USER MOD reduce.3.24.130724 H: found=0, std=0, add=477, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 480 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 153 HIS : no HD1:sc= -1.67 K(o=-1.7,f=-0.49) USER MOD Single : A 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 156 THR OG1 : rot -160:sc= -0.0225 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 GLN : amide:sc= -1.69 K(o=-1.7,f=-2.5) USER MOD Single : A 166 ASN : amide:sc= -0.248 K(o=-0.25,f=-1.4!) USER MOD Single : A 168 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 170 SER OG : rot 180:sc= 0 USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 THR OG1 : rot -85:sc= 0.318 USER MOD Single : A 185 ASN : amide:sc= -2.39! C(o=-2.4!,f=-6.1!) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.0041) USER MOD Single : A 195 GLN : amide:sc= -2.24 X(o=-2.2,f=-1.8) USER MOD Single : A 197 ASN : amide:sc= -0.176 K(o=-0.18,f=-2!) USER MOD Single : A 198 ASN : amide:sc= -1.9 K(o=-1.9,f=-3.8!) USER MOD Single : A 205 SER OG : rot -145:sc= 0.531 USER MOD Single : A 206 ASN : amide:sc= -0.461 K(o=-0.46,f=-3.1!) USER MOD Single : A 207 TYR OH : rot 180:sc= 0 USER MOD Single : A 211 TYR OH : rot 180:sc= 0 USER MOD Single : A 212 ASN : amide:sc= -0.696 K(o=-0.7,f=-0.13) USER MOD Single : A 213 SER OG : rot 140:sc= -2.04 USER MOD Single : A 214 ASN : amide:sc= -0.166 K(o=-0.17,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 153 -13.062 14.442 4.956 1.00 0.00 N ATOM 2 CA HIS A 153 -13.015 14.951 3.559 1.00 0.00 C ATOM 3 C HIS A 153 -11.984 14.190 2.730 1.00 0.00 C ATOM 4 O HIS A 153 -11.279 14.777 1.909 1.00 0.00 O ATOM 5 CB HIS A 153 -12.670 16.442 3.594 1.00 0.00 C ATOM 6 CG HIS A 153 -11.321 16.731 4.177 1.00 0.00 C ATOM 7 ND1 HIS A 153 -10.875 18.009 4.443 1.00 0.00 N ATOM 8 CD2 HIS A 153 -10.317 15.902 4.545 1.00 0.00 C ATOM 9 CE1 HIS A 153 -9.656 17.953 4.948 1.00 0.00 C ATOM 10 NE2 HIS A 153 -9.295 16.684 5.021 1.00 0.00 N ATOM 0 HA HIS A 153 -13.988 14.802 3.090 1.00 0.00 H new ATOM 0 HB2 HIS A 153 -12.711 16.840 2.580 1.00 0.00 H new ATOM 0 HB3 HIS A 153 -13.428 16.968 4.174 1.00 0.00 H new ATOM 0 HD2 HIS A 153 -10.320 14.824 4.477 1.00 0.00 H new ATOM 0 HE1 HIS A 153 -9.057 18.799 5.250 1.00 0.00 H new ATOM 0 HE2 HIS A 153 -8.401 16.341 5.374 1.00 0.00 H new ATOM 21 N MET A 154 -11.904 12.883 2.951 1.00 0.00 N ATOM 22 CA MET A 154 -10.959 12.042 2.225 1.00 0.00 C ATOM 23 C MET A 154 -11.649 10.794 1.682 1.00 0.00 C ATOM 24 O MET A 154 -12.791 10.503 2.032 1.00 0.00 O ATOM 25 CB MET A 154 -9.795 11.643 3.133 1.00 0.00 C ATOM 26 CG MET A 154 -8.674 12.667 3.171 1.00 0.00 C ATOM 27 SD MET A 154 -7.430 12.288 4.420 1.00 0.00 S ATOM 28 CE MET A 154 -6.414 13.762 4.343 1.00 0.00 C ATOM 0 H MET A 154 -12.482 12.383 3.627 1.00 0.00 H new ATOM 0 HA MET A 154 -10.571 12.616 1.384 1.00 0.00 H new ATOM 0 HB2 MET A 154 -10.170 11.490 4.145 1.00 0.00 H new ATOM 0 HB3 MET A 154 -9.392 10.688 2.795 1.00 0.00 H new ATOM 0 HG2 MET A 154 -8.197 12.715 2.192 1.00 0.00 H new ATOM 0 HG3 MET A 154 -9.094 13.653 3.370 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.598 13.679 5.061 1.00 0.00 H new ATOM 0 HE2 MET A 154 -6.005 13.870 3.339 1.00 0.00 H new ATOM 0 HE3 MET A 154 -7.021 14.635 4.583 1.00 0.00 H new ATOM 38 N GLU A 155 -10.944 10.061 0.826 1.00 0.00 N ATOM 39 CA GLU A 155 -11.488 8.842 0.235 1.00 0.00 C ATOM 40 C GLU A 155 -10.378 7.838 -0.057 1.00 0.00 C ATOM 41 O GLU A 155 -9.212 8.078 0.254 1.00 0.00 O ATOM 42 CB GLU A 155 -12.247 9.171 -1.051 1.00 0.00 C ATOM 43 CG GLU A 155 -13.718 9.483 -0.828 1.00 0.00 C ATOM 44 CD GLU A 155 -14.205 10.635 -1.685 1.00 0.00 C ATOM 45 OE1 GLU A 155 -13.471 11.639 -1.802 1.00 0.00 O ATOM 46 OE2 GLU A 155 -15.321 10.533 -2.239 1.00 0.00 O ATOM 0 H GLU A 155 -9.996 10.289 0.526 1.00 0.00 H new ATOM 0 HA GLU A 155 -12.177 8.395 0.951 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -11.773 10.025 -1.534 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -12.163 8.329 -1.738 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -14.311 8.595 -1.047 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -13.880 9.723 0.223 1.00 0.00 H new ATOM 53 N THR A 156 -10.750 6.712 -0.655 1.00 0.00 N ATOM 54 CA THR A 156 -9.788 5.669 -0.989 1.00 0.00 C ATOM 55 C THR A 156 -8.852 6.129 -2.103 1.00 0.00 C ATOM 56 O THR A 156 -9.260 6.854 -3.010 1.00 0.00 O ATOM 57 CB THR A 156 -10.513 4.390 -1.412 1.00 0.00 C ATOM 58 OG1 THR A 156 -9.602 3.454 -1.957 1.00 0.00 O ATOM 59 CG2 THR A 156 -11.594 4.631 -2.443 1.00 0.00 C ATOM 0 H THR A 156 -11.712 6.498 -0.919 1.00 0.00 H new ATOM 0 HA THR A 156 -9.193 5.462 -0.100 1.00 0.00 H new ATOM 0 HB THR A 156 -10.977 4.006 -0.503 1.00 0.00 H new ATOM 0 HG1 THR A 156 -10.090 2.800 -2.499 1.00 0.00 H new ATOM 0 HG21 THR A 156 -12.069 3.684 -2.700 1.00 0.00 H new ATOM 0 HG22 THR A 156 -12.340 5.313 -2.035 1.00 0.00 H new ATOM 0 HG23 THR A 156 -11.152 5.070 -3.338 1.00 0.00 H new ATOM 67 N LYS A 157 -7.596 5.702 -2.029 1.00 0.00 N ATOM 68 CA LYS A 157 -6.602 6.072 -3.029 1.00 0.00 C ATOM 69 C LYS A 157 -5.791 4.855 -3.464 1.00 0.00 C ATOM 70 O LYS A 157 -5.154 4.196 -2.644 1.00 0.00 O ATOM 71 CB LYS A 157 -5.670 7.150 -2.481 1.00 0.00 C ATOM 72 CG LYS A 157 -6.184 8.564 -2.691 1.00 0.00 C ATOM 73 CD LYS A 157 -5.521 9.547 -1.739 1.00 0.00 C ATOM 74 CE LYS A 157 -5.619 10.974 -2.254 1.00 0.00 C ATOM 75 NZ LYS A 157 -6.952 11.576 -1.972 1.00 0.00 N ATOM 0 H LYS A 157 -7.242 5.099 -1.286 1.00 0.00 H new ATOM 0 HA LYS A 157 -7.128 6.467 -3.898 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -5.521 6.981 -1.414 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -4.695 7.052 -2.958 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -5.997 8.871 -3.720 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -7.264 8.585 -2.543 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -5.992 9.480 -0.759 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -4.473 9.278 -1.608 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -4.841 11.581 -1.791 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -5.435 10.986 -3.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -6.978 12.549 -2.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -7.693 11.011 -2.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -7.117 11.589 -0.945 1.00 0.00 H new ATOM 89 N PHE A 158 -5.819 4.564 -4.760 1.00 0.00 N ATOM 90 CA PHE A 158 -5.086 3.426 -5.304 1.00 0.00 C ATOM 91 C PHE A 158 -3.642 3.808 -5.619 1.00 0.00 C ATOM 92 O PHE A 158 -3.386 4.828 -6.259 1.00 0.00 O ATOM 93 CB PHE A 158 -5.774 2.906 -6.568 1.00 0.00 C ATOM 94 CG PHE A 158 -7.177 2.423 -6.332 1.00 0.00 C ATOM 95 CD1 PHE A 158 -8.244 3.305 -6.381 1.00 0.00 C ATOM 96 CD2 PHE A 158 -7.427 1.087 -6.063 1.00 0.00 C ATOM 97 CE1 PHE A 158 -9.537 2.864 -6.164 1.00 0.00 C ATOM 98 CE2 PHE A 158 -8.716 0.640 -5.845 1.00 0.00 C ATOM 99 CZ PHE A 158 -9.772 1.529 -5.895 1.00 0.00 C ATOM 0 H PHE A 158 -6.341 5.100 -5.453 1.00 0.00 H new ATOM 0 HA PHE A 158 -5.079 2.638 -4.551 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -5.792 3.700 -7.315 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -5.183 2.090 -6.984 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -8.064 4.349 -6.591 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -6.605 0.387 -6.023 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -10.361 3.561 -6.205 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -8.898 -0.404 -5.636 1.00 0.00 H new ATOM 0 HZ PHE A 158 -10.780 1.181 -5.724 1.00 0.00 H new ATOM 109 N VAL A 159 -2.705 2.984 -5.164 1.00 0.00 N ATOM 110 CA VAL A 159 -1.288 3.236 -5.396 1.00 0.00 C ATOM 111 C VAL A 159 -0.615 2.030 -6.043 1.00 0.00 C ATOM 112 O VAL A 159 -1.100 0.904 -5.936 1.00 0.00 O ATOM 113 CB VAL A 159 -0.552 3.575 -4.088 1.00 0.00 C ATOM 114 CG1 VAL A 159 -0.861 5.001 -3.657 1.00 0.00 C ATOM 115 CG2 VAL A 159 -0.925 2.589 -2.991 1.00 0.00 C ATOM 0 H VAL A 159 -2.901 2.136 -4.632 1.00 0.00 H new ATOM 0 HA VAL A 159 -1.228 4.091 -6.069 1.00 0.00 H new ATOM 0 HB VAL A 159 0.520 3.495 -4.266 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -0.332 5.224 -2.730 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -0.539 5.694 -4.434 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -1.934 5.108 -3.497 1.00 0.00 H new ATOM 0 HG21 VAL A 159 -0.394 2.846 -2.075 1.00 0.00 H new ATOM 0 HG22 VAL A 159 -1.999 2.633 -2.812 1.00 0.00 H new ATOM 0 HG23 VAL A 159 -0.649 1.580 -3.299 1.00 0.00 H new ATOM 125 N GLN A 160 0.507 2.276 -6.709 1.00 0.00 N ATOM 126 CA GLN A 160 1.251 1.210 -7.370 1.00 0.00 C ATOM 127 C GLN A 160 2.618 1.022 -6.717 1.00 0.00 C ATOM 128 O GLN A 160 3.412 1.959 -6.635 1.00 0.00 O ATOM 129 CB GLN A 160 1.422 1.523 -8.858 1.00 0.00 C ATOM 130 CG GLN A 160 1.302 0.300 -9.754 1.00 0.00 C ATOM 131 CD GLN A 160 2.258 0.343 -10.931 1.00 0.00 C ATOM 132 OE1 GLN A 160 3.438 0.659 -10.776 1.00 0.00 O ATOM 133 NE2 GLN A 160 1.752 0.027 -12.116 1.00 0.00 N ATOM 0 H GLN A 160 0.921 3.203 -6.806 1.00 0.00 H new ATOM 0 HA GLN A 160 0.685 0.284 -7.266 1.00 0.00 H new ATOM 0 HB2 GLN A 160 0.672 2.256 -9.155 1.00 0.00 H new ATOM 0 HB3 GLN A 160 2.397 1.984 -9.014 1.00 0.00 H new ATOM 0 HG2 GLN A 160 1.496 -0.597 -9.166 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.279 0.224 -10.124 1.00 0.00 H new ATOM 0 HE21 GLN A 160 0.768 -0.229 -12.199 1.00 0.00 H new ATOM 0 HE22 GLN A 160 2.347 0.040 -12.944 1.00 0.00 H new ATOM 142 N ALA A 161 2.879 -0.192 -6.248 1.00 0.00 N ATOM 143 CA ALA A 161 4.140 -0.507 -5.594 1.00 0.00 C ATOM 144 C ALA A 161 5.297 -0.515 -6.583 1.00 0.00 C ATOM 145 O ALA A 161 5.102 -0.688 -7.786 1.00 0.00 O ATOM 146 CB ALA A 161 4.041 -1.852 -4.893 1.00 0.00 C ATOM 0 H ALA A 161 2.230 -0.977 -6.310 1.00 0.00 H new ATOM 0 HA ALA A 161 4.338 0.271 -4.857 1.00 0.00 H new ATOM 0 HB1 ALA A 161 4.989 -2.079 -4.406 1.00 0.00 H new ATOM 0 HB2 ALA A 161 3.249 -1.815 -4.145 1.00 0.00 H new ATOM 0 HB3 ALA A 161 3.813 -2.628 -5.624 1.00 0.00 H new ATOM 152 N LEU A 162 6.508 -0.335 -6.065 1.00 0.00 N ATOM 153 CA LEU A 162 7.706 -0.334 -6.897 1.00 0.00 C ATOM 154 C LEU A 162 8.736 -1.332 -6.368 1.00 0.00 C ATOM 155 O LEU A 162 9.916 -1.259 -6.711 1.00 0.00 O ATOM 156 CB LEU A 162 8.320 1.064 -6.956 1.00 0.00 C ATOM 157 CG LEU A 162 8.354 1.807 -5.622 1.00 0.00 C ATOM 158 CD1 LEU A 162 9.775 2.219 -5.269 1.00 0.00 C ATOM 159 CD2 LEU A 162 7.439 3.022 -5.664 1.00 0.00 C ATOM 0 H LEU A 162 6.686 -0.188 -5.071 1.00 0.00 H new ATOM 0 HA LEU A 162 7.414 -0.634 -7.904 1.00 0.00 H new ATOM 0 HB2 LEU A 162 9.338 0.982 -7.336 1.00 0.00 H new ATOM 0 HB3 LEU A 162 7.759 1.662 -7.674 1.00 0.00 H new ATOM 0 HG LEU A 162 7.994 1.131 -4.846 1.00 0.00 H new ATOM 0 HD11 LEU A 162 9.775 2.747 -4.315 1.00 0.00 H new ATOM 0 HD12 LEU A 162 10.403 1.331 -5.192 1.00 0.00 H new ATOM 0 HD13 LEU A 162 10.167 2.875 -6.046 1.00 0.00 H new ATOM 0 HD21 LEU A 162 7.476 3.539 -4.705 1.00 0.00 H new ATOM 0 HD22 LEU A 162 7.768 3.698 -6.453 1.00 0.00 H new ATOM 0 HD23 LEU A 162 6.417 2.701 -5.864 1.00 0.00 H new ATOM 171 N PHE A 163 8.280 -2.263 -5.531 1.00 0.00 N ATOM 172 CA PHE A 163 9.160 -3.273 -4.957 1.00 0.00 C ATOM 173 C PHE A 163 8.348 -4.348 -4.238 1.00 0.00 C ATOM 174 O PHE A 163 7.361 -4.047 -3.565 1.00 0.00 O ATOM 175 CB PHE A 163 10.151 -2.629 -3.986 1.00 0.00 C ATOM 176 CG PHE A 163 11.573 -3.061 -4.206 1.00 0.00 C ATOM 177 CD1 PHE A 163 12.005 -4.306 -3.778 1.00 0.00 C ATOM 178 CD2 PHE A 163 12.476 -2.222 -4.840 1.00 0.00 C ATOM 179 CE1 PHE A 163 13.314 -4.707 -3.979 1.00 0.00 C ATOM 180 CE2 PHE A 163 13.784 -2.619 -5.043 1.00 0.00 C ATOM 181 CZ PHE A 163 14.204 -3.863 -4.611 1.00 0.00 C ATOM 0 H PHE A 163 7.306 -2.337 -5.237 1.00 0.00 H new ATOM 0 HA PHE A 163 9.716 -3.741 -5.769 1.00 0.00 H new ATOM 0 HB2 PHE A 163 10.090 -1.545 -4.083 1.00 0.00 H new ATOM 0 HB3 PHE A 163 9.859 -2.875 -2.965 1.00 0.00 H new ATOM 0 HD1 PHE A 163 11.313 -4.970 -3.282 1.00 0.00 H new ATOM 0 HD2 PHE A 163 12.154 -1.248 -5.179 1.00 0.00 H new ATOM 0 HE1 PHE A 163 13.639 -5.680 -3.641 1.00 0.00 H new ATOM 0 HE2 PHE A 163 14.478 -1.957 -5.539 1.00 0.00 H new ATOM 0 HZ PHE A 163 15.226 -4.174 -4.768 1.00 0.00 H new ATOM 191 N ASP A 164 8.767 -5.601 -4.383 1.00 0.00 N ATOM 192 CA ASP A 164 8.077 -6.716 -3.745 1.00 0.00 C ATOM 193 C ASP A 164 8.269 -6.684 -2.233 1.00 0.00 C ATOM 194 O ASP A 164 9.344 -6.341 -1.741 1.00 0.00 O ATOM 195 CB ASP A 164 8.586 -8.045 -4.307 1.00 0.00 C ATOM 196 CG ASP A 164 8.331 -8.180 -5.797 1.00 0.00 C ATOM 197 OD1 ASP A 164 8.436 -7.161 -6.511 1.00 0.00 O ATOM 198 OD2 ASP A 164 8.028 -9.304 -6.247 1.00 0.00 O ATOM 0 H ASP A 164 9.581 -5.869 -4.936 1.00 0.00 H new ATOM 0 HA ASP A 164 7.012 -6.621 -3.959 1.00 0.00 H new ATOM 0 HB2 ASP A 164 9.655 -8.131 -4.115 1.00 0.00 H new ATOM 0 HB3 ASP A 164 8.100 -8.868 -3.782 1.00 0.00 H new ATOM 203 N PHE A 165 7.219 -7.041 -1.499 1.00 0.00 N ATOM 204 CA PHE A 165 7.276 -7.052 -0.042 1.00 0.00 C ATOM 205 C PHE A 165 6.650 -8.324 0.520 1.00 0.00 C ATOM 206 O PHE A 165 5.437 -8.518 0.442 1.00 0.00 O ATOM 207 CB PHE A 165 6.558 -5.826 0.525 1.00 0.00 C ATOM 208 CG PHE A 165 6.957 -5.497 1.936 1.00 0.00 C ATOM 209 CD1 PHE A 165 8.188 -4.924 2.205 1.00 0.00 C ATOM 210 CD2 PHE A 165 6.098 -5.761 2.990 1.00 0.00 C ATOM 211 CE1 PHE A 165 8.557 -4.621 3.502 1.00 0.00 C ATOM 212 CE2 PHE A 165 6.461 -5.459 4.289 1.00 0.00 C ATOM 213 CZ PHE A 165 7.693 -4.888 4.545 1.00 0.00 C ATOM 0 H PHE A 165 6.321 -7.326 -1.889 1.00 0.00 H new ATOM 0 HA PHE A 165 8.324 -7.023 0.255 1.00 0.00 H new ATOM 0 HB2 PHE A 165 6.765 -4.966 -0.113 1.00 0.00 H new ATOM 0 HB3 PHE A 165 5.482 -5.997 0.490 1.00 0.00 H new ATOM 0 HD1 PHE A 165 8.867 -4.711 1.393 1.00 0.00 H new ATOM 0 HD2 PHE A 165 5.134 -6.208 2.795 1.00 0.00 H new ATOM 0 HE1 PHE A 165 9.521 -4.176 3.699 1.00 0.00 H new ATOM 0 HE2 PHE A 165 5.783 -5.669 5.103 1.00 0.00 H new ATOM 0 HZ PHE A 165 7.979 -4.651 5.559 1.00 0.00 H new ATOM 223 N ASN A 166 7.487 -9.187 1.087 1.00 0.00 N ATOM 224 CA ASN A 166 7.017 -10.441 1.666 1.00 0.00 C ATOM 225 C ASN A 166 7.134 -10.412 3.188 1.00 0.00 C ATOM 226 O ASN A 166 8.097 -10.926 3.755 1.00 0.00 O ATOM 227 CB ASN A 166 7.818 -11.616 1.103 1.00 0.00 C ATOM 228 CG ASN A 166 7.128 -12.271 -0.079 1.00 0.00 C ATOM 229 OD1 ASN A 166 5.900 -12.324 -0.145 1.00 0.00 O ATOM 230 ND2 ASN A 166 7.919 -12.772 -1.020 1.00 0.00 N ATOM 0 H ASN A 166 8.494 -9.041 1.158 1.00 0.00 H new ATOM 0 HA ASN A 166 5.967 -10.566 1.402 1.00 0.00 H new ATOM 0 HB2 ASN A 166 8.804 -11.267 0.797 1.00 0.00 H new ATOM 0 HB3 ASN A 166 7.971 -12.357 1.887 1.00 0.00 H new ATOM 0 HD21 ASN A 166 7.514 -13.224 -1.840 1.00 0.00 H new ATOM 0 HD22 ASN A 166 8.932 -12.705 -0.923 1.00 0.00 H new ATOM 237 N PRO A 167 6.148 -9.804 3.872 1.00 0.00 N ATOM 238 CA PRO A 167 6.145 -9.708 5.332 1.00 0.00 C ATOM 239 C PRO A 167 5.733 -11.015 5.997 1.00 0.00 C ATOM 240 O PRO A 167 4.589 -11.452 5.876 1.00 0.00 O ATOM 241 CB PRO A 167 5.110 -8.620 5.605 1.00 0.00 C ATOM 242 CG PRO A 167 4.161 -8.703 4.459 1.00 0.00 C ATOM 243 CD PRO A 167 4.962 -9.162 3.273 1.00 0.00 C ATOM 0 HA PRO A 167 7.135 -9.488 5.732 1.00 0.00 H new ATOM 0 HB2 PRO A 167 4.600 -8.788 6.554 1.00 0.00 H new ATOM 0 HB3 PRO A 167 5.576 -7.636 5.663 1.00 0.00 H new ATOM 0 HG2 PRO A 167 3.353 -9.402 4.675 1.00 0.00 H new ATOM 0 HG3 PRO A 167 3.702 -7.734 4.265 1.00 0.00 H new ATOM 0 HD2 PRO A 167 4.398 -9.862 2.657 1.00 0.00 H new ATOM 0 HD3 PRO A 167 5.241 -8.326 2.632 1.00 0.00 H new ATOM 251 N GLN A 168 6.674 -11.633 6.703 1.00 0.00 N ATOM 252 CA GLN A 168 6.411 -12.890 7.393 1.00 0.00 C ATOM 253 C GLN A 168 5.611 -12.653 8.671 1.00 0.00 C ATOM 254 O GLN A 168 4.873 -13.528 9.125 1.00 0.00 O ATOM 255 CB GLN A 168 7.725 -13.600 7.724 1.00 0.00 C ATOM 256 CG GLN A 168 7.545 -15.049 8.145 1.00 0.00 C ATOM 257 CD GLN A 168 8.837 -15.839 8.084 1.00 0.00 C ATOM 258 OE1 GLN A 168 9.913 -15.275 7.883 1.00 0.00 O ATOM 259 NE2 GLN A 168 8.740 -17.151 8.257 1.00 0.00 N ATOM 0 H GLN A 168 7.626 -11.283 6.812 1.00 0.00 H new ATOM 0 HA GLN A 168 5.822 -13.523 6.729 1.00 0.00 H new ATOM 0 HB2 GLN A 168 8.378 -13.562 6.852 1.00 0.00 H new ATOM 0 HB3 GLN A 168 8.229 -13.058 8.524 1.00 0.00 H new ATOM 0 HG2 GLN A 168 7.151 -15.082 9.161 1.00 0.00 H new ATOM 0 HG3 GLN A 168 6.804 -15.521 7.500 1.00 0.00 H new ATOM 0 HE21 GLN A 168 7.828 -17.578 8.421 1.00 0.00 H new ATOM 0 HE22 GLN A 168 9.577 -17.733 8.226 1.00 0.00 H new ATOM 268 N GLU A 169 5.763 -11.463 9.246 1.00 0.00 N ATOM 269 CA GLU A 169 5.054 -11.111 10.470 1.00 0.00 C ATOM 270 C GLU A 169 3.659 -10.580 10.157 1.00 0.00 C ATOM 271 O GLU A 169 3.340 -10.291 9.004 1.00 0.00 O ATOM 272 CB GLU A 169 5.845 -10.067 11.260 1.00 0.00 C ATOM 273 CG GLU A 169 7.307 -10.431 11.455 1.00 0.00 C ATOM 274 CD GLU A 169 8.217 -9.217 11.439 1.00 0.00 C ATOM 275 OE1 GLU A 169 8.077 -8.359 12.335 1.00 0.00 O ATOM 276 OE2 GLU A 169 9.069 -9.126 10.531 1.00 0.00 O ATOM 0 H GLU A 169 6.370 -10.728 8.884 1.00 0.00 H new ATOM 0 HA GLU A 169 4.952 -12.013 11.074 1.00 0.00 H new ATOM 0 HB2 GLU A 169 5.784 -9.109 10.743 1.00 0.00 H new ATOM 0 HB3 GLU A 169 5.379 -9.933 12.236 1.00 0.00 H new ATOM 0 HG2 GLU A 169 7.424 -10.956 12.403 1.00 0.00 H new ATOM 0 HG3 GLU A 169 7.614 -11.121 10.669 1.00 0.00 H new ATOM 283 N SER A 170 2.833 -10.454 11.190 1.00 0.00 N ATOM 284 CA SER A 170 1.473 -9.957 11.023 1.00 0.00 C ATOM 285 C SER A 170 1.425 -8.441 11.168 1.00 0.00 C ATOM 286 O SER A 170 2.212 -7.851 11.908 1.00 0.00 O ATOM 287 CB SER A 170 0.540 -10.609 12.047 1.00 0.00 C ATOM 288 OG SER A 170 0.696 -10.020 13.326 1.00 0.00 O ATOM 0 H SER A 170 3.082 -10.689 12.151 1.00 0.00 H new ATOM 0 HA SER A 170 1.139 -10.218 10.019 1.00 0.00 H new ATOM 0 HB2 SER A 170 -0.494 -10.505 11.719 1.00 0.00 H new ATOM 0 HB3 SER A 170 0.750 -11.677 12.107 1.00 0.00 H new ATOM 0 HG SER A 170 0.088 -10.452 13.962 1.00 0.00 H new ATOM 294 N GLY A 171 0.495 -7.814 10.453 1.00 0.00 N ATOM 295 CA GLY A 171 0.361 -6.371 10.513 1.00 0.00 C ATOM 296 C GLY A 171 0.770 -5.699 9.219 1.00 0.00 C ATOM 297 O GLY A 171 0.184 -4.692 8.822 1.00 0.00 O ATOM 0 H GLY A 171 -0.168 -8.280 9.834 1.00 0.00 H new ATOM 0 HA2 GLY A 171 -0.673 -6.114 10.742 1.00 0.00 H new ATOM 0 HA3 GLY A 171 0.973 -5.986 11.329 1.00 0.00 H new ATOM 301 N GLU A 172 1.777 -6.258 8.558 1.00 0.00 N ATOM 302 CA GLU A 172 2.265 -5.707 7.299 1.00 0.00 C ATOM 303 C GLU A 172 1.543 -6.340 6.116 1.00 0.00 C ATOM 304 O GLU A 172 1.318 -7.552 6.090 1.00 0.00 O ATOM 305 CB GLU A 172 3.773 -5.926 7.173 1.00 0.00 C ATOM 306 CG GLU A 172 4.597 -4.933 7.976 1.00 0.00 C ATOM 307 CD GLU A 172 6.029 -4.833 7.489 1.00 0.00 C ATOM 308 OE1 GLU A 172 6.800 -5.789 7.713 1.00 0.00 O ATOM 309 OE2 GLU A 172 6.379 -3.799 6.881 1.00 0.00 O ATOM 0 H GLU A 172 2.272 -7.093 8.873 1.00 0.00 H new ATOM 0 HA GLU A 172 2.062 -4.636 7.294 1.00 0.00 H new ATOM 0 HB2 GLU A 172 4.014 -6.937 7.502 1.00 0.00 H new ATOM 0 HB3 GLU A 172 4.056 -5.856 6.123 1.00 0.00 H new ATOM 0 HG2 GLU A 172 4.129 -3.950 7.921 1.00 0.00 H new ATOM 0 HG3 GLU A 172 4.594 -5.229 9.025 1.00 0.00 H new ATOM 316 N LEU A 173 1.172 -5.515 5.142 1.00 0.00 N ATOM 317 CA LEU A 173 0.466 -6.001 3.963 1.00 0.00 C ATOM 318 C LEU A 173 1.434 -6.639 2.968 1.00 0.00 C ATOM 319 O LEU A 173 2.596 -6.239 2.875 1.00 0.00 O ATOM 320 CB LEU A 173 -0.327 -4.854 3.309 1.00 0.00 C ATOM 321 CG LEU A 173 -0.126 -4.654 1.803 1.00 0.00 C ATOM 322 CD1 LEU A 173 -0.955 -5.662 1.020 1.00 0.00 C ATOM 323 CD2 LEU A 173 -0.492 -3.232 1.402 1.00 0.00 C ATOM 0 H LEU A 173 1.348 -4.510 5.146 1.00 0.00 H new ATOM 0 HA LEU A 173 -0.238 -6.772 4.275 1.00 0.00 H new ATOM 0 HB2 LEU A 173 -1.388 -5.026 3.492 1.00 0.00 H new ATOM 0 HB3 LEU A 173 -0.063 -3.925 3.815 1.00 0.00 H new ATOM 0 HG LEU A 173 0.926 -4.816 1.568 1.00 0.00 H new ATOM 0 HD11 LEU A 173 -0.802 -5.508 -0.048 1.00 0.00 H new ATOM 0 HD12 LEU A 173 -0.647 -6.673 1.288 1.00 0.00 H new ATOM 0 HD13 LEU A 173 -2.010 -5.529 1.258 1.00 0.00 H new ATOM 0 HD21 LEU A 173 -0.344 -3.107 0.329 1.00 0.00 H new ATOM 0 HD22 LEU A 173 -1.537 -3.042 1.648 1.00 0.00 H new ATOM 0 HD23 LEU A 173 0.142 -2.528 1.941 1.00 0.00 H new ATOM 335 N ALA A 174 0.948 -7.624 2.220 1.00 0.00 N ATOM 336 CA ALA A 174 1.769 -8.307 1.226 1.00 0.00 C ATOM 337 C ALA A 174 1.490 -7.757 -0.168 1.00 0.00 C ATOM 338 O ALA A 174 0.396 -7.931 -0.705 1.00 0.00 O ATOM 339 CB ALA A 174 1.515 -9.805 1.269 1.00 0.00 C ATOM 0 H ALA A 174 -0.010 -7.967 2.283 1.00 0.00 H new ATOM 0 HA ALA A 174 2.818 -8.127 1.461 1.00 0.00 H new ATOM 0 HB1 ALA A 174 2.135 -10.301 0.522 1.00 0.00 H new ATOM 0 HB2 ALA A 174 1.764 -10.188 2.259 1.00 0.00 H new ATOM 0 HB3 ALA A 174 0.464 -10.002 1.057 1.00 0.00 H new ATOM 345 N PHE A 175 2.481 -7.087 -0.746 1.00 0.00 N ATOM 346 CA PHE A 175 2.330 -6.506 -2.076 1.00 0.00 C ATOM 347 C PHE A 175 3.536 -6.812 -2.956 1.00 0.00 C ATOM 348 O PHE A 175 4.614 -7.138 -2.459 1.00 0.00 O ATOM 349 CB PHE A 175 2.140 -4.992 -1.968 1.00 0.00 C ATOM 350 CG PHE A 175 3.231 -4.305 -1.194 1.00 0.00 C ATOM 351 CD1 PHE A 175 3.337 -4.476 0.178 1.00 0.00 C ATOM 352 CD2 PHE A 175 4.146 -3.489 -1.836 1.00 0.00 C ATOM 353 CE1 PHE A 175 4.338 -3.845 0.892 1.00 0.00 C ATOM 354 CE2 PHE A 175 5.150 -2.856 -1.127 1.00 0.00 C ATOM 355 CZ PHE A 175 5.244 -3.035 0.239 1.00 0.00 C ATOM 0 H PHE A 175 3.394 -6.933 -0.317 1.00 0.00 H new ATOM 0 HA PHE A 175 1.450 -6.952 -2.538 1.00 0.00 H new ATOM 0 HB2 PHE A 175 2.094 -4.567 -2.971 1.00 0.00 H new ATOM 0 HB3 PHE A 175 1.182 -4.787 -1.490 1.00 0.00 H new ATOM 0 HD1 PHE A 175 2.630 -5.109 0.694 1.00 0.00 H new ATOM 0 HD2 PHE A 175 4.075 -3.345 -2.904 1.00 0.00 H new ATOM 0 HE1 PHE A 175 4.411 -3.986 1.960 1.00 0.00 H new ATOM 0 HE2 PHE A 175 5.859 -2.223 -1.640 1.00 0.00 H new ATOM 0 HZ PHE A 175 6.026 -2.541 0.796 1.00 0.00 H new ATOM 365 N LYS A 176 3.345 -6.696 -4.266 1.00 0.00 N ATOM 366 CA LYS A 176 4.416 -6.951 -5.224 1.00 0.00 C ATOM 367 C LYS A 176 4.773 -5.678 -5.983 1.00 0.00 C ATOM 368 O LYS A 176 4.334 -4.587 -5.621 1.00 0.00 O ATOM 369 CB LYS A 176 3.999 -8.048 -6.205 1.00 0.00 C ATOM 370 CG LYS A 176 3.366 -9.257 -5.536 1.00 0.00 C ATOM 371 CD LYS A 176 3.258 -10.432 -6.495 1.00 0.00 C ATOM 372 CE LYS A 176 1.905 -10.464 -7.186 1.00 0.00 C ATOM 373 NZ LYS A 176 1.424 -11.857 -7.400 1.00 0.00 N ATOM 0 H LYS A 176 2.457 -6.427 -4.690 1.00 0.00 H new ATOM 0 HA LYS A 176 5.296 -7.284 -4.674 1.00 0.00 H new ATOM 0 HB2 LYS A 176 3.294 -7.631 -6.924 1.00 0.00 H new ATOM 0 HB3 LYS A 176 4.874 -8.372 -6.768 1.00 0.00 H new ATOM 0 HG2 LYS A 176 3.960 -9.547 -4.669 1.00 0.00 H new ATOM 0 HG3 LYS A 176 2.374 -8.993 -5.169 1.00 0.00 H new ATOM 0 HD2 LYS A 176 4.048 -10.366 -7.243 1.00 0.00 H new ATOM 0 HD3 LYS A 176 3.411 -11.363 -5.950 1.00 0.00 H new ATOM 0 HE2 LYS A 176 1.178 -9.917 -6.586 1.00 0.00 H new ATOM 0 HE3 LYS A 176 1.975 -9.953 -8.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 0.498 -11.836 -7.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 2.105 -12.372 -7.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 1.332 -12.337 -6.482 1.00 0.00 H new ATOM 387 N ARG A 177 5.569 -5.823 -7.036 1.00 0.00 N ATOM 388 CA ARG A 177 5.979 -4.680 -7.844 1.00 0.00 C ATOM 389 C ARG A 177 4.864 -4.254 -8.791 1.00 0.00 C ATOM 390 O ARG A 177 4.247 -5.088 -9.457 1.00 0.00 O ATOM 391 CB ARG A 177 7.243 -5.015 -8.637 1.00 0.00 C ATOM 392 CG ARG A 177 8.433 -4.139 -8.279 1.00 0.00 C ATOM 393 CD ARG A 177 9.750 -4.858 -8.526 1.00 0.00 C ATOM 394 NE ARG A 177 10.477 -4.298 -9.663 1.00 0.00 N ATOM 395 CZ ARG A 177 10.200 -4.582 -10.933 1.00 0.00 C ATOM 396 NH1 ARG A 177 9.215 -5.420 -11.235 1.00 0.00 N ATOM 397 NH2 ARG A 177 10.910 -4.027 -11.907 1.00 0.00 N ATOM 0 H ARG A 177 5.943 -6.719 -7.350 1.00 0.00 H new ATOM 0 HA ARG A 177 6.193 -3.850 -7.171 1.00 0.00 H new ATOM 0 HB2 ARG A 177 7.505 -6.059 -8.464 1.00 0.00 H new ATOM 0 HB3 ARG A 177 7.033 -4.911 -9.702 1.00 0.00 H new ATOM 0 HG2 ARG A 177 8.402 -3.223 -8.868 1.00 0.00 H new ATOM 0 HG3 ARG A 177 8.368 -3.846 -7.231 1.00 0.00 H new ATOM 0 HD2 ARG A 177 10.371 -4.794 -7.632 1.00 0.00 H new ATOM 0 HD3 ARG A 177 9.557 -5.916 -8.705 1.00 0.00 H new ATOM 0 HE ARG A 177 11.242 -3.651 -9.472 1.00 0.00 H new ATOM 0 HH11 ARG A 177 8.665 -5.850 -10.491 1.00 0.00 H new ATOM 0 HH12 ARG A 177 9.008 -5.633 -12.211 1.00 0.00 H new ATOM 0 HH21 ARG A 177 11.668 -3.383 -11.682 1.00 0.00 H new ATOM 0 HH22 ARG A 177 10.698 -4.245 -12.881 1.00 0.00 H new ATOM 411 N GLY A 178 4.604 -2.953 -8.840 1.00 0.00 N ATOM 412 CA GLY A 178 3.559 -2.437 -9.703 1.00 0.00 C ATOM 413 C GLY A 178 2.195 -2.980 -9.330 1.00 0.00 C ATOM 414 O GLY A 178 1.263 -2.945 -10.133 1.00 0.00 O ATOM 0 H GLY A 178 5.099 -2.246 -8.297 1.00 0.00 H new ATOM 0 HA2 GLY A 178 3.544 -1.349 -9.644 1.00 0.00 H new ATOM 0 HA3 GLY A 178 3.782 -2.697 -10.738 1.00 0.00 H new ATOM 418 N ASP A 179 2.082 -3.486 -8.106 1.00 0.00 N ATOM 419 CA ASP A 179 0.834 -4.044 -7.619 1.00 0.00 C ATOM 420 C ASP A 179 -0.074 -2.951 -7.067 1.00 0.00 C ATOM 421 O ASP A 179 0.339 -2.149 -6.231 1.00 0.00 O ATOM 422 CB ASP A 179 1.118 -5.084 -6.535 1.00 0.00 C ATOM 423 CG ASP A 179 -0.110 -5.892 -6.170 1.00 0.00 C ATOM 424 OD1 ASP A 179 -1.236 -5.384 -6.362 1.00 0.00 O ATOM 425 OD2 ASP A 179 0.052 -7.034 -5.690 1.00 0.00 O ATOM 0 H ASP A 179 2.847 -3.519 -7.433 1.00 0.00 H new ATOM 0 HA ASP A 179 0.323 -4.522 -8.454 1.00 0.00 H new ATOM 0 HB2 ASP A 179 1.903 -5.757 -6.879 1.00 0.00 H new ATOM 0 HB3 ASP A 179 1.496 -4.582 -5.645 1.00 0.00 H new ATOM 430 N VAL A 180 -1.314 -2.924 -7.542 1.00 0.00 N ATOM 431 CA VAL A 180 -2.282 -1.932 -7.096 1.00 0.00 C ATOM 432 C VAL A 180 -2.698 -2.184 -5.651 1.00 0.00 C ATOM 433 O VAL A 180 -3.225 -3.249 -5.327 1.00 0.00 O ATOM 434 CB VAL A 180 -3.540 -1.936 -7.983 1.00 0.00 C ATOM 435 CG1 VAL A 180 -4.470 -0.792 -7.606 1.00 0.00 C ATOM 436 CG2 VAL A 180 -3.156 -1.859 -9.454 1.00 0.00 C ATOM 0 H VAL A 180 -1.672 -3.579 -8.237 1.00 0.00 H new ATOM 0 HA VAL A 180 -1.795 -0.960 -7.171 1.00 0.00 H new ATOM 0 HB VAL A 180 -4.073 -2.872 -7.817 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -5.352 -0.814 -8.246 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -4.774 -0.898 -6.565 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -3.951 0.157 -7.737 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -4.058 -1.863 -10.066 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -2.597 -0.941 -9.637 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -2.537 -2.718 -9.714 1.00 0.00 H new ATOM 446 N ILE A 181 -2.453 -1.207 -4.785 1.00 0.00 N ATOM 447 CA ILE A 181 -2.802 -1.337 -3.375 1.00 0.00 C ATOM 448 C ILE A 181 -3.773 -0.243 -2.941 1.00 0.00 C ATOM 449 O ILE A 181 -3.423 0.938 -2.915 1.00 0.00 O ATOM 450 CB ILE A 181 -1.547 -1.290 -2.483 1.00 0.00 C ATOM 451 CG1 ILE A 181 -0.561 -2.379 -2.911 1.00 0.00 C ATOM 452 CG2 ILE A 181 -1.924 -1.459 -1.017 1.00 0.00 C ATOM 453 CD1 ILE A 181 0.789 -2.270 -2.239 1.00 0.00 C ATOM 0 H ILE A 181 -2.016 -0.319 -5.033 1.00 0.00 H new ATOM 0 HA ILE A 181 -3.286 -2.306 -3.255 1.00 0.00 H new ATOM 0 HB ILE A 181 -1.070 -0.317 -2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 181 -0.991 -3.355 -2.688 1.00 0.00 H new ATOM 0 HG13 ILE A 181 -0.425 -2.330 -3.991 1.00 0.00 H new ATOM 0 HG21 ILE A 181 -1.024 -1.423 -0.403 1.00 0.00 H new ATOM 0 HG22 ILE A 181 -2.598 -0.656 -0.720 1.00 0.00 H new ATOM 0 HG23 ILE A 181 -2.420 -2.419 -0.877 1.00 0.00 H new ATOM 0 HD11 ILE A 181 1.436 -3.074 -2.590 1.00 0.00 H new ATOM 0 HD12 ILE A 181 1.240 -1.308 -2.483 1.00 0.00 H new ATOM 0 HD13 ILE A 181 0.665 -2.349 -1.159 1.00 0.00 H new ATOM 465 N THR A 182 -4.990 -0.647 -2.593 1.00 0.00 N ATOM 466 CA THR A 182 -6.012 0.296 -2.152 1.00 0.00 C ATOM 467 C THR A 182 -5.660 0.858 -0.781 1.00 0.00 C ATOM 468 O THR A 182 -5.728 0.154 0.226 1.00 0.00 O ATOM 469 CB THR A 182 -7.379 -0.388 -2.102 1.00 0.00 C ATOM 470 OG1 THR A 182 -7.555 -1.241 -3.218 1.00 0.00 O ATOM 471 CG2 THR A 182 -8.535 0.589 -2.083 1.00 0.00 C ATOM 0 H THR A 182 -5.293 -1.621 -2.608 1.00 0.00 H new ATOM 0 HA THR A 182 -6.055 1.118 -2.867 1.00 0.00 H new ATOM 0 HB THR A 182 -7.386 -0.953 -1.170 1.00 0.00 H new ATOM 0 HG1 THR A 182 -7.888 -0.720 -3.979 1.00 0.00 H new ATOM 0 HG21 THR A 182 -9.476 0.039 -2.047 1.00 0.00 H new ATOM 0 HG22 THR A 182 -8.456 1.230 -1.205 1.00 0.00 H new ATOM 0 HG23 THR A 182 -8.507 1.203 -2.983 1.00 0.00 H new ATOM 479 N LEU A 183 -5.275 2.130 -0.749 1.00 0.00 N ATOM 480 CA LEU A 183 -4.905 2.783 0.500 1.00 0.00 C ATOM 481 C LEU A 183 -6.032 2.711 1.523 1.00 0.00 C ATOM 482 O LEU A 183 -7.153 3.142 1.262 1.00 0.00 O ATOM 483 CB LEU A 183 -4.535 4.246 0.249 1.00 0.00 C ATOM 484 CG LEU A 183 -3.903 4.961 1.444 1.00 0.00 C ATOM 485 CD1 LEU A 183 -2.599 4.286 1.841 1.00 0.00 C ATOM 486 CD2 LEU A 183 -3.668 6.429 1.124 1.00 0.00 C ATOM 0 H LEU A 183 -5.211 2.728 -1.573 1.00 0.00 H new ATOM 0 HA LEU A 183 -4.041 2.253 0.902 1.00 0.00 H new ATOM 0 HB2 LEU A 183 -3.843 4.292 -0.592 1.00 0.00 H new ATOM 0 HB3 LEU A 183 -5.433 4.788 -0.047 1.00 0.00 H new ATOM 0 HG LEU A 183 -4.593 4.899 2.286 1.00 0.00 H new ATOM 0 HD11 LEU A 183 -2.164 4.808 2.693 1.00 0.00 H new ATOM 0 HD12 LEU A 183 -2.794 3.249 2.113 1.00 0.00 H new ATOM 0 HD13 LEU A 183 -1.903 4.317 1.002 1.00 0.00 H new ATOM 0 HD21 LEU A 183 -3.218 6.922 1.986 1.00 0.00 H new ATOM 0 HD22 LEU A 183 -2.999 6.512 0.268 1.00 0.00 H new ATOM 0 HD23 LEU A 183 -4.619 6.907 0.889 1.00 0.00 H new ATOM 498 N ILE A 184 -5.716 2.174 2.697 1.00 0.00 N ATOM 499 CA ILE A 184 -6.693 2.057 3.771 1.00 0.00 C ATOM 500 C ILE A 184 -6.677 3.313 4.640 1.00 0.00 C ATOM 501 O ILE A 184 -7.705 3.729 5.172 1.00 0.00 O ATOM 502 CB ILE A 184 -6.419 0.822 4.652 1.00 0.00 C ATOM 503 CG1 ILE A 184 -6.316 -0.436 3.788 1.00 0.00 C ATOM 504 CG2 ILE A 184 -7.510 0.663 5.700 1.00 0.00 C ATOM 505 CD1 ILE A 184 -5.537 -1.556 4.443 1.00 0.00 C ATOM 0 H ILE A 184 -4.790 1.813 2.928 1.00 0.00 H new ATOM 0 HA ILE A 184 -7.674 1.941 3.311 1.00 0.00 H new ATOM 0 HB ILE A 184 -5.469 0.967 5.166 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -7.320 -0.790 3.555 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -5.841 -0.179 2.841 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -7.301 -0.214 6.313 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -7.539 1.550 6.333 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -8.474 0.539 5.206 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -5.504 -2.416 3.774 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -4.521 -1.219 4.651 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -6.023 -1.840 5.376 1.00 0.00 H new ATOM 517 N ASN A 185 -5.497 3.917 4.760 1.00 0.00 N ATOM 518 CA ASN A 185 -5.331 5.137 5.543 1.00 0.00 C ATOM 519 C ASN A 185 -3.907 5.674 5.410 1.00 0.00 C ATOM 520 O ASN A 185 -3.124 5.184 4.598 1.00 0.00 O ATOM 521 CB ASN A 185 -5.677 4.895 7.015 1.00 0.00 C ATOM 522 CG ASN A 185 -4.609 4.111 7.745 1.00 0.00 C ATOM 523 OD1 ASN A 185 -3.666 4.681 8.293 1.00 0.00 O ATOM 524 ND2 ASN A 185 -4.754 2.796 7.753 1.00 0.00 N ATOM 0 H ASN A 185 -4.640 3.579 4.323 1.00 0.00 H new ATOM 0 HA ASN A 185 -6.020 5.885 5.150 1.00 0.00 H new ATOM 0 HB2 ASN A 185 -5.822 5.854 7.512 1.00 0.00 H new ATOM 0 HB3 ASN A 185 -6.623 4.358 7.078 1.00 0.00 H new ATOM 0 HD21 ASN A 185 -4.067 2.210 8.227 1.00 0.00 H new ATOM 0 HD22 ASN A 185 -5.553 2.368 7.285 1.00 0.00 H new ATOM 531 N LYS A 186 -3.583 6.683 6.208 1.00 0.00 N ATOM 532 CA LYS A 186 -2.257 7.287 6.180 1.00 0.00 C ATOM 533 C LYS A 186 -1.899 7.866 7.544 1.00 0.00 C ATOM 534 O LYS A 186 -1.511 9.030 7.653 1.00 0.00 O ATOM 535 CB LYS A 186 -2.200 8.385 5.115 1.00 0.00 C ATOM 536 CG LYS A 186 -1.926 7.863 3.716 1.00 0.00 C ATOM 537 CD LYS A 186 -2.066 8.962 2.674 1.00 0.00 C ATOM 538 CE LYS A 186 -3.471 9.543 2.664 1.00 0.00 C ATOM 539 NZ LYS A 186 -3.841 10.080 1.325 1.00 0.00 N ATOM 0 H LYS A 186 -4.222 7.101 6.884 1.00 0.00 H new ATOM 0 HA LYS A 186 -1.532 6.511 5.932 1.00 0.00 H new ATOM 0 HB2 LYS A 186 -3.146 8.926 5.113 1.00 0.00 H new ATOM 0 HB3 LYS A 186 -1.424 9.101 5.385 1.00 0.00 H new ATOM 0 HG2 LYS A 186 -0.920 7.445 3.673 1.00 0.00 H new ATOM 0 HG3 LYS A 186 -2.618 7.053 3.487 1.00 0.00 H new ATOM 0 HD2 LYS A 186 -1.345 9.753 2.879 1.00 0.00 H new ATOM 0 HD3 LYS A 186 -1.829 8.563 1.688 1.00 0.00 H new ATOM 0 HE2 LYS A 186 -4.184 8.772 2.956 1.00 0.00 H new ATOM 0 HE3 LYS A 186 -3.540 10.339 3.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 186 -4.806 10.467 1.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 186 -3.176 10.833 1.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 186 -3.800 9.316 0.621 1.00 0.00 H new ATOM 553 N ASP A 187 -2.033 7.049 8.582 1.00 0.00 N ATOM 554 CA ASP A 187 -1.726 7.483 9.940 1.00 0.00 C ATOM 555 C ASP A 187 -0.328 8.087 10.022 1.00 0.00 C ATOM 556 O ASP A 187 -0.110 9.083 10.713 1.00 0.00 O ATOM 557 CB ASP A 187 -1.844 6.309 10.914 1.00 0.00 C ATOM 558 CG ASP A 187 -1.768 6.749 12.364 1.00 0.00 C ATOM 559 OD1 ASP A 187 -2.787 7.245 12.889 1.00 0.00 O ATOM 560 OD2 ASP A 187 -0.687 6.598 12.973 1.00 0.00 O ATOM 0 H ASP A 187 -2.352 6.083 8.510 1.00 0.00 H new ATOM 0 HA ASP A 187 -2.448 8.251 10.217 1.00 0.00 H new ATOM 0 HB2 ASP A 187 -2.789 5.793 10.743 1.00 0.00 H new ATOM 0 HB3 ASP A 187 -1.048 5.592 10.713 1.00 0.00 H new ATOM 565 N ASP A 188 0.616 7.477 9.314 1.00 0.00 N ATOM 566 CA ASP A 188 1.993 7.949 9.306 1.00 0.00 C ATOM 567 C ASP A 188 2.448 8.283 7.890 1.00 0.00 C ATOM 568 O ASP A 188 2.296 7.471 6.978 1.00 0.00 O ATOM 569 CB ASP A 188 2.932 6.895 9.900 1.00 0.00 C ATOM 570 CG ASP A 188 2.246 5.571 10.164 1.00 0.00 C ATOM 571 OD1 ASP A 188 1.575 5.445 11.210 1.00 0.00 O ATOM 572 OD2 ASP A 188 2.382 4.662 9.324 1.00 0.00 O ATOM 0 H ASP A 188 0.451 6.652 8.737 1.00 0.00 H new ATOM 0 HA ASP A 188 2.032 8.852 9.915 1.00 0.00 H new ATOM 0 HB2 ASP A 188 3.767 6.735 9.218 1.00 0.00 H new ATOM 0 HB3 ASP A 188 3.350 7.273 10.833 1.00 0.00 H new ATOM 577 N PRO A 189 3.035 9.474 7.685 1.00 0.00 N ATOM 578 CA PRO A 189 3.528 9.885 6.369 1.00 0.00 C ATOM 579 C PRO A 189 4.547 8.898 5.810 1.00 0.00 C ATOM 580 O PRO A 189 4.832 8.899 4.613 1.00 0.00 O ATOM 581 CB PRO A 189 4.184 11.248 6.630 1.00 0.00 C ATOM 582 CG PRO A 189 4.394 11.310 8.104 1.00 0.00 C ATOM 583 CD PRO A 189 3.288 10.496 8.711 1.00 0.00 C ATOM 0 HA PRO A 189 2.729 9.927 5.629 1.00 0.00 H new ATOM 0 HB2 PRO A 189 5.129 11.338 6.094 1.00 0.00 H new ATOM 0 HB3 PRO A 189 3.545 12.063 6.289 1.00 0.00 H new ATOM 0 HG2 PRO A 189 5.370 10.908 8.377 1.00 0.00 H new ATOM 0 HG3 PRO A 189 4.362 12.340 8.460 1.00 0.00 H new ATOM 0 HD2 PRO A 189 3.587 10.051 9.660 1.00 0.00 H new ATOM 0 HD3 PRO A 189 2.402 11.100 8.907 1.00 0.00 H new ATOM 591 N ASN A 190 5.098 8.056 6.686 1.00 0.00 N ATOM 592 CA ASN A 190 6.085 7.069 6.273 1.00 0.00 C ATOM 593 C ASN A 190 5.447 5.723 5.972 1.00 0.00 C ATOM 594 O ASN A 190 5.754 5.098 4.958 1.00 0.00 O ATOM 595 CB ASN A 190 7.156 6.893 7.347 1.00 0.00 C ATOM 596 CG ASN A 190 8.310 7.849 7.163 1.00 0.00 C ATOM 597 OD1 ASN A 190 8.610 8.662 8.039 1.00 0.00 O ATOM 598 ND2 ASN A 190 8.961 7.752 6.013 1.00 0.00 N ATOM 0 H ASN A 190 4.876 8.041 7.681 1.00 0.00 H new ATOM 0 HA ASN A 190 6.545 7.443 5.358 1.00 0.00 H new ATOM 0 HB2 ASN A 190 6.711 7.048 8.330 1.00 0.00 H new ATOM 0 HB3 ASN A 190 7.528 5.869 7.323 1.00 0.00 H new ATOM 0 HD21 ASN A 190 9.751 8.368 5.821 1.00 0.00 H new ATOM 0 HD22 ASN A 190 8.672 7.061 5.320 1.00 0.00 H new ATOM 605 N TRP A 191 4.568 5.266 6.858 1.00 0.00 N ATOM 606 CA TRP A 191 3.918 3.979 6.664 1.00 0.00 C ATOM 607 C TRP A 191 2.439 4.152 6.343 1.00 0.00 C ATOM 608 O TRP A 191 1.690 4.757 7.107 1.00 0.00 O ATOM 609 CB TRP A 191 4.111 3.101 7.900 1.00 0.00 C ATOM 610 CG TRP A 191 5.468 2.471 7.964 1.00 0.00 C ATOM 611 CD1 TRP A 191 6.668 3.120 7.963 1.00 0.00 C ATOM 612 CD2 TRP A 191 5.767 1.073 8.038 1.00 0.00 C ATOM 613 NE1 TRP A 191 7.696 2.213 8.030 1.00 0.00 N ATOM 614 CE2 TRP A 191 7.169 0.948 8.078 1.00 0.00 C ATOM 615 CE3 TRP A 191 4.986 -0.086 8.074 1.00 0.00 C ATOM 616 CZ2 TRP A 191 7.806 -0.288 8.151 1.00 0.00 C ATOM 617 CZ3 TRP A 191 5.619 -1.312 8.148 1.00 0.00 C ATOM 618 CH2 TRP A 191 7.017 -1.406 8.186 1.00 0.00 C ATOM 0 H TRP A 191 4.293 5.762 7.706 1.00 0.00 H new ATOM 0 HA TRP A 191 4.382 3.485 5.811 1.00 0.00 H new ATOM 0 HB2 TRP A 191 3.953 3.703 8.795 1.00 0.00 H new ATOM 0 HB3 TRP A 191 3.352 2.318 7.905 1.00 0.00 H new ATOM 0 HD1 TRP A 191 6.791 4.192 7.916 1.00 0.00 H new ATOM 0 HE1 TRP A 191 8.690 2.443 8.042 1.00 0.00 H new ATOM 0 HE3 TRP A 191 3.908 -0.024 8.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 191 8.883 -0.362 8.179 1.00 0.00 H new ATOM 0 HZ3 TRP A 191 5.026 -2.214 8.177 1.00 0.00 H new ATOM 0 HH2 TRP A 191 7.481 -2.380 8.244 1.00 0.00 H new ATOM 629 N TRP A 192 2.029 3.620 5.201 1.00 0.00 N ATOM 630 CA TRP A 192 0.643 3.716 4.769 1.00 0.00 C ATOM 631 C TRP A 192 -0.012 2.343 4.742 1.00 0.00 C ATOM 632 O TRP A 192 0.608 1.355 4.345 1.00 0.00 O ATOM 633 CB TRP A 192 0.560 4.354 3.382 1.00 0.00 C ATOM 634 CG TRP A 192 0.912 5.810 3.362 1.00 0.00 C ATOM 635 CD1 TRP A 192 1.288 6.581 4.424 1.00 0.00 C ATOM 636 CD2 TRP A 192 0.917 6.672 2.218 1.00 0.00 C ATOM 637 NE1 TRP A 192 1.533 7.866 4.009 1.00 0.00 N ATOM 638 CE2 TRP A 192 1.313 7.948 2.660 1.00 0.00 C ATOM 639 CE3 TRP A 192 0.629 6.486 0.863 1.00 0.00 C ATOM 640 CZ2 TRP A 192 1.427 9.032 1.794 1.00 0.00 C ATOM 641 CZ3 TRP A 192 0.743 7.564 0.004 1.00 0.00 C ATOM 642 CH2 TRP A 192 1.139 8.823 0.473 1.00 0.00 C ATOM 0 H TRP A 192 2.638 3.117 4.556 1.00 0.00 H new ATOM 0 HA TRP A 192 0.110 4.343 5.484 1.00 0.00 H new ATOM 0 HB2 TRP A 192 1.228 3.819 2.706 1.00 0.00 H new ATOM 0 HB3 TRP A 192 -0.451 4.229 2.995 1.00 0.00 H new ATOM 0 HD1 TRP A 192 1.379 6.231 5.442 1.00 0.00 H new ATOM 0 HE1 TRP A 192 1.831 8.636 4.609 1.00 0.00 H new ATOM 0 HE3 TRP A 192 0.323 5.518 0.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 192 1.732 10.004 2.152 1.00 0.00 H new ATOM 0 HZ3 TRP A 192 0.523 7.433 -1.045 1.00 0.00 H new ATOM 0 HH2 TRP A 192 1.219 9.646 -0.222 1.00 0.00 H new ATOM 653 N GLU A 193 -1.271 2.289 5.153 1.00 0.00 N ATOM 654 CA GLU A 193 -2.014 1.038 5.163 1.00 0.00 C ATOM 655 C GLU A 193 -2.724 0.849 3.830 1.00 0.00 C ATOM 656 O GLU A 193 -3.232 1.809 3.253 1.00 0.00 O ATOM 657 CB GLU A 193 -3.029 1.032 6.307 1.00 0.00 C ATOM 658 CG GLU A 193 -3.514 -0.357 6.687 1.00 0.00 C ATOM 659 CD GLU A 193 -3.358 -0.648 8.167 1.00 0.00 C ATOM 660 OE1 GLU A 193 -3.500 0.296 8.975 1.00 0.00 O ATOM 661 OE2 GLU A 193 -3.097 -1.817 8.520 1.00 0.00 O ATOM 0 H GLU A 193 -1.799 3.097 5.484 1.00 0.00 H new ATOM 0 HA GLU A 193 -1.317 0.214 5.315 1.00 0.00 H new ATOM 0 HB2 GLU A 193 -2.580 1.502 7.182 1.00 0.00 H new ATOM 0 HB3 GLU A 193 -3.887 1.641 6.023 1.00 0.00 H new ATOM 0 HG2 GLU A 193 -4.563 -0.459 6.410 1.00 0.00 H new ATOM 0 HG3 GLU A 193 -2.959 -1.100 6.115 1.00 0.00 H new ATOM 668 N GLY A 194 -2.748 -0.383 3.334 1.00 0.00 N ATOM 669 CA GLY A 194 -3.396 -0.638 2.061 1.00 0.00 C ATOM 670 C GLY A 194 -3.956 -2.041 1.948 1.00 0.00 C ATOM 671 O GLY A 194 -3.575 -2.935 2.702 1.00 0.00 O ATOM 0 H GLY A 194 -2.336 -1.201 3.784 1.00 0.00 H new ATOM 0 HA2 GLY A 194 -4.203 0.081 1.921 1.00 0.00 H new ATOM 0 HA3 GLY A 194 -2.679 -0.474 1.256 1.00 0.00 H new ATOM 675 N GLN A 195 -4.864 -2.229 0.995 1.00 0.00 N ATOM 676 CA GLN A 195 -5.486 -3.527 0.772 1.00 0.00 C ATOM 677 C GLN A 195 -5.173 -4.048 -0.625 1.00 0.00 C ATOM 678 O GLN A 195 -5.624 -3.485 -1.623 1.00 0.00 O ATOM 679 CB GLN A 195 -6.995 -3.428 0.957 1.00 0.00 C ATOM 680 CG GLN A 195 -7.668 -4.770 1.205 1.00 0.00 C ATOM 681 CD GLN A 195 -9.012 -4.881 0.512 1.00 0.00 C ATOM 682 OE1 GLN A 195 -10.044 -5.059 1.157 1.00 0.00 O ATOM 683 NE2 GLN A 195 -9.004 -4.780 -0.813 1.00 0.00 N ATOM 0 H GLN A 195 -5.185 -1.495 0.364 1.00 0.00 H new ATOM 0 HA GLN A 195 -5.079 -4.226 1.503 1.00 0.00 H new ATOM 0 HB2 GLN A 195 -7.207 -2.764 1.795 1.00 0.00 H new ATOM 0 HB3 GLN A 195 -7.432 -2.970 0.070 1.00 0.00 H new ATOM 0 HG2 GLN A 195 -7.015 -5.570 0.856 1.00 0.00 H new ATOM 0 HG3 GLN A 195 -7.802 -4.913 2.277 1.00 0.00 H new ATOM 0 HE21 GLN A 195 -8.124 -4.632 -1.308 1.00 0.00 H new ATOM 0 HE22 GLN A 195 -9.877 -4.850 -1.335 1.00 0.00 H new ATOM 692 N LEU A 196 -4.403 -5.130 -0.694 1.00 0.00 N ATOM 693 CA LEU A 196 -4.039 -5.724 -1.974 1.00 0.00 C ATOM 694 C LEU A 196 -5.235 -6.437 -2.597 1.00 0.00 C ATOM 695 O LEU A 196 -5.223 -7.654 -2.784 1.00 0.00 O ATOM 696 CB LEU A 196 -2.878 -6.708 -1.794 1.00 0.00 C ATOM 697 CG LEU A 196 -2.012 -6.932 -3.036 1.00 0.00 C ATOM 698 CD1 LEU A 196 -2.877 -7.228 -4.252 1.00 0.00 C ATOM 699 CD2 LEU A 196 -1.128 -5.723 -3.291 1.00 0.00 C ATOM 0 H LEU A 196 -4.020 -5.611 0.120 1.00 0.00 H new ATOM 0 HA LEU A 196 -3.724 -4.924 -2.644 1.00 0.00 H new ATOM 0 HB2 LEU A 196 -2.240 -6.348 -0.987 1.00 0.00 H new ATOM 0 HB3 LEU A 196 -3.283 -7.668 -1.476 1.00 0.00 H new ATOM 0 HG LEU A 196 -1.373 -7.797 -2.856 1.00 0.00 H new ATOM 0 HD11 LEU A 196 -2.240 -7.384 -5.123 1.00 0.00 H new ATOM 0 HD12 LEU A 196 -3.467 -8.126 -4.069 1.00 0.00 H new ATOM 0 HD13 LEU A 196 -3.545 -6.387 -4.437 1.00 0.00 H new ATOM 0 HD21 LEU A 196 -0.519 -5.898 -4.178 1.00 0.00 H new ATOM 0 HD22 LEU A 196 -1.752 -4.843 -3.448 1.00 0.00 H new ATOM 0 HD23 LEU A 196 -0.479 -5.559 -2.431 1.00 0.00 H new ATOM 711 N ASN A 197 -6.273 -5.668 -2.915 1.00 0.00 N ATOM 712 CA ASN A 197 -7.483 -6.219 -3.514 1.00 0.00 C ATOM 713 C ASN A 197 -8.188 -7.184 -2.563 1.00 0.00 C ATOM 714 O ASN A 197 -9.064 -7.944 -2.978 1.00 0.00 O ATOM 715 CB ASN A 197 -7.146 -6.934 -4.825 1.00 0.00 C ATOM 716 CG ASN A 197 -8.234 -6.768 -5.869 1.00 0.00 C ATOM 717 OD1 ASN A 197 -8.982 -5.789 -5.856 1.00 0.00 O ATOM 718 ND2 ASN A 197 -8.330 -7.731 -6.780 1.00 0.00 N ATOM 0 H ASN A 197 -6.299 -4.659 -2.767 1.00 0.00 H new ATOM 0 HA ASN A 197 -8.160 -5.389 -3.718 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -6.207 -6.544 -5.217 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -6.993 -7.995 -4.628 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -9.044 -7.677 -7.506 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -7.689 -8.524 -6.753 1.00 0.00 H new ATOM 725 N ASN A 198 -7.809 -7.153 -1.285 1.00 0.00 N ATOM 726 CA ASN A 198 -8.418 -8.030 -0.285 1.00 0.00 C ATOM 727 C ASN A 198 -7.665 -7.961 1.039 1.00 0.00 C ATOM 728 O ASN A 198 -8.189 -7.472 2.041 1.00 0.00 O ATOM 729 CB ASN A 198 -8.449 -9.476 -0.789 1.00 0.00 C ATOM 730 CG ASN A 198 -9.836 -9.906 -1.226 1.00 0.00 C ATOM 731 OD1 ASN A 198 -10.709 -9.073 -1.471 1.00 0.00 O ATOM 732 ND2 ASN A 198 -10.047 -11.214 -1.327 1.00 0.00 N ATOM 0 H ASN A 198 -7.086 -6.533 -0.919 1.00 0.00 H new ATOM 0 HA ASN A 198 -9.439 -7.687 -0.119 1.00 0.00 H new ATOM 0 HB2 ASN A 198 -7.758 -9.581 -1.626 1.00 0.00 H new ATOM 0 HB3 ASN A 198 -8.097 -10.141 0.000 1.00 0.00 H new ATOM 0 HD21 ASN A 198 -10.961 -11.562 -1.617 1.00 0.00 H new ATOM 0 HD22 ASN A 198 -9.295 -11.870 -1.114 1.00 0.00 H new ATOM 739 N ARG A 199 -6.438 -8.462 1.038 1.00 0.00 N ATOM 740 CA ARG A 199 -5.608 -8.473 2.235 1.00 0.00 C ATOM 741 C ARG A 199 -5.135 -7.069 2.600 1.00 0.00 C ATOM 742 O ARG A 199 -4.620 -6.336 1.757 1.00 0.00 O ATOM 743 CB ARG A 199 -4.402 -9.388 2.029 1.00 0.00 C ATOM 744 CG ARG A 199 -3.710 -9.195 0.688 1.00 0.00 C ATOM 745 CD ARG A 199 -4.101 -10.279 -0.303 1.00 0.00 C ATOM 746 NE ARG A 199 -3.092 -11.331 -0.390 1.00 0.00 N ATOM 747 CZ ARG A 199 -3.317 -12.532 -0.918 1.00 0.00 C ATOM 748 NH1 ARG A 199 -4.512 -12.836 -1.407 1.00 0.00 N ATOM 749 NH2 ARG A 199 -2.342 -13.431 -0.958 1.00 0.00 N ATOM 0 H ARG A 199 -5.992 -8.869 0.216 1.00 0.00 H new ATOM 0 HA ARG A 199 -6.215 -8.850 3.058 1.00 0.00 H new ATOM 0 HB2 ARG A 199 -3.682 -9.211 2.828 1.00 0.00 H new ATOM 0 HB3 ARG A 199 -4.725 -10.425 2.115 1.00 0.00 H new ATOM 0 HG2 ARG A 199 -3.970 -8.218 0.281 1.00 0.00 H new ATOM 0 HG3 ARG A 199 -2.629 -9.204 0.831 1.00 0.00 H new ATOM 0 HD2 ARG A 199 -5.055 -10.715 -0.006 1.00 0.00 H new ATOM 0 HD3 ARG A 199 -4.247 -9.835 -1.287 1.00 0.00 H new ATOM 0 HE ARG A 199 -2.160 -11.134 -0.025 1.00 0.00 H new ATOM 0 HH11 ARG A 199 -5.264 -12.148 -1.380 1.00 0.00 H new ATOM 0 HH12 ARG A 199 -4.679 -13.758 -1.810 1.00 0.00 H new ATOM 0 HH21 ARG A 199 -1.421 -13.202 -0.584 1.00 0.00 H new ATOM 0 HH22 ARG A 199 -2.513 -14.352 -1.362 1.00 0.00 H new ATOM 763 N ARG A 200 -5.308 -6.708 3.869 1.00 0.00 N ATOM 764 CA ARG A 200 -4.898 -5.400 4.362 1.00 0.00 C ATOM 765 C ARG A 200 -3.534 -5.489 5.039 1.00 0.00 C ATOM 766 O ARG A 200 -3.057 -6.584 5.339 1.00 0.00 O ATOM 767 CB ARG A 200 -5.934 -4.863 5.352 1.00 0.00 C ATOM 768 CG ARG A 200 -7.109 -4.164 4.689 1.00 0.00 C ATOM 769 CD ARG A 200 -8.352 -5.040 4.689 1.00 0.00 C ATOM 770 NE ARG A 200 -9.543 -4.302 4.271 1.00 0.00 N ATOM 771 CZ ARG A 200 -10.787 -4.724 4.479 1.00 0.00 C ATOM 772 NH1 ARG A 200 -11.011 -5.877 5.098 1.00 0.00 N ATOM 773 NH2 ARG A 200 -11.813 -3.992 4.068 1.00 0.00 N ATOM 0 H ARG A 200 -5.732 -7.308 4.576 1.00 0.00 H new ATOM 0 HA ARG A 200 -4.826 -4.718 3.515 1.00 0.00 H new ATOM 0 HB2 ARG A 200 -6.308 -5.689 5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 200 -5.445 -4.166 6.033 1.00 0.00 H new ATOM 0 HG2 ARG A 200 -7.320 -3.231 5.211 1.00 0.00 H new ATOM 0 HG3 ARG A 200 -6.847 -3.903 3.664 1.00 0.00 H new ATOM 0 HD2 ARG A 200 -8.198 -5.888 4.021 1.00 0.00 H new ATOM 0 HD3 ARG A 200 -8.509 -5.446 5.688 1.00 0.00 H new ATOM 0 HE ARG A 200 -9.412 -3.411 3.792 1.00 0.00 H new ATOM 0 HH11 ARG A 200 -10.226 -6.445 5.417 1.00 0.00 H new ATOM 0 HH12 ARG A 200 -11.968 -6.195 5.254 1.00 0.00 H new ATOM 0 HH21 ARG A 200 -11.648 -3.105 3.592 1.00 0.00 H new ATOM 0 HH22 ARG A 200 -12.767 -4.316 4.228 1.00 0.00 H new ATOM 787 N GLY A 201 -2.907 -4.340 5.275 1.00 0.00 N ATOM 788 CA GLY A 201 -1.604 -4.337 5.915 1.00 0.00 C ATOM 789 C GLY A 201 -0.926 -2.982 5.875 1.00 0.00 C ATOM 790 O GLY A 201 -1.278 -2.127 5.061 1.00 0.00 O ATOM 0 H GLY A 201 -3.274 -3.419 5.037 1.00 0.00 H new ATOM 0 HA2 GLY A 201 -1.715 -4.651 6.953 1.00 0.00 H new ATOM 0 HA3 GLY A 201 -0.964 -5.072 5.426 1.00 0.00 H new ATOM 794 N ILE A 202 0.057 -2.788 6.750 1.00 0.00 N ATOM 795 CA ILE A 202 0.793 -1.531 6.806 1.00 0.00 C ATOM 796 C ILE A 202 2.198 -1.702 6.243 1.00 0.00 C ATOM 797 O ILE A 202 2.797 -2.772 6.357 1.00 0.00 O ATOM 798 CB ILE A 202 0.900 -0.995 8.248 1.00 0.00 C ATOM 799 CG1 ILE A 202 1.343 -2.109 9.198 1.00 0.00 C ATOM 800 CG2 ILE A 202 -0.427 -0.401 8.695 1.00 0.00 C ATOM 801 CD1 ILE A 202 2.135 -1.609 10.387 1.00 0.00 C ATOM 0 H ILE A 202 0.361 -3.486 7.429 1.00 0.00 H new ATOM 0 HA ILE A 202 0.236 -0.814 6.203 1.00 0.00 H new ATOM 0 HB ILE A 202 1.651 -0.206 8.271 1.00 0.00 H new ATOM 0 HG12 ILE A 202 0.462 -2.642 9.556 1.00 0.00 H new ATOM 0 HG13 ILE A 202 1.948 -2.828 8.645 1.00 0.00 H new ATOM 0 HG21 ILE A 202 -0.333 -0.028 9.715 1.00 0.00 H new ATOM 0 HG22 ILE A 202 -0.700 0.420 8.032 1.00 0.00 H new ATOM 0 HG23 ILE A 202 -1.200 -1.169 8.659 1.00 0.00 H new ATOM 0 HD11 ILE A 202 2.416 -2.452 11.018 1.00 0.00 H new ATOM 0 HD12 ILE A 202 3.034 -1.102 10.038 1.00 0.00 H new ATOM 0 HD13 ILE A 202 1.526 -0.912 10.963 1.00 0.00 H new ATOM 813 N PHE A 203 2.722 -0.645 5.636 1.00 0.00 N ATOM 814 CA PHE A 203 4.058 -0.688 5.053 1.00 0.00 C ATOM 815 C PHE A 203 4.516 0.704 4.631 1.00 0.00 C ATOM 816 O PHE A 203 3.704 1.622 4.505 1.00 0.00 O ATOM 817 CB PHE A 203 4.073 -1.620 3.844 1.00 0.00 C ATOM 818 CG PHE A 203 3.176 -1.161 2.730 1.00 0.00 C ATOM 819 CD1 PHE A 203 1.806 -1.082 2.917 1.00 0.00 C ATOM 820 CD2 PHE A 203 3.699 -0.807 1.498 1.00 0.00 C ATOM 821 CE1 PHE A 203 0.974 -0.663 1.899 1.00 0.00 C ATOM 822 CE2 PHE A 203 2.870 -0.386 0.474 1.00 0.00 C ATOM 823 CZ PHE A 203 1.507 -0.314 0.675 1.00 0.00 C ATOM 0 H PHE A 203 2.244 0.251 5.534 1.00 0.00 H new ATOM 0 HA PHE A 203 4.745 -1.064 5.811 1.00 0.00 H new ATOM 0 HB2 PHE A 203 5.093 -1.702 3.469 1.00 0.00 H new ATOM 0 HB3 PHE A 203 3.768 -2.618 4.159 1.00 0.00 H new ATOM 0 HD1 PHE A 203 1.383 -1.352 3.873 1.00 0.00 H new ATOM 0 HD2 PHE A 203 4.765 -0.860 1.335 1.00 0.00 H new ATOM 0 HE1 PHE A 203 -0.093 -0.608 2.060 1.00 0.00 H new ATOM 0 HE2 PHE A 203 3.290 -0.114 -0.483 1.00 0.00 H new ATOM 0 HZ PHE A 203 0.859 0.015 -0.124 1.00 0.00 H new ATOM 833 N PRO A 204 5.825 0.875 4.389 1.00 0.00 N ATOM 834 CA PRO A 204 6.381 2.159 3.961 1.00 0.00 C ATOM 835 C PRO A 204 5.829 2.571 2.603 1.00 0.00 C ATOM 836 O PRO A 204 6.029 1.875 1.607 1.00 0.00 O ATOM 837 CB PRO A 204 7.892 1.899 3.872 1.00 0.00 C ATOM 838 CG PRO A 204 8.120 0.640 4.639 1.00 0.00 C ATOM 839 CD PRO A 204 6.861 -0.162 4.496 1.00 0.00 C ATOM 0 HA PRO A 204 6.129 2.968 4.646 1.00 0.00 H new ATOM 0 HB2 PRO A 204 8.212 1.792 2.836 1.00 0.00 H new ATOM 0 HB3 PRO A 204 8.459 2.727 4.297 1.00 0.00 H new ATOM 0 HG2 PRO A 204 8.978 0.094 4.247 1.00 0.00 H new ATOM 0 HG3 PRO A 204 8.330 0.854 5.687 1.00 0.00 H new ATOM 0 HD2 PRO A 204 6.886 -0.801 3.613 1.00 0.00 H new ATOM 0 HD3 PRO A 204 6.696 -0.812 5.355 1.00 0.00 H new ATOM 847 N SER A 205 5.126 3.696 2.562 1.00 0.00 N ATOM 848 CA SER A 205 4.544 4.176 1.316 1.00 0.00 C ATOM 849 C SER A 205 5.624 4.501 0.293 1.00 0.00 C ATOM 850 O SER A 205 5.347 4.605 -0.902 1.00 0.00 O ATOM 851 CB SER A 205 3.668 5.400 1.569 1.00 0.00 C ATOM 852 OG SER A 205 4.166 6.171 2.650 1.00 0.00 O ATOM 0 H SER A 205 4.946 4.289 3.372 1.00 0.00 H new ATOM 0 HA SER A 205 3.922 3.378 0.910 1.00 0.00 H new ATOM 0 HB2 SER A 205 3.627 6.014 0.669 1.00 0.00 H new ATOM 0 HB3 SER A 205 2.648 5.082 1.785 1.00 0.00 H new ATOM 0 HG SER A 205 3.416 6.557 3.149 1.00 0.00 H new ATOM 858 N ASN A 206 6.859 4.646 0.762 1.00 0.00 N ATOM 859 CA ASN A 206 7.974 4.942 -0.123 1.00 0.00 C ATOM 860 C ASN A 206 8.208 3.797 -1.106 1.00 0.00 C ATOM 861 O ASN A 206 8.929 3.952 -2.092 1.00 0.00 O ATOM 862 CB ASN A 206 9.242 5.203 0.691 1.00 0.00 C ATOM 863 CG ASN A 206 9.779 6.601 0.504 1.00 0.00 C ATOM 864 OD1 ASN A 206 9.216 7.407 -0.239 1.00 0.00 O ATOM 865 ND2 ASN A 206 10.880 6.894 1.176 1.00 0.00 N ATOM 0 H ASN A 206 7.110 4.563 1.747 1.00 0.00 H new ATOM 0 HA ASN A 206 7.727 5.838 -0.692 1.00 0.00 H new ATOM 0 HB2 ASN A 206 9.031 5.038 1.748 1.00 0.00 H new ATOM 0 HB3 ASN A 206 10.008 4.483 0.403 1.00 0.00 H new ATOM 0 HD21 ASN A 206 11.298 7.820 1.091 1.00 0.00 H new ATOM 0 HD22 ASN A 206 11.311 6.194 1.780 1.00 0.00 H new ATOM 872 N TYR A 207 7.598 2.641 -0.834 1.00 0.00 N ATOM 873 CA TYR A 207 7.749 1.480 -1.700 1.00 0.00 C ATOM 874 C TYR A 207 6.667 1.443 -2.777 1.00 0.00 C ATOM 875 O TYR A 207 6.449 0.407 -3.405 1.00 0.00 O ATOM 876 CB TYR A 207 7.684 0.198 -0.867 1.00 0.00 C ATOM 877 CG TYR A 207 9.033 -0.445 -0.638 1.00 0.00 C ATOM 878 CD1 TYR A 207 9.944 -0.585 -1.677 1.00 0.00 C ATOM 879 CD2 TYR A 207 9.396 -0.915 0.620 1.00 0.00 C ATOM 880 CE1 TYR A 207 11.177 -1.173 -1.472 1.00 0.00 C ATOM 881 CE2 TYR A 207 10.627 -1.504 0.833 1.00 0.00 C ATOM 882 CZ TYR A 207 11.514 -1.630 -0.215 1.00 0.00 C ATOM 883 OH TYR A 207 12.742 -2.217 -0.007 1.00 0.00 O ATOM 0 H TYR A 207 6.998 2.489 -0.023 1.00 0.00 H new ATOM 0 HA TYR A 207 8.719 1.553 -2.192 1.00 0.00 H new ATOM 0 HB2 TYR A 207 7.230 0.424 0.098 1.00 0.00 H new ATOM 0 HB3 TYR A 207 7.030 -0.517 -1.367 1.00 0.00 H new ATOM 0 HD1 TYR A 207 9.684 -0.228 -2.662 1.00 0.00 H new ATOM 0 HD2 TYR A 207 8.704 -0.818 1.443 1.00 0.00 H new ATOM 0 HE1 TYR A 207 11.873 -1.274 -2.291 1.00 0.00 H new ATOM 0 HE2 TYR A 207 10.893 -1.864 1.816 1.00 0.00 H new ATOM 0 HH TYR A 207 12.823 -2.483 0.933 1.00 0.00 H new ATOM 893 N VAL A 208 5.985 2.565 -2.984 1.00 0.00 N ATOM 894 CA VAL A 208 4.925 2.625 -3.983 1.00 0.00 C ATOM 895 C VAL A 208 4.816 4.013 -4.612 1.00 0.00 C ATOM 896 O VAL A 208 5.661 4.881 -4.388 1.00 0.00 O ATOM 897 CB VAL A 208 3.561 2.233 -3.372 1.00 0.00 C ATOM 898 CG1 VAL A 208 3.708 1.015 -2.473 1.00 0.00 C ATOM 899 CG2 VAL A 208 2.963 3.387 -2.587 1.00 0.00 C ATOM 0 H VAL A 208 6.145 3.437 -2.479 1.00 0.00 H new ATOM 0 HA VAL A 208 5.189 1.910 -4.762 1.00 0.00 H new ATOM 0 HB VAL A 208 2.887 1.988 -4.193 1.00 0.00 H new ATOM 0 HG11 VAL A 208 2.737 0.754 -2.052 1.00 0.00 H new ATOM 0 HG12 VAL A 208 4.088 0.176 -3.056 1.00 0.00 H new ATOM 0 HG13 VAL A 208 4.405 1.241 -1.666 1.00 0.00 H new ATOM 0 HG21 VAL A 208 2.004 3.084 -2.168 1.00 0.00 H new ATOM 0 HG22 VAL A 208 3.639 3.667 -1.779 1.00 0.00 H new ATOM 0 HG23 VAL A 208 2.816 4.240 -3.249 1.00 0.00 H new ATOM 909 N ALA A 209 3.760 4.209 -5.395 1.00 0.00 N ATOM 910 CA ALA A 209 3.517 5.481 -6.060 1.00 0.00 C ATOM 911 C ALA A 209 2.061 5.580 -6.517 1.00 0.00 C ATOM 912 O ALA A 209 1.586 4.733 -7.273 1.00 0.00 O ATOM 913 CB ALA A 209 4.457 5.646 -7.246 1.00 0.00 C ATOM 0 H ALA A 209 3.055 3.496 -5.584 1.00 0.00 H new ATOM 0 HA ALA A 209 3.709 6.284 -5.348 1.00 0.00 H new ATOM 0 HB1 ALA A 209 4.264 6.602 -7.733 1.00 0.00 H new ATOM 0 HB2 ALA A 209 5.490 5.618 -6.898 1.00 0.00 H new ATOM 0 HB3 ALA A 209 4.292 4.836 -7.957 1.00 0.00 H new ATOM 919 N PRO A 210 1.327 6.612 -6.062 1.00 0.00 N ATOM 920 CA PRO A 210 -0.079 6.803 -6.429 1.00 0.00 C ATOM 921 C PRO A 210 -0.333 6.596 -7.921 1.00 0.00 C ATOM 922 O PRO A 210 0.342 7.187 -8.763 1.00 0.00 O ATOM 923 CB PRO A 210 -0.343 8.252 -6.029 1.00 0.00 C ATOM 924 CG PRO A 210 0.567 8.483 -4.874 1.00 0.00 C ATOM 925 CD PRO A 210 1.805 7.673 -5.152 1.00 0.00 C ATOM 0 HA PRO A 210 -0.733 6.082 -5.939 1.00 0.00 H new ATOM 0 HB2 PRO A 210 -0.128 8.937 -6.849 1.00 0.00 H new ATOM 0 HB3 PRO A 210 -1.386 8.405 -5.751 1.00 0.00 H new ATOM 0 HG2 PRO A 210 0.808 9.541 -4.773 1.00 0.00 H new ATOM 0 HG3 PRO A 210 0.099 8.172 -3.940 1.00 0.00 H new ATOM 0 HD2 PRO A 210 2.584 8.278 -5.615 1.00 0.00 H new ATOM 0 HD3 PRO A 210 2.226 7.257 -4.237 1.00 0.00 H new ATOM 933 N TYR A 211 -1.307 5.750 -8.233 1.00 0.00 N ATOM 934 CA TYR A 211 -1.653 5.454 -9.619 1.00 0.00 C ATOM 935 C TYR A 211 -2.967 6.128 -10.007 1.00 0.00 C ATOM 936 O TYR A 211 -3.001 6.977 -10.898 1.00 0.00 O ATOM 937 CB TYR A 211 -1.757 3.939 -9.821 1.00 0.00 C ATOM 938 CG TYR A 211 -2.236 3.535 -11.197 1.00 0.00 C ATOM 939 CD1 TYR A 211 -1.364 3.512 -12.278 1.00 0.00 C ATOM 940 CD2 TYR A 211 -3.560 3.172 -11.413 1.00 0.00 C ATOM 941 CE1 TYR A 211 -1.798 3.141 -13.536 1.00 0.00 C ATOM 942 CE2 TYR A 211 -4.001 2.799 -12.668 1.00 0.00 C ATOM 943 CZ TYR A 211 -3.116 2.786 -13.726 1.00 0.00 C ATOM 944 OH TYR A 211 -3.553 2.414 -14.979 1.00 0.00 O ATOM 0 H TYR A 211 -1.873 5.255 -7.544 1.00 0.00 H new ATOM 0 HA TYR A 211 -0.865 5.847 -10.262 1.00 0.00 H new ATOM 0 HB2 TYR A 211 -0.780 3.491 -9.641 1.00 0.00 H new ATOM 0 HB3 TYR A 211 -2.438 3.529 -9.075 1.00 0.00 H new ATOM 0 HD1 TYR A 211 -0.330 3.789 -12.133 1.00 0.00 H new ATOM 0 HD2 TYR A 211 -4.255 3.182 -10.587 1.00 0.00 H new ATOM 0 HE1 TYR A 211 -1.108 3.129 -14.367 1.00 0.00 H new ATOM 0 HE2 TYR A 211 -5.033 2.519 -12.820 1.00 0.00 H new ATOM 0 HH TYR A 211 -4.507 2.193 -14.941 1.00 0.00 H new ATOM 954 N ASN A 212 -4.046 5.740 -9.334 1.00 0.00 N ATOM 955 CA ASN A 212 -5.362 6.305 -9.608 1.00 0.00 C ATOM 956 C ASN A 212 -5.472 7.729 -9.071 1.00 0.00 C ATOM 957 O ASN A 212 -6.325 8.502 -9.511 1.00 0.00 O ATOM 958 CB ASN A 212 -6.452 5.429 -8.989 1.00 0.00 C ATOM 959 CG ASN A 212 -7.816 5.684 -9.601 1.00 0.00 C ATOM 960 OD1 ASN A 212 -8.326 4.866 -10.368 1.00 0.00 O ATOM 961 ND2 ASN A 212 -8.412 6.822 -9.268 1.00 0.00 N ATOM 0 H ASN A 212 -4.034 5.037 -8.595 1.00 0.00 H new ATOM 0 HA ASN A 212 -5.497 6.336 -10.689 1.00 0.00 H new ATOM 0 HB2 ASN A 212 -6.189 4.379 -9.120 1.00 0.00 H new ATOM 0 HB3 ASN A 212 -6.498 5.615 -7.916 1.00 0.00 H new ATOM 0 HD21 ASN A 212 -9.330 7.048 -9.651 1.00 0.00 H new ATOM 0 HD22 ASN A 212 -7.952 7.470 -8.629 1.00 0.00 H new ATOM 968 N SER A 213 -4.608 8.073 -8.120 1.00 0.00 N ATOM 969 CA SER A 213 -4.614 9.406 -7.526 1.00 0.00 C ATOM 970 C SER A 213 -4.492 10.485 -8.599 1.00 0.00 C ATOM 971 O SER A 213 -4.372 10.182 -9.786 1.00 0.00 O ATOM 972 CB SER A 213 -3.471 9.542 -6.519 1.00 0.00 C ATOM 973 OG SER A 213 -2.252 9.862 -7.167 1.00 0.00 O ATOM 0 H SER A 213 -3.895 7.447 -7.745 1.00 0.00 H new ATOM 0 HA SER A 213 -5.565 9.541 -7.010 1.00 0.00 H new ATOM 0 HB2 SER A 213 -3.714 10.317 -5.792 1.00 0.00 H new ATOM 0 HB3 SER A 213 -3.358 8.610 -5.965 1.00 0.00 H new ATOM 0 HG SER A 213 -1.761 10.521 -6.633 1.00 0.00 H new ATOM 979 N ASN A 214 -4.525 11.742 -8.172 1.00 0.00 N ATOM 980 CA ASN A 214 -4.418 12.865 -9.095 1.00 0.00 C ATOM 981 C ASN A 214 -2.963 13.132 -9.463 1.00 0.00 C ATOM 982 O ASN A 214 -2.125 13.215 -8.539 1.00 0.00 O ATOM 983 CB ASN A 214 -5.038 14.121 -8.478 1.00 0.00 C ATOM 984 CG ASN A 214 -5.130 15.266 -9.466 1.00 0.00 C ATOM 985 OD1 ASN A 214 -4.113 15.812 -9.899 1.00 0.00 O ATOM 986 ND2 ASN A 214 -6.351 15.641 -9.829 1.00 0.00 N ATOM 987 OXT ASN A 214 -2.671 13.255 -10.671 1.00 0.00 O ATOM 0 H ASN A 214 -4.625 12.009 -7.193 1.00 0.00 H new ATOM 0 HA ASN A 214 -4.962 12.607 -10.004 1.00 0.00 H new ATOM 0 HB2 ASN A 214 -6.035 13.885 -8.106 1.00 0.00 H new ATOM 0 HB3 ASN A 214 -4.443 14.432 -7.620 1.00 0.00 H new ATOM 0 HD21 ASN A 214 -6.474 16.408 -10.490 1.00 0.00 H new ATOM 0 HD22 ASN A 214 -7.166 15.162 -9.447 1.00 0.00 H new TER 994 ASN A 214