USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 452 hydrogens (2 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 179 ASN : amide:sc= 0.0505 K(o=1.2,f=-4.2!) USER MOD Set 1.2: A 182 LYS NZ :NH3+ -148:sc= 0.503 (180deg=-0.551) USER MOD Set 1.3: A 183 ASN : amide:sc= 0.68 K(o=1.2,f=-8.3!) USER MOD Set 2.1: A 159 HIS : no HE2:sc= -0.356 K(o=-0.2,f=-3.5) USER MOD Set 2.2: A 164 ASN : amide:sc= 0.158 K(o=-0.2,f=0.54) USER MOD Set 3.1: A 143 LYS NZ :NH3+ -110:sc= 0.974 (180deg=-1.31) USER MOD Set 3.2: A 146 SER OG : rot 180:sc= 1.13 USER MOD Single : A 144 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0971) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 THR OG1 : rot -80:sc= 1.21 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 147:sc= 1.14 (180deg=-0.295) USER MOD Single : A 171 LYS NZ :NH3+ -177:sc= 2.55 (180deg=2.38) USER MOD Single : A 177 THR OG1 : rot 180:sc= 0.0268 USER MOD Single : A 184 HIS : no HD1:sc= -0.303 K(o=-0.3,f=-1.1) USER MOD Single : A 186 ASN : amide:sc= 0.973 K(o=0.97,f=0) USER MOD Single : A 187 SER OG : rot 13:sc= 1.15 USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 189 MET CE :methyl -164:sc= -0.25 (180deg=-0.87) USER MOD Single : A 192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 142 2.759 -9.018 -13.836 1.00 0.00 N ATOM 2 CA VAL A 142 3.689 -9.280 -14.953 1.00 0.00 C ATOM 3 C VAL A 142 5.049 -9.760 -14.428 1.00 0.00 C ATOM 4 O VAL A 142 5.691 -10.596 -15.060 1.00 0.00 O ATOM 5 CB VAL A 142 3.838 -8.026 -15.840 1.00 0.00 C ATOM 6 CG1 VAL A 142 4.615 -6.928 -15.104 1.00 0.00 C ATOM 7 CG2 VAL A 142 4.574 -8.390 -17.133 1.00 0.00 C ATOM 0 HA VAL A 142 3.274 -10.077 -15.569 1.00 0.00 H new ATOM 0 HB VAL A 142 2.842 -7.652 -16.076 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.708 -6.054 -15.748 1.00 0.00 H new ATOM 0 HG12 VAL A 142 4.082 -6.653 -14.194 1.00 0.00 H new ATOM 0 HG13 VAL A 142 5.608 -7.296 -14.846 1.00 0.00 H new ATOM 0 HG21 VAL A 142 4.677 -7.501 -17.756 1.00 0.00 H new ATOM 0 HG22 VAL A 142 5.563 -8.780 -16.891 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.007 -9.148 -17.673 1.00 0.00 H new ATOM 19 N LYS A 143 5.484 -9.237 -13.269 1.00 0.00 N ATOM 20 CA LYS A 143 6.756 -9.628 -12.675 1.00 0.00 C ATOM 21 C LYS A 143 6.621 -11.011 -12.037 1.00 0.00 C ATOM 22 O LYS A 143 6.495 -11.122 -10.820 1.00 0.00 O ATOM 23 CB LYS A 143 7.175 -8.594 -11.622 1.00 0.00 C ATOM 24 CG LYS A 143 7.488 -7.251 -12.293 1.00 0.00 C ATOM 25 CD LYS A 143 7.816 -6.189 -11.230 1.00 0.00 C ATOM 26 CE LYS A 143 9.109 -6.556 -10.486 1.00 0.00 C ATOM 27 NZ LYS A 143 8.825 -7.312 -9.249 1.00 0.00 N ATOM 0 H LYS A 143 4.966 -8.542 -12.731 1.00 0.00 H new ATOM 0 HA LYS A 143 7.522 -9.670 -13.450 1.00 0.00 H new ATOM 0 HB2 LYS A 143 6.377 -8.466 -10.890 1.00 0.00 H new ATOM 0 HB3 LYS A 143 8.051 -8.951 -11.080 1.00 0.00 H new ATOM 0 HG2 LYS A 143 8.330 -7.365 -12.976 1.00 0.00 H new ATOM 0 HG3 LYS A 143 6.635 -6.927 -12.890 1.00 0.00 H new ATOM 0 HD2 LYS A 143 7.926 -5.213 -11.704 1.00 0.00 H new ATOM 0 HD3 LYS A 143 6.992 -6.108 -10.521 1.00 0.00 H new ATOM 0 HE2 LYS A 143 9.749 -7.150 -11.138 1.00 0.00 H new ATOM 0 HE3 LYS A 143 9.659 -5.648 -10.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 9.039 -6.718 -8.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 7.821 -7.582 -9.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 9.414 -8.168 -9.222 1.00 0.00 H new ATOM 41 N LYS A 144 6.651 -12.064 -12.864 1.00 0.00 N ATOM 42 CA LYS A 144 6.541 -13.433 -12.381 1.00 0.00 C ATOM 43 C LYS A 144 7.665 -13.718 -11.383 1.00 0.00 C ATOM 44 O LYS A 144 7.409 -14.188 -10.277 1.00 0.00 O ATOM 45 CB LYS A 144 6.603 -14.397 -13.572 1.00 0.00 C ATOM 46 CG LYS A 144 6.185 -15.801 -13.126 1.00 0.00 C ATOM 47 CD LYS A 144 6.307 -16.770 -14.308 1.00 0.00 C ATOM 48 CE LYS A 144 5.774 -18.152 -13.912 1.00 0.00 C ATOM 49 NZ LYS A 144 6.612 -18.772 -12.868 1.00 0.00 N ATOM 0 H LYS A 144 6.751 -11.985 -13.876 1.00 0.00 H new ATOM 0 HA LYS A 144 5.588 -13.573 -11.870 1.00 0.00 H new ATOM 0 HB2 LYS A 144 5.946 -14.048 -14.369 1.00 0.00 H new ATOM 0 HB3 LYS A 144 7.614 -14.421 -13.980 1.00 0.00 H new ATOM 0 HG2 LYS A 144 6.815 -16.135 -12.302 1.00 0.00 H new ATOM 0 HG3 LYS A 144 5.159 -15.787 -12.758 1.00 0.00 H new ATOM 0 HD2 LYS A 144 5.748 -16.387 -15.162 1.00 0.00 H new ATOM 0 HD3 LYS A 144 7.349 -16.848 -14.618 1.00 0.00 H new ATOM 0 HE2 LYS A 144 4.750 -18.059 -13.551 1.00 0.00 H new ATOM 0 HE3 LYS A 144 5.746 -18.798 -14.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 6.320 -19.761 -12.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 7.609 -18.743 -13.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 6.498 -18.250 -11.976 1.00 0.00 H new ATOM 63 N THR A 145 8.910 -13.425 -11.784 1.00 0.00 N ATOM 64 CA THR A 145 10.078 -13.615 -10.930 1.00 0.00 C ATOM 65 C THR A 145 10.970 -12.373 -11.000 1.00 0.00 C ATOM 66 O THR A 145 12.157 -12.445 -10.684 1.00 0.00 O ATOM 67 CB THR A 145 10.850 -14.861 -11.391 1.00 0.00 C ATOM 68 OG1 THR A 145 11.175 -14.739 -12.761 1.00 0.00 O ATOM 69 CG2 THR A 145 9.995 -16.113 -11.183 1.00 0.00 C ATOM 0 H THR A 145 9.129 -13.051 -12.707 1.00 0.00 H new ATOM 0 HA THR A 145 9.762 -13.760 -9.897 1.00 0.00 H new ATOM 0 HB THR A 145 11.764 -14.948 -10.804 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.669 -15.534 -13.052 1.00 0.00 H new ATOM 0 HG21 THR A 145 10.550 -16.991 -11.512 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.749 -16.214 -10.126 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.076 -16.026 -11.762 1.00 0.00 H new ATOM 77 N SER A 146 10.390 -11.233 -11.422 1.00 0.00 N ATOM 78 CA SER A 146 11.120 -9.976 -11.568 1.00 0.00 C ATOM 79 C SER A 146 12.259 -10.142 -12.583 1.00 0.00 C ATOM 80 O SER A 146 12.370 -11.187 -13.226 1.00 0.00 O ATOM 81 CB SER A 146 11.650 -9.514 -10.202 1.00 0.00 C ATOM 82 OG SER A 146 10.586 -9.472 -9.271 1.00 0.00 O ATOM 0 H SER A 146 9.403 -11.166 -11.669 1.00 0.00 H new ATOM 0 HA SER A 146 10.444 -9.208 -11.945 1.00 0.00 H new ATOM 0 HB2 SER A 146 12.426 -10.195 -9.852 1.00 0.00 H new ATOM 0 HB3 SER A 146 12.107 -8.529 -10.292 1.00 0.00 H new ATOM 0 HG SER A 146 10.925 -9.179 -8.400 1.00 0.00 H new ATOM 88 N TRP A 147 13.096 -9.096 -12.719 1.00 0.00 N ATOM 89 CA TRP A 147 14.230 -9.088 -13.645 1.00 0.00 C ATOM 90 C TRP A 147 13.760 -9.250 -15.099 1.00 0.00 C ATOM 91 O TRP A 147 12.588 -9.525 -15.359 1.00 0.00 O ATOM 92 CB TRP A 147 15.231 -10.187 -13.256 1.00 0.00 C ATOM 93 CG TRP A 147 16.076 -9.857 -12.067 1.00 0.00 C ATOM 94 CD1 TRP A 147 15.972 -10.404 -10.845 1.00 0.00 C ATOM 95 CD2 TRP A 147 17.170 -8.904 -11.970 1.00 0.00 C ATOM 96 NE1 TRP A 147 16.919 -9.883 -9.993 1.00 0.00 N ATOM 97 CE2 TRP A 147 17.699 -8.946 -10.643 1.00 0.00 C ATOM 98 CE3 TRP A 147 17.774 -8.005 -12.869 1.00 0.00 C ATOM 99 CZ2 TRP A 147 18.777 -8.151 -10.242 1.00 0.00 C ATOM 100 CZ3 TRP A 147 18.856 -7.196 -12.470 1.00 0.00 C ATOM 101 CH2 TRP A 147 19.363 -7.276 -11.166 1.00 0.00 C ATOM 0 H TRP A 147 12.999 -8.232 -12.185 1.00 0.00 H new ATOM 0 HA TRP A 147 14.731 -8.123 -13.574 1.00 0.00 H new ATOM 0 HB2 TRP A 147 14.682 -11.107 -13.053 1.00 0.00 H new ATOM 0 HB3 TRP A 147 15.883 -10.386 -14.107 1.00 0.00 H new ATOM 0 HD1 TRP A 147 15.244 -11.152 -10.568 1.00 0.00 H new ATOM 0 HE1 TRP A 147 17.030 -10.152 -9.015 1.00 0.00 H new ATOM 0 HE3 TRP A 147 17.402 -7.934 -13.880 1.00 0.00 H new ATOM 0 HZ2 TRP A 147 19.154 -8.211 -9.232 1.00 0.00 H new ATOM 0 HZ3 TRP A 147 19.299 -6.508 -13.175 1.00 0.00 H new ATOM 0 HH2 TRP A 147 20.204 -6.664 -10.874 1.00 0.00 H new ATOM 112 N THR A 148 14.692 -9.068 -16.048 1.00 0.00 N ATOM 113 CA THR A 148 14.402 -9.192 -17.472 1.00 0.00 C ATOM 114 C THR A 148 15.612 -9.797 -18.182 1.00 0.00 C ATOM 115 O THR A 148 16.725 -9.755 -17.660 1.00 0.00 O ATOM 116 CB THR A 148 14.077 -7.813 -18.067 1.00 0.00 C ATOM 117 OG1 THR A 148 15.173 -6.943 -17.875 1.00 0.00 O ATOM 118 CG2 THR A 148 12.833 -7.221 -17.399 1.00 0.00 C ATOM 0 H THR A 148 15.663 -8.832 -15.843 1.00 0.00 H new ATOM 0 HA THR A 148 13.538 -9.842 -17.610 1.00 0.00 H new ATOM 0 HB THR A 148 13.883 -7.930 -19.133 1.00 0.00 H new ATOM 0 HG1 THR A 148 15.158 -6.596 -16.959 1.00 0.00 H new ATOM 0 HG21 THR A 148 12.617 -6.244 -17.832 1.00 0.00 H new ATOM 0 HG22 THR A 148 11.983 -7.885 -17.559 1.00 0.00 H new ATOM 0 HG23 THR A 148 13.012 -7.112 -16.329 1.00 0.00 H new ATOM 126 N GLU A 149 15.390 -10.354 -19.378 1.00 0.00 N ATOM 127 CA GLU A 149 16.456 -10.959 -20.161 1.00 0.00 C ATOM 128 C GLU A 149 17.572 -9.942 -20.400 1.00 0.00 C ATOM 129 O GLU A 149 18.749 -10.284 -20.324 1.00 0.00 O ATOM 130 CB GLU A 149 15.896 -11.460 -21.498 1.00 0.00 C ATOM 131 CG GLU A 149 14.720 -12.416 -21.260 1.00 0.00 C ATOM 132 CD GLU A 149 13.387 -11.724 -21.528 1.00 0.00 C ATOM 133 OE1 GLU A 149 13.059 -10.801 -20.750 1.00 0.00 O ATOM 134 OE2 GLU A 149 12.725 -12.130 -22.506 1.00 0.00 O ATOM 0 H GLU A 149 14.472 -10.395 -19.821 1.00 0.00 H new ATOM 0 HA GLU A 149 16.869 -11.805 -19.612 1.00 0.00 H new ATOM 0 HB2 GLU A 149 15.569 -10.614 -22.102 1.00 0.00 H new ATOM 0 HB3 GLU A 149 16.679 -11.969 -22.060 1.00 0.00 H new ATOM 0 HG2 GLU A 149 14.818 -13.287 -21.908 1.00 0.00 H new ATOM 0 HG3 GLU A 149 14.745 -12.779 -20.233 1.00 0.00 H new ATOM 141 N GLU A 150 17.198 -8.691 -20.691 1.00 0.00 N ATOM 142 CA GLU A 150 18.164 -7.635 -20.941 1.00 0.00 C ATOM 143 C GLU A 150 19.089 -7.481 -19.733 1.00 0.00 C ATOM 144 O GLU A 150 20.309 -7.502 -19.879 1.00 0.00 O ATOM 145 CB GLU A 150 17.419 -6.328 -21.235 1.00 0.00 C ATOM 146 CG GLU A 150 18.411 -5.261 -21.708 1.00 0.00 C ATOM 147 CD GLU A 150 17.679 -4.000 -22.149 1.00 0.00 C ATOM 148 OE1 GLU A 150 17.010 -4.072 -23.202 1.00 0.00 O ATOM 149 OE2 GLU A 150 17.803 -2.989 -21.426 1.00 0.00 O ATOM 0 H GLU A 150 16.225 -8.392 -20.758 1.00 0.00 H new ATOM 0 HA GLU A 150 18.777 -7.889 -21.806 1.00 0.00 H new ATOM 0 HB2 GLU A 150 16.659 -6.495 -21.999 1.00 0.00 H new ATOM 0 HB3 GLU A 150 16.901 -5.985 -20.340 1.00 0.00 H new ATOM 0 HG2 GLU A 150 19.105 -5.021 -20.903 1.00 0.00 H new ATOM 0 HG3 GLU A 150 19.004 -5.651 -22.535 1.00 0.00 H new ATOM 156 N GLU A 151 18.507 -7.331 -18.540 1.00 0.00 N ATOM 157 CA GLU A 151 19.281 -7.176 -17.319 1.00 0.00 C ATOM 158 C GLU A 151 20.202 -8.383 -17.119 1.00 0.00 C ATOM 159 O GLU A 151 21.386 -8.216 -16.837 1.00 0.00 O ATOM 160 CB GLU A 151 18.336 -7.032 -16.131 1.00 0.00 C ATOM 161 CG GLU A 151 17.660 -5.658 -16.148 1.00 0.00 C ATOM 162 CD GLU A 151 16.586 -5.571 -15.068 1.00 0.00 C ATOM 163 OE1 GLU A 151 15.520 -6.188 -15.278 1.00 0.00 O ATOM 164 OE2 GLU A 151 16.850 -4.892 -14.051 1.00 0.00 O ATOM 0 H GLU A 151 17.497 -7.314 -18.400 1.00 0.00 H new ATOM 0 HA GLU A 151 19.897 -6.280 -17.397 1.00 0.00 H new ATOM 0 HB2 GLU A 151 17.580 -7.816 -16.163 1.00 0.00 H new ATOM 0 HB3 GLU A 151 18.889 -7.160 -15.201 1.00 0.00 H new ATOM 0 HG2 GLU A 151 18.405 -4.879 -15.990 1.00 0.00 H new ATOM 0 HG3 GLU A 151 17.214 -5.479 -17.126 1.00 0.00 H new ATOM 171 N ASP A 152 19.655 -9.598 -17.265 1.00 0.00 N ATOM 172 CA ASP A 152 20.433 -10.821 -17.098 1.00 0.00 C ATOM 173 C ASP A 152 21.665 -10.790 -18.007 1.00 0.00 C ATOM 174 O ASP A 152 22.755 -11.168 -17.584 1.00 0.00 O ATOM 175 CB ASP A 152 19.555 -12.040 -17.413 1.00 0.00 C ATOM 176 CG ASP A 152 18.679 -12.418 -16.219 1.00 0.00 C ATOM 177 OD1 ASP A 152 18.077 -11.492 -15.635 1.00 0.00 O ATOM 178 OD2 ASP A 152 18.629 -13.630 -15.915 1.00 0.00 O ATOM 0 H ASP A 152 18.674 -9.754 -17.499 1.00 0.00 H new ATOM 0 HA ASP A 152 20.773 -10.894 -16.065 1.00 0.00 H new ATOM 0 HB2 ASP A 152 18.924 -11.823 -18.275 1.00 0.00 H new ATOM 0 HB3 ASP A 152 20.187 -12.885 -17.685 1.00 0.00 H new ATOM 183 N ARG A 153 21.491 -10.336 -19.257 1.00 0.00 N ATOM 184 CA ARG A 153 22.593 -10.254 -20.209 1.00 0.00 C ATOM 185 C ARG A 153 23.641 -9.250 -19.718 1.00 0.00 C ATOM 186 O ARG A 153 24.838 -9.521 -19.797 1.00 0.00 O ATOM 187 CB ARG A 153 22.056 -9.847 -21.585 1.00 0.00 C ATOM 188 CG ARG A 153 21.234 -10.995 -22.183 1.00 0.00 C ATOM 189 CD ARG A 153 20.397 -10.476 -23.358 1.00 0.00 C ATOM 190 NE ARG A 153 19.213 -11.319 -23.580 1.00 0.00 N ATOM 191 CZ ARG A 153 19.262 -12.527 -24.172 1.00 0.00 C ATOM 192 NH1 ARG A 153 20.433 -13.033 -24.584 1.00 0.00 N ATOM 193 NH2 ARG A 153 18.134 -13.226 -24.350 1.00 0.00 N ATOM 0 H ARG A 153 20.594 -10.021 -19.626 1.00 0.00 H new ATOM 0 HA ARG A 153 23.070 -11.231 -20.294 1.00 0.00 H new ATOM 0 HB2 ARG A 153 21.438 -8.954 -21.494 1.00 0.00 H new ATOM 0 HB3 ARG A 153 22.883 -9.596 -22.249 1.00 0.00 H new ATOM 0 HG2 ARG A 153 21.897 -11.792 -22.520 1.00 0.00 H new ATOM 0 HG3 ARG A 153 20.582 -11.423 -21.421 1.00 0.00 H new ATOM 0 HD2 ARG A 153 20.085 -9.450 -23.161 1.00 0.00 H new ATOM 0 HD3 ARG A 153 21.007 -10.455 -24.261 1.00 0.00 H new ATOM 0 HE ARG A 153 18.306 -10.970 -23.269 1.00 0.00 H new ATOM 0 HH11 ARG A 153 21.294 -12.502 -24.450 1.00 0.00 H new ATOM 0 HH12 ARG A 153 20.463 -13.949 -25.032 1.00 0.00 H new ATOM 0 HH21 ARG A 153 17.242 -12.843 -24.037 1.00 0.00 H new ATOM 0 HH22 ARG A 153 18.167 -14.142 -24.798 1.00 0.00 H new ATOM 207 N ILE A 154 23.193 -8.092 -19.208 1.00 0.00 N ATOM 208 CA ILE A 154 24.107 -7.069 -18.704 1.00 0.00 C ATOM 209 C ILE A 154 24.952 -7.652 -17.572 1.00 0.00 C ATOM 210 O ILE A 154 26.175 -7.498 -17.565 1.00 0.00 O ATOM 211 CB ILE A 154 23.310 -5.843 -18.210 1.00 0.00 C ATOM 212 CG1 ILE A 154 22.587 -5.160 -19.392 1.00 0.00 C ATOM 213 CG2 ILE A 154 24.261 -4.846 -17.532 1.00 0.00 C ATOM 214 CD1 ILE A 154 23.560 -4.312 -20.222 1.00 0.00 C ATOM 0 H ILE A 154 22.206 -7.846 -19.136 1.00 0.00 H new ATOM 0 HA ILE A 154 24.768 -6.746 -19.508 1.00 0.00 H new ATOM 0 HB ILE A 154 22.563 -6.176 -17.490 1.00 0.00 H new ATOM 0 HG12 ILE A 154 22.127 -5.917 -20.027 1.00 0.00 H new ATOM 0 HG13 ILE A 154 21.782 -4.530 -19.014 1.00 0.00 H new ATOM 0 HG21 ILE A 154 23.695 -3.982 -17.185 1.00 0.00 H new ATOM 0 HG22 ILE A 154 24.747 -5.327 -16.683 1.00 0.00 H new ATOM 0 HG23 ILE A 154 25.017 -4.521 -18.247 1.00 0.00 H new ATOM 0 HD11 ILE A 154 23.022 -3.844 -21.047 1.00 0.00 H new ATOM 0 HD12 ILE A 154 24.000 -3.540 -19.591 1.00 0.00 H new ATOM 0 HD13 ILE A 154 24.350 -4.949 -20.619 1.00 0.00 H new ATOM 226 N ILE A 155 24.298 -8.320 -16.615 1.00 0.00 N ATOM 227 CA ILE A 155 24.989 -8.906 -15.479 1.00 0.00 C ATOM 228 C ILE A 155 25.939 -9.997 -15.963 1.00 0.00 C ATOM 229 O ILE A 155 27.053 -10.091 -15.476 1.00 0.00 O ATOM 230 CB ILE A 155 23.970 -9.467 -14.476 1.00 0.00 C ATOM 231 CG1 ILE A 155 23.089 -8.328 -13.943 1.00 0.00 C ATOM 232 CG2 ILE A 155 24.710 -10.124 -13.301 1.00 0.00 C ATOM 233 CD1 ILE A 155 21.797 -8.898 -13.363 1.00 0.00 C ATOM 0 H ILE A 155 23.288 -8.464 -16.612 1.00 0.00 H new ATOM 0 HA ILE A 155 25.574 -8.138 -14.973 1.00 0.00 H new ATOM 0 HB ILE A 155 23.347 -10.208 -14.977 1.00 0.00 H new ATOM 0 HG12 ILE A 155 23.626 -7.769 -13.177 1.00 0.00 H new ATOM 0 HG13 ILE A 155 22.859 -7.628 -14.746 1.00 0.00 H new ATOM 0 HG21 ILE A 155 23.985 -10.521 -12.591 1.00 0.00 H new ATOM 0 HG22 ILE A 155 25.336 -10.935 -13.673 1.00 0.00 H new ATOM 0 HG23 ILE A 155 25.335 -9.382 -12.804 1.00 0.00 H new ATOM 0 HD11 ILE A 155 21.177 -8.084 -12.987 1.00 0.00 H new ATOM 0 HD12 ILE A 155 21.256 -9.437 -14.141 1.00 0.00 H new ATOM 0 HD13 ILE A 155 22.035 -9.580 -12.547 1.00 0.00 H new ATOM 245 N TYR A 156 25.499 -10.822 -16.921 1.00 0.00 N ATOM 246 CA TYR A 156 26.326 -11.897 -17.452 1.00 0.00 C ATOM 247 C TYR A 156 27.617 -11.331 -18.040 1.00 0.00 C ATOM 248 O TYR A 156 28.700 -11.832 -17.748 1.00 0.00 O ATOM 249 CB TYR A 156 25.544 -12.676 -18.514 1.00 0.00 C ATOM 250 CG TYR A 156 26.375 -13.737 -19.206 1.00 0.00 C ATOM 251 CD1 TYR A 156 26.505 -15.015 -18.632 1.00 0.00 C ATOM 252 CD2 TYR A 156 27.026 -13.444 -20.418 1.00 0.00 C ATOM 253 CE1 TYR A 156 27.286 -15.995 -19.268 1.00 0.00 C ATOM 254 CE2 TYR A 156 27.806 -14.425 -21.053 1.00 0.00 C ATOM 255 CZ TYR A 156 27.936 -15.701 -20.478 1.00 0.00 C ATOM 256 OH TYR A 156 28.696 -16.653 -21.092 1.00 0.00 O ATOM 0 H TYR A 156 24.572 -10.760 -17.341 1.00 0.00 H new ATOM 0 HA TYR A 156 26.590 -12.577 -16.643 1.00 0.00 H new ATOM 0 HB2 TYR A 156 24.680 -13.148 -18.047 1.00 0.00 H new ATOM 0 HB3 TYR A 156 25.162 -11.979 -19.260 1.00 0.00 H new ATOM 0 HD1 TYR A 156 26.005 -15.243 -17.702 1.00 0.00 H new ATOM 0 HD2 TYR A 156 26.926 -12.464 -20.861 1.00 0.00 H new ATOM 0 HE1 TYR A 156 27.387 -16.975 -18.826 1.00 0.00 H new ATOM 0 HE2 TYR A 156 28.306 -14.199 -21.983 1.00 0.00 H new ATOM 0 HH TYR A 156 29.074 -16.287 -21.919 1.00 0.00 H new ATOM 266 N GLN A 157 27.499 -10.290 -18.869 1.00 0.00 N ATOM 267 CA GLN A 157 28.652 -9.673 -19.502 1.00 0.00 C ATOM 268 C GLN A 157 29.603 -9.114 -18.441 1.00 0.00 C ATOM 269 O GLN A 157 30.790 -9.442 -18.434 1.00 0.00 O ATOM 270 CB GLN A 157 28.172 -8.563 -20.445 1.00 0.00 C ATOM 271 CG GLN A 157 29.354 -8.011 -21.248 1.00 0.00 C ATOM 272 CD GLN A 157 28.914 -6.857 -22.142 1.00 0.00 C ATOM 273 OE1 GLN A 157 29.281 -5.710 -21.902 1.00 0.00 O ATOM 274 NE2 GLN A 157 28.127 -7.162 -23.174 1.00 0.00 N ATOM 0 H GLN A 157 26.607 -9.860 -19.114 1.00 0.00 H new ATOM 0 HA GLN A 157 29.197 -10.419 -20.080 1.00 0.00 H new ATOM 0 HB2 GLN A 157 27.412 -8.953 -21.122 1.00 0.00 H new ATOM 0 HB3 GLN A 157 27.706 -7.762 -19.870 1.00 0.00 H new ATOM 0 HG2 GLN A 157 30.134 -7.671 -20.567 1.00 0.00 H new ATOM 0 HG3 GLN A 157 29.786 -8.804 -21.858 1.00 0.00 H new ATOM 0 HE21 GLN A 157 27.848 -8.130 -23.334 1.00 0.00 H new ATOM 0 HE22 GLN A 157 27.804 -6.427 -23.804 1.00 0.00 H new ATOM 283 N ALA A 158 29.080 -8.265 -17.550 1.00 0.00 N ATOM 284 CA ALA A 158 29.885 -7.636 -16.512 1.00 0.00 C ATOM 285 C ALA A 158 30.498 -8.687 -15.580 1.00 0.00 C ATOM 286 O ALA A 158 31.634 -8.534 -15.139 1.00 0.00 O ATOM 287 CB ALA A 158 29.011 -6.661 -15.725 1.00 0.00 C ATOM 0 H ALA A 158 28.095 -8.000 -17.532 1.00 0.00 H new ATOM 0 HA ALA A 158 30.707 -7.092 -16.978 1.00 0.00 H new ATOM 0 HB1 ALA A 158 29.607 -6.186 -14.946 1.00 0.00 H new ATOM 0 HB2 ALA A 158 28.620 -5.898 -16.398 1.00 0.00 H new ATOM 0 HB3 ALA A 158 28.182 -7.202 -15.269 1.00 0.00 H new ATOM 293 N HIS A 159 29.743 -9.749 -15.280 1.00 0.00 N ATOM 294 CA HIS A 159 30.205 -10.806 -14.393 1.00 0.00 C ATOM 295 C HIS A 159 31.329 -11.595 -15.055 1.00 0.00 C ATOM 296 O HIS A 159 32.336 -11.878 -14.425 1.00 0.00 O ATOM 297 CB HIS A 159 29.035 -11.729 -14.040 1.00 0.00 C ATOM 298 CG HIS A 159 29.451 -12.874 -13.155 1.00 0.00 C ATOM 299 ND1 HIS A 159 30.069 -14.019 -13.645 1.00 0.00 N ATOM 300 CD2 HIS A 159 29.356 -13.078 -11.803 1.00 0.00 C ATOM 301 CE1 HIS A 159 30.301 -14.818 -12.586 1.00 0.00 C ATOM 302 NE2 HIS A 159 29.888 -14.303 -11.430 1.00 0.00 N ATOM 0 H HIS A 159 28.802 -9.894 -15.646 1.00 0.00 H new ATOM 0 HA HIS A 159 30.593 -10.362 -13.476 1.00 0.00 H new ATOM 0 HB2 HIS A 159 28.258 -11.151 -13.540 1.00 0.00 H new ATOM 0 HB3 HIS A 159 28.598 -12.123 -14.957 1.00 0.00 H new ATOM 0 HD1 HIS A 159 30.302 -14.216 -14.618 1.00 0.00 H new ATOM 0 HD2 HIS A 159 28.920 -12.371 -11.113 1.00 0.00 H new ATOM 0 HE1 HIS A 159 30.777 -15.784 -12.667 1.00 0.00 H new ATOM 310 N LYS A 160 31.159 -11.955 -16.325 1.00 0.00 N ATOM 311 CA LYS A 160 32.171 -12.713 -17.038 1.00 0.00 C ATOM 312 C LYS A 160 33.434 -11.866 -17.209 1.00 0.00 C ATOM 313 O LYS A 160 34.540 -12.401 -17.250 1.00 0.00 O ATOM 314 CB LYS A 160 31.612 -13.152 -18.395 1.00 0.00 C ATOM 315 CG LYS A 160 32.572 -14.149 -19.049 1.00 0.00 C ATOM 316 CD LYS A 160 31.797 -15.042 -20.026 1.00 0.00 C ATOM 317 CE LYS A 160 32.723 -16.119 -20.603 1.00 0.00 C ATOM 318 NZ LYS A 160 33.312 -16.949 -19.535 1.00 0.00 N ATOM 0 H LYS A 160 30.330 -11.732 -16.876 1.00 0.00 H new ATOM 0 HA LYS A 160 32.438 -13.602 -16.467 1.00 0.00 H new ATOM 0 HB2 LYS A 160 30.631 -13.609 -18.265 1.00 0.00 H new ATOM 0 HB3 LYS A 160 31.477 -12.285 -19.041 1.00 0.00 H new ATOM 0 HG2 LYS A 160 33.363 -13.616 -19.577 1.00 0.00 H new ATOM 0 HG3 LYS A 160 33.054 -14.760 -18.286 1.00 0.00 H new ATOM 0 HD2 LYS A 160 30.956 -15.510 -19.514 1.00 0.00 H new ATOM 0 HD3 LYS A 160 31.382 -14.438 -20.833 1.00 0.00 H new ATOM 0 HE2 LYS A 160 32.163 -16.752 -21.291 1.00 0.00 H new ATOM 0 HE3 LYS A 160 33.518 -15.647 -21.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 33.443 -17.920 -19.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 34.233 -16.554 -19.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 32.676 -16.958 -18.712 1.00 0.00 H new ATOM 332 N ARG A 161 33.261 -10.543 -17.305 1.00 0.00 N ATOM 333 CA ARG A 161 34.370 -9.620 -17.469 1.00 0.00 C ATOM 334 C ARG A 161 35.136 -9.458 -16.150 1.00 0.00 C ATOM 335 O ARG A 161 36.361 -9.556 -16.134 1.00 0.00 O ATOM 336 CB ARG A 161 33.813 -8.273 -17.945 1.00 0.00 C ATOM 337 CG ARG A 161 34.951 -7.264 -18.140 1.00 0.00 C ATOM 338 CD ARG A 161 34.382 -5.949 -18.680 1.00 0.00 C ATOM 339 NE ARG A 161 33.432 -5.357 -17.727 1.00 0.00 N ATOM 340 CZ ARG A 161 32.649 -4.305 -18.026 1.00 0.00 C ATOM 341 NH1 ARG A 161 32.740 -3.716 -19.226 1.00 0.00 N ATOM 342 NH2 ARG A 161 31.776 -3.845 -17.120 1.00 0.00 N ATOM 0 H ARG A 161 32.347 -10.091 -17.270 1.00 0.00 H new ATOM 0 HA ARG A 161 35.070 -10.009 -18.208 1.00 0.00 H new ATOM 0 HB2 ARG A 161 33.272 -8.406 -18.882 1.00 0.00 H new ATOM 0 HB3 ARG A 161 33.099 -7.889 -17.216 1.00 0.00 H new ATOM 0 HG2 ARG A 161 35.463 -7.090 -17.193 1.00 0.00 H new ATOM 0 HG3 ARG A 161 35.691 -7.664 -18.833 1.00 0.00 H new ATOM 0 HD2 ARG A 161 35.195 -5.248 -18.872 1.00 0.00 H new ATOM 0 HD3 ARG A 161 33.884 -6.128 -19.633 1.00 0.00 H new ATOM 0 HE ARG A 161 33.363 -5.764 -16.794 1.00 0.00 H new ATOM 0 HH11 ARG A 161 33.405 -4.065 -19.916 1.00 0.00 H new ATOM 0 HH12 ARG A 161 32.145 -2.918 -19.449 1.00 0.00 H new ATOM 0 HH21 ARG A 161 31.706 -4.292 -16.206 1.00 0.00 H new ATOM 0 HH22 ARG A 161 31.181 -3.047 -17.344 1.00 0.00 H new ATOM 356 N LEU A 162 34.411 -9.194 -15.051 1.00 0.00 N ATOM 357 CA LEU A 162 35.028 -8.955 -13.747 1.00 0.00 C ATOM 358 C LEU A 162 34.966 -10.212 -12.875 1.00 0.00 C ATOM 359 O LEU A 162 36.001 -10.774 -12.524 1.00 0.00 O ATOM 360 CB LEU A 162 34.309 -7.783 -13.054 1.00 0.00 C ATOM 361 CG LEU A 162 34.332 -6.526 -13.940 1.00 0.00 C ATOM 362 CD1 LEU A 162 33.516 -5.421 -13.266 1.00 0.00 C ATOM 363 CD2 LEU A 162 35.772 -6.041 -14.138 1.00 0.00 C ATOM 0 H LEU A 162 33.392 -9.142 -15.046 1.00 0.00 H new ATOM 0 HA LEU A 162 36.078 -8.703 -13.891 1.00 0.00 H new ATOM 0 HB2 LEU A 162 33.278 -8.061 -12.836 1.00 0.00 H new ATOM 0 HB3 LEU A 162 34.790 -7.569 -12.099 1.00 0.00 H new ATOM 0 HG LEU A 162 33.903 -6.769 -14.912 1.00 0.00 H new ATOM 0 HD11 LEU A 162 33.529 -4.527 -13.890 1.00 0.00 H new ATOM 0 HD12 LEU A 162 32.487 -5.757 -13.134 1.00 0.00 H new ATOM 0 HD13 LEU A 162 33.950 -5.191 -12.293 1.00 0.00 H new ATOM 0 HD21 LEU A 162 35.773 -5.151 -14.767 1.00 0.00 H new ATOM 0 HD22 LEU A 162 36.212 -5.802 -13.170 1.00 0.00 H new ATOM 0 HD23 LEU A 162 36.357 -6.825 -14.618 1.00 0.00 H new ATOM 375 N GLY A 163 33.749 -10.639 -12.520 1.00 0.00 N ATOM 376 CA GLY A 163 33.536 -11.798 -11.662 1.00 0.00 C ATOM 377 C GLY A 163 32.357 -11.518 -10.741 1.00 0.00 C ATOM 378 O GLY A 163 31.383 -10.894 -11.157 1.00 0.00 O ATOM 0 H GLY A 163 32.886 -10.187 -12.823 1.00 0.00 H new ATOM 0 HA2 GLY A 163 33.340 -12.684 -12.266 1.00 0.00 H new ATOM 0 HA3 GLY A 163 34.432 -12.003 -11.076 1.00 0.00 H new ATOM 382 N ASN A 164 32.446 -11.960 -9.479 1.00 0.00 N ATOM 383 CA ASN A 164 31.389 -11.713 -8.501 1.00 0.00 C ATOM 384 C ASN A 164 31.548 -10.309 -7.909 1.00 0.00 C ATOM 385 O ASN A 164 31.194 -10.079 -6.755 1.00 0.00 O ATOM 386 CB ASN A 164 31.448 -12.768 -7.390 1.00 0.00 C ATOM 387 CG ASN A 164 31.480 -14.179 -7.967 1.00 0.00 C ATOM 388 OD1 ASN A 164 32.517 -14.836 -7.947 1.00 0.00 O ATOM 389 ND2 ASN A 164 30.343 -14.644 -8.483 1.00 0.00 N ATOM 0 H ASN A 164 33.239 -12.489 -9.116 1.00 0.00 H new ATOM 0 HA ASN A 164 30.420 -11.779 -8.995 1.00 0.00 H new ATOM 0 HB2 ASN A 164 32.334 -12.604 -6.776 1.00 0.00 H new ATOM 0 HB3 ASN A 164 30.583 -12.660 -6.736 1.00 0.00 H new ATOM 0 HD21 ASN A 164 30.310 -15.582 -8.883 1.00 0.00 H new ATOM 0 HD22 ASN A 164 29.505 -14.062 -8.478 1.00 0.00 H new ATOM 396 N ARG A 165 32.083 -9.370 -8.701 1.00 0.00 N ATOM 397 CA ARG A 165 32.283 -8.006 -8.255 1.00 0.00 C ATOM 398 C ARG A 165 30.988 -7.227 -8.426 1.00 0.00 C ATOM 399 O ARG A 165 30.909 -6.313 -9.247 1.00 0.00 O ATOM 400 CB ARG A 165 33.420 -7.361 -9.060 1.00 0.00 C ATOM 401 CG ARG A 165 34.769 -7.741 -8.450 1.00 0.00 C ATOM 402 CD ARG A 165 35.893 -7.033 -9.212 1.00 0.00 C ATOM 403 NE ARG A 165 37.126 -6.992 -8.414 1.00 0.00 N ATOM 404 CZ ARG A 165 37.356 -6.084 -7.445 1.00 0.00 C ATOM 405 NH1 ARG A 165 36.459 -5.120 -7.181 1.00 0.00 N ATOM 406 NH2 ARG A 165 38.491 -6.144 -6.736 1.00 0.00 N ATOM 0 H ARG A 165 32.384 -9.544 -9.660 1.00 0.00 H new ATOM 0 HA ARG A 165 32.561 -7.996 -7.201 1.00 0.00 H new ATOM 0 HB2 ARG A 165 33.375 -7.690 -10.098 1.00 0.00 H new ATOM 0 HB3 ARG A 165 33.305 -6.277 -9.064 1.00 0.00 H new ATOM 0 HG2 ARG A 165 34.796 -7.460 -7.397 1.00 0.00 H new ATOM 0 HG3 ARG A 165 34.909 -8.821 -8.495 1.00 0.00 H new ATOM 0 HD2 ARG A 165 36.081 -7.550 -10.153 1.00 0.00 H new ATOM 0 HD3 ARG A 165 35.584 -6.018 -9.463 1.00 0.00 H new ATOM 0 HE ARG A 165 37.847 -7.688 -8.604 1.00 0.00 H new ATOM 0 HH11 ARG A 165 35.592 -5.069 -7.716 1.00 0.00 H new ATOM 0 HH12 ARG A 165 36.644 -4.438 -6.445 1.00 0.00 H new ATOM 0 HH21 ARG A 165 39.176 -6.874 -6.931 1.00 0.00 H new ATOM 0 HH22 ARG A 165 38.670 -5.459 -6.001 1.00 0.00 H new ATOM 420 N TRP A 166 29.965 -7.582 -7.640 1.00 0.00 N ATOM 421 CA TRP A 166 28.691 -6.884 -7.695 1.00 0.00 C ATOM 422 C TRP A 166 28.898 -5.436 -7.285 1.00 0.00 C ATOM 423 O TRP A 166 28.074 -4.599 -7.580 1.00 0.00 O ATOM 424 CB TRP A 166 27.661 -7.551 -6.788 1.00 0.00 C ATOM 425 CG TRP A 166 27.875 -9.004 -6.572 1.00 0.00 C ATOM 426 CD1 TRP A 166 28.426 -9.539 -5.483 1.00 0.00 C ATOM 427 CD2 TRP A 166 27.573 -10.121 -7.450 1.00 0.00 C ATOM 428 NE1 TRP A 166 28.500 -10.907 -5.588 1.00 0.00 N ATOM 429 CE2 TRP A 166 27.980 -11.328 -6.800 1.00 0.00 C ATOM 430 CE3 TRP A 166 26.999 -10.245 -8.733 1.00 0.00 C ATOM 431 CZ2 TRP A 166 27.825 -12.585 -7.389 1.00 0.00 C ATOM 432 CZ3 TRP A 166 26.841 -11.513 -9.336 1.00 0.00 C ATOM 433 CH2 TRP A 166 27.256 -12.679 -8.664 1.00 0.00 C ATOM 0 H TRP A 166 30.001 -8.345 -6.964 1.00 0.00 H new ATOM 0 HA TRP A 166 28.309 -6.925 -8.715 1.00 0.00 H new ATOM 0 HB2 TRP A 166 27.669 -7.048 -5.821 1.00 0.00 H new ATOM 0 HB3 TRP A 166 26.670 -7.403 -7.216 1.00 0.00 H new ATOM 0 HD1 TRP A 166 28.769 -8.972 -4.630 1.00 0.00 H new ATOM 0 HE1 TRP A 166 28.884 -11.525 -4.873 1.00 0.00 H new ATOM 0 HE3 TRP A 166 26.676 -9.360 -9.261 1.00 0.00 H new ATOM 0 HZ2 TRP A 166 28.141 -13.475 -6.866 1.00 0.00 H new ATOM 0 HZ3 TRP A 166 26.399 -11.589 -10.319 1.00 0.00 H new ATOM 0 HH2 TRP A 166 27.135 -13.645 -9.132 1.00 0.00 H new ATOM 444 N ALA A 167 30.013 -5.140 -6.609 1.00 0.00 N ATOM 445 CA ALA A 167 30.333 -3.782 -6.230 1.00 0.00 C ATOM 446 C ALA A 167 30.428 -2.919 -7.490 1.00 0.00 C ATOM 447 O ALA A 167 30.036 -1.757 -7.471 1.00 0.00 O ATOM 448 CB ALA A 167 31.654 -3.769 -5.461 1.00 0.00 C ATOM 0 H ALA A 167 30.703 -5.832 -6.318 1.00 0.00 H new ATOM 0 HA ALA A 167 29.553 -3.376 -5.586 1.00 0.00 H new ATOM 0 HB1 ALA A 167 31.898 -2.746 -5.174 1.00 0.00 H new ATOM 0 HB2 ALA A 167 31.560 -4.384 -4.566 1.00 0.00 H new ATOM 0 HB3 ALA A 167 32.447 -4.167 -6.094 1.00 0.00 H new ATOM 454 N GLU A 168 30.950 -3.497 -8.584 1.00 0.00 N ATOM 455 CA GLU A 168 31.110 -2.785 -9.846 1.00 0.00 C ATOM 456 C GLU A 168 29.826 -2.881 -10.675 1.00 0.00 C ATOM 457 O GLU A 168 29.392 -1.889 -11.252 1.00 0.00 O ATOM 458 CB GLU A 168 32.302 -3.370 -10.613 1.00 0.00 C ATOM 459 CG GLU A 168 33.607 -2.721 -10.130 1.00 0.00 C ATOM 460 CD GLU A 168 33.809 -2.914 -8.631 1.00 0.00 C ATOM 461 OE1 GLU A 168 34.245 -4.025 -8.254 1.00 0.00 O ATOM 462 OE2 GLU A 168 33.521 -1.946 -7.888 1.00 0.00 O ATOM 0 H GLU A 168 31.269 -4.465 -8.611 1.00 0.00 H new ATOM 0 HA GLU A 168 31.303 -1.731 -9.647 1.00 0.00 H new ATOM 0 HB2 GLU A 168 32.346 -4.449 -10.465 1.00 0.00 H new ATOM 0 HB3 GLU A 168 32.176 -3.200 -11.682 1.00 0.00 H new ATOM 0 HG2 GLU A 168 34.450 -3.152 -10.670 1.00 0.00 H new ATOM 0 HG3 GLU A 168 33.592 -1.656 -10.361 1.00 0.00 H new ATOM 469 N ILE A 169 29.213 -4.069 -10.738 1.00 0.00 N ATOM 470 CA ILE A 169 27.969 -4.243 -11.489 1.00 0.00 C ATOM 471 C ILE A 169 26.906 -3.305 -10.906 1.00 0.00 C ATOM 472 O ILE A 169 26.196 -2.624 -11.642 1.00 0.00 O ATOM 473 CB ILE A 169 27.506 -5.709 -11.421 1.00 0.00 C ATOM 474 CG1 ILE A 169 28.643 -6.643 -11.874 1.00 0.00 C ATOM 475 CG2 ILE A 169 26.289 -5.902 -12.336 1.00 0.00 C ATOM 476 CD1 ILE A 169 28.196 -8.102 -11.776 1.00 0.00 C ATOM 0 H ILE A 169 29.556 -4.915 -10.282 1.00 0.00 H new ATOM 0 HA ILE A 169 28.130 -3.995 -12.538 1.00 0.00 H new ATOM 0 HB ILE A 169 27.235 -5.951 -10.393 1.00 0.00 H new ATOM 0 HG12 ILE A 169 28.928 -6.410 -12.900 1.00 0.00 H new ATOM 0 HG13 ILE A 169 29.525 -6.482 -11.254 1.00 0.00 H new ATOM 0 HG21 ILE A 169 25.960 -6.940 -12.289 1.00 0.00 H new ATOM 0 HG22 ILE A 169 25.480 -5.249 -12.008 1.00 0.00 H new ATOM 0 HG23 ILE A 169 26.562 -5.654 -13.362 1.00 0.00 H new ATOM 0 HD11 ILE A 169 29.008 -8.754 -12.099 1.00 0.00 H new ATOM 0 HD12 ILE A 169 27.933 -8.334 -10.744 1.00 0.00 H new ATOM 0 HD13 ILE A 169 27.328 -8.260 -12.416 1.00 0.00 H new ATOM 488 N ALA A 170 26.818 -3.276 -9.575 1.00 0.00 N ATOM 489 CA ALA A 170 25.881 -2.425 -8.855 1.00 0.00 C ATOM 490 C ALA A 170 26.103 -0.946 -9.213 1.00 0.00 C ATOM 491 O ALA A 170 25.147 -0.181 -9.262 1.00 0.00 O ATOM 492 CB ALA A 170 26.046 -2.658 -7.346 1.00 0.00 C ATOM 0 H ALA A 170 27.402 -3.849 -8.965 1.00 0.00 H new ATOM 0 HA ALA A 170 24.862 -2.682 -9.146 1.00 0.00 H new ATOM 0 HB1 ALA A 170 25.347 -2.023 -6.801 1.00 0.00 H new ATOM 0 HB2 ALA A 170 25.843 -3.704 -7.115 1.00 0.00 H new ATOM 0 HB3 ALA A 170 27.066 -2.413 -7.049 1.00 0.00 H new ATOM 498 N LYS A 171 27.359 -0.536 -9.472 1.00 0.00 N ATOM 499 CA LYS A 171 27.643 0.848 -9.858 1.00 0.00 C ATOM 500 C LYS A 171 27.019 1.127 -11.226 1.00 0.00 C ATOM 501 O LYS A 171 26.427 2.184 -11.434 1.00 0.00 O ATOM 502 CB LYS A 171 29.157 1.100 -9.906 1.00 0.00 C ATOM 503 CG LYS A 171 29.710 1.311 -8.496 1.00 0.00 C ATOM 504 CD LYS A 171 31.238 1.447 -8.569 1.00 0.00 C ATOM 505 CE LYS A 171 31.846 1.368 -7.164 1.00 0.00 C ATOM 506 NZ LYS A 171 31.990 -0.031 -6.722 1.00 0.00 N ATOM 0 H LYS A 171 28.180 -1.139 -9.420 1.00 0.00 H new ATOM 0 HA LYS A 171 27.212 1.519 -9.115 1.00 0.00 H new ATOM 0 HB2 LYS A 171 29.658 0.254 -10.376 1.00 0.00 H new ATOM 0 HB3 LYS A 171 29.367 1.976 -10.520 1.00 0.00 H new ATOM 0 HG2 LYS A 171 29.274 2.206 -8.051 1.00 0.00 H new ATOM 0 HG3 LYS A 171 29.438 0.472 -7.856 1.00 0.00 H new ATOM 0 HD2 LYS A 171 31.651 0.657 -9.196 1.00 0.00 H new ATOM 0 HD3 LYS A 171 31.504 2.396 -9.035 1.00 0.00 H new ATOM 0 HE2 LYS A 171 32.821 1.856 -7.159 1.00 0.00 H new ATOM 0 HE3 LYS A 171 31.214 1.911 -6.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 171 32.356 -0.052 -5.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 171 31.063 -0.502 -6.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 171 32.652 -0.528 -7.352 1.00 0.00 H new ATOM 520 N LEU A 172 27.154 0.171 -12.158 1.00 0.00 N ATOM 521 CA LEU A 172 26.599 0.311 -13.500 1.00 0.00 C ATOM 522 C LEU A 172 25.070 0.303 -13.435 1.00 0.00 C ATOM 523 O LEU A 172 24.416 0.981 -14.226 1.00 0.00 O ATOM 524 CB LEU A 172 27.107 -0.831 -14.393 1.00 0.00 C ATOM 525 CG LEU A 172 28.636 -0.760 -14.549 1.00 0.00 C ATOM 526 CD1 LEU A 172 29.136 -2.048 -15.208 1.00 0.00 C ATOM 527 CD2 LEU A 172 29.024 0.438 -15.424 1.00 0.00 C ATOM 0 H LEU A 172 27.646 -0.708 -11.999 1.00 0.00 H new ATOM 0 HA LEU A 172 26.923 1.260 -13.928 1.00 0.00 H new ATOM 0 HB2 LEU A 172 26.825 -1.791 -13.960 1.00 0.00 H new ATOM 0 HB3 LEU A 172 26.633 -0.771 -15.373 1.00 0.00 H new ATOM 0 HG LEU A 172 29.089 -0.644 -13.564 1.00 0.00 H new ATOM 0 HD11 LEU A 172 30.219 -2.002 -15.321 1.00 0.00 H new ATOM 0 HD12 LEU A 172 28.872 -2.902 -14.584 1.00 0.00 H new ATOM 0 HD13 LEU A 172 28.674 -2.158 -16.189 1.00 0.00 H new ATOM 0 HD21 LEU A 172 30.108 0.477 -15.527 1.00 0.00 H new ATOM 0 HD22 LEU A 172 28.570 0.331 -16.409 1.00 0.00 H new ATOM 0 HD23 LEU A 172 28.670 1.358 -14.959 1.00 0.00 H new ATOM 539 N LEU A 173 24.507 -0.466 -12.488 1.00 0.00 N ATOM 540 CA LEU A 173 23.063 -0.559 -12.300 1.00 0.00 C ATOM 541 C LEU A 173 22.704 -0.094 -10.882 1.00 0.00 C ATOM 542 O LEU A 173 22.505 -0.926 -10.002 1.00 0.00 O ATOM 543 CB LEU A 173 22.614 -2.015 -12.509 1.00 0.00 C ATOM 544 CG LEU A 173 22.906 -2.480 -13.946 1.00 0.00 C ATOM 545 CD1 LEU A 173 22.625 -3.981 -14.051 1.00 0.00 C ATOM 546 CD2 LEU A 173 22.013 -1.728 -14.939 1.00 0.00 C ATOM 0 H LEU A 173 25.045 -1.037 -11.836 1.00 0.00 H new ATOM 0 HA LEU A 173 22.554 0.078 -13.024 1.00 0.00 H new ATOM 0 HB2 LEU A 173 23.130 -2.664 -11.801 1.00 0.00 H new ATOM 0 HB3 LEU A 173 21.547 -2.104 -12.304 1.00 0.00 H new ATOM 0 HG LEU A 173 23.950 -2.275 -14.184 1.00 0.00 H new ATOM 0 HD11 LEU A 173 22.829 -4.319 -15.067 1.00 0.00 H new ATOM 0 HD12 LEU A 173 23.265 -4.521 -13.353 1.00 0.00 H new ATOM 0 HD13 LEU A 173 21.580 -4.173 -13.808 1.00 0.00 H new ATOM 0 HD21 LEU A 173 22.230 -2.067 -15.952 1.00 0.00 H new ATOM 0 HD22 LEU A 173 20.966 -1.924 -14.707 1.00 0.00 H new ATOM 0 HD23 LEU A 173 22.207 -0.658 -14.865 1.00 0.00 H new ATOM 558 N PRO A 174 22.620 1.236 -10.649 1.00 0.00 N ATOM 559 CA PRO A 174 22.310 1.784 -9.339 1.00 0.00 C ATOM 560 C PRO A 174 20.968 1.264 -8.814 1.00 0.00 C ATOM 561 O PRO A 174 20.787 1.132 -7.605 1.00 0.00 O ATOM 562 CB PRO A 174 22.284 3.306 -9.515 1.00 0.00 C ATOM 563 CG PRO A 174 22.623 3.594 -10.982 1.00 0.00 C ATOM 564 CD PRO A 174 22.835 2.244 -11.666 1.00 0.00 C ATOM 0 HA PRO A 174 23.054 1.481 -8.602 1.00 0.00 H new ATOM 0 HB2 PRO A 174 21.303 3.707 -9.260 1.00 0.00 H new ATOM 0 HB3 PRO A 174 23.005 3.783 -8.852 1.00 0.00 H new ATOM 0 HG2 PRO A 174 21.816 4.147 -11.463 1.00 0.00 H new ATOM 0 HG3 PRO A 174 23.520 4.209 -11.057 1.00 0.00 H new ATOM 0 HD2 PRO A 174 22.139 2.115 -12.495 1.00 0.00 H new ATOM 0 HD3 PRO A 174 23.841 2.171 -12.079 1.00 0.00 H new ATOM 572 N GLY A 175 20.029 0.968 -9.723 1.00 0.00 N ATOM 573 CA GLY A 175 18.713 0.471 -9.344 1.00 0.00 C ATOM 574 C GLY A 175 18.787 -0.967 -8.813 1.00 0.00 C ATOM 575 O GLY A 175 17.769 -1.510 -8.382 1.00 0.00 O ATOM 0 H GLY A 175 20.164 1.067 -10.729 1.00 0.00 H new ATOM 0 HA2 GLY A 175 18.284 1.120 -8.581 1.00 0.00 H new ATOM 0 HA3 GLY A 175 18.047 0.508 -10.206 1.00 0.00 H new ATOM 579 N ARG A 176 19.984 -1.582 -8.847 1.00 0.00 N ATOM 580 CA ARG A 176 20.186 -2.946 -8.373 1.00 0.00 C ATOM 581 C ARG A 176 21.337 -2.951 -7.364 1.00 0.00 C ATOM 582 O ARG A 176 22.476 -2.658 -7.720 1.00 0.00 O ATOM 583 CB ARG A 176 20.511 -3.864 -9.563 1.00 0.00 C ATOM 584 CG ARG A 176 19.486 -3.691 -10.696 1.00 0.00 C ATOM 585 CD ARG A 176 18.123 -4.251 -10.280 1.00 0.00 C ATOM 586 NE ARG A 176 17.165 -4.143 -11.392 1.00 0.00 N ATOM 587 CZ ARG A 176 16.223 -3.183 -11.489 1.00 0.00 C ATOM 588 NH1 ARG A 176 16.087 -2.244 -10.537 1.00 0.00 N ATOM 589 NH2 ARG A 176 15.417 -3.169 -12.554 1.00 0.00 N ATOM 0 H ARG A 176 20.831 -1.140 -9.205 1.00 0.00 H new ATOM 0 HA ARG A 176 19.281 -3.314 -7.890 1.00 0.00 H new ATOM 0 HB2 ARG A 176 21.510 -3.640 -9.936 1.00 0.00 H new ATOM 0 HB3 ARG A 176 20.520 -4.903 -9.233 1.00 0.00 H new ATOM 0 HG2 ARG A 176 19.390 -2.635 -10.948 1.00 0.00 H new ATOM 0 HG3 ARG A 176 19.837 -4.202 -11.592 1.00 0.00 H new ATOM 0 HD2 ARG A 176 18.227 -5.294 -9.981 1.00 0.00 H new ATOM 0 HD3 ARG A 176 17.748 -3.706 -9.414 1.00 0.00 H new ATOM 0 HE ARG A 176 17.217 -4.838 -12.136 1.00 0.00 H new ATOM 0 HH11 ARG A 176 16.702 -2.250 -9.724 1.00 0.00 H new ATOM 0 HH12 ARG A 176 15.368 -1.526 -10.628 1.00 0.00 H new ATOM 0 HH21 ARG A 176 15.519 -3.878 -13.280 1.00 0.00 H new ATOM 0 HH22 ARG A 176 14.700 -2.449 -12.641 1.00 0.00 H new ATOM 603 N THR A 177 21.040 -3.275 -6.102 1.00 0.00 N ATOM 604 CA THR A 177 22.048 -3.279 -5.050 1.00 0.00 C ATOM 605 C THR A 177 22.952 -4.508 -5.169 1.00 0.00 C ATOM 606 O THR A 177 22.614 -5.478 -5.849 1.00 0.00 O ATOM 607 CB THR A 177 21.357 -3.253 -3.681 1.00 0.00 C ATOM 608 OG1 THR A 177 20.541 -4.397 -3.540 1.00 0.00 O ATOM 609 CG2 THR A 177 20.495 -1.994 -3.555 1.00 0.00 C ATOM 0 H THR A 177 20.106 -3.538 -5.788 1.00 0.00 H new ATOM 0 HA THR A 177 22.673 -2.392 -5.155 1.00 0.00 H new ATOM 0 HB THR A 177 22.117 -3.248 -2.899 1.00 0.00 H new ATOM 0 HG1 THR A 177 20.102 -4.380 -2.664 1.00 0.00 H new ATOM 0 HG21 THR A 177 20.008 -1.983 -2.580 1.00 0.00 H new ATOM 0 HG22 THR A 177 21.125 -1.110 -3.656 1.00 0.00 H new ATOM 0 HG23 THR A 177 19.738 -1.991 -4.339 1.00 0.00 H new ATOM 617 N ASP A 178 24.107 -4.454 -4.490 1.00 0.00 N ATOM 618 CA ASP A 178 25.068 -5.547 -4.472 1.00 0.00 C ATOM 619 C ASP A 178 24.365 -6.850 -4.091 1.00 0.00 C ATOM 620 O ASP A 178 24.449 -7.840 -4.815 1.00 0.00 O ATOM 621 CB ASP A 178 26.172 -5.204 -3.457 1.00 0.00 C ATOM 622 CG ASP A 178 27.212 -6.317 -3.349 1.00 0.00 C ATOM 623 OD1 ASP A 178 26.835 -7.409 -2.866 1.00 0.00 O ATOM 624 OD2 ASP A 178 28.368 -6.051 -3.746 1.00 0.00 O ATOM 0 H ASP A 178 24.394 -3.645 -3.939 1.00 0.00 H new ATOM 0 HA ASP A 178 25.511 -5.681 -5.459 1.00 0.00 H new ATOM 0 HB2 ASP A 178 26.662 -4.277 -3.753 1.00 0.00 H new ATOM 0 HB3 ASP A 178 25.724 -5.029 -2.479 1.00 0.00 H new ATOM 629 N ASN A 179 23.673 -6.838 -2.946 1.00 0.00 N ATOM 630 CA ASN A 179 22.978 -8.013 -2.446 1.00 0.00 C ATOM 631 C ASN A 179 21.905 -8.475 -3.428 1.00 0.00 C ATOM 632 O ASN A 179 21.749 -9.673 -3.637 1.00 0.00 O ATOM 633 CB ASN A 179 22.359 -7.699 -1.081 1.00 0.00 C ATOM 634 CG ASN A 179 23.419 -7.740 0.015 1.00 0.00 C ATOM 635 OD1 ASN A 179 24.014 -8.788 0.264 1.00 0.00 O ATOM 636 ND2 ASN A 179 23.657 -6.603 0.670 1.00 0.00 N ATOM 0 H ASN A 179 23.584 -6.016 -2.349 1.00 0.00 H new ATOM 0 HA ASN A 179 23.697 -8.825 -2.336 1.00 0.00 H new ATOM 0 HB2 ASN A 179 21.893 -6.714 -1.106 1.00 0.00 H new ATOM 0 HB3 ASN A 179 21.572 -8.419 -0.859 1.00 0.00 H new ATOM 0 HD21 ASN A 179 24.357 -6.579 1.412 1.00 0.00 H new ATOM 0 HD22 ASN A 179 23.139 -5.758 0.429 1.00 0.00 H new ATOM 643 N ALA A 180 21.162 -7.537 -4.028 1.00 0.00 N ATOM 644 CA ALA A 180 20.103 -7.888 -4.965 1.00 0.00 C ATOM 645 C ALA A 180 20.671 -8.707 -6.125 1.00 0.00 C ATOM 646 O ALA A 180 20.155 -9.780 -6.434 1.00 0.00 O ATOM 647 CB ALA A 180 19.424 -6.617 -5.481 1.00 0.00 C ATOM 0 H ALA A 180 21.278 -6.535 -3.878 1.00 0.00 H new ATOM 0 HA ALA A 180 19.359 -8.497 -4.451 1.00 0.00 H new ATOM 0 HB1 ALA A 180 18.633 -6.886 -6.181 1.00 0.00 H new ATOM 0 HB2 ALA A 180 18.995 -6.068 -4.643 1.00 0.00 H new ATOM 0 HB3 ALA A 180 20.159 -5.991 -5.987 1.00 0.00 H new ATOM 653 N ILE A 181 21.731 -8.200 -6.768 1.00 0.00 N ATOM 654 CA ILE A 181 22.338 -8.880 -7.908 1.00 0.00 C ATOM 655 C ILE A 181 22.973 -10.196 -7.454 1.00 0.00 C ATOM 656 O ILE A 181 22.778 -11.228 -8.090 1.00 0.00 O ATOM 657 CB ILE A 181 23.397 -7.980 -8.567 1.00 0.00 C ATOM 658 CG1 ILE A 181 22.791 -6.621 -8.957 1.00 0.00 C ATOM 659 CG2 ILE A 181 23.922 -8.674 -9.829 1.00 0.00 C ATOM 660 CD1 ILE A 181 23.903 -5.577 -9.081 1.00 0.00 C ATOM 0 H ILE A 181 22.182 -7.321 -6.514 1.00 0.00 H new ATOM 0 HA ILE A 181 21.561 -9.096 -8.642 1.00 0.00 H new ATOM 0 HB ILE A 181 24.207 -7.811 -7.857 1.00 0.00 H new ATOM 0 HG12 ILE A 181 22.254 -6.709 -9.902 1.00 0.00 H new ATOM 0 HG13 ILE A 181 22.066 -6.307 -8.207 1.00 0.00 H new ATOM 0 HG21 ILE A 181 24.674 -8.044 -10.305 1.00 0.00 H new ATOM 0 HG22 ILE A 181 24.368 -9.631 -9.559 1.00 0.00 H new ATOM 0 HG23 ILE A 181 23.098 -8.841 -10.522 1.00 0.00 H new ATOM 0 HD11 ILE A 181 23.470 -4.616 -9.357 1.00 0.00 H new ATOM 0 HD12 ILE A 181 24.420 -5.481 -8.126 1.00 0.00 H new ATOM 0 HD13 ILE A 181 24.612 -5.890 -9.848 1.00 0.00 H new ATOM 672 N LYS A 182 23.738 -10.152 -6.357 1.00 0.00 N ATOM 673 CA LYS A 182 24.417 -11.326 -5.827 1.00 0.00 C ATOM 674 C LYS A 182 23.422 -12.461 -5.595 1.00 0.00 C ATOM 675 O LYS A 182 23.615 -13.571 -6.092 1.00 0.00 O ATOM 676 CB LYS A 182 25.114 -10.942 -4.515 1.00 0.00 C ATOM 677 CG LYS A 182 25.815 -12.167 -3.911 1.00 0.00 C ATOM 678 CD LYS A 182 26.665 -11.742 -2.703 1.00 0.00 C ATOM 679 CE LYS A 182 25.905 -11.999 -1.394 1.00 0.00 C ATOM 680 NZ LYS A 182 24.696 -11.162 -1.295 1.00 0.00 N ATOM 0 H LYS A 182 23.899 -9.301 -5.818 1.00 0.00 H new ATOM 0 HA LYS A 182 25.158 -11.676 -6.545 1.00 0.00 H new ATOM 0 HB2 LYS A 182 25.841 -10.151 -4.699 1.00 0.00 H new ATOM 0 HB3 LYS A 182 24.384 -10.546 -3.809 1.00 0.00 H new ATOM 0 HG2 LYS A 182 25.075 -12.906 -3.604 1.00 0.00 H new ATOM 0 HG3 LYS A 182 26.447 -12.642 -4.662 1.00 0.00 H new ATOM 0 HD2 LYS A 182 27.605 -12.295 -2.699 1.00 0.00 H new ATOM 0 HD3 LYS A 182 26.917 -10.685 -2.782 1.00 0.00 H new ATOM 0 HE2 LYS A 182 25.626 -13.051 -1.335 1.00 0.00 H new ATOM 0 HE3 LYS A 182 26.560 -11.795 -0.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 24.516 -10.929 -0.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 24.836 -10.285 -1.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 23.882 -11.681 -1.682 1.00 0.00 H new ATOM 694 N ASN A 183 22.367 -12.179 -4.831 1.00 0.00 N ATOM 695 CA ASN A 183 21.359 -13.172 -4.500 1.00 0.00 C ATOM 696 C ASN A 183 20.677 -13.668 -5.772 1.00 0.00 C ATOM 697 O ASN A 183 20.536 -14.872 -5.965 1.00 0.00 O ATOM 698 CB ASN A 183 20.337 -12.559 -3.535 1.00 0.00 C ATOM 699 CG ASN A 183 20.986 -12.156 -2.208 1.00 0.00 C ATOM 700 OD1 ASN A 183 22.206 -12.245 -2.045 1.00 0.00 O ATOM 701 ND2 ASN A 183 20.168 -11.710 -1.256 1.00 0.00 N ATOM 0 H ASN A 183 22.192 -11.258 -4.428 1.00 0.00 H new ATOM 0 HA ASN A 183 21.831 -14.025 -4.014 1.00 0.00 H new ATOM 0 HB2 ASN A 183 19.879 -11.685 -3.997 1.00 0.00 H new ATOM 0 HB3 ASN A 183 19.538 -13.276 -3.347 1.00 0.00 H new ATOM 0 HD21 ASN A 183 20.545 -11.427 -0.352 1.00 0.00 H new ATOM 0 HD22 ASN A 183 19.165 -11.652 -1.432 1.00 0.00 H new ATOM 708 N HIS A 184 20.259 -12.734 -6.640 1.00 0.00 N ATOM 709 CA HIS A 184 19.597 -13.073 -7.894 1.00 0.00 C ATOM 710 C HIS A 184 20.444 -14.061 -8.691 1.00 0.00 C ATOM 711 O HIS A 184 19.938 -15.086 -9.148 1.00 0.00 O ATOM 712 CB HIS A 184 19.368 -11.793 -8.703 1.00 0.00 C ATOM 713 CG HIS A 184 19.203 -12.054 -10.179 1.00 0.00 C ATOM 714 ND1 HIS A 184 18.114 -12.735 -10.711 1.00 0.00 N ATOM 715 CD2 HIS A 184 19.985 -11.740 -11.261 1.00 0.00 C ATOM 716 CE1 HIS A 184 18.302 -12.784 -12.046 1.00 0.00 C ATOM 717 NE2 HIS A 184 19.429 -12.195 -12.446 1.00 0.00 N ATOM 0 H HIS A 184 20.372 -11.732 -6.488 1.00 0.00 H new ATOM 0 HA HIS A 184 18.637 -13.543 -7.681 1.00 0.00 H new ATOM 0 HB2 HIS A 184 18.479 -11.286 -8.327 1.00 0.00 H new ATOM 0 HB3 HIS A 184 20.209 -11.117 -8.550 1.00 0.00 H new ATOM 0 HD2 HIS A 184 20.920 -11.204 -11.197 1.00 0.00 H new ATOM 0 HE1 HIS A 184 17.607 -13.255 -12.725 1.00 0.00 H new ATOM 0 HE2 HIS A 184 19.794 -12.102 -13.394 1.00 0.00 H new ATOM 725 N TRP A 185 21.729 -13.749 -8.865 1.00 0.00 N ATOM 726 CA TRP A 185 22.623 -14.599 -9.622 1.00 0.00 C ATOM 727 C TRP A 185 22.728 -15.965 -8.958 1.00 0.00 C ATOM 728 O TRP A 185 22.527 -16.979 -9.608 1.00 0.00 O ATOM 729 CB TRP A 185 23.994 -13.938 -9.734 1.00 0.00 C ATOM 730 CG TRP A 185 24.965 -14.675 -10.605 1.00 0.00 C ATOM 731 CD1 TRP A 185 25.733 -15.703 -10.219 1.00 0.00 C ATOM 732 CD2 TRP A 185 25.285 -14.466 -12.013 1.00 0.00 C ATOM 733 NE1 TRP A 185 26.522 -16.148 -11.250 1.00 0.00 N ATOM 734 CE2 TRP A 185 26.288 -15.415 -12.395 1.00 0.00 C ATOM 735 CE3 TRP A 185 24.837 -13.576 -13.014 1.00 0.00 C ATOM 736 CZ2 TRP A 185 26.818 -15.467 -13.686 1.00 0.00 C ATOM 737 CZ3 TRP A 185 25.366 -13.630 -14.320 1.00 0.00 C ATOM 738 CH2 TRP A 185 26.358 -14.571 -14.652 1.00 0.00 C ATOM 0 H TRP A 185 22.167 -12.909 -8.487 1.00 0.00 H new ATOM 0 HA TRP A 185 22.226 -14.739 -10.628 1.00 0.00 H new ATOM 0 HB2 TRP A 185 23.867 -12.929 -10.125 1.00 0.00 H new ATOM 0 HB3 TRP A 185 24.420 -13.841 -8.736 1.00 0.00 H new ATOM 0 HD1 TRP A 185 25.731 -16.126 -9.225 1.00 0.00 H new ATOM 0 HE1 TRP A 185 27.190 -16.916 -11.179 1.00 0.00 H new ATOM 0 HE3 TRP A 185 24.079 -12.844 -12.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 185 27.577 -16.194 -13.935 1.00 0.00 H new ATOM 0 HZ3 TRP A 185 25.007 -12.943 -15.072 1.00 0.00 H new ATOM 0 HH2 TRP A 185 26.763 -14.600 -15.653 1.00 0.00 H new ATOM 749 N ASN A 186 23.038 -15.996 -7.661 1.00 0.00 N ATOM 750 CA ASN A 186 23.176 -17.254 -6.939 1.00 0.00 C ATOM 751 C ASN A 186 21.795 -17.792 -6.548 1.00 0.00 C ATOM 752 O ASN A 186 21.559 -18.119 -5.387 1.00 0.00 O ATOM 753 CB ASN A 186 24.063 -17.040 -5.708 1.00 0.00 C ATOM 754 CG ASN A 186 25.495 -16.714 -6.124 1.00 0.00 C ATOM 755 OD1 ASN A 186 26.318 -17.613 -6.279 1.00 0.00 O ATOM 756 ND2 ASN A 186 25.793 -15.427 -6.306 1.00 0.00 N ATOM 0 H ASN A 186 23.197 -15.164 -7.093 1.00 0.00 H new ATOM 0 HA ASN A 186 23.651 -17.997 -7.580 1.00 0.00 H new ATOM 0 HB2 ASN A 186 23.662 -16.228 -5.101 1.00 0.00 H new ATOM 0 HB3 ASN A 186 24.054 -17.936 -5.087 1.00 0.00 H new ATOM 0 HD21 ASN A 186 26.736 -15.156 -6.585 1.00 0.00 H new ATOM 0 HD22 ASN A 186 25.078 -14.713 -6.166 1.00 0.00 H new ATOM 763 N SER A 187 20.893 -17.886 -7.536 1.00 0.00 N ATOM 764 CA SER A 187 19.543 -18.400 -7.342 1.00 0.00 C ATOM 765 C SER A 187 18.932 -18.697 -8.709 1.00 0.00 C ATOM 766 O SER A 187 18.598 -19.841 -9.008 1.00 0.00 O ATOM 767 CB SER A 187 18.681 -17.373 -6.592 1.00 0.00 C ATOM 768 OG SER A 187 18.987 -17.394 -5.215 1.00 0.00 O ATOM 0 H SER A 187 21.088 -17.604 -8.496 1.00 0.00 H new ATOM 0 HA SER A 187 19.582 -19.312 -6.746 1.00 0.00 H new ATOM 0 HB2 SER A 187 18.856 -16.376 -6.996 1.00 0.00 H new ATOM 0 HB3 SER A 187 17.624 -17.596 -6.741 1.00 0.00 H new ATOM 0 HG SER A 187 19.814 -17.900 -5.071 1.00 0.00 H new ATOM 774 N THR A 188 18.787 -17.651 -9.533 1.00 0.00 N ATOM 775 CA THR A 188 18.196 -17.770 -10.857 1.00 0.00 C ATOM 776 C THR A 188 19.285 -17.978 -11.911 1.00 0.00 C ATOM 777 O THR A 188 19.156 -18.856 -12.764 1.00 0.00 O ATOM 778 CB THR A 188 17.391 -16.498 -11.158 1.00 0.00 C ATOM 779 OG1 THR A 188 16.502 -16.241 -10.090 1.00 0.00 O ATOM 780 CG2 THR A 188 16.591 -16.679 -12.450 1.00 0.00 C ATOM 0 H THR A 188 19.078 -16.703 -9.294 1.00 0.00 H new ATOM 0 HA THR A 188 17.533 -18.635 -10.885 1.00 0.00 H new ATOM 0 HB THR A 188 18.078 -15.660 -11.276 1.00 0.00 H new ATOM 0 HG1 THR A 188 15.989 -15.428 -10.280 1.00 0.00 H new ATOM 0 HG21 THR A 188 16.023 -15.772 -12.656 1.00 0.00 H new ATOM 0 HG22 THR A 188 17.274 -16.875 -13.276 1.00 0.00 H new ATOM 0 HG23 THR A 188 15.906 -17.519 -12.339 1.00 0.00 H new ATOM 788 N MET A 189 20.351 -17.163 -11.856 1.00 0.00 N ATOM 789 CA MET A 189 21.440 -17.227 -12.829 1.00 0.00 C ATOM 790 C MET A 189 22.666 -17.892 -12.195 1.00 0.00 C ATOM 791 O MET A 189 23.773 -17.357 -12.250 1.00 0.00 O ATOM 792 CB MET A 189 21.755 -15.798 -13.311 1.00 0.00 C ATOM 793 CG MET A 189 21.001 -15.508 -14.611 1.00 0.00 C ATOM 794 SD MET A 189 21.618 -16.429 -16.048 1.00 0.00 S ATOM 795 CE MET A 189 23.303 -15.768 -16.126 1.00 0.00 C ATOM 0 H MET A 189 20.477 -16.448 -11.139 1.00 0.00 H new ATOM 0 HA MET A 189 21.149 -17.830 -13.689 1.00 0.00 H new ATOM 0 HB2 MET A 189 21.470 -15.076 -12.546 1.00 0.00 H new ATOM 0 HB3 MET A 189 22.828 -15.687 -13.470 1.00 0.00 H new ATOM 0 HG2 MET A 189 19.947 -15.744 -14.467 1.00 0.00 H new ATOM 0 HG3 MET A 189 21.062 -14.441 -14.824 1.00 0.00 H new ATOM 0 HE1 MET A 189 23.739 -15.996 -17.099 1.00 0.00 H new ATOM 0 HE2 MET A 189 23.277 -14.688 -15.985 1.00 0.00 H new ATOM 0 HE3 MET A 189 23.909 -16.222 -15.342 1.00 0.00 H new ATOM 805 N ARG A 190 22.465 -19.068 -11.589 1.00 0.00 N ATOM 806 CA ARG A 190 23.543 -19.795 -10.932 1.00 0.00 C ATOM 807 C ARG A 190 24.413 -20.500 -11.981 1.00 0.00 C ATOM 808 O ARG A 190 24.467 -21.730 -12.027 1.00 0.00 O ATOM 809 CB ARG A 190 22.937 -20.796 -9.941 1.00 0.00 C ATOM 810 CG ARG A 190 24.032 -21.354 -9.019 1.00 0.00 C ATOM 811 CD ARG A 190 23.799 -22.848 -8.779 1.00 0.00 C ATOM 812 NE ARG A 190 23.990 -23.610 -10.020 1.00 0.00 N ATOM 813 CZ ARG A 190 23.842 -24.943 -10.098 1.00 0.00 C ATOM 814 NH1 ARG A 190 23.511 -25.650 -9.008 1.00 0.00 N ATOM 815 NH2 ARG A 190 24.027 -25.565 -11.269 1.00 0.00 N ATOM 0 H ARG A 190 21.559 -19.534 -11.543 1.00 0.00 H new ATOM 0 HA ARG A 190 24.183 -19.105 -10.382 1.00 0.00 H new ATOM 0 HB2 ARG A 190 22.164 -20.309 -9.347 1.00 0.00 H new ATOM 0 HB3 ARG A 190 22.457 -21.611 -10.483 1.00 0.00 H new ATOM 0 HG2 ARG A 190 25.013 -21.197 -9.468 1.00 0.00 H new ATOM 0 HG3 ARG A 190 24.028 -20.819 -8.069 1.00 0.00 H new ATOM 0 HD2 ARG A 190 24.487 -23.210 -8.015 1.00 0.00 H new ATOM 0 HD3 ARG A 190 22.789 -23.007 -8.400 1.00 0.00 H new ATOM 0 HE ARG A 190 24.248 -23.101 -10.866 1.00 0.00 H new ATOM 0 HH11 ARG A 190 23.371 -25.176 -8.116 1.00 0.00 H new ATOM 0 HH12 ARG A 190 23.399 -26.662 -9.071 1.00 0.00 H new ATOM 0 HH21 ARG A 190 24.279 -25.027 -12.098 1.00 0.00 H new ATOM 0 HH22 ARG A 190 23.916 -26.577 -11.332 1.00 0.00 H new ATOM 829 N ARG A 191 25.092 -19.707 -12.821 1.00 0.00 N ATOM 830 CA ARG A 191 25.967 -20.225 -13.866 1.00 0.00 C ATOM 831 C ARG A 191 27.421 -20.007 -13.463 1.00 0.00 C ATOM 832 O ARG A 191 28.233 -20.924 -13.551 1.00 0.00 O ATOM 833 CB ARG A 191 25.674 -19.497 -15.189 1.00 0.00 C ATOM 834 CG ARG A 191 24.617 -20.256 -16.002 1.00 0.00 C ATOM 835 CD ARG A 191 23.283 -20.266 -15.256 1.00 0.00 C ATOM 836 NE ARG A 191 22.182 -20.622 -16.158 1.00 0.00 N ATOM 837 CZ ARG A 191 20.895 -20.611 -15.775 1.00 0.00 C ATOM 838 NH1 ARG A 191 20.583 -20.374 -14.497 1.00 0.00 N ATOM 839 NH2 ARG A 191 19.927 -20.836 -16.672 1.00 0.00 N ATOM 0 H ARG A 191 25.046 -18.689 -12.790 1.00 0.00 H new ATOM 0 HA ARG A 191 25.788 -21.292 -13.999 1.00 0.00 H new ATOM 0 HB2 ARG A 191 25.325 -18.485 -14.984 1.00 0.00 H new ATOM 0 HB3 ARG A 191 26.591 -19.406 -15.771 1.00 0.00 H new ATOM 0 HG2 ARG A 191 24.493 -19.787 -16.978 1.00 0.00 H new ATOM 0 HG3 ARG A 191 24.950 -21.279 -16.180 1.00 0.00 H new ATOM 0 HD2 ARG A 191 23.328 -20.978 -14.432 1.00 0.00 H new ATOM 0 HD3 ARG A 191 23.098 -19.284 -14.820 1.00 0.00 H new ATOM 0 HE ARG A 191 22.404 -20.889 -17.117 1.00 0.00 H new ATOM 0 HH11 ARG A 191 21.322 -20.202 -13.815 1.00 0.00 H new ATOM 0 HH12 ARG A 191 19.606 -20.365 -14.204 1.00 0.00 H new ATOM 0 HH21 ARG A 191 20.167 -21.016 -17.647 1.00 0.00 H new ATOM 0 HH22 ARG A 191 18.950 -20.828 -16.380 1.00 0.00 H new ATOM 853 N LYS A 192 27.738 -18.777 -13.028 1.00 0.00 N ATOM 854 CA LYS A 192 29.094 -18.393 -12.638 1.00 0.00 C ATOM 855 C LYS A 192 30.040 -18.505 -13.842 1.00 0.00 C ATOM 856 O LYS A 192 31.236 -18.729 -13.671 1.00 0.00 O ATOM 857 CB LYS A 192 29.583 -19.262 -11.465 1.00 0.00 C ATOM 858 CG LYS A 192 28.578 -19.196 -10.306 1.00 0.00 C ATOM 859 CD LYS A 192 29.193 -19.805 -9.039 1.00 0.00 C ATOM 860 CE LYS A 192 29.431 -21.307 -9.235 1.00 0.00 C ATOM 861 NZ LYS A 192 29.880 -21.938 -7.981 1.00 0.00 N ATOM 0 H LYS A 192 27.056 -18.023 -12.939 1.00 0.00 H new ATOM 0 HA LYS A 192 29.087 -17.355 -12.305 1.00 0.00 H new ATOM 0 HB2 LYS A 192 29.705 -20.294 -11.793 1.00 0.00 H new ATOM 0 HB3 LYS A 192 30.561 -18.917 -11.129 1.00 0.00 H new ATOM 0 HG2 LYS A 192 28.293 -18.160 -10.120 1.00 0.00 H new ATOM 0 HG3 LYS A 192 27.668 -19.734 -10.572 1.00 0.00 H new ATOM 0 HD2 LYS A 192 30.135 -19.307 -8.808 1.00 0.00 H new ATOM 0 HD3 LYS A 192 28.530 -19.642 -8.190 1.00 0.00 H new ATOM 0 HE2 LYS A 192 28.512 -21.783 -9.577 1.00 0.00 H new ATOM 0 HE3 LYS A 192 30.179 -21.462 -10.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 192 30.034 -22.954 -8.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 192 30.769 -21.497 -7.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 192 29.154 -21.808 -7.248 1.00 0.00 H new ATOM 875 N VAL A 193 29.494 -18.343 -15.060 1.00 0.00 N ATOM 876 CA VAL A 193 30.278 -18.420 -16.288 1.00 0.00 C ATOM 877 C VAL A 193 30.688 -17.014 -16.729 1.00 0.00 C ATOM 878 O VAL A 193 31.797 -16.816 -17.220 1.00 0.00 O ATOM 879 CB VAL A 193 29.448 -19.119 -17.379 1.00 0.00 C ATOM 880 CG1 VAL A 193 30.187 -19.060 -18.720 1.00 0.00 C ATOM 881 CG2 VAL A 193 29.221 -20.584 -16.995 1.00 0.00 C ATOM 0 H VAL A 193 28.503 -18.157 -15.212 1.00 0.00 H new ATOM 0 HA VAL A 193 31.184 -19.000 -16.114 1.00 0.00 H new ATOM 0 HB VAL A 193 28.489 -18.610 -17.472 1.00 0.00 H new ATOM 0 HG11 VAL A 193 29.592 -19.557 -19.486 1.00 0.00 H new ATOM 0 HG12 VAL A 193 30.346 -18.019 -19.003 1.00 0.00 H new ATOM 0 HG13 VAL A 193 31.150 -19.561 -18.627 1.00 0.00 H new ATOM 0 HG21 VAL A 193 28.633 -21.076 -17.770 1.00 0.00 H new ATOM 0 HG22 VAL A 193 30.183 -21.087 -16.895 1.00 0.00 H new ATOM 0 HG23 VAL A 193 28.686 -20.633 -16.047 1.00 0.00 H new HETATM 891 N NH2 A 194 29.791 -16.039 -16.559 1.00 0.00 N TER 894 NH2 A 194