USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 906 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 85 TYR OH : rot 180:sc= 0.0225 USER MOD Set 1.2: A 86 LYS NZ :NH3+ -144:sc= 0.0244 (180deg=0) USER MOD Set 2.1: A 37 SER OG : rot 180:sc= -0.612 USER MOD Set 2.2: A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 39:sc= 0.289 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 28:sc= 0.167 USER MOD Single : A 6 SER OG : rot 29:sc= 0.895 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc=-0.00822 X(o=-0.0082,f=-0.33) USER MOD Single : A 18 ASN : amide:sc= -6.55! C(o=-6.5!,f=-13!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0263) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -17:sc= 0.904 USER MOD Single : A 39 SER OG : rot 120:sc= -1.98 USER MOD Single : A 41 TYR OH : rot 70:sc= -0.345 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.019) USER MOD Single : A 49 LYS NZ :NH3+ -137:sc=-0.00185 (180deg=-0.609) USER MOD Single : A 50 LYS NZ :NH3+ 171:sc= -0.757 (180deg=-0.935) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.66 K(o=-0.66,f=-1.6) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0.0399 USER MOD Single : A 70 ASN : amide:sc= -0.0111 X(o=-0.011,f=-0.21) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HD1:sc= -0.245 X(o=-0.24,f=-0.23) USER MOD Single : A 78 ASN :FLIP amide:sc= -1.23 F(o=-3.5!,f=-1.2) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0686 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 83 ASN : amide:sc= -0.729 K(o=-0.73,f=-5!) USER MOD Single : A 90 GLN : amide:sc= -1.11 K(o=-1.1,f=-1.8) USER MOD Single : A 95 CYS SG : rot 180:sc= -1.4 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.0769 X(o=-0.077,f=-0.19) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot -155:sc= -1.13 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.933 18.615 -9.852 1.00 0.00 N ATOM 2 CA GLY A 1 14.156 17.738 -8.995 1.00 0.00 C ATOM 3 C GLY A 1 13.454 18.488 -7.881 1.00 0.00 C ATOM 4 O GLY A 1 12.635 19.371 -8.138 1.00 0.00 O ATOM 0 H1 GLY A 1 15.393 18.054 -10.597 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.305 19.320 -10.287 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.659 19.100 -9.286 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.416 17.210 -9.596 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.812 16.983 -8.563 1.00 0.00 H new ATOM 8 N SER A 2 13.773 18.136 -6.640 1.00 0.00 N ATOM 9 CA SER A 2 13.162 18.779 -5.482 1.00 0.00 C ATOM 10 C SER A 2 13.963 20.006 -5.057 1.00 0.00 C ATOM 11 O SER A 2 15.126 19.897 -4.668 1.00 0.00 O ATOM 12 CB SER A 2 13.062 17.792 -4.318 1.00 0.00 C ATOM 13 OG SER A 2 14.323 17.213 -4.031 1.00 0.00 O ATOM 0 H SER A 2 14.451 17.409 -6.410 1.00 0.00 H new ATOM 0 HA SER A 2 12.159 19.101 -5.763 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.684 18.305 -3.434 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.345 17.008 -4.562 1.00 0.00 H new ATOM 0 HG SER A 2 15.024 17.892 -4.125 1.00 0.00 H new ATOM 19 N SER A 3 13.331 21.173 -5.134 1.00 0.00 N ATOM 20 CA SER A 3 13.985 22.422 -4.761 1.00 0.00 C ATOM 21 C SER A 3 13.734 22.749 -3.292 1.00 0.00 C ATOM 22 O SER A 3 13.293 23.847 -2.955 1.00 0.00 O ATOM 23 CB SER A 3 13.484 23.567 -5.643 1.00 0.00 C ATOM 24 OG SER A 3 14.170 23.593 -6.883 1.00 0.00 O ATOM 0 H SER A 3 12.367 21.280 -5.451 1.00 0.00 H new ATOM 0 HA SER A 3 15.058 22.301 -4.910 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.414 23.454 -5.818 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.624 24.516 -5.126 1.00 0.00 H new ATOM 0 HG SER A 3 13.831 24.332 -7.429 1.00 0.00 H new ATOM 30 N GLY A 4 14.018 21.785 -2.421 1.00 0.00 N ATOM 31 CA GLY A 4 13.817 21.989 -0.998 1.00 0.00 C ATOM 32 C GLY A 4 13.916 20.699 -0.208 1.00 0.00 C ATOM 33 O GLY A 4 13.825 19.609 -0.772 1.00 0.00 O ATOM 0 H GLY A 4 14.383 20.867 -2.675 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.559 22.696 -0.627 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.838 22.438 -0.833 1.00 0.00 H new ATOM 37 N SER A 5 14.105 20.823 1.102 1.00 0.00 N ATOM 38 CA SER A 5 14.223 19.657 1.971 1.00 0.00 C ATOM 39 C SER A 5 12.846 19.099 2.319 1.00 0.00 C ATOM 40 O SER A 5 11.953 19.836 2.736 1.00 0.00 O ATOM 41 CB SER A 5 14.977 20.022 3.250 1.00 0.00 C ATOM 42 OG SER A 5 14.346 21.096 3.925 1.00 0.00 O ATOM 0 H SER A 5 14.180 21.718 1.585 1.00 0.00 H new ATOM 0 HA SER A 5 14.782 18.890 1.436 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.026 19.154 3.907 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.004 20.295 3.005 1.00 0.00 H new ATOM 0 HG SER A 5 13.388 21.093 3.720 1.00 0.00 H new ATOM 48 N SER A 6 12.684 17.791 2.146 1.00 0.00 N ATOM 49 CA SER A 6 11.416 17.133 2.439 1.00 0.00 C ATOM 50 C SER A 6 11.559 15.616 2.355 1.00 0.00 C ATOM 51 O SER A 6 11.817 15.064 1.286 1.00 0.00 O ATOM 52 CB SER A 6 10.334 17.609 1.467 1.00 0.00 C ATOM 53 OG SER A 6 10.615 17.185 0.144 1.00 0.00 O ATOM 0 H SER A 6 13.415 17.166 1.805 1.00 0.00 H new ATOM 0 HA SER A 6 11.124 17.397 3.455 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.364 17.221 1.779 1.00 0.00 H new ATOM 0 HB3 SER A 6 10.266 18.696 1.497 1.00 0.00 H new ATOM 0 HG SER A 6 11.122 16.347 0.170 1.00 0.00 H new ATOM 59 N GLY A 7 11.390 14.948 3.492 1.00 0.00 N ATOM 60 CA GLY A 7 11.504 13.502 3.527 1.00 0.00 C ATOM 61 C GLY A 7 10.156 12.812 3.458 1.00 0.00 C ATOM 62 O GLY A 7 9.366 13.066 2.549 1.00 0.00 O ATOM 0 H GLY A 7 11.176 15.383 4.390 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.122 13.169 2.693 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.015 13.203 4.442 1.00 0.00 H new ATOM 66 N VAL A 8 9.892 11.935 4.422 1.00 0.00 N ATOM 67 CA VAL A 8 8.630 11.206 4.467 1.00 0.00 C ATOM 68 C VAL A 8 7.462 12.103 4.074 1.00 0.00 C ATOM 69 O VAL A 8 7.370 13.248 4.518 1.00 0.00 O ATOM 70 CB VAL A 8 8.368 10.625 5.869 1.00 0.00 C ATOM 71 CG1 VAL A 8 6.945 10.097 5.971 1.00 0.00 C ATOM 72 CG2 VAL A 8 9.375 9.531 6.190 1.00 0.00 C ATOM 0 H VAL A 8 10.535 11.712 5.182 1.00 0.00 H new ATOM 0 HA VAL A 8 8.712 10.388 3.752 1.00 0.00 H new ATOM 0 HB VAL A 8 8.488 11.423 6.602 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.778 9.690 6.969 1.00 0.00 H new ATOM 0 HG12 VAL A 8 6.242 10.909 5.788 1.00 0.00 H new ATOM 0 HG13 VAL A 8 6.794 9.312 5.230 1.00 0.00 H new ATOM 0 HG21 VAL A 8 9.174 9.132 7.184 1.00 0.00 H new ATOM 0 HG22 VAL A 8 9.290 8.731 5.454 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.383 9.945 6.162 1.00 0.00 H new ATOM 82 N ILE A 9 6.573 11.576 3.240 1.00 0.00 N ATOM 83 CA ILE A 9 5.409 12.329 2.789 1.00 0.00 C ATOM 84 C ILE A 9 4.213 12.095 3.706 1.00 0.00 C ATOM 85 O ILE A 9 3.447 13.016 3.990 1.00 0.00 O ATOM 86 CB ILE A 9 5.018 11.951 1.348 1.00 0.00 C ATOM 87 CG1 ILE A 9 6.235 12.048 0.424 1.00 0.00 C ATOM 88 CG2 ILE A 9 3.896 12.850 0.850 1.00 0.00 C ATOM 89 CD1 ILE A 9 6.042 11.350 -0.904 1.00 0.00 C ATOM 0 H ILE A 9 6.636 10.631 2.863 1.00 0.00 H new ATOM 0 HA ILE A 9 5.685 13.383 2.818 1.00 0.00 H new ATOM 0 HB ILE A 9 4.662 10.921 1.343 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.461 13.099 0.244 1.00 0.00 H new ATOM 0 HG13 ILE A 9 7.100 11.618 0.929 1.00 0.00 H new ATOM 0 HG21 ILE A 9 3.631 12.570 -0.170 1.00 0.00 H new ATOM 0 HG22 ILE A 9 3.025 12.736 1.495 1.00 0.00 H new ATOM 0 HG23 ILE A 9 4.227 13.888 0.867 1.00 0.00 H new ATOM 0 HD11 ILE A 9 6.943 11.460 -1.507 1.00 0.00 H new ATOM 0 HD12 ILE A 9 5.846 10.291 -0.734 1.00 0.00 H new ATOM 0 HD13 ILE A 9 5.197 11.795 -1.430 1.00 0.00 H new ATOM 101 N ARG A 10 4.061 10.858 4.167 1.00 0.00 N ATOM 102 CA ARG A 10 2.959 10.503 5.053 1.00 0.00 C ATOM 103 C ARG A 10 3.211 9.154 5.720 1.00 0.00 C ATOM 104 O ARG A 10 4.075 8.390 5.291 1.00 0.00 O ATOM 105 CB ARG A 10 1.644 10.461 4.273 1.00 0.00 C ATOM 106 CG ARG A 10 0.422 10.246 5.151 1.00 0.00 C ATOM 107 CD ARG A 10 -0.820 10.878 4.542 1.00 0.00 C ATOM 108 NE ARG A 10 -2.039 10.174 4.931 1.00 0.00 N ATOM 109 CZ ARG A 10 -2.625 10.319 6.114 1.00 0.00 C ATOM 110 NH1 ARG A 10 -2.107 11.138 7.019 1.00 0.00 N ATOM 111 NH2 ARG A 10 -3.733 9.644 6.395 1.00 0.00 N ATOM 0 H ARG A 10 4.687 10.085 3.942 1.00 0.00 H new ATOM 0 HA ARG A 10 2.889 11.265 5.829 1.00 0.00 H new ATOM 0 HB2 ARG A 10 1.527 11.395 3.724 1.00 0.00 H new ATOM 0 HB3 ARG A 10 1.695 9.662 3.534 1.00 0.00 H new ATOM 0 HG2 ARG A 10 0.257 9.178 5.291 1.00 0.00 H new ATOM 0 HG3 ARG A 10 0.602 10.673 6.138 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -0.887 11.920 4.855 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -0.732 10.877 3.456 1.00 0.00 H new ATOM 0 HE ARG A 10 -2.463 9.536 4.258 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -1.256 11.659 6.808 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -2.560 11.247 7.927 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -4.135 9.013 5.702 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -4.182 9.756 7.304 1.00 0.00 H new ATOM 125 N ARG A 11 2.451 8.870 6.773 1.00 0.00 N ATOM 126 CA ARG A 11 2.593 7.614 7.501 1.00 0.00 C ATOM 127 C ARG A 11 1.300 7.259 8.228 1.00 0.00 C ATOM 128 O ARG A 11 0.538 8.138 8.628 1.00 0.00 O ATOM 129 CB ARG A 11 3.745 7.709 8.503 1.00 0.00 C ATOM 130 CG ARG A 11 5.081 8.049 7.864 1.00 0.00 C ATOM 131 CD ARG A 11 6.176 8.199 8.909 1.00 0.00 C ATOM 132 NE ARG A 11 6.081 9.470 9.622 1.00 0.00 N ATOM 133 CZ ARG A 11 7.042 9.945 10.407 1.00 0.00 C ATOM 134 NH1 ARG A 11 8.164 9.260 10.577 1.00 0.00 N ATOM 135 NH2 ARG A 11 6.882 11.110 11.023 1.00 0.00 N ATOM 0 H ARG A 11 1.731 9.492 7.141 1.00 0.00 H new ATOM 0 HA ARG A 11 2.812 6.827 6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 11 3.505 8.467 9.249 1.00 0.00 H new ATOM 0 HB3 ARG A 11 3.835 6.760 9.031 1.00 0.00 H new ATOM 0 HG2 ARG A 11 5.357 7.267 7.156 1.00 0.00 H new ATOM 0 HG3 ARG A 11 4.989 8.975 7.296 1.00 0.00 H new ATOM 0 HD2 ARG A 11 6.111 7.377 9.622 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.150 8.126 8.426 1.00 0.00 H new ATOM 0 HE ARG A 11 5.231 10.023 9.511 1.00 0.00 H new ATOM 0 HH11 ARG A 11 8.292 8.365 10.104 1.00 0.00 H new ATOM 0 HH12 ARG A 11 8.900 9.628 11.180 1.00 0.00 H new ATOM 0 HH21 ARG A 11 6.021 11.641 10.894 1.00 0.00 H new ATOM 0 HH22 ARG A 11 7.620 11.474 11.625 1.00 0.00 H new ATOM 149 N GLY A 12 1.058 5.962 8.396 1.00 0.00 N ATOM 150 CA GLY A 12 -0.144 5.513 9.074 1.00 0.00 C ATOM 151 C GLY A 12 -0.209 4.003 9.199 1.00 0.00 C ATOM 152 O GLY A 12 0.499 3.285 8.493 1.00 0.00 O ATOM 0 H GLY A 12 1.673 5.215 8.075 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -0.185 5.959 10.068 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -1.019 5.868 8.529 1.00 0.00 H new ATOM 156 N TRP A 13 -1.059 3.522 10.099 1.00 0.00 N ATOM 157 CA TRP A 13 -1.213 2.088 10.314 1.00 0.00 C ATOM 158 C TRP A 13 -2.221 1.495 9.336 1.00 0.00 C ATOM 159 O TRP A 13 -3.432 1.613 9.530 1.00 0.00 O ATOM 160 CB TRP A 13 -1.655 1.812 11.752 1.00 0.00 C ATOM 161 CG TRP A 13 -0.569 2.032 12.761 1.00 0.00 C ATOM 162 CD1 TRP A 13 -0.225 3.215 13.350 1.00 0.00 C ATOM 163 CD2 TRP A 13 0.316 1.042 13.296 1.00 0.00 C ATOM 164 NE1 TRP A 13 0.821 3.021 14.220 1.00 0.00 N ATOM 165 CE2 TRP A 13 1.171 1.696 14.206 1.00 0.00 C ATOM 166 CE3 TRP A 13 0.469 -0.332 13.098 1.00 0.00 C ATOM 167 CZ2 TRP A 13 2.162 1.021 14.912 1.00 0.00 C ATOM 168 CZ3 TRP A 13 1.454 -1.001 13.800 1.00 0.00 C ATOM 169 CH2 TRP A 13 2.289 -0.325 14.699 1.00 0.00 C ATOM 0 H TRP A 13 -1.652 4.104 10.691 1.00 0.00 H new ATOM 0 HA TRP A 13 -0.247 1.614 10.141 1.00 0.00 H new ATOM 0 HB2 TRP A 13 -2.501 2.455 11.994 1.00 0.00 H new ATOM 0 HB3 TRP A 13 -2.006 0.783 11.825 1.00 0.00 H new ATOM 0 HD1 TRP A 13 -0.705 4.164 13.160 1.00 0.00 H new ATOM 0 HE1 TRP A 13 1.265 3.745 14.784 1.00 0.00 H new ATOM 0 HE3 TRP A 13 -0.171 -0.862 12.409 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 2.808 1.541 15.604 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 1.582 -2.063 13.653 1.00 0.00 H new ATOM 0 HH2 TRP A 13 3.048 -0.877 15.234 1.00 0.00 H new ATOM 180 N LEU A 14 -1.716 0.859 8.285 1.00 0.00 N ATOM 181 CA LEU A 14 -2.574 0.247 7.276 1.00 0.00 C ATOM 182 C LEU A 14 -2.763 -1.241 7.553 1.00 0.00 C ATOM 183 O LEU A 14 -2.102 -1.812 8.420 1.00 0.00 O ATOM 184 CB LEU A 14 -1.977 0.447 5.882 1.00 0.00 C ATOM 185 CG LEU A 14 -2.359 1.743 5.168 1.00 0.00 C ATOM 186 CD1 LEU A 14 -1.535 1.918 3.901 1.00 0.00 C ATOM 187 CD2 LEU A 14 -3.846 1.756 4.845 1.00 0.00 C ATOM 0 H LEU A 14 -0.717 0.753 8.109 1.00 0.00 H new ATOM 0 HA LEU A 14 -3.549 0.732 7.320 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -0.891 0.408 5.965 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -2.279 -0.392 5.255 1.00 0.00 H new ATOM 0 HG LEU A 14 -2.145 2.579 5.834 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.821 2.846 3.406 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.476 1.955 4.158 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -1.717 1.078 3.230 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -4.100 2.686 4.337 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -4.085 0.912 4.198 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -4.420 1.679 5.769 1.00 0.00 H new ATOM 199 N THR A 15 -3.670 -1.865 6.807 1.00 0.00 N ATOM 200 CA THR A 15 -3.947 -3.287 6.971 1.00 0.00 C ATOM 201 C THR A 15 -4.161 -3.964 5.622 1.00 0.00 C ATOM 202 O THR A 15 -5.144 -3.694 4.931 1.00 0.00 O ATOM 203 CB THR A 15 -5.188 -3.520 7.853 1.00 0.00 C ATOM 204 OG1 THR A 15 -4.939 -3.051 9.182 1.00 0.00 O ATOM 205 CG2 THR A 15 -5.555 -4.996 7.891 1.00 0.00 C ATOM 0 H THR A 15 -4.225 -1.408 6.084 1.00 0.00 H new ATOM 0 HA THR A 15 -3.077 -3.724 7.460 1.00 0.00 H new ATOM 0 HB THR A 15 -6.022 -2.965 7.423 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.733 -3.201 9.736 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.434 -5.136 8.520 1.00 0.00 H new ATOM 0 HG22 THR A 15 -5.772 -5.343 6.881 1.00 0.00 H new ATOM 0 HG23 THR A 15 -4.722 -5.568 8.300 1.00 0.00 H new ATOM 213 N ILE A 16 -3.236 -4.843 5.253 1.00 0.00 N ATOM 214 CA ILE A 16 -3.326 -5.560 3.987 1.00 0.00 C ATOM 215 C ILE A 16 -4.526 -6.501 3.972 1.00 0.00 C ATOM 216 O ILE A 16 -4.778 -7.217 4.940 1.00 0.00 O ATOM 217 CB ILE A 16 -2.048 -6.372 3.708 1.00 0.00 C ATOM 218 CG1 ILE A 16 -0.812 -5.481 3.845 1.00 0.00 C ATOM 219 CG2 ILE A 16 -2.108 -6.994 2.321 1.00 0.00 C ATOM 220 CD1 ILE A 16 0.493 -6.244 3.783 1.00 0.00 C ATOM 0 H ILE A 16 -2.416 -5.076 5.813 1.00 0.00 H new ATOM 0 HA ILE A 16 -3.447 -4.808 3.207 1.00 0.00 H new ATOM 0 HB ILE A 16 -1.977 -7.175 4.442 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -0.824 -4.733 3.053 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -0.865 -4.944 4.792 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -1.198 -7.565 2.139 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -2.971 -7.657 2.257 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.199 -6.207 1.573 1.00 0.00 H new ATOM 0 HD11 ILE A 16 1.326 -5.549 3.887 1.00 0.00 H new ATOM 0 HD12 ILE A 16 0.526 -6.974 4.592 1.00 0.00 H new ATOM 0 HD13 ILE A 16 0.568 -6.760 2.826 1.00 0.00 H new ATOM 232 N ASN A 17 -5.262 -6.496 2.865 1.00 0.00 N ATOM 233 CA ASN A 17 -6.435 -7.350 2.723 1.00 0.00 C ATOM 234 C ASN A 17 -6.121 -8.567 1.858 1.00 0.00 C ATOM 235 O ASN A 17 -6.785 -9.598 1.955 1.00 0.00 O ATOM 236 CB ASN A 17 -7.595 -6.561 2.112 1.00 0.00 C ATOM 237 CG ASN A 17 -8.947 -7.072 2.572 1.00 0.00 C ATOM 238 OD1 ASN A 17 -9.068 -8.201 3.046 1.00 0.00 O ATOM 239 ND2 ASN A 17 -9.972 -6.239 2.432 1.00 0.00 N ATOM 0 H ASN A 17 -5.066 -5.910 2.053 1.00 0.00 H new ATOM 0 HA ASN A 17 -6.723 -7.697 3.715 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -7.497 -5.509 2.380 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -7.538 -6.619 1.025 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -10.906 -6.527 2.723 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -9.825 -5.312 2.034 1.00 0.00 H new ATOM 246 N ASN A 18 -5.103 -8.438 1.013 1.00 0.00 N ATOM 247 CA ASN A 18 -4.700 -9.527 0.131 1.00 0.00 C ATOM 248 C ASN A 18 -3.557 -10.330 0.745 1.00 0.00 C ATOM 249 O ASN A 18 -2.450 -10.364 0.208 1.00 0.00 O ATOM 250 CB ASN A 18 -4.275 -8.976 -1.232 1.00 0.00 C ATOM 251 CG ASN A 18 -2.933 -8.271 -1.178 1.00 0.00 C ATOM 252 OD1 ASN A 18 -2.732 -7.357 -0.378 1.00 0.00 O ATOM 253 ND2 ASN A 18 -2.009 -8.693 -2.032 1.00 0.00 N ATOM 0 H ASN A 18 -4.543 -7.591 0.921 1.00 0.00 H new ATOM 0 HA ASN A 18 -5.556 -10.189 -0.002 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -4.224 -9.793 -1.951 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -5.033 -8.281 -1.592 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -1.087 -8.256 -2.043 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -2.220 -9.454 -2.677 1.00 0.00 H new ATOM 260 N ILE A 19 -3.835 -10.976 1.873 1.00 0.00 N ATOM 261 CA ILE A 19 -2.832 -11.781 2.559 1.00 0.00 C ATOM 262 C ILE A 19 -3.398 -13.138 2.961 1.00 0.00 C ATOM 263 O ILE A 19 -2.803 -14.179 2.680 1.00 0.00 O ATOM 264 CB ILE A 19 -2.300 -11.066 3.815 1.00 0.00 C ATOM 265 CG1 ILE A 19 -1.436 -9.867 3.419 1.00 0.00 C ATOM 266 CG2 ILE A 19 -1.507 -12.035 4.680 1.00 0.00 C ATOM 267 CD1 ILE A 19 -0.021 -10.243 3.035 1.00 0.00 C ATOM 0 H ILE A 19 -4.746 -10.957 2.331 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.010 -11.926 1.858 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.148 -10.702 4.395 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -1.906 -9.351 2.582 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -1.403 -9.162 4.250 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -1.137 -11.515 5.564 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -2.151 -12.859 4.987 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -0.664 -12.425 4.110 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.534 -9.344 2.766 1.00 0.00 H new ATOM 0 HD12 ILE A 19 0.467 -10.732 3.878 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.044 -10.924 2.184 1.00 0.00 H new ATOM 279 N SER A 20 -4.552 -13.121 3.621 1.00 0.00 N ATOM 280 CA SER A 20 -5.198 -14.351 4.064 1.00 0.00 C ATOM 281 C SER A 20 -6.635 -14.083 4.499 1.00 0.00 C ATOM 282 O SER A 20 -6.992 -12.956 4.846 1.00 0.00 O ATOM 283 CB SER A 20 -4.412 -14.977 5.218 1.00 0.00 C ATOM 284 OG SER A 20 -4.764 -16.338 5.395 1.00 0.00 O ATOM 0 H SER A 20 -5.059 -12.269 3.861 1.00 0.00 H new ATOM 0 HA SER A 20 -5.214 -15.047 3.225 1.00 0.00 H new ATOM 0 HB2 SER A 20 -3.343 -14.897 5.020 1.00 0.00 H new ATOM 0 HB3 SER A 20 -4.608 -14.425 6.137 1.00 0.00 H new ATOM 0 HG SER A 20 -4.247 -16.716 6.137 1.00 0.00 H new ATOM 290 N LEU A 21 -7.457 -15.127 4.478 1.00 0.00 N ATOM 291 CA LEU A 21 -8.857 -15.006 4.870 1.00 0.00 C ATOM 292 C LEU A 21 -9.079 -15.560 6.273 1.00 0.00 C ATOM 293 O LEU A 21 -9.857 -15.011 7.052 1.00 0.00 O ATOM 294 CB LEU A 21 -9.752 -15.742 3.871 1.00 0.00 C ATOM 295 CG LEU A 21 -10.251 -14.918 2.683 1.00 0.00 C ATOM 296 CD1 LEU A 21 -10.776 -13.570 3.152 1.00 0.00 C ATOM 297 CD2 LEU A 21 -9.141 -14.734 1.658 1.00 0.00 C ATOM 0 H LEU A 21 -7.178 -16.066 4.194 1.00 0.00 H new ATOM 0 HA LEU A 21 -9.118 -13.948 4.872 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -9.203 -16.601 3.486 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -10.618 -16.131 4.407 1.00 0.00 H new ATOM 0 HG LEU A 21 -11.070 -15.458 2.208 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.127 -12.997 2.293 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.601 -13.723 3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -9.977 -13.022 3.652 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.514 -14.145 0.820 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.301 -14.215 2.120 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.812 -15.709 1.299 1.00 0.00 H new ATOM 309 N MET A 22 -8.389 -16.651 6.590 1.00 0.00 N ATOM 310 CA MET A 22 -8.508 -17.277 7.901 1.00 0.00 C ATOM 311 C MET A 22 -7.683 -16.525 8.940 1.00 0.00 C ATOM 312 O MET A 22 -7.087 -15.489 8.644 1.00 0.00 O ATOM 313 CB MET A 22 -8.058 -18.738 7.835 1.00 0.00 C ATOM 314 CG MET A 22 -8.946 -19.608 6.961 1.00 0.00 C ATOM 315 SD MET A 22 -8.394 -21.324 6.901 1.00 0.00 S ATOM 316 CE MET A 22 -7.748 -21.414 5.233 1.00 0.00 C ATOM 0 H MET A 22 -7.742 -17.120 5.956 1.00 0.00 H new ATOM 0 HA MET A 22 -9.556 -17.240 8.200 1.00 0.00 H new ATOM 0 HB2 MET A 22 -7.037 -18.778 7.455 1.00 0.00 H new ATOM 0 HB3 MET A 22 -8.040 -19.150 8.844 1.00 0.00 H new ATOM 0 HG2 MET A 22 -9.968 -19.572 7.338 1.00 0.00 H new ATOM 0 HG3 MET A 22 -8.965 -19.201 5.950 1.00 0.00 H new ATOM 0 HE1 MET A 22 -7.368 -22.418 5.044 1.00 0.00 H new ATOM 0 HE2 MET A 22 -8.543 -21.187 4.522 1.00 0.00 H new ATOM 0 HE3 MET A 22 -6.940 -20.692 5.116 1.00 0.00 H new ATOM 326 N LYS A 23 -7.651 -17.053 10.159 1.00 0.00 N ATOM 327 CA LYS A 23 -6.898 -16.432 11.243 1.00 0.00 C ATOM 328 C LYS A 23 -5.613 -17.205 11.524 1.00 0.00 C ATOM 329 O LYS A 23 -5.649 -18.327 12.027 1.00 0.00 O ATOM 330 CB LYS A 23 -7.752 -16.364 12.511 1.00 0.00 C ATOM 331 CG LYS A 23 -8.936 -15.419 12.396 1.00 0.00 C ATOM 332 CD LYS A 23 -10.088 -15.859 13.283 1.00 0.00 C ATOM 333 CE LYS A 23 -9.898 -15.390 14.718 1.00 0.00 C ATOM 334 NZ LYS A 23 -10.200 -13.940 14.872 1.00 0.00 N ATOM 0 H LYS A 23 -8.138 -17.910 10.421 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.634 -15.420 10.936 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -8.117 -17.364 12.747 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.125 -16.048 13.345 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.627 -14.411 12.673 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -9.269 -15.376 11.359 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -11.024 -15.461 12.890 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.170 -16.946 13.262 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -10.545 -15.968 15.378 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -8.871 -15.582 15.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.174 -13.685 15.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -9.491 -13.381 14.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -11.146 -13.740 14.488 1.00 0.00 H new ATOM 348 N GLY A 24 -4.477 -16.595 11.197 1.00 0.00 N ATOM 349 CA GLY A 24 -3.197 -17.240 11.423 1.00 0.00 C ATOM 350 C GLY A 24 -2.032 -16.281 11.280 1.00 0.00 C ATOM 351 O GLY A 24 -0.993 -16.634 10.723 1.00 0.00 O ATOM 0 H GLY A 24 -4.421 -15.666 10.780 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.184 -17.676 12.422 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.077 -18.061 10.716 1.00 0.00 H new ATOM 355 N GLY A 25 -2.204 -15.063 11.784 1.00 0.00 N ATOM 356 CA GLY A 25 -1.151 -14.069 11.698 1.00 0.00 C ATOM 357 C GLY A 25 -1.672 -12.655 11.865 1.00 0.00 C ATOM 358 O GLY A 25 -2.602 -12.416 12.635 1.00 0.00 O ATOM 0 H GLY A 25 -3.054 -14.747 12.250 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.403 -14.270 12.465 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.651 -14.157 10.734 1.00 0.00 H new ATOM 362 N SER A 26 -1.072 -11.715 11.142 1.00 0.00 N ATOM 363 CA SER A 26 -1.478 -10.317 11.218 1.00 0.00 C ATOM 364 C SER A 26 -1.555 -9.697 9.826 1.00 0.00 C ATOM 365 O SER A 26 -0.879 -10.140 8.897 1.00 0.00 O ATOM 366 CB SER A 26 -0.498 -9.526 12.087 1.00 0.00 C ATOM 367 OG SER A 26 0.776 -9.443 11.473 1.00 0.00 O ATOM 0 H SER A 26 -0.303 -11.896 10.497 1.00 0.00 H new ATOM 0 HA SER A 26 -2.469 -10.276 11.670 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.888 -8.523 12.259 1.00 0.00 H new ATOM 0 HB3 SER A 26 -0.405 -10.004 13.062 1.00 0.00 H new ATOM 0 HG SER A 26 1.383 -8.931 12.047 1.00 0.00 H new ATOM 373 N LYS A 27 -2.384 -8.668 9.688 1.00 0.00 N ATOM 374 CA LYS A 27 -2.550 -7.984 8.411 1.00 0.00 C ATOM 375 C LYS A 27 -2.156 -6.515 8.525 1.00 0.00 C ATOM 376 O LYS A 27 -1.950 -5.839 7.518 1.00 0.00 O ATOM 377 CB LYS A 27 -4.000 -8.099 7.933 1.00 0.00 C ATOM 378 CG LYS A 27 -4.445 -9.528 7.679 1.00 0.00 C ATOM 379 CD LYS A 27 -5.935 -9.700 7.925 1.00 0.00 C ATOM 380 CE LYS A 27 -6.522 -10.795 7.047 1.00 0.00 C ATOM 381 NZ LYS A 27 -7.846 -11.257 7.548 1.00 0.00 N ATOM 0 H LYS A 27 -2.952 -8.289 10.446 1.00 0.00 H new ATOM 0 HA LYS A 27 -1.894 -8.462 7.683 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -4.656 -7.650 8.679 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -4.118 -7.522 7.016 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.210 -9.806 6.651 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -3.888 -10.204 8.327 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -6.106 -9.942 8.974 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -6.449 -8.759 7.727 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -6.628 -10.425 6.027 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -5.833 -11.639 7.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.213 -12.003 6.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -7.740 -11.634 8.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -8.511 -10.457 7.560 1.00 0.00 H new ATOM 395 N GLU A 28 -2.053 -6.028 9.758 1.00 0.00 N ATOM 396 CA GLU A 28 -1.682 -4.639 10.001 1.00 0.00 C ATOM 397 C GLU A 28 -0.174 -4.447 9.867 1.00 0.00 C ATOM 398 O GLU A 28 0.609 -5.329 10.218 1.00 0.00 O ATOM 399 CB GLU A 28 -2.141 -4.202 11.394 1.00 0.00 C ATOM 400 CG GLU A 28 -1.651 -2.820 11.791 1.00 0.00 C ATOM 401 CD GLU A 28 -2.388 -2.262 12.993 1.00 0.00 C ATOM 402 OE1 GLU A 28 -3.464 -1.658 12.802 1.00 0.00 O ATOM 403 OE2 GLU A 28 -1.888 -2.431 14.125 1.00 0.00 O ATOM 0 H GLU A 28 -2.221 -6.574 10.603 1.00 0.00 H new ATOM 0 HA GLU A 28 -2.177 -4.021 9.252 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.230 -4.216 11.429 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -1.789 -4.928 12.127 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -0.585 -2.867 12.013 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -1.772 -2.140 10.948 1.00 0.00 H new ATOM 410 N TYR A 29 0.224 -3.287 9.355 1.00 0.00 N ATOM 411 CA TYR A 29 1.638 -2.979 9.171 1.00 0.00 C ATOM 412 C TYR A 29 1.868 -1.471 9.154 1.00 0.00 C ATOM 413 O TYR A 29 0.995 -0.703 8.752 1.00 0.00 O ATOM 414 CB TYR A 29 2.151 -3.599 7.871 1.00 0.00 C ATOM 415 CG TYR A 29 2.281 -5.105 7.928 1.00 0.00 C ATOM 416 CD1 TYR A 29 3.419 -5.704 8.452 1.00 0.00 C ATOM 417 CD2 TYR A 29 1.264 -5.928 7.458 1.00 0.00 C ATOM 418 CE1 TYR A 29 3.542 -7.079 8.506 1.00 0.00 C ATOM 419 CE2 TYR A 29 1.378 -7.303 7.509 1.00 0.00 C ATOM 420 CZ TYR A 29 2.519 -7.874 8.033 1.00 0.00 C ATOM 421 OH TYR A 29 2.637 -9.244 8.086 1.00 0.00 O ATOM 0 H TYR A 29 -0.412 -2.546 9.060 1.00 0.00 H new ATOM 0 HA TYR A 29 2.189 -3.403 10.010 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.475 -3.332 7.059 1.00 0.00 H new ATOM 0 HB3 TYR A 29 3.123 -3.168 7.631 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.222 -5.084 8.824 1.00 0.00 H new ATOM 0 HD2 TYR A 29 0.370 -5.484 7.046 1.00 0.00 H new ATOM 0 HE1 TYR A 29 4.434 -7.529 8.916 1.00 0.00 H new ATOM 0 HE2 TYR A 29 0.578 -7.928 7.141 1.00 0.00 H new ATOM 0 HH TYR A 29 1.830 -9.657 7.714 1.00 0.00 H new ATOM 431 N TRP A 30 3.051 -1.056 9.593 1.00 0.00 N ATOM 432 CA TRP A 30 3.399 0.360 9.629 1.00 0.00 C ATOM 433 C TRP A 30 3.938 0.822 8.279 1.00 0.00 C ATOM 434 O TRP A 30 5.128 0.687 7.996 1.00 0.00 O ATOM 435 CB TRP A 30 4.433 0.625 10.723 1.00 0.00 C ATOM 436 CG TRP A 30 4.904 2.048 10.764 1.00 0.00 C ATOM 437 CD1 TRP A 30 6.175 2.497 10.546 1.00 0.00 C ATOM 438 CD2 TRP A 30 4.109 3.206 11.041 1.00 0.00 C ATOM 439 NE1 TRP A 30 6.219 3.865 10.671 1.00 0.00 N ATOM 440 CE2 TRP A 30 4.964 4.324 10.974 1.00 0.00 C ATOM 441 CE3 TRP A 30 2.759 3.408 11.338 1.00 0.00 C ATOM 442 CZ2 TRP A 30 4.510 5.621 11.194 1.00 0.00 C ATOM 443 CZ3 TRP A 30 2.310 4.696 11.556 1.00 0.00 C ATOM 444 CH2 TRP A 30 3.183 5.790 11.482 1.00 0.00 C ATOM 0 H TRP A 30 3.785 -1.680 9.929 1.00 0.00 H new ATOM 0 HA TRP A 30 2.494 0.926 9.851 1.00 0.00 H new ATOM 0 HB2 TRP A 30 4.003 0.364 11.690 1.00 0.00 H new ATOM 0 HB3 TRP A 30 5.291 -0.030 10.568 1.00 0.00 H new ATOM 0 HD1 TRP A 30 7.022 1.869 10.310 1.00 0.00 H new ATOM 0 HE1 TRP A 30 7.051 4.444 10.557 1.00 0.00 H new ATOM 0 HE3 TRP A 30 2.078 2.572 11.396 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 5.182 6.465 11.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 1.268 4.863 11.787 1.00 0.00 H new ATOM 0 HH2 TRP A 30 2.801 6.785 11.656 1.00 0.00 H new ATOM 455 N PHE A 31 3.055 1.368 7.450 1.00 0.00 N ATOM 456 CA PHE A 31 3.443 1.850 6.129 1.00 0.00 C ATOM 457 C PHE A 31 4.043 3.250 6.215 1.00 0.00 C ATOM 458 O PHE A 31 3.499 4.131 6.880 1.00 0.00 O ATOM 459 CB PHE A 31 2.235 1.857 5.190 1.00 0.00 C ATOM 460 CG PHE A 31 1.885 0.499 4.653 1.00 0.00 C ATOM 461 CD1 PHE A 31 1.227 -0.426 5.447 1.00 0.00 C ATOM 462 CD2 PHE A 31 2.213 0.148 3.353 1.00 0.00 C ATOM 463 CE1 PHE A 31 0.904 -1.677 4.955 1.00 0.00 C ATOM 464 CE2 PHE A 31 1.893 -1.101 2.856 1.00 0.00 C ATOM 465 CZ PHE A 31 1.236 -2.014 3.657 1.00 0.00 C ATOM 0 H PHE A 31 2.066 1.488 7.669 1.00 0.00 H new ATOM 0 HA PHE A 31 4.200 1.174 5.731 1.00 0.00 H new ATOM 0 HB2 PHE A 31 1.374 2.261 5.722 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.438 2.528 4.355 1.00 0.00 H new ATOM 0 HD1 PHE A 31 0.963 -0.167 6.462 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.725 0.859 2.721 1.00 0.00 H new ATOM 0 HE1 PHE A 31 0.393 -2.390 5.585 1.00 0.00 H new ATOM 0 HE2 PHE A 31 2.157 -1.363 1.842 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.982 -2.990 3.270 1.00 0.00 H new ATOM 475 N VAL A 32 5.170 3.447 5.539 1.00 0.00 N ATOM 476 CA VAL A 32 5.846 4.739 5.537 1.00 0.00 C ATOM 477 C VAL A 32 6.162 5.193 4.117 1.00 0.00 C ATOM 478 O VAL A 32 7.232 4.898 3.583 1.00 0.00 O ATOM 479 CB VAL A 32 7.152 4.691 6.352 1.00 0.00 C ATOM 480 CG1 VAL A 32 7.873 6.028 6.285 1.00 0.00 C ATOM 481 CG2 VAL A 32 6.866 4.302 7.794 1.00 0.00 C ATOM 0 H VAL A 32 5.635 2.728 4.985 1.00 0.00 H new ATOM 0 HA VAL A 32 5.164 5.453 5.999 1.00 0.00 H new ATOM 0 HB VAL A 32 7.803 3.932 5.917 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.793 5.975 6.867 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.113 6.261 5.247 1.00 0.00 H new ATOM 0 HG13 VAL A 32 7.231 6.809 6.693 1.00 0.00 H new ATOM 0 HG21 VAL A 32 7.800 4.273 8.355 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.196 5.035 8.243 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.397 3.318 7.819 1.00 0.00 H new ATOM 491 N LEU A 33 5.225 5.911 3.509 1.00 0.00 N ATOM 492 CA LEU A 33 5.403 6.407 2.148 1.00 0.00 C ATOM 493 C LEU A 33 6.380 7.578 2.119 1.00 0.00 C ATOM 494 O LEU A 33 6.064 8.677 2.576 1.00 0.00 O ATOM 495 CB LEU A 33 4.058 6.836 1.560 1.00 0.00 C ATOM 496 CG LEU A 33 4.097 7.413 0.145 1.00 0.00 C ATOM 497 CD1 LEU A 33 3.937 6.308 -0.887 1.00 0.00 C ATOM 498 CD2 LEU A 33 3.017 8.470 -0.031 1.00 0.00 C ATOM 0 H LEU A 33 4.334 6.163 3.936 1.00 0.00 H new ATOM 0 HA LEU A 33 5.815 5.598 1.544 1.00 0.00 H new ATOM 0 HB2 LEU A 33 3.392 5.973 1.561 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.616 7.580 2.222 1.00 0.00 H new ATOM 0 HG LEU A 33 5.067 7.886 -0.006 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.967 6.738 -1.888 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.747 5.587 -0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.982 5.805 -0.737 1.00 0.00 H new ATOM 0 HD21 LEU A 33 3.060 8.869 -1.044 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.038 8.022 0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 33 3.178 9.277 0.684 1.00 0.00 H new ATOM 510 N THR A 34 7.570 7.336 1.578 1.00 0.00 N ATOM 511 CA THR A 34 8.593 8.370 1.488 1.00 0.00 C ATOM 512 C THR A 34 8.920 8.695 0.035 1.00 0.00 C ATOM 513 O THR A 34 8.634 7.908 -0.867 1.00 0.00 O ATOM 514 CB THR A 34 9.886 7.945 2.210 1.00 0.00 C ATOM 515 OG1 THR A 34 10.422 6.766 1.602 1.00 0.00 O ATOM 516 CG2 THR A 34 9.621 7.686 3.686 1.00 0.00 C ATOM 0 H THR A 34 7.849 6.432 1.195 1.00 0.00 H new ATOM 0 HA THR A 34 8.189 9.258 1.974 1.00 0.00 H new ATOM 0 HB THR A 34 10.608 8.757 2.124 1.00 0.00 H new ATOM 0 HG1 THR A 34 9.729 6.333 1.061 1.00 0.00 H new ATOM 0 HG21 THR A 34 10.548 7.387 4.175 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.241 8.595 4.152 1.00 0.00 H new ATOM 0 HG23 THR A 34 8.884 6.890 3.789 1.00 0.00 H new ATOM 524 N ALA A 35 9.522 9.860 -0.185 1.00 0.00 N ATOM 525 CA ALA A 35 9.890 10.287 -1.529 1.00 0.00 C ATOM 526 C ALA A 35 10.700 9.211 -2.245 1.00 0.00 C ATOM 527 O ALA A 35 10.516 8.975 -3.439 1.00 0.00 O ATOM 528 CB ALA A 35 10.674 11.590 -1.472 1.00 0.00 C ATOM 0 H ALA A 35 9.765 10.524 0.550 1.00 0.00 H new ATOM 0 HA ALA A 35 8.973 10.451 -2.095 1.00 0.00 H new ATOM 0 HB1 ALA A 35 10.943 11.898 -2.483 1.00 0.00 H new ATOM 0 HB2 ALA A 35 10.062 12.363 -1.008 1.00 0.00 H new ATOM 0 HB3 ALA A 35 11.580 11.444 -0.884 1.00 0.00 H new ATOM 534 N GLU A 36 11.596 8.562 -1.508 1.00 0.00 N ATOM 535 CA GLU A 36 12.434 7.512 -2.075 1.00 0.00 C ATOM 536 C GLU A 36 11.597 6.297 -2.460 1.00 0.00 C ATOM 537 O GLU A 36 11.451 5.979 -3.641 1.00 0.00 O ATOM 538 CB GLU A 36 13.520 7.102 -1.077 1.00 0.00 C ATOM 539 CG GLU A 36 14.545 8.191 -0.811 1.00 0.00 C ATOM 540 CD GLU A 36 15.388 7.912 0.418 1.00 0.00 C ATOM 541 OE1 GLU A 36 14.847 7.342 1.390 1.00 0.00 O ATOM 542 OE2 GLU A 36 16.586 8.262 0.409 1.00 0.00 O ATOM 0 H GLU A 36 11.760 8.745 -0.518 1.00 0.00 H new ATOM 0 HA GLU A 36 12.907 7.905 -2.975 1.00 0.00 H new ATOM 0 HB2 GLU A 36 13.049 6.821 -0.135 1.00 0.00 H new ATOM 0 HB3 GLU A 36 14.032 6.217 -1.454 1.00 0.00 H new ATOM 0 HG2 GLU A 36 15.197 8.291 -1.679 1.00 0.00 H new ATOM 0 HG3 GLU A 36 14.032 9.145 -0.686 1.00 0.00 H new ATOM 549 N SER A 37 11.049 5.620 -1.456 1.00 0.00 N ATOM 550 CA SER A 37 10.230 4.436 -1.689 1.00 0.00 C ATOM 551 C SER A 37 9.312 4.168 -0.500 1.00 0.00 C ATOM 552 O SER A 37 9.474 4.757 0.570 1.00 0.00 O ATOM 553 CB SER A 37 11.118 3.217 -1.946 1.00 0.00 C ATOM 554 OG SER A 37 12.340 3.596 -2.556 1.00 0.00 O ATOM 0 H SER A 37 11.157 5.871 -0.473 1.00 0.00 H new ATOM 0 HA SER A 37 9.613 4.619 -2.569 1.00 0.00 H new ATOM 0 HB2 SER A 37 11.321 2.706 -1.005 1.00 0.00 H new ATOM 0 HB3 SER A 37 10.592 2.509 -2.586 1.00 0.00 H new ATOM 0 HG SER A 37 12.890 2.800 -2.708 1.00 0.00 H new ATOM 560 N LEU A 38 8.347 3.276 -0.695 1.00 0.00 N ATOM 561 CA LEU A 38 7.402 2.929 0.360 1.00 0.00 C ATOM 562 C LEU A 38 7.770 1.596 1.005 1.00 0.00 C ATOM 563 O LEU A 38 7.923 0.585 0.319 1.00 0.00 O ATOM 564 CB LEU A 38 5.981 2.860 -0.203 1.00 0.00 C ATOM 565 CG LEU A 38 4.965 2.081 0.632 1.00 0.00 C ATOM 566 CD1 LEU A 38 4.435 2.941 1.769 1.00 0.00 C ATOM 567 CD2 LEU A 38 3.822 1.587 -0.243 1.00 0.00 C ATOM 0 H LEU A 38 8.199 2.780 -1.574 1.00 0.00 H new ATOM 0 HA LEU A 38 7.447 3.706 1.123 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.612 3.878 -0.330 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.026 2.411 -1.195 1.00 0.00 H new ATOM 0 HG LEU A 38 5.467 1.215 1.063 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.713 2.369 2.352 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.262 3.244 2.412 1.00 0.00 H new ATOM 0 HD13 LEU A 38 3.950 3.827 1.359 1.00 0.00 H new ATOM 0 HD21 LEU A 38 3.108 1.035 0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.322 2.439 -0.704 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.216 0.933 -1.021 1.00 0.00 H new ATOM 579 N SER A 39 7.909 1.602 2.327 1.00 0.00 N ATOM 580 CA SER A 39 8.261 0.395 3.064 1.00 0.00 C ATOM 581 C SER A 39 7.375 0.232 4.295 1.00 0.00 C ATOM 582 O SER A 39 6.973 1.215 4.918 1.00 0.00 O ATOM 583 CB SER A 39 9.732 0.437 3.482 1.00 0.00 C ATOM 584 OG SER A 39 10.583 0.475 2.350 1.00 0.00 O ATOM 0 H SER A 39 7.783 2.430 2.909 1.00 0.00 H new ATOM 0 HA SER A 39 8.102 -0.461 2.408 1.00 0.00 H new ATOM 0 HB2 SER A 39 9.911 1.313 4.105 1.00 0.00 H new ATOM 0 HB3 SER A 39 9.966 -0.438 4.088 1.00 0.00 H new ATOM 0 HG SER A 39 11.122 1.293 2.373 1.00 0.00 H new ATOM 590 N TRP A 40 7.074 -1.015 4.640 1.00 0.00 N ATOM 591 CA TRP A 40 6.236 -1.307 5.797 1.00 0.00 C ATOM 592 C TRP A 40 7.010 -2.099 6.844 1.00 0.00 C ATOM 593 O TRP A 40 7.769 -3.009 6.512 1.00 0.00 O ATOM 594 CB TRP A 40 4.992 -2.087 5.367 1.00 0.00 C ATOM 595 CG TRP A 40 5.301 -3.258 4.485 1.00 0.00 C ATOM 596 CD1 TRP A 40 5.467 -4.557 4.875 1.00 0.00 C ATOM 597 CD2 TRP A 40 5.482 -3.238 3.065 1.00 0.00 C ATOM 598 NE1 TRP A 40 5.741 -5.344 3.783 1.00 0.00 N ATOM 599 CE2 TRP A 40 5.755 -4.560 2.661 1.00 0.00 C ATOM 600 CE3 TRP A 40 5.439 -2.232 2.096 1.00 0.00 C ATOM 601 CZ2 TRP A 40 5.984 -4.898 1.330 1.00 0.00 C ATOM 602 CZ3 TRP A 40 5.667 -2.570 0.775 1.00 0.00 C ATOM 603 CH2 TRP A 40 5.936 -3.894 0.402 1.00 0.00 C ATOM 0 H TRP A 40 7.398 -1.840 4.135 1.00 0.00 H new ATOM 0 HA TRP A 40 5.928 -0.360 6.240 1.00 0.00 H new ATOM 0 HB2 TRP A 40 4.467 -2.439 6.255 1.00 0.00 H new ATOM 0 HB3 TRP A 40 4.314 -1.415 4.842 1.00 0.00 H new ATOM 0 HD1 TRP A 40 5.394 -4.913 5.892 1.00 0.00 H new ATOM 0 HE1 TRP A 40 5.907 -6.350 3.805 1.00 0.00 H new ATOM 0 HE3 TRP A 40 5.231 -1.209 2.374 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 6.192 -5.917 1.040 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 5.637 -1.801 0.018 1.00 0.00 H new ATOM 0 HH2 TRP A 40 6.109 -4.126 -0.639 1.00 0.00 H new ATOM 614 N TYR A 41 6.814 -1.746 8.110 1.00 0.00 N ATOM 615 CA TYR A 41 7.497 -2.423 9.206 1.00 0.00 C ATOM 616 C TYR A 41 6.503 -2.868 10.275 1.00 0.00 C ATOM 617 O TYR A 41 5.299 -2.641 10.154 1.00 0.00 O ATOM 618 CB TYR A 41 8.550 -1.503 9.825 1.00 0.00 C ATOM 619 CG TYR A 41 9.169 -0.541 8.837 1.00 0.00 C ATOM 620 CD1 TYR A 41 8.401 0.435 8.212 1.00 0.00 C ATOM 621 CD2 TYR A 41 10.522 -0.607 8.526 1.00 0.00 C ATOM 622 CE1 TYR A 41 8.962 1.316 7.308 1.00 0.00 C ATOM 623 CE2 TYR A 41 11.091 0.271 7.624 1.00 0.00 C ATOM 624 CZ TYR A 41 10.307 1.230 7.018 1.00 0.00 C ATOM 625 OH TYR A 41 10.871 2.105 6.118 1.00 0.00 O ATOM 0 H TYR A 41 6.188 -0.995 8.402 1.00 0.00 H new ATOM 0 HA TYR A 41 7.990 -3.308 8.802 1.00 0.00 H new ATOM 0 HB2 TYR A 41 8.093 -0.935 10.635 1.00 0.00 H new ATOM 0 HB3 TYR A 41 9.338 -2.112 10.268 1.00 0.00 H new ATOM 0 HD1 TYR A 41 7.347 0.506 8.437 1.00 0.00 H new ATOM 0 HD2 TYR A 41 11.139 -1.358 8.998 1.00 0.00 H new ATOM 0 HE1 TYR A 41 8.351 2.068 6.831 1.00 0.00 H new ATOM 0 HE2 TYR A 41 12.144 0.207 7.395 1.00 0.00 H new ATOM 0 HH TYR A 41 10.893 3.005 6.506 1.00 0.00 H new ATOM 635 N LYS A 42 7.016 -3.504 11.323 1.00 0.00 N ATOM 636 CA LYS A 42 6.177 -3.980 12.416 1.00 0.00 C ATOM 637 C LYS A 42 5.444 -2.821 13.084 1.00 0.00 C ATOM 638 O LYS A 42 4.216 -2.814 13.162 1.00 0.00 O ATOM 639 CB LYS A 42 7.024 -4.725 13.450 1.00 0.00 C ATOM 640 CG LYS A 42 7.146 -6.215 13.177 1.00 0.00 C ATOM 641 CD LYS A 42 7.475 -6.988 14.442 1.00 0.00 C ATOM 642 CE LYS A 42 7.259 -8.482 14.254 1.00 0.00 C ATOM 643 NZ LYS A 42 5.837 -8.868 14.470 1.00 0.00 N ATOM 0 H LYS A 42 8.010 -3.702 11.438 1.00 0.00 H new ATOM 0 HA LYS A 42 5.437 -4.664 12.001 1.00 0.00 H new ATOM 0 HB2 LYS A 42 8.021 -4.286 13.475 1.00 0.00 H new ATOM 0 HB3 LYS A 42 6.587 -4.580 14.438 1.00 0.00 H new ATOM 0 HG2 LYS A 42 6.212 -6.586 12.755 1.00 0.00 H new ATOM 0 HG3 LYS A 42 7.923 -6.387 12.432 1.00 0.00 H new ATOM 0 HD2 LYS A 42 8.511 -6.802 14.724 1.00 0.00 H new ATOM 0 HD3 LYS A 42 6.852 -6.629 15.261 1.00 0.00 H new ATOM 0 HE2 LYS A 42 7.565 -8.769 13.248 1.00 0.00 H new ATOM 0 HE3 LYS A 42 7.894 -9.031 14.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 5.731 -9.893 14.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 5.552 -8.617 15.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 5.233 -8.363 13.790 1.00 0.00 H new ATOM 657 N ASP A 43 6.205 -1.843 13.563 1.00 0.00 N ATOM 658 CA ASP A 43 5.628 -0.678 14.222 1.00 0.00 C ATOM 659 C ASP A 43 6.300 0.606 13.744 1.00 0.00 C ATOM 660 O ASP A 43 7.137 0.579 12.842 1.00 0.00 O ATOM 661 CB ASP A 43 5.764 -0.804 15.740 1.00 0.00 C ATOM 662 CG ASP A 43 4.966 -1.966 16.299 1.00 0.00 C ATOM 663 OD1 ASP A 43 5.154 -3.102 15.816 1.00 0.00 O ATOM 664 OD2 ASP A 43 4.154 -1.738 17.219 1.00 0.00 O ATOM 0 H ASP A 43 7.223 -1.834 13.507 1.00 0.00 H new ATOM 0 HA ASP A 43 4.570 -0.632 13.962 1.00 0.00 H new ATOM 0 HB2 ASP A 43 6.815 -0.932 15.998 1.00 0.00 H new ATOM 0 HB3 ASP A 43 5.430 0.121 16.210 1.00 0.00 H new ATOM 669 N GLU A 44 5.925 1.726 14.352 1.00 0.00 N ATOM 670 CA GLU A 44 6.491 3.020 13.986 1.00 0.00 C ATOM 671 C GLU A 44 7.901 3.176 14.549 1.00 0.00 C ATOM 672 O GLU A 44 8.207 4.162 15.218 1.00 0.00 O ATOM 673 CB GLU A 44 5.598 4.154 14.495 1.00 0.00 C ATOM 674 CG GLU A 44 4.116 3.909 14.270 1.00 0.00 C ATOM 675 CD GLU A 44 3.243 4.698 15.227 1.00 0.00 C ATOM 676 OE1 GLU A 44 3.038 4.228 16.367 1.00 0.00 O ATOM 677 OE2 GLU A 44 2.764 5.783 14.838 1.00 0.00 O ATOM 0 H GLU A 44 5.232 1.764 15.100 1.00 0.00 H new ATOM 0 HA GLU A 44 6.545 3.070 12.899 1.00 0.00 H new ATOM 0 HB2 GLU A 44 5.777 4.295 15.561 1.00 0.00 H new ATOM 0 HB3 GLU A 44 5.884 5.081 13.998 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.859 4.176 13.245 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.906 2.846 14.385 1.00 0.00 H new ATOM 684 N GLU A 45 8.754 2.195 14.271 1.00 0.00 N ATOM 685 CA GLU A 45 10.131 2.222 14.751 1.00 0.00 C ATOM 686 C GLU A 45 11.114 2.149 13.586 1.00 0.00 C ATOM 687 O GLU A 45 12.210 2.705 13.650 1.00 0.00 O ATOM 688 CB GLU A 45 10.381 1.063 15.718 1.00 0.00 C ATOM 689 CG GLU A 45 9.502 -0.148 15.456 1.00 0.00 C ATOM 690 CD GLU A 45 9.928 -1.362 16.259 1.00 0.00 C ATOM 691 OE1 GLU A 45 10.103 -1.227 17.489 1.00 0.00 O ATOM 692 OE2 GLU A 45 10.085 -2.446 15.660 1.00 0.00 O ATOM 0 H GLU A 45 8.516 1.373 13.717 1.00 0.00 H new ATOM 0 HA GLU A 45 10.287 3.164 15.277 1.00 0.00 H new ATOM 0 HB2 GLU A 45 11.427 0.764 15.651 1.00 0.00 H new ATOM 0 HB3 GLU A 45 10.214 1.409 16.738 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.468 0.099 15.698 1.00 0.00 H new ATOM 0 HG3 GLU A 45 9.531 -0.391 14.394 1.00 0.00 H new ATOM 699 N GLU A 46 10.713 1.459 12.523 1.00 0.00 N ATOM 700 CA GLU A 46 11.559 1.311 11.345 1.00 0.00 C ATOM 701 C GLU A 46 12.877 0.631 11.703 1.00 0.00 C ATOM 702 O GLU A 46 13.954 1.115 11.355 1.00 0.00 O ATOM 703 CB GLU A 46 11.833 2.678 10.713 1.00 0.00 C ATOM 704 CG GLU A 46 10.581 3.383 10.220 1.00 0.00 C ATOM 705 CD GLU A 46 10.892 4.551 9.303 1.00 0.00 C ATOM 706 OE1 GLU A 46 11.633 5.459 9.732 1.00 0.00 O ATOM 707 OE2 GLU A 46 10.393 4.556 8.159 1.00 0.00 O ATOM 0 H GLU A 46 9.808 0.994 12.454 1.00 0.00 H new ATOM 0 HA GLU A 46 11.031 0.685 10.626 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.333 3.313 11.444 1.00 0.00 H new ATOM 0 HB3 GLU A 46 12.521 2.551 9.877 1.00 0.00 H new ATOM 0 HG2 GLU A 46 9.951 2.668 9.691 1.00 0.00 H new ATOM 0 HG3 GLU A 46 10.009 3.740 11.076 1.00 0.00 H new ATOM 714 N LYS A 47 12.783 -0.496 12.401 1.00 0.00 N ATOM 715 CA LYS A 47 13.966 -1.246 12.807 1.00 0.00 C ATOM 716 C LYS A 47 14.125 -2.508 11.967 1.00 0.00 C ATOM 717 O LYS A 47 15.227 -2.841 11.533 1.00 0.00 O ATOM 718 CB LYS A 47 13.877 -1.615 14.290 1.00 0.00 C ATOM 719 CG LYS A 47 14.269 -0.483 15.223 1.00 0.00 C ATOM 720 CD LYS A 47 14.163 -0.900 16.681 1.00 0.00 C ATOM 721 CE LYS A 47 14.683 0.186 17.610 1.00 0.00 C ATOM 722 NZ LYS A 47 16.169 0.270 17.590 1.00 0.00 N ATOM 0 H LYS A 47 11.899 -0.910 12.697 1.00 0.00 H new ATOM 0 HA LYS A 47 14.839 -0.613 12.648 1.00 0.00 H new ATOM 0 HB2 LYS A 47 12.857 -1.926 14.518 1.00 0.00 H new ATOM 0 HB3 LYS A 47 14.522 -2.473 14.482 1.00 0.00 H new ATOM 0 HG2 LYS A 47 15.290 -0.169 15.007 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.626 0.378 15.042 1.00 0.00 H new ATOM 0 HD2 LYS A 47 13.123 -1.120 16.923 1.00 0.00 H new ATOM 0 HD3 LYS A 47 14.729 -1.818 16.840 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.261 1.147 17.316 1.00 0.00 H new ATOM 0 HE3 LYS A 47 14.344 -0.013 18.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 16.488 0.950 18.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 16.572 -0.666 17.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 16.486 0.585 16.651 1.00 0.00 H new ATOM 736 N GLU A 48 13.016 -3.206 11.739 1.00 0.00 N ATOM 737 CA GLU A 48 13.034 -4.432 10.949 1.00 0.00 C ATOM 738 C GLU A 48 12.075 -4.331 9.767 1.00 0.00 C ATOM 739 O GLU A 48 10.967 -4.867 9.804 1.00 0.00 O ATOM 740 CB GLU A 48 12.662 -5.632 11.821 1.00 0.00 C ATOM 741 CG GLU A 48 11.430 -5.402 12.680 1.00 0.00 C ATOM 742 CD GLU A 48 11.340 -6.372 13.843 1.00 0.00 C ATOM 743 OE1 GLU A 48 11.323 -7.595 13.594 1.00 0.00 O ATOM 744 OE2 GLU A 48 11.288 -5.907 15.001 1.00 0.00 O ATOM 0 H GLU A 48 12.095 -2.944 12.090 1.00 0.00 H new ATOM 0 HA GLU A 48 14.044 -4.571 10.564 1.00 0.00 H new ATOM 0 HB2 GLU A 48 12.491 -6.497 11.180 1.00 0.00 H new ATOM 0 HB3 GLU A 48 13.505 -5.876 12.468 1.00 0.00 H new ATOM 0 HG2 GLU A 48 11.444 -4.382 13.063 1.00 0.00 H new ATOM 0 HG3 GLU A 48 10.537 -5.498 12.062 1.00 0.00 H new ATOM 751 N LYS A 49 12.507 -3.639 8.718 1.00 0.00 N ATOM 752 CA LYS A 49 11.689 -3.468 7.524 1.00 0.00 C ATOM 753 C LYS A 49 11.335 -4.818 6.908 1.00 0.00 C ATOM 754 O LYS A 49 12.188 -5.695 6.775 1.00 0.00 O ATOM 755 CB LYS A 49 12.425 -2.604 6.496 1.00 0.00 C ATOM 756 CG LYS A 49 11.553 -2.171 5.330 1.00 0.00 C ATOM 757 CD LYS A 49 12.381 -1.907 4.083 1.00 0.00 C ATOM 758 CE LYS A 49 13.019 -0.527 4.120 1.00 0.00 C ATOM 759 NZ LYS A 49 14.225 -0.450 3.250 1.00 0.00 N ATOM 0 H LYS A 49 13.420 -3.187 8.671 1.00 0.00 H new ATOM 0 HA LYS A 49 10.765 -2.968 7.816 1.00 0.00 H new ATOM 0 HB2 LYS A 49 12.818 -1.718 6.994 1.00 0.00 H new ATOM 0 HB3 LYS A 49 13.280 -3.160 6.112 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.814 -2.944 5.120 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.003 -1.270 5.601 1.00 0.00 H new ATOM 0 HD2 LYS A 49 13.158 -2.666 3.993 1.00 0.00 H new ATOM 0 HD3 LYS A 49 11.748 -1.993 3.200 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.291 0.218 3.799 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.295 -0.282 5.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 14.980 0.063 3.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 14.551 -1.411 3.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.987 0.052 2.371 1.00 0.00 H new ATOM 773 N LYS A 50 10.070 -4.978 6.533 1.00 0.00 N ATOM 774 CA LYS A 50 9.602 -6.220 5.929 1.00 0.00 C ATOM 775 C LYS A 50 10.024 -6.305 4.466 1.00 0.00 C ATOM 776 O LYS A 50 10.690 -7.257 4.056 1.00 0.00 O ATOM 777 CB LYS A 50 8.079 -6.322 6.039 1.00 0.00 C ATOM 778 CG LYS A 50 7.599 -6.819 7.392 1.00 0.00 C ATOM 779 CD LYS A 50 7.814 -5.777 8.477 1.00 0.00 C ATOM 780 CE LYS A 50 7.733 -6.394 9.865 1.00 0.00 C ATOM 781 NZ LYS A 50 6.415 -7.044 10.106 1.00 0.00 N ATOM 0 H LYS A 50 9.350 -4.263 6.637 1.00 0.00 H new ATOM 0 HA LYS A 50 10.055 -7.052 6.469 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.643 -5.342 5.846 1.00 0.00 H new ATOM 0 HB3 LYS A 50 7.711 -6.994 5.263 1.00 0.00 H new ATOM 0 HG2 LYS A 50 6.540 -7.071 7.333 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.131 -7.734 7.654 1.00 0.00 H new ATOM 0 HD2 LYS A 50 8.788 -5.306 8.343 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.064 -4.991 8.382 1.00 0.00 H new ATOM 0 HE2 LYS A 50 8.528 -7.130 9.982 1.00 0.00 H new ATOM 0 HE3 LYS A 50 7.900 -5.622 10.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 6.450 -7.581 10.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 5.675 -6.316 10.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 6.197 -7.690 9.320 1.00 0.00 H new ATOM 795 N TYR A 51 9.634 -5.306 3.683 1.00 0.00 N ATOM 796 CA TYR A 51 9.971 -5.269 2.265 1.00 0.00 C ATOM 797 C TYR A 51 9.704 -3.886 1.677 1.00 0.00 C ATOM 798 O TYR A 51 8.591 -3.368 1.762 1.00 0.00 O ATOM 799 CB TYR A 51 9.168 -6.324 1.501 1.00 0.00 C ATOM 800 CG TYR A 51 9.490 -6.377 0.025 1.00 0.00 C ATOM 801 CD1 TYR A 51 8.954 -5.447 -0.857 1.00 0.00 C ATOM 802 CD2 TYR A 51 10.329 -7.359 -0.488 1.00 0.00 C ATOM 803 CE1 TYR A 51 9.245 -5.492 -2.207 1.00 0.00 C ATOM 804 CE2 TYR A 51 10.626 -7.411 -1.837 1.00 0.00 C ATOM 805 CZ TYR A 51 10.082 -6.476 -2.692 1.00 0.00 C ATOM 806 OH TYR A 51 10.374 -6.526 -4.035 1.00 0.00 O ATOM 0 H TYR A 51 9.084 -4.510 4.006 1.00 0.00 H new ATOM 0 HA TYR A 51 11.034 -5.487 2.164 1.00 0.00 H new ATOM 0 HB2 TYR A 51 9.358 -7.303 1.941 1.00 0.00 H new ATOM 0 HB3 TYR A 51 8.105 -6.120 1.625 1.00 0.00 H new ATOM 0 HD1 TYR A 51 8.298 -4.675 -0.481 1.00 0.00 H new ATOM 0 HD2 TYR A 51 10.756 -8.094 0.178 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.820 -4.761 -2.879 1.00 0.00 H new ATOM 0 HE2 TYR A 51 11.281 -8.180 -2.219 1.00 0.00 H new ATOM 0 HH TYR A 51 10.978 -7.278 -4.211 1.00 0.00 H new ATOM 816 N MET A 52 10.733 -3.295 1.080 1.00 0.00 N ATOM 817 CA MET A 52 10.611 -1.974 0.476 1.00 0.00 C ATOM 818 C MET A 52 10.006 -2.069 -0.921 1.00 0.00 C ATOM 819 O MET A 52 10.202 -3.059 -1.627 1.00 0.00 O ATOM 820 CB MET A 52 11.978 -1.292 0.407 1.00 0.00 C ATOM 821 CG MET A 52 11.969 0.011 -0.376 1.00 0.00 C ATOM 822 SD MET A 52 13.629 0.636 -0.704 1.00 0.00 S ATOM 823 CE MET A 52 13.843 0.145 -2.413 1.00 0.00 C ATOM 0 H MET A 52 11.661 -3.710 1.002 1.00 0.00 H new ATOM 0 HA MET A 52 9.947 -1.377 1.101 1.00 0.00 H new ATOM 0 HB2 MET A 52 12.328 -1.095 1.420 1.00 0.00 H new ATOM 0 HB3 MET A 52 12.693 -1.976 -0.050 1.00 0.00 H new ATOM 0 HG2 MET A 52 11.449 -0.142 -1.322 1.00 0.00 H new ATOM 0 HG3 MET A 52 11.406 0.761 0.180 1.00 0.00 H new ATOM 0 HE1 MET A 52 14.826 0.462 -2.762 1.00 0.00 H new ATOM 0 HE2 MET A 52 13.762 -0.939 -2.493 1.00 0.00 H new ATOM 0 HE3 MET A 52 13.072 0.613 -3.025 1.00 0.00 H new ATOM 833 N LEU A 53 9.271 -1.034 -1.314 1.00 0.00 N ATOM 834 CA LEU A 53 8.638 -1.002 -2.628 1.00 0.00 C ATOM 835 C LEU A 53 8.771 0.379 -3.262 1.00 0.00 C ATOM 836 O LEU A 53 8.518 1.406 -2.632 1.00 0.00 O ATOM 837 CB LEU A 53 7.161 -1.382 -2.513 1.00 0.00 C ATOM 838 CG LEU A 53 6.521 -1.975 -3.769 1.00 0.00 C ATOM 839 CD1 LEU A 53 7.096 -3.353 -4.062 1.00 0.00 C ATOM 840 CD2 LEU A 53 5.009 -2.048 -3.614 1.00 0.00 C ATOM 0 H LEU A 53 9.099 -0.207 -0.742 1.00 0.00 H new ATOM 0 HA LEU A 53 9.145 -1.726 -3.267 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.054 -2.101 -1.701 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.599 -0.493 -2.228 1.00 0.00 H new ATOM 0 HG LEU A 53 6.749 -1.322 -4.612 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.629 -3.759 -4.959 1.00 0.00 H new ATOM 0 HD12 LEU A 53 8.172 -3.273 -4.218 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.900 -4.016 -3.219 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.571 -2.472 -4.517 1.00 0.00 H new ATOM 0 HD22 LEU A 53 4.761 -2.678 -2.760 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.611 -1.046 -3.454 1.00 0.00 H new ATOM 852 N PRO A 54 9.175 0.407 -4.541 1.00 0.00 N ATOM 853 CA PRO A 54 9.347 1.655 -5.290 1.00 0.00 C ATOM 854 C PRO A 54 8.018 2.339 -5.593 1.00 0.00 C ATOM 855 O PRO A 54 6.952 1.743 -5.434 1.00 0.00 O ATOM 856 CB PRO A 54 10.022 1.201 -6.586 1.00 0.00 C ATOM 857 CG PRO A 54 9.614 -0.223 -6.747 1.00 0.00 C ATOM 858 CD PRO A 54 9.493 -0.778 -5.355 1.00 0.00 C ATOM 0 HA PRO A 54 9.923 2.390 -4.728 1.00 0.00 H new ATOM 0 HB2 PRO A 54 9.697 1.804 -7.434 1.00 0.00 H new ATOM 0 HB3 PRO A 54 11.106 1.298 -6.523 1.00 0.00 H new ATOM 0 HG2 PRO A 54 8.667 -0.300 -7.282 1.00 0.00 H new ATOM 0 HG3 PRO A 54 10.353 -0.778 -7.326 1.00 0.00 H new ATOM 0 HD2 PRO A 54 8.709 -1.532 -5.290 1.00 0.00 H new ATOM 0 HD3 PRO A 54 10.419 -1.252 -5.030 1.00 0.00 H new ATOM 866 N LEU A 55 8.088 3.591 -6.029 1.00 0.00 N ATOM 867 CA LEU A 55 6.890 4.356 -6.355 1.00 0.00 C ATOM 868 C LEU A 55 6.960 4.899 -7.779 1.00 0.00 C ATOM 869 O LEU A 55 6.375 5.937 -8.088 1.00 0.00 O ATOM 870 CB LEU A 55 6.712 5.509 -5.366 1.00 0.00 C ATOM 871 CG LEU A 55 7.160 5.236 -3.930 1.00 0.00 C ATOM 872 CD1 LEU A 55 7.169 6.523 -3.120 1.00 0.00 C ATOM 873 CD2 LEU A 55 6.257 4.199 -3.277 1.00 0.00 C ATOM 0 H LEU A 55 8.962 4.099 -6.165 1.00 0.00 H new ATOM 0 HA LEU A 55 6.032 3.687 -6.283 1.00 0.00 H new ATOM 0 HB2 LEU A 55 7.265 6.371 -5.740 1.00 0.00 H new ATOM 0 HB3 LEU A 55 5.658 5.788 -5.350 1.00 0.00 H new ATOM 0 HG LEU A 55 8.175 4.840 -3.956 1.00 0.00 H new ATOM 0 HD11 LEU A 55 7.490 6.309 -2.101 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.857 7.235 -3.576 1.00 0.00 H new ATOM 0 HD13 LEU A 55 6.166 6.949 -3.102 1.00 0.00 H new ATOM 0 HD21 LEU A 55 6.591 4.017 -2.255 1.00 0.00 H new ATOM 0 HD22 LEU A 55 5.231 4.567 -3.263 1.00 0.00 H new ATOM 0 HD23 LEU A 55 6.301 3.269 -3.844 1.00 0.00 H new ATOM 885 N ASP A 56 7.678 4.189 -8.642 1.00 0.00 N ATOM 886 CA ASP A 56 7.823 4.598 -10.035 1.00 0.00 C ATOM 887 C ASP A 56 7.037 3.671 -10.957 1.00 0.00 C ATOM 888 O ASP A 56 6.259 4.127 -11.794 1.00 0.00 O ATOM 889 CB ASP A 56 9.299 4.605 -10.436 1.00 0.00 C ATOM 890 CG ASP A 56 10.090 3.505 -9.754 1.00 0.00 C ATOM 891 OD1 ASP A 56 10.396 3.652 -8.552 1.00 0.00 O ATOM 892 OD2 ASP A 56 10.401 2.497 -10.423 1.00 0.00 O ATOM 0 H ASP A 56 8.169 3.328 -8.402 1.00 0.00 H new ATOM 0 HA ASP A 56 7.423 5.607 -10.136 1.00 0.00 H new ATOM 0 HB2 ASP A 56 9.379 4.490 -11.517 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.736 5.572 -10.185 1.00 0.00 H new ATOM 897 N ASN A 57 7.247 2.368 -10.798 1.00 0.00 N ATOM 898 CA ASN A 57 6.560 1.377 -11.618 1.00 0.00 C ATOM 899 C ASN A 57 5.289 0.888 -10.929 1.00 0.00 C ATOM 900 O ASN A 57 4.898 -0.270 -11.074 1.00 0.00 O ATOM 901 CB ASN A 57 7.485 0.193 -11.907 1.00 0.00 C ATOM 902 CG ASN A 57 8.887 0.633 -12.281 1.00 0.00 C ATOM 903 OD1 ASN A 57 9.856 0.303 -11.598 1.00 0.00 O ATOM 904 ND2 ASN A 57 9.000 1.382 -13.372 1.00 0.00 N ATOM 0 H ASN A 57 7.887 1.974 -10.109 1.00 0.00 H new ATOM 0 HA ASN A 57 6.283 1.850 -12.560 1.00 0.00 H new ATOM 0 HB2 ASN A 57 7.531 -0.451 -11.029 1.00 0.00 H new ATOM 0 HB3 ASN A 57 7.066 -0.403 -12.718 1.00 0.00 H new ATOM 0 HD21 ASN A 57 9.918 1.708 -13.674 1.00 0.00 H new ATOM 0 HD22 ASN A 57 8.169 1.631 -13.908 1.00 0.00 H new ATOM 911 N LEU A 58 4.649 1.779 -10.180 1.00 0.00 N ATOM 912 CA LEU A 58 3.422 1.439 -9.468 1.00 0.00 C ATOM 913 C LEU A 58 2.265 2.323 -9.925 1.00 0.00 C ATOM 914 O LEU A 58 2.463 3.297 -10.651 1.00 0.00 O ATOM 915 CB LEU A 58 3.626 1.587 -7.959 1.00 0.00 C ATOM 916 CG LEU A 58 4.696 0.689 -7.336 1.00 0.00 C ATOM 917 CD1 LEU A 58 4.595 0.713 -5.819 1.00 0.00 C ATOM 918 CD2 LEU A 58 4.569 -0.734 -7.859 1.00 0.00 C ATOM 0 H LEU A 58 4.959 2.742 -10.050 1.00 0.00 H new ATOM 0 HA LEU A 58 3.175 0.402 -9.695 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.883 2.625 -7.747 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.677 1.386 -7.463 1.00 0.00 H new ATOM 0 HG LEU A 58 5.676 1.072 -7.620 1.00 0.00 H new ATOM 0 HD11 LEU A 58 5.364 0.069 -5.393 1.00 0.00 H new ATOM 0 HD12 LEU A 58 4.737 1.733 -5.461 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.612 0.355 -5.514 1.00 0.00 H new ATOM 0 HD21 LEU A 58 5.338 -1.359 -7.405 1.00 0.00 H new ATOM 0 HD22 LEU A 58 3.585 -1.128 -7.605 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.693 -0.736 -8.942 1.00 0.00 H new ATOM 930 N LYS A 59 1.057 1.977 -9.493 1.00 0.00 N ATOM 931 CA LYS A 59 -0.132 2.739 -9.854 1.00 0.00 C ATOM 932 C LYS A 59 -1.338 2.285 -9.038 1.00 0.00 C ATOM 933 O LYS A 59 -1.430 1.122 -8.645 1.00 0.00 O ATOM 934 CB LYS A 59 -0.427 2.587 -11.348 1.00 0.00 C ATOM 935 CG LYS A 59 -1.114 3.796 -11.959 1.00 0.00 C ATOM 936 CD LYS A 59 -0.752 3.962 -13.425 1.00 0.00 C ATOM 937 CE LYS A 59 -1.665 3.139 -14.321 1.00 0.00 C ATOM 938 NZ LYS A 59 -1.385 3.375 -15.765 1.00 0.00 N ATOM 0 H LYS A 59 0.876 1.173 -8.892 1.00 0.00 H new ATOM 0 HA LYS A 59 0.060 3.789 -9.633 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.508 2.405 -11.878 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.055 1.709 -11.498 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.194 3.690 -11.860 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -0.830 4.693 -11.409 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -0.821 5.014 -13.701 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.283 3.659 -13.582 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -1.538 2.080 -14.095 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -2.704 3.388 -14.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.028 2.796 -16.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -1.531 4.380 -15.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -0.401 3.113 -15.975 1.00 0.00 H new ATOM 952 N ILE A 60 -2.260 3.209 -8.788 1.00 0.00 N ATOM 953 CA ILE A 60 -3.461 2.902 -8.021 1.00 0.00 C ATOM 954 C ILE A 60 -4.683 2.809 -8.928 1.00 0.00 C ATOM 955 O ILE A 60 -4.864 3.629 -9.828 1.00 0.00 O ATOM 956 CB ILE A 60 -3.721 3.962 -6.934 1.00 0.00 C ATOM 957 CG1 ILE A 60 -2.503 4.092 -6.016 1.00 0.00 C ATOM 958 CG2 ILE A 60 -4.961 3.602 -6.130 1.00 0.00 C ATOM 959 CD1 ILE A 60 -2.538 5.322 -5.137 1.00 0.00 C ATOM 0 H ILE A 60 -2.198 4.176 -9.106 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.292 1.937 -7.543 1.00 0.00 H new ATOM 0 HB ILE A 60 -3.892 4.924 -7.418 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -2.438 3.206 -5.385 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -1.600 4.116 -6.625 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.132 4.360 -5.366 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.824 3.555 -6.794 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.817 2.632 -5.653 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.644 5.349 -4.513 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -2.572 6.215 -5.762 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -3.423 5.290 -4.501 1.00 0.00 H new ATOM 971 N ARG A 61 -5.520 1.807 -8.683 1.00 0.00 N ATOM 972 CA ARG A 61 -6.727 1.607 -9.476 1.00 0.00 C ATOM 973 C ARG A 61 -7.907 1.230 -8.586 1.00 0.00 C ATOM 974 O ARG A 61 -7.730 0.638 -7.521 1.00 0.00 O ATOM 975 CB ARG A 61 -6.497 0.519 -10.527 1.00 0.00 C ATOM 976 CG ARG A 61 -5.880 -0.751 -9.963 1.00 0.00 C ATOM 977 CD ARG A 61 -5.642 -1.785 -11.052 1.00 0.00 C ATOM 978 NE ARG A 61 -6.888 -2.391 -11.514 1.00 0.00 N ATOM 979 CZ ARG A 61 -6.940 -3.497 -12.248 1.00 0.00 C ATOM 980 NH1 ARG A 61 -5.821 -4.116 -12.600 1.00 0.00 N ATOM 981 NH2 ARG A 61 -8.112 -3.987 -12.630 1.00 0.00 N ATOM 0 H ARG A 61 -5.385 1.120 -7.941 1.00 0.00 H new ATOM 0 HA ARG A 61 -6.961 2.545 -9.979 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -7.449 0.273 -10.997 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -5.847 0.912 -11.309 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.936 -0.512 -9.474 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -6.537 -1.169 -9.200 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -5.134 -1.314 -11.894 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -4.979 -2.563 -10.674 1.00 0.00 H new ATOM 0 HE ARG A 61 -7.767 -1.940 -11.259 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -4.918 -3.743 -12.307 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -5.863 -4.965 -13.164 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -8.975 -3.514 -12.360 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -8.150 -4.836 -13.194 1.00 0.00 H new ATOM 995 N ASP A 62 -9.110 1.576 -9.030 1.00 0.00 N ATOM 996 CA ASP A 62 -10.320 1.273 -8.274 1.00 0.00 C ATOM 997 C ASP A 62 -10.716 -0.190 -8.446 1.00 0.00 C ATOM 998 O ASP A 62 -11.232 -0.586 -9.491 1.00 0.00 O ATOM 999 CB ASP A 62 -11.467 2.181 -8.721 1.00 0.00 C ATOM 1000 CG ASP A 62 -11.529 2.336 -10.228 1.00 0.00 C ATOM 1001 OD1 ASP A 62 -12.007 1.400 -10.902 1.00 0.00 O ATOM 1002 OD2 ASP A 62 -11.100 3.395 -10.733 1.00 0.00 O ATOM 0 H ASP A 62 -9.274 2.066 -9.909 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.114 1.453 -7.219 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -12.411 1.772 -8.362 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -11.349 3.163 -8.262 1.00 0.00 H new ATOM 1007 N VAL A 63 -10.470 -0.990 -7.413 1.00 0.00 N ATOM 1008 CA VAL A 63 -10.801 -2.409 -7.449 1.00 0.00 C ATOM 1009 C VAL A 63 -12.297 -2.630 -7.252 1.00 0.00 C ATOM 1010 O VAL A 63 -12.900 -2.074 -6.334 1.00 0.00 O ATOM 1011 CB VAL A 63 -10.031 -3.193 -6.370 1.00 0.00 C ATOM 1012 CG1 VAL A 63 -10.121 -2.483 -5.028 1.00 0.00 C ATOM 1013 CG2 VAL A 63 -10.559 -4.616 -6.267 1.00 0.00 C ATOM 0 H VAL A 63 -10.042 -0.679 -6.541 1.00 0.00 H new ATOM 0 HA VAL A 63 -10.509 -2.777 -8.433 1.00 0.00 H new ATOM 0 HB VAL A 63 -8.981 -3.240 -6.659 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -9.571 -3.052 -4.278 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -9.691 -1.485 -5.115 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -11.166 -2.403 -4.728 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -10.004 -5.156 -5.500 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -11.616 -4.594 -6.002 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -10.436 -5.120 -7.226 1.00 0.00 H new ATOM 1023 N GLU A 64 -12.889 -3.446 -8.119 1.00 0.00 N ATOM 1024 CA GLU A 64 -14.315 -3.739 -8.039 1.00 0.00 C ATOM 1025 C GLU A 64 -14.556 -5.243 -7.942 1.00 0.00 C ATOM 1026 O GLU A 64 -14.090 -6.014 -8.781 1.00 0.00 O ATOM 1027 CB GLU A 64 -15.044 -3.173 -9.259 1.00 0.00 C ATOM 1028 CG GLU A 64 -14.667 -3.854 -10.564 1.00 0.00 C ATOM 1029 CD GLU A 64 -15.235 -3.145 -11.778 1.00 0.00 C ATOM 1030 OE1 GLU A 64 -14.675 -2.101 -12.172 1.00 0.00 O ATOM 1031 OE2 GLU A 64 -16.241 -3.635 -12.334 1.00 0.00 O ATOM 0 H GLU A 64 -12.404 -3.915 -8.884 1.00 0.00 H new ATOM 0 HA GLU A 64 -14.707 -3.266 -7.139 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -16.119 -3.269 -9.106 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -14.827 -2.108 -9.339 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -13.581 -3.895 -10.647 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -15.025 -4.883 -10.549 1.00 0.00 H new ATOM 1038 N LYS A 65 -15.287 -5.654 -6.911 1.00 0.00 N ATOM 1039 CA LYS A 65 -15.592 -7.064 -6.702 1.00 0.00 C ATOM 1040 C LYS A 65 -17.098 -7.301 -6.702 1.00 0.00 C ATOM 1041 O LYS A 65 -17.821 -6.763 -5.865 1.00 0.00 O ATOM 1042 CB LYS A 65 -14.989 -7.547 -5.380 1.00 0.00 C ATOM 1043 CG LYS A 65 -14.631 -9.023 -5.379 1.00 0.00 C ATOM 1044 CD LYS A 65 -13.493 -9.320 -4.416 1.00 0.00 C ATOM 1045 CE LYS A 65 -14.000 -9.496 -2.992 1.00 0.00 C ATOM 1046 NZ LYS A 65 -12.903 -9.866 -2.056 1.00 0.00 N ATOM 0 H LYS A 65 -15.679 -5.029 -6.207 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.153 -7.630 -7.523 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -14.093 -6.964 -5.164 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -15.697 -7.353 -4.575 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -15.506 -9.610 -5.102 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -14.347 -9.330 -6.385 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -12.973 -10.224 -4.733 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -12.767 -8.508 -4.447 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -14.468 -8.571 -2.656 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -14.770 -10.268 -2.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -13.288 -9.977 -1.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -12.473 -10.762 -2.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -12.181 -9.118 -2.055 1.00 0.00 H new ATOM 1060 N GLY A 66 -17.566 -8.111 -7.648 1.00 0.00 N ATOM 1061 CA GLY A 66 -18.984 -8.406 -7.738 1.00 0.00 C ATOM 1062 C GLY A 66 -19.814 -7.174 -8.040 1.00 0.00 C ATOM 1063 O GLY A 66 -19.287 -6.157 -8.491 1.00 0.00 O ATOM 0 H GLY A 66 -16.988 -8.568 -8.353 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -19.148 -9.151 -8.517 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -19.321 -8.846 -6.799 1.00 0.00 H new ATOM 1067 N PHE A 67 -21.116 -7.265 -7.794 1.00 0.00 N ATOM 1068 CA PHE A 67 -22.022 -6.150 -8.046 1.00 0.00 C ATOM 1069 C PHE A 67 -22.494 -5.526 -6.735 1.00 0.00 C ATOM 1070 O PHE A 67 -23.681 -5.255 -6.557 1.00 0.00 O ATOM 1071 CB PHE A 67 -23.227 -6.618 -8.864 1.00 0.00 C ATOM 1072 CG PHE A 67 -22.936 -6.762 -10.331 1.00 0.00 C ATOM 1073 CD1 PHE A 67 -22.836 -5.644 -11.143 1.00 0.00 C ATOM 1074 CD2 PHE A 67 -22.762 -8.014 -10.897 1.00 0.00 C ATOM 1075 CE1 PHE A 67 -22.569 -5.772 -12.493 1.00 0.00 C ATOM 1076 CE2 PHE A 67 -22.494 -8.149 -12.246 1.00 0.00 C ATOM 1077 CZ PHE A 67 -22.398 -7.027 -13.045 1.00 0.00 C ATOM 0 H PHE A 67 -21.568 -8.099 -7.420 1.00 0.00 H new ATOM 0 HA PHE A 67 -21.479 -5.394 -8.613 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -23.571 -7.576 -8.474 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -24.044 -5.908 -8.732 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -22.968 -4.661 -10.716 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -22.837 -8.895 -10.277 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -22.494 -4.893 -13.115 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -22.360 -9.131 -12.675 1.00 0.00 H new ATOM 0 HZ PHE A 67 -22.190 -7.130 -14.100 1.00 0.00 H new ATOM 1087 N MET A 68 -21.556 -5.302 -5.821 1.00 0.00 N ATOM 1088 CA MET A 68 -21.875 -4.710 -4.528 1.00 0.00 C ATOM 1089 C MET A 68 -20.772 -3.757 -4.079 1.00 0.00 C ATOM 1090 O MET A 68 -19.660 -3.787 -4.606 1.00 0.00 O ATOM 1091 CB MET A 68 -22.078 -5.805 -3.478 1.00 0.00 C ATOM 1092 CG MET A 68 -23.155 -6.811 -3.849 1.00 0.00 C ATOM 1093 SD MET A 68 -24.813 -6.239 -3.432 1.00 0.00 S ATOM 1094 CE MET A 68 -25.513 -7.723 -2.715 1.00 0.00 C ATOM 0 H MET A 68 -20.569 -5.522 -5.952 1.00 0.00 H new ATOM 0 HA MET A 68 -22.800 -4.143 -4.634 1.00 0.00 H new ATOM 0 HB2 MET A 68 -21.136 -6.332 -3.328 1.00 0.00 H new ATOM 0 HB3 MET A 68 -22.338 -5.341 -2.527 1.00 0.00 H new ATOM 0 HG2 MET A 68 -23.103 -7.015 -4.919 1.00 0.00 H new ATOM 0 HG3 MET A 68 -22.960 -7.752 -3.335 1.00 0.00 H new ATOM 0 HE1 MET A 68 -26.540 -7.528 -2.407 1.00 0.00 H new ATOM 0 HE2 MET A 68 -25.502 -8.524 -3.454 1.00 0.00 H new ATOM 0 HE3 MET A 68 -24.924 -8.021 -1.848 1.00 0.00 H new ATOM 1104 N SER A 69 -21.088 -2.911 -3.103 1.00 0.00 N ATOM 1105 CA SER A 69 -20.125 -1.946 -2.586 1.00 0.00 C ATOM 1106 C SER A 69 -19.070 -2.638 -1.728 1.00 0.00 C ATOM 1107 O SER A 69 -19.114 -3.851 -1.528 1.00 0.00 O ATOM 1108 CB SER A 69 -20.839 -0.869 -1.768 1.00 0.00 C ATOM 1109 OG SER A 69 -20.031 0.287 -1.631 1.00 0.00 O ATOM 0 H SER A 69 -22.003 -2.875 -2.655 1.00 0.00 H new ATOM 0 HA SER A 69 -19.627 -1.476 -3.434 1.00 0.00 H new ATOM 0 HB2 SER A 69 -21.779 -0.604 -2.252 1.00 0.00 H new ATOM 0 HB3 SER A 69 -21.087 -1.262 -0.782 1.00 0.00 H new ATOM 0 HG SER A 69 -20.511 0.961 -1.106 1.00 0.00 H new ATOM 1115 N ASN A 70 -18.122 -1.856 -1.222 1.00 0.00 N ATOM 1116 CA ASN A 70 -17.055 -2.392 -0.385 1.00 0.00 C ATOM 1117 C ASN A 70 -16.472 -1.306 0.515 1.00 0.00 C ATOM 1118 O ASN A 70 -16.855 -0.139 0.427 1.00 0.00 O ATOM 1119 CB ASN A 70 -15.950 -2.996 -1.255 1.00 0.00 C ATOM 1120 CG ASN A 70 -15.520 -2.065 -2.372 1.00 0.00 C ATOM 1121 OD1 ASN A 70 -14.950 -1.002 -2.125 1.00 0.00 O ATOM 1122 ND2 ASN A 70 -15.793 -2.460 -3.610 1.00 0.00 N ATOM 0 H ASN A 70 -18.071 -0.849 -1.377 1.00 0.00 H new ATOM 0 HA ASN A 70 -17.480 -3.173 0.246 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -15.088 -3.232 -0.631 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -16.301 -3.935 -1.683 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -15.529 -1.874 -4.402 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -16.267 -3.349 -3.769 1.00 0.00 H new ATOM 1129 N LYS A 71 -15.543 -1.698 1.380 1.00 0.00 N ATOM 1130 CA LYS A 71 -14.904 -0.760 2.295 1.00 0.00 C ATOM 1131 C LYS A 71 -13.856 0.079 1.571 1.00 0.00 C ATOM 1132 O LYS A 71 -13.605 -0.115 0.381 1.00 0.00 O ATOM 1133 CB LYS A 71 -14.256 -1.513 3.459 1.00 0.00 C ATOM 1134 CG LYS A 71 -15.244 -1.951 4.526 1.00 0.00 C ATOM 1135 CD LYS A 71 -14.790 -3.226 5.217 1.00 0.00 C ATOM 1136 CE LYS A 71 -13.654 -2.957 6.193 1.00 0.00 C ATOM 1137 NZ LYS A 71 -13.509 -4.053 7.191 1.00 0.00 N ATOM 0 H LYS A 71 -15.216 -2.660 1.467 1.00 0.00 H new ATOM 0 HA LYS A 71 -15.672 -0.092 2.685 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -13.741 -2.391 3.070 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -13.499 -0.876 3.916 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -15.359 -1.157 5.264 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -16.223 -2.110 4.074 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -15.630 -3.672 5.749 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -14.465 -3.950 4.470 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.721 -2.842 5.641 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -13.836 -2.016 6.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -12.725 -3.832 7.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -14.391 -4.146 7.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -13.310 -4.947 6.698 1.00 0.00 H new ATOM 1151 N HIS A 72 -13.245 1.009 2.297 1.00 0.00 N ATOM 1152 CA HIS A 72 -12.221 1.876 1.724 1.00 0.00 C ATOM 1153 C HIS A 72 -10.890 1.140 1.605 1.00 0.00 C ATOM 1154 O HIS A 72 -10.129 1.053 2.569 1.00 0.00 O ATOM 1155 CB HIS A 72 -12.048 3.132 2.580 1.00 0.00 C ATOM 1156 CG HIS A 72 -13.300 3.552 3.287 1.00 0.00 C ATOM 1157 ND1 HIS A 72 -14.344 4.193 2.653 1.00 0.00 N ATOM 1158 CD2 HIS A 72 -13.674 3.417 4.581 1.00 0.00 C ATOM 1159 CE1 HIS A 72 -15.304 4.436 3.527 1.00 0.00 C ATOM 1160 NE2 HIS A 72 -14.922 3.975 4.704 1.00 0.00 N ATOM 0 H HIS A 72 -13.441 1.182 3.283 1.00 0.00 H new ATOM 0 HA HIS A 72 -12.545 2.168 0.725 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -11.266 2.954 3.318 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -11.707 3.950 1.946 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -13.098 2.956 5.370 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -16.242 4.928 3.315 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -15.466 4.025 5.565 1.00 0.00 H new ATOM 1169 N VAL A 73 -10.616 0.611 0.417 1.00 0.00 N ATOM 1170 CA VAL A 73 -9.377 -0.118 0.172 1.00 0.00 C ATOM 1171 C VAL A 73 -8.922 0.042 -1.274 1.00 0.00 C ATOM 1172 O VAL A 73 -9.685 -0.209 -2.207 1.00 0.00 O ATOM 1173 CB VAL A 73 -9.536 -1.617 0.486 1.00 0.00 C ATOM 1174 CG1 VAL A 73 -10.770 -2.179 -0.204 1.00 0.00 C ATOM 1175 CG2 VAL A 73 -8.289 -2.383 0.072 1.00 0.00 C ATOM 0 H VAL A 73 -11.235 0.674 -0.391 1.00 0.00 H new ATOM 0 HA VAL A 73 -8.624 0.306 0.836 1.00 0.00 H new ATOM 0 HB VAL A 73 -9.666 -1.733 1.562 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -10.866 -3.239 0.029 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -11.656 -1.649 0.146 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -10.673 -2.052 -1.282 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -8.419 -3.441 0.301 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -8.126 -2.261 -0.999 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -7.427 -1.997 0.617 1.00 0.00 H new ATOM 1185 N PHE A 74 -7.674 0.462 -1.453 1.00 0.00 N ATOM 1186 CA PHE A 74 -7.116 0.656 -2.786 1.00 0.00 C ATOM 1187 C PHE A 74 -6.023 -0.369 -3.073 1.00 0.00 C ATOM 1188 O PHE A 74 -5.184 -0.653 -2.219 1.00 0.00 O ATOM 1189 CB PHE A 74 -6.553 2.072 -2.926 1.00 0.00 C ATOM 1190 CG PHE A 74 -5.530 2.415 -1.881 1.00 0.00 C ATOM 1191 CD1 PHE A 74 -5.907 2.616 -0.563 1.00 0.00 C ATOM 1192 CD2 PHE A 74 -4.191 2.537 -2.217 1.00 0.00 C ATOM 1193 CE1 PHE A 74 -4.967 2.933 0.400 1.00 0.00 C ATOM 1194 CE2 PHE A 74 -3.247 2.853 -1.259 1.00 0.00 C ATOM 1195 CZ PHE A 74 -3.635 3.050 0.052 1.00 0.00 C ATOM 0 H PHE A 74 -7.030 0.675 -0.691 1.00 0.00 H new ATOM 0 HA PHE A 74 -7.918 0.518 -3.511 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -6.103 2.180 -3.913 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -7.373 2.788 -2.869 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -6.947 2.524 -0.285 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -3.882 2.383 -3.240 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -5.274 3.089 1.424 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -2.207 2.946 -1.535 1.00 0.00 H new ATOM 0 HZ PHE A 74 -2.899 3.295 0.803 1.00 0.00 H new ATOM 1205 N ALA A 75 -6.041 -0.921 -4.282 1.00 0.00 N ATOM 1206 CA ALA A 75 -5.051 -1.913 -4.683 1.00 0.00 C ATOM 1207 C ALA A 75 -3.916 -1.269 -5.473 1.00 0.00 C ATOM 1208 O ALA A 75 -4.146 -0.380 -6.293 1.00 0.00 O ATOM 1209 CB ALA A 75 -5.708 -3.013 -5.503 1.00 0.00 C ATOM 0 H ALA A 75 -6.730 -0.698 -5.000 1.00 0.00 H new ATOM 0 HA ALA A 75 -4.627 -2.352 -3.780 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -4.957 -3.747 -5.796 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.479 -3.501 -4.906 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.160 -2.581 -6.396 1.00 0.00 H new ATOM 1215 N ILE A 76 -2.693 -1.722 -5.219 1.00 0.00 N ATOM 1216 CA ILE A 76 -1.524 -1.189 -5.907 1.00 0.00 C ATOM 1217 C ILE A 76 -0.884 -2.246 -6.801 1.00 0.00 C ATOM 1218 O ILE A 76 -0.465 -3.303 -6.329 1.00 0.00 O ATOM 1219 CB ILE A 76 -0.471 -0.671 -4.909 1.00 0.00 C ATOM 1220 CG1 ILE A 76 -0.951 0.627 -4.257 1.00 0.00 C ATOM 1221 CG2 ILE A 76 0.862 -0.458 -5.609 1.00 0.00 C ATOM 1222 CD1 ILE A 76 -0.002 1.163 -3.208 1.00 0.00 C ATOM 0 H ILE A 76 -2.486 -2.456 -4.542 1.00 0.00 H new ATOM 0 HA ILE A 76 -1.870 -0.358 -6.521 1.00 0.00 H new ATOM 0 HB ILE A 76 -0.333 -1.418 -4.128 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -1.090 1.383 -5.030 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -1.926 0.456 -3.800 1.00 0.00 H new ATOM 0 HG21 ILE A 76 1.596 -0.092 -4.891 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.207 -1.402 -6.030 1.00 0.00 H new ATOM 0 HG23 ILE A 76 0.741 0.273 -6.408 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -0.406 2.084 -2.788 1.00 0.00 H new ATOM 0 HD12 ILE A 76 0.118 0.425 -2.415 1.00 0.00 H new ATOM 0 HD13 ILE A 76 0.967 1.366 -3.664 1.00 0.00 H new ATOM 1234 N PHE A 77 -0.809 -1.951 -8.095 1.00 0.00 N ATOM 1235 CA PHE A 77 -0.218 -2.875 -9.056 1.00 0.00 C ATOM 1236 C PHE A 77 1.031 -2.273 -9.693 1.00 0.00 C ATOM 1237 O PHE A 77 1.249 -1.064 -9.633 1.00 0.00 O ATOM 1238 CB PHE A 77 -1.235 -3.234 -10.142 1.00 0.00 C ATOM 1239 CG PHE A 77 -1.678 -2.055 -10.962 1.00 0.00 C ATOM 1240 CD1 PHE A 77 -2.682 -1.216 -10.507 1.00 0.00 C ATOM 1241 CD2 PHE A 77 -1.089 -1.787 -12.187 1.00 0.00 C ATOM 1242 CE1 PHE A 77 -3.091 -0.131 -11.258 1.00 0.00 C ATOM 1243 CE2 PHE A 77 -1.494 -0.703 -12.943 1.00 0.00 C ATOM 1244 CZ PHE A 77 -2.497 0.125 -12.479 1.00 0.00 C ATOM 0 H PHE A 77 -1.150 -1.080 -8.502 1.00 0.00 H new ATOM 0 HA PHE A 77 0.069 -3.781 -8.522 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.799 -3.983 -10.803 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -2.108 -3.690 -9.675 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.151 -1.412 -9.554 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -0.305 -2.432 -12.555 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -3.874 0.516 -10.891 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.026 -0.504 -13.896 1.00 0.00 H new ATOM 0 HZ PHE A 77 -2.817 0.971 -13.069 1.00 0.00 H new ATOM 1254 N ASN A 78 1.848 -3.126 -10.301 1.00 0.00 N ATOM 1255 CA ASN A 78 3.076 -2.680 -10.948 1.00 0.00 C ATOM 1256 C ASN A 78 2.856 -2.461 -12.442 1.00 0.00 C ATOM 1257 O ASN A 78 2.770 -3.416 -13.215 1.00 0.00 O ATOM 1258 CB ASN A 78 4.193 -3.702 -10.730 1.00 0.00 C ATOM 1259 CG ASN A 78 5.571 -3.070 -10.766 1.00 0.00 C ATOM 1260 OD1 ASN A 78 6.036 -2.734 -11.963 1.00 0.00 O flip ATOM 1261 ND2 ASN A 78 6.209 -2.886 -9.729 1.00 0.00 N flip ATOM 0 H ASN A 78 1.682 -4.131 -10.359 1.00 0.00 H new ATOM 0 HA ASN A 78 3.369 -1.731 -10.499 1.00 0.00 H new ATOM 0 HB2 ASN A 78 4.048 -4.195 -9.769 1.00 0.00 H new ATOM 0 HB3 ASN A 78 4.130 -4.474 -11.497 1.00 0.00 H new ATOM 0 HD21 ASN A 78 5.812 -3.160 -8.830 1.00 0.00 H new ATOM 0 HD22 ASN A 78 7.135 -2.459 -9.769 1.00 0.00 H new ATOM 1268 N THR A 79 2.766 -1.197 -12.843 1.00 0.00 N ATOM 1269 CA THR A 79 2.555 -0.852 -14.243 1.00 0.00 C ATOM 1270 C THR A 79 3.366 -1.760 -15.161 1.00 0.00 C ATOM 1271 O THR A 79 2.831 -2.336 -16.108 1.00 0.00 O ATOM 1272 CB THR A 79 2.936 0.614 -14.524 1.00 0.00 C ATOM 1273 OG1 THR A 79 4.284 0.858 -14.110 1.00 0.00 O ATOM 1274 CG2 THR A 79 1.997 1.566 -13.797 1.00 0.00 C ATOM 0 H THR A 79 2.836 -0.395 -12.217 1.00 0.00 H new ATOM 0 HA THR A 79 1.493 -0.989 -14.446 1.00 0.00 H new ATOM 0 HB THR A 79 2.848 0.790 -15.596 1.00 0.00 H new ATOM 0 HG1 THR A 79 4.519 1.792 -14.294 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.286 2.595 -14.010 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.975 1.398 -14.136 1.00 0.00 H new ATOM 0 HG23 THR A 79 2.057 1.387 -12.723 1.00 0.00 H new ATOM 1282 N GLU A 80 4.658 -1.883 -14.873 1.00 0.00 N ATOM 1283 CA GLU A 80 5.541 -2.722 -15.674 1.00 0.00 C ATOM 1284 C GLU A 80 5.011 -4.151 -15.753 1.00 0.00 C ATOM 1285 O GLU A 80 4.042 -4.502 -15.079 1.00 0.00 O ATOM 1286 CB GLU A 80 6.953 -2.722 -15.085 1.00 0.00 C ATOM 1287 CG GLU A 80 7.630 -1.363 -15.126 1.00 0.00 C ATOM 1288 CD GLU A 80 8.163 -1.017 -16.503 1.00 0.00 C ATOM 1289 OE1 GLU A 80 8.429 -1.951 -17.288 1.00 0.00 O ATOM 1290 OE2 GLU A 80 8.314 0.187 -16.795 1.00 0.00 O ATOM 0 H GLU A 80 5.116 -1.413 -14.092 1.00 0.00 H new ATOM 0 HA GLU A 80 5.575 -2.310 -16.682 1.00 0.00 H new ATOM 0 HB2 GLU A 80 6.906 -3.064 -14.051 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.565 -3.440 -15.631 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.920 -0.598 -14.813 1.00 0.00 H new ATOM 0 HG3 GLU A 80 8.451 -1.348 -14.409 1.00 0.00 H new ATOM 1297 N GLN A 81 5.653 -4.970 -16.580 1.00 0.00 N ATOM 1298 CA GLN A 81 5.246 -6.359 -16.748 1.00 0.00 C ATOM 1299 C GLN A 81 5.860 -7.241 -15.666 1.00 0.00 C ATOM 1300 O GLN A 81 6.595 -8.183 -15.963 1.00 0.00 O ATOM 1301 CB GLN A 81 5.654 -6.869 -18.131 1.00 0.00 C ATOM 1302 CG GLN A 81 4.653 -6.531 -19.224 1.00 0.00 C ATOM 1303 CD GLN A 81 4.883 -7.328 -20.493 1.00 0.00 C ATOM 1304 OE1 GLN A 81 6.011 -7.708 -20.805 1.00 0.00 O ATOM 1305 NE2 GLN A 81 3.811 -7.585 -21.233 1.00 0.00 N ATOM 0 H GLN A 81 6.457 -4.695 -17.144 1.00 0.00 H new ATOM 0 HA GLN A 81 4.161 -6.406 -16.657 1.00 0.00 H new ATOM 0 HB2 GLN A 81 6.623 -6.445 -18.394 1.00 0.00 H new ATOM 0 HB3 GLN A 81 5.780 -7.951 -18.087 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.644 -6.721 -18.858 1.00 0.00 H new ATOM 0 HG3 GLN A 81 4.715 -5.467 -19.452 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.894 -7.250 -20.936 1.00 0.00 H new ATOM 0 HE22 GLN A 81 3.904 -8.117 -22.098 1.00 0.00 H new ATOM 1314 N ARG A 82 5.555 -6.930 -14.411 1.00 0.00 N ATOM 1315 CA ARG A 82 6.079 -7.693 -13.285 1.00 0.00 C ATOM 1316 C ARG A 82 5.063 -7.751 -12.147 1.00 0.00 C ATOM 1317 O ARG A 82 4.068 -7.028 -12.153 1.00 0.00 O ATOM 1318 CB ARG A 82 7.385 -7.073 -12.785 1.00 0.00 C ATOM 1319 CG ARG A 82 7.188 -5.786 -12.000 1.00 0.00 C ATOM 1320 CD ARG A 82 8.474 -4.979 -11.923 1.00 0.00 C ATOM 1321 NE ARG A 82 9.322 -5.406 -10.813 1.00 0.00 N ATOM 1322 CZ ARG A 82 10.309 -4.668 -10.316 1.00 0.00 C ATOM 1323 NH1 ARG A 82 10.570 -3.473 -10.827 1.00 0.00 N ATOM 1324 NH2 ARG A 82 11.036 -5.126 -9.305 1.00 0.00 N ATOM 0 H ARG A 82 4.947 -6.154 -14.148 1.00 0.00 H new ATOM 0 HA ARG A 82 6.274 -8.709 -13.627 1.00 0.00 H new ATOM 0 HB2 ARG A 82 7.903 -7.797 -12.156 1.00 0.00 H new ATOM 0 HB3 ARG A 82 8.032 -6.872 -13.639 1.00 0.00 H new ATOM 0 HG2 ARG A 82 6.409 -5.187 -12.471 1.00 0.00 H new ATOM 0 HG3 ARG A 82 6.844 -6.022 -10.993 1.00 0.00 H new ATOM 0 HD2 ARG A 82 9.023 -5.082 -12.859 1.00 0.00 H new ATOM 0 HD3 ARG A 82 8.233 -3.922 -11.809 1.00 0.00 H new ATOM 0 HE ARG A 82 9.147 -6.321 -10.397 1.00 0.00 H new ATOM 0 HH11 ARG A 82 10.013 -3.118 -11.604 1.00 0.00 H new ATOM 0 HH12 ARG A 82 11.328 -2.909 -10.443 1.00 0.00 H new ATOM 0 HH21 ARG A 82 10.837 -6.045 -8.909 1.00 0.00 H new ATOM 0 HH22 ARG A 82 11.794 -4.559 -8.924 1.00 0.00 H new ATOM 1338 N ASN A 83 5.322 -8.617 -11.173 1.00 0.00 N ATOM 1339 CA ASN A 83 4.429 -8.771 -10.030 1.00 0.00 C ATOM 1340 C ASN A 83 4.875 -7.886 -8.869 1.00 0.00 C ATOM 1341 O ASN A 83 6.065 -7.620 -8.699 1.00 0.00 O ATOM 1342 CB ASN A 83 4.386 -10.233 -9.583 1.00 0.00 C ATOM 1343 CG ASN A 83 4.212 -11.189 -10.748 1.00 0.00 C ATOM 1344 OD1 ASN A 83 3.093 -11.457 -11.184 1.00 0.00 O ATOM 1345 ND2 ASN A 83 5.324 -11.707 -11.259 1.00 0.00 N ATOM 0 H ASN A 83 6.142 -9.223 -11.152 1.00 0.00 H new ATOM 0 HA ASN A 83 3.430 -8.462 -10.337 1.00 0.00 H new ATOM 0 HB2 ASN A 83 5.307 -10.475 -9.052 1.00 0.00 H new ATOM 0 HB3 ASN A 83 3.566 -10.371 -8.878 1.00 0.00 H new ATOM 0 HD21 ASN A 83 5.270 -12.355 -12.045 1.00 0.00 H new ATOM 0 HD22 ASN A 83 6.231 -11.456 -10.865 1.00 0.00 H new ATOM 1352 N VAL A 84 3.912 -7.434 -8.073 1.00 0.00 N ATOM 1353 CA VAL A 84 4.205 -6.581 -6.927 1.00 0.00 C ATOM 1354 C VAL A 84 4.844 -7.379 -5.797 1.00 0.00 C ATOM 1355 O VAL A 84 6.047 -7.276 -5.553 1.00 0.00 O ATOM 1356 CB VAL A 84 2.931 -5.894 -6.399 1.00 0.00 C ATOM 1357 CG1 VAL A 84 3.184 -5.279 -5.031 1.00 0.00 C ATOM 1358 CG2 VAL A 84 2.446 -4.841 -7.385 1.00 0.00 C ATOM 0 H VAL A 84 2.922 -7.644 -8.200 1.00 0.00 H new ATOM 0 HA VAL A 84 4.905 -5.819 -7.270 1.00 0.00 H new ATOM 0 HB VAL A 84 2.150 -6.647 -6.293 1.00 0.00 H new ATOM 0 HG11 VAL A 84 2.273 -4.798 -4.674 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.481 -6.060 -4.330 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.980 -4.538 -5.107 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.545 -4.366 -6.996 1.00 0.00 H new ATOM 0 HG22 VAL A 84 3.222 -4.088 -7.525 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.223 -5.314 -8.341 1.00 0.00 H new ATOM 1368 N TYR A 85 4.033 -8.176 -5.110 1.00 0.00 N ATOM 1369 CA TYR A 85 4.519 -8.991 -4.003 1.00 0.00 C ATOM 1370 C TYR A 85 5.081 -10.316 -4.509 1.00 0.00 C ATOM 1371 O TYR A 85 5.170 -10.548 -5.715 1.00 0.00 O ATOM 1372 CB TYR A 85 3.393 -9.251 -3.001 1.00 0.00 C ATOM 1373 CG TYR A 85 3.878 -9.441 -1.582 1.00 0.00 C ATOM 1374 CD1 TYR A 85 4.611 -8.450 -0.939 1.00 0.00 C ATOM 1375 CD2 TYR A 85 3.604 -10.610 -0.883 1.00 0.00 C ATOM 1376 CE1 TYR A 85 5.056 -8.619 0.358 1.00 0.00 C ATOM 1377 CE2 TYR A 85 4.044 -10.787 0.414 1.00 0.00 C ATOM 1378 CZ TYR A 85 4.770 -9.789 1.030 1.00 0.00 C ATOM 1379 OH TYR A 85 5.212 -9.962 2.322 1.00 0.00 O ATOM 0 H TYR A 85 3.036 -8.275 -5.300 1.00 0.00 H new ATOM 0 HA TYR A 85 5.319 -8.444 -3.505 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.694 -8.415 -3.028 1.00 0.00 H new ATOM 0 HB3 TYR A 85 2.841 -10.139 -3.310 1.00 0.00 H new ATOM 0 HD1 TYR A 85 4.836 -7.532 -1.462 1.00 0.00 H new ATOM 0 HD2 TYR A 85 3.037 -11.394 -1.362 1.00 0.00 H new ATOM 0 HE1 TYR A 85 5.625 -7.839 0.843 1.00 0.00 H new ATOM 0 HE2 TYR A 85 3.821 -11.702 0.943 1.00 0.00 H new ATOM 0 HH TYR A 85 4.925 -10.839 2.651 1.00 0.00 H new ATOM 1389 N LYS A 86 5.459 -11.185 -3.577 1.00 0.00 N ATOM 1390 CA LYS A 86 6.011 -12.489 -3.925 1.00 0.00 C ATOM 1391 C LYS A 86 4.927 -13.409 -4.477 1.00 0.00 C ATOM 1392 O LYS A 86 4.981 -13.821 -5.636 1.00 0.00 O ATOM 1393 CB LYS A 86 6.665 -13.132 -2.700 1.00 0.00 C ATOM 1394 CG LYS A 86 8.053 -12.593 -2.399 1.00 0.00 C ATOM 1395 CD LYS A 86 8.367 -12.659 -0.913 1.00 0.00 C ATOM 1396 CE LYS A 86 7.881 -11.414 -0.186 1.00 0.00 C ATOM 1397 NZ LYS A 86 7.956 -11.571 1.293 1.00 0.00 N ATOM 0 H LYS A 86 5.393 -11.009 -2.574 1.00 0.00 H new ATOM 0 HA LYS A 86 6.766 -12.342 -4.697 1.00 0.00 H new ATOM 0 HB2 LYS A 86 6.026 -12.972 -1.831 1.00 0.00 H new ATOM 0 HB3 LYS A 86 6.728 -14.209 -2.855 1.00 0.00 H new ATOM 0 HG2 LYS A 86 8.795 -13.166 -2.954 1.00 0.00 H new ATOM 0 HG3 LYS A 86 8.126 -11.561 -2.742 1.00 0.00 H new ATOM 0 HD2 LYS A 86 7.897 -13.542 -0.479 1.00 0.00 H new ATOM 0 HD3 LYS A 86 9.442 -12.768 -0.771 1.00 0.00 H new ATOM 0 HE2 LYS A 86 8.482 -10.557 -0.491 1.00 0.00 H new ATOM 0 HE3 LYS A 86 6.852 -11.202 -0.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 7.149 -11.087 1.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 7.929 -12.582 1.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 8.843 -11.154 1.642 1.00 0.00 H new ATOM 1411 N ASP A 87 3.945 -13.726 -3.641 1.00 0.00 N ATOM 1412 CA ASP A 87 2.846 -14.595 -4.047 1.00 0.00 C ATOM 1413 C ASP A 87 1.590 -13.782 -4.342 1.00 0.00 C ATOM 1414 O ASP A 87 0.474 -14.300 -4.282 1.00 0.00 O ATOM 1415 CB ASP A 87 2.556 -15.628 -2.956 1.00 0.00 C ATOM 1416 CG ASP A 87 3.479 -16.828 -3.034 1.00 0.00 C ATOM 1417 OD1 ASP A 87 3.307 -17.650 -3.958 1.00 0.00 O ATOM 1418 OD2 ASP A 87 4.375 -16.944 -2.172 1.00 0.00 O ATOM 0 H ASP A 87 3.887 -13.395 -2.678 1.00 0.00 H new ATOM 0 HA ASP A 87 3.143 -15.114 -4.959 1.00 0.00 H new ATOM 0 HB2 ASP A 87 2.658 -15.158 -1.978 1.00 0.00 H new ATOM 0 HB3 ASP A 87 1.522 -15.962 -3.042 1.00 0.00 H new ATOM 1423 N LEU A 88 1.779 -12.506 -4.661 1.00 0.00 N ATOM 1424 CA LEU A 88 0.661 -11.620 -4.965 1.00 0.00 C ATOM 1425 C LEU A 88 1.019 -10.659 -6.094 1.00 0.00 C ATOM 1426 O LEU A 88 2.141 -10.158 -6.164 1.00 0.00 O ATOM 1427 CB LEU A 88 0.256 -10.832 -3.718 1.00 0.00 C ATOM 1428 CG LEU A 88 0.493 -11.527 -2.378 1.00 0.00 C ATOM 1429 CD1 LEU A 88 0.722 -10.502 -1.277 1.00 0.00 C ATOM 1430 CD2 LEU A 88 -0.680 -12.432 -2.031 1.00 0.00 C ATOM 0 H LEU A 88 2.696 -12.062 -4.716 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.180 -12.234 -5.288 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.801 -9.888 -3.716 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.803 -10.588 -3.795 1.00 0.00 H new ATOM 0 HG LEU A 88 1.388 -12.143 -2.464 1.00 0.00 H new ATOM 0 HD11 LEU A 88 0.889 -11.016 -0.330 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.595 -9.896 -1.520 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.154 -9.859 -1.191 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.493 -12.918 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.591 -11.837 -1.964 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.797 -13.189 -2.806 1.00 0.00 H new ATOM 1442 N ARG A 89 0.057 -10.405 -6.976 1.00 0.00 N ATOM 1443 CA ARG A 89 0.271 -9.504 -8.101 1.00 0.00 C ATOM 1444 C ARG A 89 -0.080 -8.068 -7.721 1.00 0.00 C ATOM 1445 O ARG A 89 0.477 -7.118 -8.270 1.00 0.00 O ATOM 1446 CB ARG A 89 -0.568 -9.945 -9.302 1.00 0.00 C ATOM 1447 CG ARG A 89 0.018 -11.129 -10.053 1.00 0.00 C ATOM 1448 CD ARG A 89 -0.191 -12.429 -9.293 1.00 0.00 C ATOM 1449 NE ARG A 89 0.195 -13.594 -10.084 1.00 0.00 N ATOM 1450 CZ ARG A 89 0.552 -14.758 -9.553 1.00 0.00 C ATOM 1451 NH1 ARG A 89 0.571 -14.912 -8.236 1.00 0.00 N ATOM 1452 NH2 ARG A 89 0.890 -15.772 -10.340 1.00 0.00 N ATOM 0 H ARG A 89 -0.878 -10.811 -6.932 1.00 0.00 H new ATOM 0 HA ARG A 89 1.326 -9.543 -8.370 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -1.570 -10.203 -8.959 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -0.673 -9.105 -9.989 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.445 -11.203 -11.037 1.00 0.00 H new ATOM 0 HG3 ARG A 89 1.084 -10.968 -10.214 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.391 -12.408 -8.372 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -1.239 -12.517 -9.006 1.00 0.00 H new ATOM 0 HE ARG A 89 0.190 -13.509 -11.100 1.00 0.00 H new ATOM 0 HH11 ARG A 89 0.311 -14.135 -7.628 1.00 0.00 H new ATOM 0 HH12 ARG A 89 0.846 -15.807 -7.831 1.00 0.00 H new ATOM 0 HH21 ARG A 89 0.876 -15.658 -11.353 1.00 0.00 H new ATOM 0 HH22 ARG A 89 1.164 -16.665 -9.931 1.00 0.00 H new ATOM 1466 N GLN A 90 -1.007 -7.920 -6.781 1.00 0.00 N ATOM 1467 CA GLN A 90 -1.432 -6.600 -6.330 1.00 0.00 C ATOM 1468 C GLN A 90 -1.650 -6.585 -4.820 1.00 0.00 C ATOM 1469 O GLN A 90 -2.302 -7.472 -4.269 1.00 0.00 O ATOM 1470 CB GLN A 90 -2.718 -6.183 -7.046 1.00 0.00 C ATOM 1471 CG GLN A 90 -3.695 -7.327 -7.258 1.00 0.00 C ATOM 1472 CD GLN A 90 -4.541 -7.607 -6.031 1.00 0.00 C ATOM 1473 OE1 GLN A 90 -4.350 -8.612 -5.347 1.00 0.00 O ATOM 1474 NE2 GLN A 90 -5.484 -6.716 -5.746 1.00 0.00 N ATOM 0 H GLN A 90 -1.478 -8.697 -6.317 1.00 0.00 H new ATOM 0 HA GLN A 90 -0.642 -5.889 -6.572 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -3.208 -5.400 -6.468 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -2.462 -5.751 -8.013 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -4.348 -7.091 -8.099 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -3.142 -8.227 -7.526 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -5.608 -5.897 -6.341 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -6.084 -6.851 -4.933 1.00 0.00 H new ATOM 1483 N ILE A 91 -1.100 -5.572 -4.158 1.00 0.00 N ATOM 1484 CA ILE A 91 -1.235 -5.442 -2.713 1.00 0.00 C ATOM 1485 C ILE A 91 -2.339 -4.455 -2.351 1.00 0.00 C ATOM 1486 O ILE A 91 -2.269 -3.276 -2.697 1.00 0.00 O ATOM 1487 CB ILE A 91 0.083 -4.981 -2.063 1.00 0.00 C ATOM 1488 CG1 ILE A 91 1.237 -5.887 -2.501 1.00 0.00 C ATOM 1489 CG2 ILE A 91 -0.046 -4.975 -0.548 1.00 0.00 C ATOM 1490 CD1 ILE A 91 2.593 -5.404 -2.037 1.00 0.00 C ATOM 0 H ILE A 91 -0.557 -4.830 -4.600 1.00 0.00 H new ATOM 0 HA ILE A 91 -1.493 -6.429 -2.330 1.00 0.00 H new ATOM 0 HB ILE A 91 0.297 -3.965 -2.393 1.00 0.00 H new ATOM 0 HG12 ILE A 91 1.066 -6.892 -2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.239 -5.960 -3.589 1.00 0.00 H new ATOM 0 HG21 ILE A 91 0.894 -4.647 -0.104 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -0.844 -4.293 -0.253 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.281 -5.981 -0.199 1.00 0.00 H new ATOM 0 HD11 ILE A 91 3.363 -6.094 -2.383 1.00 0.00 H new ATOM 0 HD12 ILE A 91 2.785 -4.412 -2.445 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.610 -5.358 -0.948 1.00 0.00 H new ATOM 1502 N GLU A 92 -3.357 -4.945 -1.650 1.00 0.00 N ATOM 1503 CA GLU A 92 -4.476 -4.105 -1.240 1.00 0.00 C ATOM 1504 C GLU A 92 -4.180 -3.414 0.088 1.00 0.00 C ATOM 1505 O GLU A 92 -3.370 -3.893 0.883 1.00 0.00 O ATOM 1506 CB GLU A 92 -5.753 -4.940 -1.120 1.00 0.00 C ATOM 1507 CG GLU A 92 -6.148 -5.638 -2.410 1.00 0.00 C ATOM 1508 CD GLU A 92 -7.430 -6.435 -2.274 1.00 0.00 C ATOM 1509 OE1 GLU A 92 -8.450 -5.852 -1.851 1.00 0.00 O ATOM 1510 OE2 GLU A 92 -7.413 -7.643 -2.590 1.00 0.00 O ATOM 0 H GLU A 92 -3.430 -5.919 -1.355 1.00 0.00 H new ATOM 0 HA GLU A 92 -4.621 -3.340 -2.003 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.616 -5.688 -0.339 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -6.571 -4.294 -0.801 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -6.269 -4.895 -3.198 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -5.342 -6.303 -2.720 1.00 0.00 H new ATOM 1517 N LEU A 93 -4.841 -2.286 0.322 1.00 0.00 N ATOM 1518 CA LEU A 93 -4.649 -1.528 1.553 1.00 0.00 C ATOM 1519 C LEU A 93 -5.975 -0.968 2.060 1.00 0.00 C ATOM 1520 O LEU A 93 -6.518 -0.022 1.491 1.00 0.00 O ATOM 1521 CB LEU A 93 -3.656 -0.388 1.324 1.00 0.00 C ATOM 1522 CG LEU A 93 -2.295 -0.789 0.753 1.00 0.00 C ATOM 1523 CD1 LEU A 93 -1.446 0.444 0.482 1.00 0.00 C ATOM 1524 CD2 LEU A 93 -1.576 -1.735 1.704 1.00 0.00 C ATOM 0 H LEU A 93 -5.515 -1.876 -0.325 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.248 -2.204 2.308 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.113 0.335 0.648 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.493 0.122 2.274 1.00 0.00 H new ATOM 0 HG LEU A 93 -2.457 -1.308 -0.191 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.481 0.139 0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.956 1.086 -0.237 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.292 0.991 1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.609 -2.010 1.282 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.425 -1.241 2.664 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -2.178 -2.632 1.848 1.00 0.00 H new ATOM 1536 N ALA A 94 -6.488 -1.558 3.134 1.00 0.00 N ATOM 1537 CA ALA A 94 -7.748 -1.116 3.720 1.00 0.00 C ATOM 1538 C ALA A 94 -7.509 -0.097 4.829 1.00 0.00 C ATOM 1539 O ALA A 94 -6.446 -0.080 5.452 1.00 0.00 O ATOM 1540 CB ALA A 94 -8.528 -2.307 4.255 1.00 0.00 C ATOM 0 H ALA A 94 -6.051 -2.343 3.616 1.00 0.00 H new ATOM 0 HA ALA A 94 -8.334 -0.633 2.938 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -9.466 -1.962 4.690 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -8.739 -3.000 3.440 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -7.939 -2.814 5.019 1.00 0.00 H new ATOM 1546 N CYS A 95 -8.502 0.752 5.071 1.00 0.00 N ATOM 1547 CA CYS A 95 -8.399 1.776 6.104 1.00 0.00 C ATOM 1548 C CYS A 95 -9.625 1.758 7.011 1.00 0.00 C ATOM 1549 O CYS A 95 -10.588 1.036 6.755 1.00 0.00 O ATOM 1550 CB CYS A 95 -8.240 3.157 5.468 1.00 0.00 C ATOM 1551 SG CYS A 95 -6.542 3.562 4.995 1.00 0.00 S ATOM 0 H CYS A 95 -9.388 0.751 4.565 1.00 0.00 H new ATOM 0 HA CYS A 95 -7.519 1.560 6.709 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -8.875 3.213 4.584 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -8.600 3.911 6.168 1.00 0.00 H new ATOM 0 HG CYS A 95 -6.511 4.748 4.464 1.00 0.00 H new ATOM 1557 N ASP A 96 -9.580 2.555 8.073 1.00 0.00 N ATOM 1558 CA ASP A 96 -10.687 2.631 9.019 1.00 0.00 C ATOM 1559 C ASP A 96 -11.733 3.638 8.553 1.00 0.00 C ATOM 1560 O ASP A 96 -12.932 3.436 8.743 1.00 0.00 O ATOM 1561 CB ASP A 96 -10.173 3.016 10.408 1.00 0.00 C ATOM 1562 CG ASP A 96 -9.347 1.916 11.045 1.00 0.00 C ATOM 1563 OD1 ASP A 96 -8.344 1.496 10.431 1.00 0.00 O ATOM 1564 OD2 ASP A 96 -9.703 1.476 12.158 1.00 0.00 O ATOM 0 H ASP A 96 -8.789 3.157 8.300 1.00 0.00 H new ATOM 0 HA ASP A 96 -11.155 1.648 9.072 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -9.570 3.921 10.331 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -11.020 3.251 11.053 1.00 0.00 H new ATOM 1569 N SER A 97 -11.270 4.724 7.942 1.00 0.00 N ATOM 1570 CA SER A 97 -12.165 5.766 7.453 1.00 0.00 C ATOM 1571 C SER A 97 -11.665 6.335 6.128 1.00 0.00 C ATOM 1572 O SER A 97 -10.476 6.257 5.818 1.00 0.00 O ATOM 1573 CB SER A 97 -12.291 6.887 8.487 1.00 0.00 C ATOM 1574 OG SER A 97 -12.754 6.385 9.728 1.00 0.00 O ATOM 0 H SER A 97 -10.280 4.905 7.774 1.00 0.00 H new ATOM 0 HA SER A 97 -13.146 5.320 7.290 1.00 0.00 H new ATOM 0 HB2 SER A 97 -11.324 7.370 8.624 1.00 0.00 H new ATOM 0 HB3 SER A 97 -12.978 7.649 8.120 1.00 0.00 H new ATOM 0 HG SER A 97 -12.825 7.120 10.372 1.00 0.00 H new ATOM 1580 N GLN A 98 -12.581 6.906 5.353 1.00 0.00 N ATOM 1581 CA GLN A 98 -12.233 7.487 4.061 1.00 0.00 C ATOM 1582 C GLN A 98 -11.209 8.605 4.226 1.00 0.00 C ATOM 1583 O GLN A 98 -10.247 8.695 3.464 1.00 0.00 O ATOM 1584 CB GLN A 98 -13.485 8.024 3.366 1.00 0.00 C ATOM 1585 CG GLN A 98 -13.190 8.781 2.081 1.00 0.00 C ATOM 1586 CD GLN A 98 -12.873 7.858 0.920 1.00 0.00 C ATOM 1587 OE1 GLN A 98 -13.617 6.918 0.639 1.00 0.00 O ATOM 1588 NE2 GLN A 98 -11.764 8.123 0.239 1.00 0.00 N ATOM 0 H GLN A 98 -13.569 6.979 5.596 1.00 0.00 H new ATOM 0 HA GLN A 98 -11.792 6.703 3.445 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -14.152 7.191 3.142 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -14.017 8.683 4.052 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -14.049 9.401 1.824 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -12.349 9.454 2.245 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -11.177 8.913 0.507 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -11.499 7.537 -0.553 1.00 0.00 H new ATOM 1597 N GLU A 99 -11.423 9.455 5.225 1.00 0.00 N ATOM 1598 CA GLU A 99 -10.518 10.568 5.488 1.00 0.00 C ATOM 1599 C GLU A 99 -9.066 10.149 5.282 1.00 0.00 C ATOM 1600 O GLU A 99 -8.280 10.873 4.671 1.00 0.00 O ATOM 1601 CB GLU A 99 -10.714 11.088 6.913 1.00 0.00 C ATOM 1602 CG GLU A 99 -11.866 12.070 7.051 1.00 0.00 C ATOM 1603 CD GLU A 99 -11.648 13.072 8.168 1.00 0.00 C ATOM 1604 OE1 GLU A 99 -10.662 13.835 8.097 1.00 0.00 O ATOM 1605 OE2 GLU A 99 -12.464 13.093 9.113 1.00 0.00 O ATOM 0 H GLU A 99 -12.215 9.394 5.865 1.00 0.00 H new ATOM 0 HA GLU A 99 -10.751 11.366 4.783 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -10.887 10.242 7.578 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -9.795 11.571 7.244 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -11.998 12.604 6.110 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -12.788 11.519 7.237 1.00 0.00 H new ATOM 1612 N ASP A 100 -8.717 8.975 5.798 1.00 0.00 N ATOM 1613 CA ASP A 100 -7.359 8.458 5.671 1.00 0.00 C ATOM 1614 C ASP A 100 -7.028 8.150 4.214 1.00 0.00 C ATOM 1615 O ASP A 100 -6.100 8.722 3.643 1.00 0.00 O ATOM 1616 CB ASP A 100 -7.189 7.199 6.523 1.00 0.00 C ATOM 1617 CG ASP A 100 -6.756 7.513 7.942 1.00 0.00 C ATOM 1618 OD1 ASP A 100 -7.372 8.402 8.566 1.00 0.00 O ATOM 1619 OD2 ASP A 100 -5.801 6.872 8.427 1.00 0.00 O ATOM 0 H ASP A 100 -9.355 8.364 6.308 1.00 0.00 H new ATOM 0 HA ASP A 100 -6.670 9.224 6.026 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -8.131 6.650 6.547 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -6.451 6.546 6.057 1.00 0.00 H new ATOM 1624 N VAL A 101 -7.794 7.242 3.618 1.00 0.00 N ATOM 1625 CA VAL A 101 -7.583 6.857 2.228 1.00 0.00 C ATOM 1626 C VAL A 101 -7.424 8.084 1.337 1.00 0.00 C ATOM 1627 O VAL A 101 -6.473 8.181 0.560 1.00 0.00 O ATOM 1628 CB VAL A 101 -8.748 6.000 1.699 1.00 0.00 C ATOM 1629 CG1 VAL A 101 -8.536 5.657 0.233 1.00 0.00 C ATOM 1630 CG2 VAL A 101 -8.901 4.738 2.534 1.00 0.00 C ATOM 0 H VAL A 101 -8.567 6.759 4.076 1.00 0.00 H new ATOM 0 HA VAL A 101 -6.666 6.268 2.198 1.00 0.00 H new ATOM 0 HB VAL A 101 -9.669 6.577 1.782 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -9.369 5.051 -0.123 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -8.480 6.576 -0.351 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -7.607 5.098 0.121 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -9.729 4.144 2.147 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -7.981 4.155 2.484 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -9.103 5.010 3.570 1.00 0.00 H new ATOM 1640 N ASP A 102 -8.360 9.019 1.454 1.00 0.00 N ATOM 1641 CA ASP A 102 -8.324 10.242 0.660 1.00 0.00 C ATOM 1642 C ASP A 102 -6.962 10.921 0.771 1.00 0.00 C ATOM 1643 O ASP A 102 -6.317 11.208 -0.237 1.00 0.00 O ATOM 1644 CB ASP A 102 -9.425 11.202 1.112 1.00 0.00 C ATOM 1645 CG ASP A 102 -9.693 12.295 0.097 1.00 0.00 C ATOM 1646 OD1 ASP A 102 -9.646 12.003 -1.117 1.00 0.00 O ATOM 1647 OD2 ASP A 102 -9.951 13.443 0.515 1.00 0.00 O ATOM 0 H ASP A 102 -9.154 8.954 2.091 1.00 0.00 H new ATOM 0 HA ASP A 102 -8.493 9.974 -0.383 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -10.343 10.641 1.288 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -9.141 11.654 2.062 1.00 0.00 H new ATOM 1652 N SER A 103 -6.533 11.177 2.003 1.00 0.00 N ATOM 1653 CA SER A 103 -5.251 11.827 2.245 1.00 0.00 C ATOM 1654 C SER A 103 -4.102 10.987 1.694 1.00 0.00 C ATOM 1655 O SER A 103 -3.108 11.522 1.204 1.00 0.00 O ATOM 1656 CB SER A 103 -5.050 12.065 3.743 1.00 0.00 C ATOM 1657 OG SER A 103 -4.145 13.130 3.975 1.00 0.00 O ATOM 0 H SER A 103 -7.054 10.944 2.848 1.00 0.00 H new ATOM 0 HA SER A 103 -5.256 12.787 1.729 1.00 0.00 H new ATOM 0 HB2 SER A 103 -6.009 12.291 4.210 1.00 0.00 H new ATOM 0 HB3 SER A 103 -4.673 11.156 4.211 1.00 0.00 H new ATOM 0 HG SER A 103 -4.036 13.262 4.940 1.00 0.00 H new ATOM 1663 N TRP A 104 -4.248 9.670 1.779 1.00 0.00 N ATOM 1664 CA TRP A 104 -3.224 8.755 1.289 1.00 0.00 C ATOM 1665 C TRP A 104 -3.018 8.922 -0.213 1.00 0.00 C ATOM 1666 O TRP A 104 -1.900 9.150 -0.675 1.00 0.00 O ATOM 1667 CB TRP A 104 -3.608 7.309 1.606 1.00 0.00 C ATOM 1668 CG TRP A 104 -3.109 6.840 2.938 1.00 0.00 C ATOM 1669 CD1 TRP A 104 -3.865 6.475 4.015 1.00 0.00 C ATOM 1670 CD2 TRP A 104 -1.741 6.688 3.336 1.00 0.00 C ATOM 1671 NE1 TRP A 104 -3.050 6.105 5.058 1.00 0.00 N ATOM 1672 CE2 TRP A 104 -1.743 6.226 4.667 1.00 0.00 C ATOM 1673 CE3 TRP A 104 -0.516 6.895 2.697 1.00 0.00 C ATOM 1674 CZ2 TRP A 104 -0.568 5.970 5.367 1.00 0.00 C ATOM 1675 CZ3 TRP A 104 0.650 6.641 3.393 1.00 0.00 C ATOM 1676 CH2 TRP A 104 0.618 6.181 4.717 1.00 0.00 C ATOM 0 H TRP A 104 -5.065 9.212 2.182 1.00 0.00 H new ATOM 0 HA TRP A 104 -2.288 8.993 1.794 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -4.694 7.215 1.579 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -3.212 6.657 0.828 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -4.945 6.477 4.043 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -3.367 5.791 5.975 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -0.481 7.247 1.677 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -0.591 5.617 6.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 1.602 6.799 2.909 1.00 0.00 H new ATOM 0 HH2 TRP A 104 1.547 5.989 5.234 1.00 0.00 H new ATOM 1687 N LYS A 105 -4.103 8.807 -0.971 1.00 0.00 N ATOM 1688 CA LYS A 105 -4.043 8.947 -2.421 1.00 0.00 C ATOM 1689 C LYS A 105 -3.300 10.219 -2.815 1.00 0.00 C ATOM 1690 O LYS A 105 -2.292 10.168 -3.519 1.00 0.00 O ATOM 1691 CB LYS A 105 -5.455 8.964 -3.012 1.00 0.00 C ATOM 1692 CG LYS A 105 -6.105 7.593 -3.073 1.00 0.00 C ATOM 1693 CD LYS A 105 -7.546 7.681 -3.548 1.00 0.00 C ATOM 1694 CE LYS A 105 -8.109 6.307 -3.878 1.00 0.00 C ATOM 1695 NZ LYS A 105 -9.571 6.358 -4.156 1.00 0.00 N ATOM 0 H LYS A 105 -5.036 8.617 -0.605 1.00 0.00 H new ATOM 0 HA LYS A 105 -3.499 8.091 -2.821 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -6.081 9.628 -2.416 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -5.414 9.382 -4.018 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -5.538 6.950 -3.746 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -6.073 7.130 -2.087 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -8.157 8.150 -2.776 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -7.601 8.319 -4.430 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -7.589 5.900 -4.745 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -7.921 5.628 -3.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -9.916 5.402 -4.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -10.071 6.722 -3.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -9.749 6.985 -4.966 1.00 0.00 H new ATOM 1709 N ALA A 106 -3.803 11.360 -2.354 1.00 0.00 N ATOM 1710 CA ALA A 106 -3.185 12.644 -2.655 1.00 0.00 C ATOM 1711 C ALA A 106 -1.702 12.636 -2.301 1.00 0.00 C ATOM 1712 O ALA A 106 -0.880 13.212 -3.014 1.00 0.00 O ATOM 1713 CB ALA A 106 -3.901 13.762 -1.912 1.00 0.00 C ATOM 0 H ALA A 106 -4.637 11.420 -1.770 1.00 0.00 H new ATOM 0 HA ALA A 106 -3.275 12.820 -3.727 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.428 14.716 -2.147 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.947 13.790 -2.218 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -3.842 13.582 -0.839 1.00 0.00 H new ATOM 1719 N SER A 107 -1.366 11.981 -1.194 1.00 0.00 N ATOM 1720 CA SER A 107 0.018 11.902 -0.743 1.00 0.00 C ATOM 1721 C SER A 107 0.884 11.177 -1.769 1.00 0.00 C ATOM 1722 O SER A 107 1.970 11.639 -2.120 1.00 0.00 O ATOM 1723 CB SER A 107 0.097 11.185 0.606 1.00 0.00 C ATOM 1724 OG SER A 107 1.403 10.690 0.845 1.00 0.00 O ATOM 0 H SER A 107 -2.034 11.497 -0.593 1.00 0.00 H new ATOM 0 HA SER A 107 0.395 12.918 -0.629 1.00 0.00 H new ATOM 0 HB2 SER A 107 -0.186 11.872 1.403 1.00 0.00 H new ATOM 0 HB3 SER A 107 -0.617 10.361 0.626 1.00 0.00 H new ATOM 0 HG SER A 107 1.357 9.932 1.465 1.00 0.00 H new ATOM 1730 N PHE A 108 0.395 10.037 -2.247 1.00 0.00 N ATOM 1731 CA PHE A 108 1.123 9.246 -3.232 1.00 0.00 C ATOM 1732 C PHE A 108 1.452 10.083 -4.465 1.00 0.00 C ATOM 1733 O PHE A 108 2.592 10.099 -4.931 1.00 0.00 O ATOM 1734 CB PHE A 108 0.304 8.019 -3.638 1.00 0.00 C ATOM 1735 CG PHE A 108 0.591 6.804 -2.803 1.00 0.00 C ATOM 1736 CD1 PHE A 108 -0.018 6.634 -1.571 1.00 0.00 C ATOM 1737 CD2 PHE A 108 1.470 5.831 -3.252 1.00 0.00 C ATOM 1738 CE1 PHE A 108 0.243 5.517 -0.800 1.00 0.00 C ATOM 1739 CE2 PHE A 108 1.735 4.712 -2.486 1.00 0.00 C ATOM 1740 CZ PHE A 108 1.122 4.555 -1.258 1.00 0.00 C ATOM 0 H PHE A 108 -0.502 9.641 -1.968 1.00 0.00 H new ATOM 0 HA PHE A 108 2.058 8.916 -2.778 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -0.757 8.259 -3.563 1.00 0.00 H new ATOM 0 HB3 PHE A 108 0.506 7.787 -4.684 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.706 7.384 -1.208 1.00 0.00 H new ATOM 0 HD2 PHE A 108 1.953 5.949 -4.211 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.239 5.397 0.159 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.421 3.960 -2.847 1.00 0.00 H new ATOM 0 HZ PHE A 108 1.330 3.682 -0.657 1.00 0.00 H new ATOM 1750 N LEU A 109 0.447 10.775 -4.988 1.00 0.00 N ATOM 1751 CA LEU A 109 0.628 11.614 -6.168 1.00 0.00 C ATOM 1752 C LEU A 109 1.868 12.491 -6.027 1.00 0.00 C ATOM 1753 O LEU A 109 2.709 12.544 -6.925 1.00 0.00 O ATOM 1754 CB LEU A 109 -0.607 12.489 -6.391 1.00 0.00 C ATOM 1755 CG LEU A 109 -1.699 11.894 -7.280 1.00 0.00 C ATOM 1756 CD1 LEU A 109 -2.710 11.127 -6.443 1.00 0.00 C ATOM 1757 CD2 LEU A 109 -2.388 12.988 -8.082 1.00 0.00 C ATOM 0 H LEU A 109 -0.502 10.772 -4.614 1.00 0.00 H new ATOM 0 HA LEU A 109 0.763 10.961 -7.030 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -1.044 12.721 -5.420 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -0.284 13.433 -6.829 1.00 0.00 H new ATOM 0 HG LEU A 109 -1.234 11.198 -7.978 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -3.480 10.711 -7.093 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -2.206 10.318 -5.914 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -3.171 11.801 -5.721 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.162 12.546 -8.709 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.840 13.709 -7.401 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.656 13.494 -8.711 1.00 0.00 H new ATOM 1769 N ARG A 110 1.976 13.176 -4.893 1.00 0.00 N ATOM 1770 CA ARG A 110 3.114 14.051 -4.634 1.00 0.00 C ATOM 1771 C ARG A 110 4.428 13.291 -4.788 1.00 0.00 C ATOM 1772 O ARG A 110 5.409 13.827 -5.303 1.00 0.00 O ATOM 1773 CB ARG A 110 3.017 14.646 -3.229 1.00 0.00 C ATOM 1774 CG ARG A 110 2.023 15.791 -3.119 1.00 0.00 C ATOM 1775 CD ARG A 110 2.432 16.783 -2.042 1.00 0.00 C ATOM 1776 NE ARG A 110 1.288 17.522 -1.516 1.00 0.00 N ATOM 1777 CZ ARG A 110 1.399 18.646 -0.816 1.00 0.00 C ATOM 1778 NH1 ARG A 110 2.595 19.157 -0.560 1.00 0.00 N ATOM 1779 NH2 ARG A 110 0.310 19.261 -0.371 1.00 0.00 N ATOM 0 H ARG A 110 1.290 13.142 -4.139 1.00 0.00 H new ATOM 0 HA ARG A 110 3.094 14.860 -5.365 1.00 0.00 H new ATOM 0 HB2 ARG A 110 2.732 13.860 -2.530 1.00 0.00 H new ATOM 0 HB3 ARG A 110 4.002 15.001 -2.925 1.00 0.00 H new ATOM 0 HG2 ARG A 110 1.949 16.304 -4.078 1.00 0.00 H new ATOM 0 HG3 ARG A 110 1.033 15.394 -2.893 1.00 0.00 H new ATOM 0 HD2 ARG A 110 2.926 16.252 -1.228 1.00 0.00 H new ATOM 0 HD3 ARG A 110 3.159 17.484 -2.452 1.00 0.00 H new ATOM 0 HE ARG A 110 0.353 17.156 -1.696 1.00 0.00 H new ATOM 0 HH11 ARG A 110 3.434 18.687 -0.901 1.00 0.00 H new ATOM 0 HH12 ARG A 110 2.676 20.020 -0.022 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -0.612 18.871 -0.566 1.00 0.00 H new ATOM 0 HH22 ARG A 110 0.395 20.124 0.166 1.00 0.00 H new ATOM 1793 N ALA A 111 4.440 12.041 -4.336 1.00 0.00 N ATOM 1794 CA ALA A 111 5.633 11.209 -4.424 1.00 0.00 C ATOM 1795 C ALA A 111 5.977 10.894 -5.876 1.00 0.00 C ATOM 1796 O ALA A 111 7.141 10.694 -6.219 1.00 0.00 O ATOM 1797 CB ALA A 111 5.438 9.922 -3.635 1.00 0.00 C ATOM 0 H ALA A 111 3.637 11.583 -3.905 1.00 0.00 H new ATOM 0 HA ALA A 111 6.466 11.765 -3.993 1.00 0.00 H new ATOM 0 HB1 ALA A 111 6.337 9.310 -3.709 1.00 0.00 H new ATOM 0 HB2 ALA A 111 5.248 10.162 -2.589 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.589 9.371 -4.041 1.00 0.00 H new ATOM 1803 N GLY A 112 4.955 10.850 -6.725 1.00 0.00 N ATOM 1804 CA GLY A 112 5.170 10.558 -8.130 1.00 0.00 C ATOM 1805 C GLY A 112 4.314 9.408 -8.621 1.00 0.00 C ATOM 1806 O GLY A 112 4.693 8.695 -9.551 1.00 0.00 O ATOM 0 H GLY A 112 3.982 11.011 -6.465 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.951 11.448 -8.720 1.00 0.00 H new ATOM 0 HA3 GLY A 112 6.221 10.319 -8.291 1.00 0.00 H new ATOM 1810 N VAL A 113 3.156 9.225 -7.995 1.00 0.00 N ATOM 1811 CA VAL A 113 2.243 8.152 -8.373 1.00 0.00 C ATOM 1812 C VAL A 113 0.856 8.698 -8.693 1.00 0.00 C ATOM 1813 O VAL A 113 0.192 8.231 -9.618 1.00 0.00 O ATOM 1814 CB VAL A 113 2.123 7.098 -7.257 1.00 0.00 C ATOM 1815 CG1 VAL A 113 1.390 5.865 -7.763 1.00 0.00 C ATOM 1816 CG2 VAL A 113 3.499 6.728 -6.724 1.00 0.00 C ATOM 0 H VAL A 113 2.827 9.806 -7.224 1.00 0.00 H new ATOM 0 HA VAL A 113 2.659 7.681 -9.264 1.00 0.00 H new ATOM 0 HB VAL A 113 1.544 7.525 -6.439 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.315 5.131 -6.960 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.390 6.146 -8.092 1.00 0.00 H new ATOM 0 HG13 VAL A 113 1.939 5.433 -8.599 1.00 0.00 H new ATOM 0 HG21 VAL A 113 3.395 5.982 -5.936 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.105 6.320 -7.533 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.984 7.617 -6.321 1.00 0.00 H new TER 1826 VAL A 113