00 H new ATOM 0 HA LYS A 178 15.153 4.851 -10.887 1.00 0.00 H new ATOM 0 HB2 LYS A 178 17.020 3.495 -10.038 1.00 0.00 H new ATOM 0 HB3 LYS A 178 17.319 5.220 -9.980 1.00 0.00 H new ATOM 0 HG2 LYS A 178 17.547 5.202 -7.715 1.00 0.00 H new ATOM 0 HG3 LYS A 178 16.055 4.309 -7.498 1.00 0.00 H new ATOM 0 HD2 LYS A 178 18.822 3.169 -8.083 1.00 0.00 H new ATOM 0 HD3 LYS A 178 17.858 2.931 -6.638 1.00 0.00 H new ATOM 0 HE2 LYS A 178 16.947 1.081 -7.580 1.00 0.00 H new ATOM 0 HE3 LYS A 178 16.206 2.091 -8.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 17.493 0.705 -10.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 18.570 2.001 -9.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 18.737 0.600 -8.915 1.00 0.00 H new ATOM 727 N ARG A 179 13.828 2.861 -10.517 1.00 0.00 N ATOM 728 CA ARG A 179 12.949 1.717 -10.341 1.00 0.00 C ATOM 729 C ARG A 179 13.769 0.436 -10.184 1.00 0.00 C ATOM 730 O ARG A 179 14.486 0.037 -11.101 1.00 0.00 O ATOM 731 CB ARG A 179 12.000 1.564 -11.532 1.00 0.00 C ATOM 732 CG ARG A 179 11.764 2.910 -12.221 1.00 0.00 C ATOM 733 CD ARG A 179 10.555 2.843 -13.155 1.00 0.00 C ATOM 734 NE ARG A 179 9.677 4.013 -12.932 1.00 0.00 N ATOM 735 CZ ARG A 179 8.968 4.218 -11.814 1.00 0.00 C ATOM 736 NH1 ARG A 179 9.028 3.332 -10.810 1.00 0.00 N ATOM 737 NH2 ARG A 179 8.198 5.310 -11.699 1.00 0.00 N ATOM 0 H ARG A 179 14.015 3.110 -11.488 1.00 0.00 H new ATOM 0 HA ARG A 179 12.360 1.887 -9.440 1.00 0.00 H new ATOM 0 HB2 ARG A 179 12.418 0.854 -12.246 1.00 0.00 H new ATOM 0 HB3 ARG A 179 11.049 1.153 -11.193 1.00 0.00 H new ATOM 0 HG2 ARG A 179 11.606 3.684 -11.470 1.00 0.00 H new ATOM 0 HG3 ARG A 179 12.651 3.193 -12.788 1.00 0.00 H new ATOM 0 HD2 ARG A 179 10.888 2.820 -14.193 1.00 0.00 H new ATOM 0 HD3 ARG A 179 9.999 1.922 -12.978 1.00 0.00 H new ATOM 0 HE ARG A 179 9.607 4.707 -13.676 1.00 0.00 H new ATOM 0 HH11 ARG A 179 9.614 2.501 -10.897 1.00 0.00 H new ATOM 0 HH12 ARG A 179 8.488 3.488 -9.959 1.00 0.00 H new ATOM 0 HH21 ARG A 179 8.152 5.984 -12.463 1.00 0.00 H new ATOM 0 HH22 ARG A 179 7.658 5.466 -10.848 1.00 0.00 H new ATOM 751 N GLY A 180 13.638 -0.174 -9.015 1.00 0.00 N ATOM 752 CA GLY A 180 14.358 -1.403 -8.727 1.00 0.00 C ATOM 753 C GLY A 180 13.579 -2.277 -7.743 1.00 0.00 C ATOM 754 O GLY A 180 12.578 -1.840 -7.177 1.00 0.00 O ATOM 0 H GLY A 180 13.044 0.160 -8.256 1.00 0.00 H new ATOM 0 HA2 GLY A 180 14.529 -1.954 -9.652 1.00 0.00 H new ATOM 0 HA3 GLY A 180 15.338 -1.166 -8.312 1.00 0.00 H new ATOM 758 N MET A 181 14.067 -3.497 -7.569 1.00 0.00 N ATOM 759 CA MET A 181 13.428 -4.437 -6.664 1.00 0.00 C ATOM 760 C MET A 181 13.937 -4.251 -5.233 1.00 0.00 C ATOM 761 O MET A 181 15.109 -3.942 -5.022 1.00 0.00 O ATOM 762 CB MET A 181 13.715 -5.866 -7.126 1.00 0.00 C ATOM 763 CG MET A 181 12.499 -6.468 -7.834 1.00 0.00 C ATOM 764 SD MET A 181 13.021 -7.742 -8.969 1.00 0.00 S ATOM 765 CE MET A 181 12.140 -7.231 -10.436 1.00 0.00 C ATOM 0 H MET A 181 14.898 -3.856 -8.040 1.00 0.00 H new ATOM 0 HA MET A 181 12.354 -4.251 -6.675 1.00 0.00 H new ATOM 0 HB2 MET A 181 14.571 -5.869 -7.800 1.00 0.00 H new ATOM 0 HB3 MET A 181 13.983 -6.483 -6.268 1.00 0.00 H new ATOM 0 HG2 MET A 181 11.810 -6.884 -7.099 1.00 0.00 H new ATOM 0 HG3 MET A 181 11.959 -5.689 -8.372 1.00 0.00 H new ATOM 0 HE1 MET A 181 12.765 -7.399 -11.313 1.00 0.00 H new ATOM 0 HE2 MET A 181 11.221 -7.810 -10.529 1.00 0.00 H new ATOM 0 HE3 MET A 181 11.895 -6.171 -10.363 1.00 0.00 H new ATOM 775 N ILE A 182 13.031 -4.447 -4.287 1.00 0.00 N ATOM 776 CA ILE A 182 13.373 -4.306 -2.881 1.00 0.00 C ATOM 777 C ILE A 182 12.618 -5.360 -2.068 1.00 0.00 C ATOM 778 O ILE A 182 11.452 -5.642 -2.342 1.00 0.00 O ATOM 779 CB ILE A 182 13.123 -2.872 -2.411 1.00 0.00 C ATOM 780 CG1 ILE A 182 14.054 -1.890 -3.127 1.00 0.00 C ATOM 781 CG2 ILE A 182 13.239 -2.766 -0.889 1.00 0.00 C ATOM 782 CD1 ILE A 182 13.663 -0.443 -2.823 1.00 0.00 C ATOM 0 H ILE A 182 12.060 -4.702 -4.466 1.00 0.00 H new ATOM 0 HA ILE A 182 14.437 -4.487 -2.728 1.00 0.00 H new ATOM 0 HB ILE A 182 12.102 -2.599 -2.676 1.00 0.00 H new ATOM 0 HG12 ILE A 182 15.083 -2.066 -2.814 1.00 0.00 H new ATOM 0 HG13 ILE A 182 14.013 -2.063 -4.202 1.00 0.00 H new ATOM 0 HG21 ILE A 182 13.057 -1.736 -0.581 1.00 0.00 H new ATOM 0 HG22 ILE A 182 12.503 -3.420 -0.422 1.00 0.00 H new ATOM 0 HG23 ILE A 182 14.240 -3.066 -0.579 1.00 0.00 H new ATOM 0 HD11 ILE A 182 14.340 0.234 -3.344 1.00 0.00 H new ATOM 0 HD12 ILE A 182 12.642 -0.264 -3.159 1.00 0.00 H new ATOM 0 HD13 ILE A 182 13.728 -0.266 -1.749 1.00 0.00 H new ATOM 794 N PRO A 183 13.331 -5.928 -1.060 1.00 0.00 N ATOM 795 CA PRO A 183 12.741 -6.944 -0.205 1.00 0.00 C ATOM 796 C PRO A 183 11.762 -6.321 0.792 1.00 0.00 C ATOM 797 O PRO A 183 12.080 -5.326 1.442 1.00 0.00 O ATOM 798 CB PRO A 183 13.921 -7.625 0.469 1.00 0.00 C ATOM 799 CG PRO A 183 15.092 -6.666 0.326 1.00 0.00 C ATOM 800 CD PRO A 183 14.714 -5.618 -0.707 1.00 0.00 C ATOM 0 HA PRO A 183 12.145 -7.667 -0.762 1.00 0.00 H new ATOM 0 HB2 PRO A 183 13.708 -7.828 1.519 1.00 0.00 H new ATOM 0 HB3 PRO A 183 14.141 -8.583 -0.002 1.00 0.00 H new ATOM 0 HG2 PRO A 183 15.318 -6.195 1.282 1.00 0.00 H new ATOM 0 HG3 PRO A 183 15.989 -7.202 0.015 1.00 0.00 H new ATOM 0 HD2 PRO A 183 14.803 -4.611 -0.300 1.00 0.00 H new ATOM 0 HD3 PRO A 183 15.366 -5.668 -1.579 1.00 0.00 H new ATOM 808 N VAL A 184 10.590 -6.932 0.881 1.00 0.00 N ATOM 809 CA VAL A 184 9.561 -6.449 1.787 1.00 0.00 C ATOM 810 C VAL A 184 9.968 -6.765 3.228 1.00 0.00 C ATOM 811 O VAL A 184 9.629 -6.025 4.149 1.00 0.00 O ATOM 812 CB VAL A 184 8.205 -7.046 1.406 1.00 0.00 C ATOM 813 CG1 VAL A 184 7.202 -6.907 2.553 1.00 0.00 C ATOM 814 CG2 VAL A 184 7.665 -6.406 0.125 1.00 0.00 C ATOM 0 H VAL A 184 10.330 -7.757 0.341 1.00 0.00 H new ATOM 0 HA VAL A 184 9.459 -5.367 1.706 1.00 0.00 H new ATOM 0 HB VAL A 184 8.349 -8.109 1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 184 6.247 -7.339 2.255 1.00 0.00 H new ATOM 0 HG12 VAL A 184 7.579 -7.430 3.432 1.00 0.00 H new ATOM 0 HG13 VAL A 184 7.065 -5.852 2.790 1.00 0.00 H new ATOM 0 HG21 VAL A 184 6.700 -6.848 -0.124 1.00 0.00 H new ATOM 0 HG22 VAL A 184 7.544 -5.333 0.277 1.00 0.00 H new ATOM 0 HG23 VAL A 184 8.365 -6.580 -0.692 1.00 0.00 H new ATOM 824 N PRO A 185 10.711 -7.894 3.381 1.00 0.00 N ATOM 825 CA PRO A 185 11.169 -8.316 4.694 1.00 0.00 C ATOM 826 C PRO A 185 12.331 -7.446 5.176 1.00 0.00 C ATOM 827 O PRO A 185 12.761 -7.557 6.324 1.00 0.00 O ATOM 828 CB PRO A 185 11.552 -9.777 4.525 1.00 0.00 C ATOM 829 CG PRO A 185 11.735 -9.991 3.032 1.00 0.00 C ATOM 830 CD PRO A 185 11.132 -8.795 2.313 1.00 0.00 C ATOM 0 HA PRO A 185 10.404 -8.204 5.462 1.00 0.00 H new ATOM 0 HB2 PRO A 185 12.470 -10.005 5.067 1.00 0.00 H new ATOM 0 HB3 PRO A 185 10.776 -10.432 4.921 1.00 0.00 H new ATOM 0 HG2 PRO A 185 12.793 -10.090 2.787 1.00 0.00 H new ATOM 0 HG3 PRO A 185 11.247 -10.913 2.716 1.00 0.00 H new ATOM 0 HD2 PRO A 185 11.861 -8.319 1.657 1.00 0.00 H new ATOM 0 HD3 PRO A 185 10.288 -9.092 1.690 1.00 0.00 H new ATOM 838 N TYR A 186 12.806 -6.598 4.276 1.00 0.00 N ATOM 839 CA TYR A 186 13.910 -5.708 4.595 1.00 0.00 C ATOM 840 C TYR A 186 13.406 -4.297 4.904 1.00 0.00 C ATOM 841 O TYR A 186 14.016 -3.575 5.692 1.00 0.00 O ATOM 842 CB TYR A 186 14.788 -5.660 3.342 1.00 0.00 C ATOM 843 CG TYR A 186 16.020 -6.565 3.409 1.00 0.00 C ATOM 844 CD1 TYR A 186 15.903 -7.854 3.889 1.00 0.00 C ATOM 845 CD2 TYR A 186 17.246 -6.094 2.989 1.00 0.00 C ATOM 846 CE1 TYR A 186 17.061 -8.707 3.953 1.00 0.00 C ATOM 847 CE2 TYR A 186 18.405 -6.946 3.053 1.00 0.00 C ATOM 848 CZ TYR A 186 18.255 -8.210 3.531 1.00 0.00 C ATOM 849 OH TYR A 186 19.350 -9.016 3.591 1.00 0.00 O ATOM 0 H TYR A 186 12.447 -6.508 3.326 1.00 0.00 H new ATOM 0 HA TYR A 186 14.450 -6.066 5.471 1.00 0.00 H new ATOM 0 HB2 TYR A 186 14.187 -5.946 2.479 1.00 0.00 H new ATOM 0 HB3 TYR A 186 15.113 -4.633 3.178 1.00 0.00 H new ATOM 0 HD1 TYR A 186 14.942 -8.223 4.217 1.00 0.00 H new ATOM 0 HD2 TYR A 186 17.337 -5.086 2.612 1.00 0.00 H new ATOM 0 HE1 TYR A 186 16.984 -9.717 4.327 1.00 0.00 H new ATOM 0 HE2 TYR A 186 19.371 -6.589 2.729 1.00 0.00 H new ATOM 0 HH TYR A 186 20.133 -8.530 3.256 1.00 0.00 H new ATOM 859 N VAL A 187 12.297 -3.947 4.269 1.00 0.00 N ATOM 860 CA VAL A 187 11.703 -2.636 4.467 1.00 0.00 C ATOM 861 C VAL A 187 10.259 -2.802 4.943 1.00 0.00 C ATOM 862 O VAL A 187 9.732 -3.913 4.966 1.00 0.00 O ATOM 863 CB VAL A 187 11.820 -1.810 3.184 1.00 0.00 C ATOM 864 CG1 VAL A 187 13.112 -2.139 2.436 1.00 0.00 C ATOM 865 CG2 VAL A 187 10.598 -2.017 2.286 1.00 0.00 C ATOM 0 H VAL A 187 11.794 -4.549 3.617 1.00 0.00 H new ATOM 0 HA VAL A 187 12.238 -2.086 5.241 1.00 0.00 H new ATOM 0 HB VAL A 187 11.855 -0.757 3.465 1.00 0.00 H new ATOM 0 HG11 VAL A 187 13.170 -1.538 1.528 1.00 0.00 H new ATOM 0 HG12 VAL A 187 13.968 -1.917 3.073 1.00 0.00 H new ATOM 0 HG13 VAL A 187 13.121 -3.197 2.172 1.00 0.00 H new ATOM 0 HG21 VAL A 187 10.706 -1.419 1.381 1.00 0.00 H new ATOM 0 HG22 VAL A 187 10.518 -3.070 2.017 1.00 0.00 H new ATOM 0 HG23 VAL A 187 9.698 -1.709 2.819 1.00 0.00 H new ATOM 875 N GLU A 188 9.659 -1.679 5.311 1.00 0.00 N ATOM 876 CA GLU A 188 8.285 -1.685 5.785 1.00 0.00 C ATOM 877 C GLU A 188 7.432 -0.728 4.951 1.00 0.00 C ATOM 878 O GLU A 188 7.791 -0.390 3.824 1.00 0.00 O ATOM 879 CB GLU A 188 8.216 -1.329 7.271 1.00 0.00 C ATOM 880 CG GLU A 188 9.535 -1.656 7.975 1.00 0.00 C ATOM 881 CD GLU A 188 9.353 -1.689 9.494 1.00 0.00 C ATOM 882 OE1 GLU A 188 8.902 -0.655 10.034 1.00 0.00 O ATOM 883 OE2 GLU A 188 9.667 -2.747 10.080 1.00 0.00 O ATOM 0 H GLU A 188 10.099 -0.759 5.290 1.00 0.00 H new ATOM 0 HA GLU A 188 7.885 -2.692 5.668 1.00 0.00 H new ATOM 0 HB2 GLU A 188 7.992 -0.268 7.384 1.00 0.00 H new ATOM 0 HB3 GLU A 188 7.402 -1.879 7.743 1.00 0.00 H new ATOM 0 HG2 GLU A 188 9.907 -2.620 7.629 1.00 0.00 H new ATOM 0 HG3 GLU A 188 10.286 -0.912 7.711 1.00 0.00 H new ATOM 890 N LYS A 189 6.317 -0.316 5.539 1.00 0.00 N ATOM 891 CA LYS A 189 5.409 0.596 4.864 1.00 0.00 C ATOM 892 C LYS A 189 5.304 1.892 5.669 1.00 0.00 C ATOM 893 O LYS A 189 5.067 1.861 6.875 1.00 0.00 O ATOM 894 CB LYS A 189 4.061 -0.080 4.610 1.00 0.00 C ATOM 895 CG LYS A 189 3.476 0.351 3.263 1.00 0.00 C ATOM 896 CD LYS A 189 3.579 -0.776 2.235 1.00 0.00 C ATOM 897 CE LYS A 189 2.296 -0.882 1.407 1.00 0.00 C ATOM 898 NZ LYS A 189 1.779 -2.269 1.426 1.00 0.00 N ATOM 0 H LYS A 189 6.023 -0.597 6.474 1.00 0.00 H new ATOM 0 HA LYS A 189 5.797 0.861 3.880 1.00 0.00 H new ATOM 0 HB2 LYS A 189 4.184 -1.163 4.627 1.00 0.00 H new ATOM 0 HB3 LYS A 189 3.366 0.174 5.410 1.00 0.00 H new ATOM 0 HG2 LYS A 189 2.432 0.637 3.391 1.00 0.00 H new ATOM 0 HG3 LYS A 189 4.005 1.231 2.897 1.00 0.00 H new ATOM 0 HD2 LYS A 189 4.428 -0.595 1.576 1.00 0.00 H new ATOM 0 HD3 LYS A 189 3.767 -1.721 2.744 1.00 0.00 H new ATOM 0 HE2 LYS A 189 1.543 -0.202 1.804 1.00 0.00 H new ATOM 0 HE3 LYS A 189 2.493 -0.575 0.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 0.781 -2.271 1.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 2.333 -2.855 0.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 1.859 -2.656 2.388 1.00 0.00 H new ATOM 912 N TYR A 190 5.488 3.003 4.969 1.00 0.00 N ATOM 913 CA TYR A 190 5.418 4.308 5.604 1.00 0.00 C ATOM 914 C TYR A 190 4.215 5.103 5.091 1.00 0.00 C ATOM 915 O TYR A 190 4.122 5.395 3.900 1.00 0.00 O ATOM 916 CB TYR A 190 6.703 5.039 5.210 1.00 0.00 C ATOM 917 CG TYR A 190 6.678 6.541 5.500 1.00 0.00 C ATOM 918 CD1 TYR A 190 6.298 6.998 6.746 1.00 0.00 C ATOM 919 CD2 TYR A 190 7.036 7.439 4.516 1.00 0.00 C ATOM 920 CE1 TYR A 190 6.275 8.411 7.018 1.00 0.00 C ATOM 921 CE2 TYR A 190 7.014 8.853 4.788 1.00 0.00 C ATOM 922 CZ TYR A 190 6.634 9.269 6.026 1.00 0.00 C ATOM 923 OH TYR A 190 6.613 10.605 6.284 1.00 0.00 O ATOM 0 H TYR A 190 5.685 3.026 3.969 1.00 0.00 H new ATOM 0 HA TYR A 190 5.311 4.204 6.684 1.00 0.00 H new ATOM 0 HB2 TYR A 190 7.542 4.590 5.742 1.00 0.00 H new ATOM 0 HB3 TYR A 190 6.883 4.888 4.146 1.00 0.00 H new ATOM 0 HD1 TYR A 190 6.018 6.295 7.517 1.00 0.00 H new ATOM 0 HD2 TYR A 190 7.333 7.081 3.541 1.00 0.00 H new ATOM 0 HE1 TYR A 190 5.979 8.782 7.988 1.00 0.00 H new ATOM 0 HE2 TYR A 190 7.293 9.567 4.027 1.00 0.00 H new ATOM 0 HH TYR A 190 6.894 11.097 5.485 1.00 0.00 H new ATOM 933 N GLY A 191 3.324 5.431 6.015 1.00 0.00 N ATOM 934 CA GLY A 191 2.133 6.187 5.671 1.00 0.00 C ATOM 935 C GLY A 191 2.464 7.664 5.449 1.00 0.00 C ATOM 936 O GLY A 191 2.728 8.394 6.403 1.00 0.00 O ATOM 0 H GLY A 191 3.404 5.187 7.002 1.00 0.00 H new ATOM 0 HA2 GLY A 191 1.683 5.772 4.769 1.00 0.00 H new ATOM 0 HA3 GLY A 191 1.395 6.092 6.468 1.00 0.00 H new TER 940 GLY A 191