USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 992 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 82 CYS SG : rot 45:sc= 0.538 USER MOD Set 1.2: A 100 GLN : amide:sc= 1.72 K(o=2.3,f=0.43) USER MOD Set 2.1: A 5 MET CE :methyl 167:sc= -0.266 (180deg=-0.931) USER MOD Set 2.2: A 35 CYS SG : rot -98:sc= 0.466 USER MOD Set 2.3: A 69 ASN : amide:sc= 0.318 K(o=0.69,f=-0.32) USER MOD Set 2.4: A 73 TYR OH : rot 30:sc= 0.167 USER MOD Set 3.1: A 11 ASN : amide:sc= 0.421 K(o=1.7,f=-4.6!) USER MOD Set 3.2: A 15 SER OG : rot -55:sc= 0.699 USER MOD Set 3.3: A 34 SER OG : rot 180:sc= 0.549 USER MOD Set 4.1: A 16 GLN : amide:sc= 1.95 K(o=3.3,f=-1.6) USER MOD Set 4.2: A 60 GLN : amide:sc= 1.37 K(o=3.3,f=0.044) USER MOD Set 5.1: A 8 CYS SG : rot 174:sc= 0.234 USER MOD Set 5.2: A 13 CYS SG : rot 175:sc= 0.139 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 148:sc= 1.22 (180deg=0.558) USER MOD Single : A 2 LYS NZ :NH3+ 177:sc= 1.22 (180deg=1.19) USER MOD Single : A 3 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.2) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 150:sc= 0.0364 USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0.887 (180deg=0.887) USER MOD Single : A 24 THR OG1 : rot 91:sc= 0.755 USER MOD Single : A 29 LYS NZ :NH3+ -169:sc= 0.872 (180deg=0.796) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 140:sc= 0.525 USER MOD Single : A 43 HIS : no HD1:sc= 0.665 K(o=0.66,f=-4.1!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -139:sc= -0.807 (180deg=-1.04) USER MOD Single : A 50 MET CE :methyl -143:sc= -0.408 (180deg=-4.06!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -70:sc= 0.235 USER MOD Single : A 67 ASN : amide:sc= 0.715 K(o=0.72,f=-0.15) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.475 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot -35:sc= 0.259 USER MOD Single : A 93 GLN : amide:sc= 0.978 K(o=0.98,f=-0.27) USER MOD Single : A 107 GLN : amide:sc= 0.251 K(o=0.25,f=-0.84) USER MOD Single : A 108 SER OG : rot 180:sc= 0.155 USER MOD Single : A 114 THR OG1 : rot 74:sc= 1.18 USER MOD Single : A 118 GLN : amide:sc= 0.906 K(o=0.91,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -175:sc= 1.18 (180deg=1.15) USER MOD Single : A 125 ASN : amide:sc= 0.853 K(o=0.85,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 53:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.727 -0.214 0.973 1.00 0.00 N ATOM 2 CA MET A 1 2.228 0.070 -0.399 1.00 0.00 C ATOM 3 C MET A 1 2.257 1.575 -0.688 1.00 0.00 C ATOM 4 O MET A 1 1.221 2.235 -0.618 1.00 0.00 O ATOM 5 CB MET A 1 1.438 -0.696 -1.493 1.00 0.00 C ATOM 6 CG MET A 1 1.944 -0.394 -2.918 1.00 0.00 C ATOM 7 SD MET A 1 1.223 -1.388 -4.253 1.00 0.00 S ATOM 8 CE MET A 1 2.134 -2.946 -4.052 1.00 0.00 C ATOM 0 H1 MET A 1 1.218 -1.121 0.976 1.00 0.00 H new ATOM 0 H2 MET A 1 2.530 -0.265 1.632 1.00 0.00 H new ATOM 0 H3 MET A 1 1.082 0.546 1.271 1.00 0.00 H new ATOM 0 HA MET A 1 3.253 -0.299 -0.434 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.512 -1.767 -1.305 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.383 -0.433 -1.424 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.754 0.658 -3.133 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.025 -0.532 -2.934 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.801 -3.662 -4.804 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.201 -2.762 -4.174 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.947 -3.351 -3.058 1.00 0.00 H new ATOM 18 N LYS A 2 3.429 2.102 -1.072 1.00 0.00 N ATOM 19 CA LYS A 2 3.646 3.469 -1.604 1.00 0.00 C ATOM 20 C LYS A 2 4.461 3.420 -2.906 1.00 0.00 C ATOM 21 O LYS A 2 5.045 2.383 -3.227 1.00 0.00 O ATOM 22 CB LYS A 2 4.304 4.353 -0.521 1.00 0.00 C ATOM 23 CG LYS A 2 3.330 4.643 0.633 1.00 0.00 C ATOM 24 CD LYS A 2 3.938 5.548 1.712 1.00 0.00 C ATOM 25 CE LYS A 2 2.883 5.838 2.790 1.00 0.00 C ATOM 26 NZ LYS A 2 3.441 6.651 3.904 1.00 0.00 N ATOM 0 H LYS A 2 4.296 1.567 -1.020 1.00 0.00 H new ATOM 0 HA LYS A 2 2.687 3.921 -1.856 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.193 3.855 -0.133 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.633 5.292 -0.966 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.432 5.114 0.234 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.021 3.701 1.087 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.807 5.066 2.159 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.285 6.481 1.267 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.041 6.365 2.342 1.00 0.00 H new ATOM 0 HE3 LYS A 2 2.498 4.898 3.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 2.687 6.869 4.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 4.195 6.116 4.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.832 7.537 3.525 1.00 0.00 H new ATOM 40 N LYS A 3 4.471 4.512 -3.682 1.00 0.00 N ATOM 41 CA LYS A 3 5.113 4.594 -5.010 1.00 0.00 C ATOM 42 C LYS A 3 6.386 5.443 -4.970 1.00 0.00 C ATOM 43 O LYS A 3 6.424 6.484 -4.319 1.00 0.00 O ATOM 44 CB LYS A 3 4.129 5.083 -6.099 1.00 0.00 C ATOM 45 CG LYS A 3 2.910 4.154 -6.306 1.00 0.00 C ATOM 46 CD LYS A 3 1.710 4.373 -5.368 1.00 0.00 C ATOM 47 CE LYS A 3 1.112 5.767 -5.574 1.00 0.00 C ATOM 48 NZ LYS A 3 0.428 6.284 -4.359 1.00 0.00 N ATOM 0 H LYS A 3 4.024 5.385 -3.402 1.00 0.00 H new ATOM 0 HA LYS A 3 5.410 3.582 -5.285 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.774 6.078 -5.833 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.665 5.178 -7.043 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.565 4.269 -7.333 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.245 3.123 -6.196 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.951 3.614 -5.557 1.00 0.00 H new ATOM 0 HD3 LYS A 3 2.026 4.257 -4.331 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.904 6.458 -5.862 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.401 5.734 -6.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.002 7.207 -4.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.313 5.616 -4.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.120 6.391 -3.590 1.00 0.00 H new ATOM 62 N VAL A 4 7.408 5.008 -5.704 1.00 0.00 N ATOM 63 CA VAL A 4 8.706 5.709 -5.824 1.00 0.00 C ATOM 64 C VAL A 4 8.991 6.033 -7.292 1.00 0.00 C ATOM 65 O VAL A 4 8.730 5.217 -8.174 1.00 0.00 O ATOM 66 CB VAL A 4 9.869 4.943 -5.156 1.00 0.00 C ATOM 67 CG1 VAL A 4 11.140 5.798 -5.082 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.529 4.460 -3.739 1.00 0.00 C ATOM 0 H VAL A 4 7.367 4.145 -6.245 1.00 0.00 H new ATOM 0 HA VAL A 4 8.629 6.646 -5.273 1.00 0.00 H new ATOM 0 HB VAL A 4 10.041 4.073 -5.790 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.936 5.226 -4.606 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.448 6.080 -6.089 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.940 6.697 -4.498 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.384 3.929 -3.321 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.291 5.318 -3.110 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.670 3.790 -3.779 1.00 0.00 H new ATOM 78 N MET A 5 9.529 7.220 -7.561 1.00 0.00 N ATOM 79 CA MET A 5 9.852 7.685 -8.910 1.00 0.00 C ATOM 80 C MET A 5 11.265 8.264 -8.947 1.00 0.00 C ATOM 81 O MET A 5 11.640 9.058 -8.086 1.00 0.00 O ATOM 82 CB MET A 5 8.785 8.687 -9.379 1.00 0.00 C ATOM 83 CG MET A 5 9.147 9.430 -10.670 1.00 0.00 C ATOM 84 SD MET A 5 9.470 8.416 -12.138 1.00 0.00 S ATOM 85 CE MET A 5 8.105 8.941 -13.205 1.00 0.00 C ATOM 0 H MET A 5 9.757 7.899 -6.835 1.00 0.00 H new ATOM 0 HA MET A 5 9.840 6.847 -9.607 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.845 8.156 -9.530 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.615 9.417 -8.588 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.334 10.117 -10.905 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.032 10.037 -10.476 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.283 8.592 -14.222 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.171 8.519 -12.835 1.00 0.00 H new ATOM 0 HE3 MET A 5 8.038 10.029 -13.201 1.00 0.00 H new ATOM 95 N PHE A 6 12.034 7.875 -9.957 1.00 0.00 N ATOM 96 CA PHE A 6 13.443 8.252 -10.123 1.00 0.00 C ATOM 97 C PHE A 6 13.626 9.254 -11.274 1.00 0.00 C ATOM 98 O PHE A 6 13.085 9.041 -12.352 1.00 0.00 O ATOM 99 CB PHE A 6 14.283 6.973 -10.313 1.00 0.00 C ATOM 100 CG PHE A 6 14.026 5.900 -9.267 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.586 6.007 -7.979 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.189 4.812 -9.571 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.257 5.071 -6.981 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.861 3.875 -8.575 1.00 0.00 C ATOM 105 CZ PHE A 6 13.374 4.016 -7.274 1.00 0.00 C ATOM 0 H PHE A 6 11.691 7.273 -10.706 1.00 0.00 H new ATOM 0 HA PHE A 6 13.792 8.765 -9.227 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.077 6.559 -11.300 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.340 7.239 -10.293 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.271 6.811 -7.756 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.797 4.696 -10.571 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.682 5.162 -5.992 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.213 3.044 -8.811 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.091 3.316 -6.502 1.00 0.00 H new ATOM 115 N VAL A 7 14.418 10.311 -11.068 1.00 0.00 N ATOM 116 CA VAL A 7 14.822 11.322 -12.066 1.00 0.00 C ATOM 117 C VAL A 7 16.334 11.256 -12.296 1.00 0.00 C ATOM 118 O VAL A 7 17.102 11.472 -11.367 1.00 0.00 O ATOM 119 CB VAL A 7 14.338 12.744 -11.653 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.212 13.896 -12.179 1.00 0.00 C ATOM 121 CG2 VAL A 7 12.941 13.000 -12.217 1.00 0.00 C ATOM 0 H VAL A 7 14.820 10.500 -10.150 1.00 0.00 H new ATOM 0 HA VAL A 7 14.337 11.099 -13.016 1.00 0.00 H new ATOM 0 HB VAL A 7 14.378 12.740 -10.564 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.800 14.848 -11.843 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.227 13.785 -11.799 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.228 13.872 -13.269 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.608 13.996 -11.925 1.00 0.00 H new ATOM 0 HG22 VAL A 7 12.969 12.931 -13.304 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.248 12.256 -11.824 1.00 0.00 H new ATOM 131 N CYS A 8 16.781 11.001 -13.530 1.00 0.00 N ATOM 132 CA CYS A 8 18.189 11.119 -13.961 1.00 0.00 C ATOM 133 C CYS A 8 18.325 12.171 -15.086 1.00 0.00 C ATOM 134 O CYS A 8 17.323 12.667 -15.590 1.00 0.00 O ATOM 135 CB CYS A 8 18.676 9.693 -14.296 1.00 0.00 C ATOM 136 SG CYS A 8 20.404 9.630 -14.860 1.00 0.00 S ATOM 0 H CYS A 8 16.161 10.698 -14.281 1.00 0.00 H new ATOM 0 HA CYS A 8 18.846 11.505 -13.181 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.567 9.064 -13.413 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.034 9.271 -15.069 1.00 0.00 H new ATOM 0 HG CYS A 8 20.774 8.390 -14.987 1.00 0.00 H new ATOM 142 N LYS A 9 19.551 12.542 -15.497 1.00 0.00 N ATOM 143 CA LYS A 9 19.774 13.679 -16.429 1.00 0.00 C ATOM 144 C LYS A 9 19.239 13.419 -17.853 1.00 0.00 C ATOM 145 O LYS A 9 18.525 14.255 -18.384 1.00 0.00 O ATOM 146 CB LYS A 9 21.260 14.106 -16.395 1.00 0.00 C ATOM 147 CG LYS A 9 21.434 15.580 -16.809 1.00 0.00 C ATOM 148 CD LYS A 9 22.904 16.019 -16.947 1.00 0.00 C ATOM 149 CE LYS A 9 23.598 15.413 -18.183 1.00 0.00 C ATOM 150 NZ LYS A 9 24.963 15.984 -18.378 1.00 0.00 N ATOM 0 H LYS A 9 20.408 12.075 -15.202 1.00 0.00 H new ATOM 0 HA LYS A 9 19.179 14.522 -16.078 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.659 13.959 -15.391 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.838 13.468 -17.064 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.925 15.743 -17.759 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.943 16.215 -16.072 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.949 17.106 -17.008 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.451 15.727 -16.050 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.668 14.331 -18.069 1.00 0.00 H new ATOM 0 HE3 LYS A 9 22.993 15.601 -19.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.402 15.555 -19.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.893 17.013 -18.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 25.547 15.782 -17.541 1.00 0.00 H new ATOM 164 N ARG A 10 19.520 12.230 -18.417 1.00 0.00 N ATOM 165 CA ARG A 10 18.990 11.744 -19.731 1.00 0.00 C ATOM 166 C ARG A 10 18.233 10.401 -19.684 1.00 0.00 C ATOM 167 O ARG A 10 18.020 9.755 -20.703 1.00 0.00 O ATOM 168 CB ARG A 10 20.040 11.881 -20.862 1.00 0.00 C ATOM 169 CG ARG A 10 21.196 10.859 -20.959 1.00 0.00 C ATOM 170 CD ARG A 10 22.144 10.851 -19.754 1.00 0.00 C ATOM 171 NE ARG A 10 23.448 10.214 -20.054 1.00 0.00 N ATOM 172 CZ ARG A 10 24.430 10.010 -19.187 1.00 0.00 C ATOM 173 NH1 ARG A 10 24.298 10.281 -17.922 1.00 0.00 N ATOM 174 NH2 ARG A 10 25.576 9.523 -19.543 1.00 0.00 N ATOM 0 H ARG A 10 20.138 11.553 -17.969 1.00 0.00 H new ATOM 0 HA ARG A 10 18.183 12.427 -19.996 1.00 0.00 H new ATOM 0 HB2 ARG A 10 19.503 11.857 -21.810 1.00 0.00 H new ATOM 0 HB3 ARG A 10 20.487 12.871 -20.774 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.773 9.862 -21.078 1.00 0.00 H new ATOM 0 HG3 ARG A 10 21.775 11.069 -21.858 1.00 0.00 H new ATOM 0 HD2 ARG A 10 22.313 11.876 -19.423 1.00 0.00 H new ATOM 0 HD3 ARG A 10 21.669 10.324 -18.927 1.00 0.00 H new ATOM 0 HE ARG A 10 23.604 9.905 -21.013 1.00 0.00 H new ATOM 0 HH11 ARG A 10 23.419 10.662 -17.571 1.00 0.00 H new ATOM 0 HH12 ARG A 10 25.073 10.112 -17.281 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.747 9.282 -20.519 1.00 0.00 H new ATOM 0 HH22 ARG A 10 26.308 9.380 -18.847 1.00 0.00 H new ATOM 188 N ASN A 11 17.876 9.977 -18.469 1.00 0.00 N ATOM 189 CA ASN A 11 17.185 8.724 -18.097 1.00 0.00 C ATOM 190 C ASN A 11 17.739 7.428 -18.727 1.00 0.00 C ATOM 191 O ASN A 11 17.005 6.477 -18.993 1.00 0.00 O ATOM 192 CB ASN A 11 15.670 8.959 -18.213 1.00 0.00 C ATOM 193 CG ASN A 11 14.792 7.844 -17.672 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.794 7.504 -18.275 1.00 0.00 O ATOM 195 ND2 ASN A 11 15.077 7.271 -16.525 1.00 0.00 N ATOM 0 H ASN A 11 18.077 10.544 -17.645 1.00 0.00 H new ATOM 0 HA ASN A 11 17.411 8.496 -17.055 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.422 9.881 -17.687 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.423 9.115 -19.263 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.463 6.548 -16.149 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.913 7.549 -16.010 1.00 0.00 H new ATOM 202 N SER A 12 19.058 7.389 -18.914 1.00 0.00 N ATOM 203 CA SER A 12 19.809 6.245 -19.442 1.00 0.00 C ATOM 204 C SER A 12 20.392 5.363 -18.342 1.00 0.00 C ATOM 205 O SER A 12 20.321 4.140 -18.441 1.00 0.00 O ATOM 206 CB SER A 12 20.914 6.805 -20.337 1.00 0.00 C ATOM 207 OG SER A 12 21.624 7.755 -19.558 1.00 0.00 O ATOM 0 H SER A 12 19.658 8.184 -18.694 1.00 0.00 H new ATOM 0 HA SER A 12 19.135 5.599 -20.005 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.577 6.010 -20.677 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.492 7.271 -21.227 1.00 0.00 H new ATOM 0 HG SER A 12 22.558 7.786 -19.852 1.00 0.00 H new ATOM 213 N CYS A 13 20.951 5.979 -17.297 1.00 0.00 N ATOM 214 CA CYS A 13 21.686 5.334 -16.204 1.00 0.00 C ATOM 215 C CYS A 13 21.046 5.617 -14.835 1.00 0.00 C ATOM 216 O CYS A 13 20.125 6.423 -14.732 1.00 0.00 O ATOM 217 CB CYS A 13 23.147 5.824 -16.323 1.00 0.00 C ATOM 218 SG CYS A 13 23.234 7.620 -16.032 1.00 0.00 S ATOM 0 H CYS A 13 20.901 6.991 -17.184 1.00 0.00 H new ATOM 0 HA CYS A 13 21.654 4.247 -16.283 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.774 5.301 -15.601 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.537 5.589 -17.313 1.00 0.00 H new ATOM 0 HG CYS A 13 24.478 7.998 -16.021 1.00 0.00 H new ATOM 224 N ARG A 14 21.552 4.998 -13.761 1.00 0.00 N ATOM 225 CA ARG A 14 21.140 5.169 -12.337 1.00 0.00 C ATOM 226 C ARG A 14 19.654 4.922 -12.066 1.00 0.00 C ATOM 227 O ARG A 14 19.293 3.845 -11.622 1.00 0.00 O ATOM 228 CB ARG A 14 21.696 6.507 -11.781 1.00 0.00 C ATOM 229 CG ARG A 14 23.234 6.531 -11.779 1.00 0.00 C ATOM 230 CD ARG A 14 23.810 7.754 -11.047 1.00 0.00 C ATOM 231 NE ARG A 14 23.473 9.019 -11.737 1.00 0.00 N ATOM 232 CZ ARG A 14 24.052 9.531 -12.808 1.00 0.00 C ATOM 233 NH1 ARG A 14 25.143 9.041 -13.307 1.00 0.00 N ATOM 234 NH2 ARG A 14 23.519 10.552 -13.402 1.00 0.00 N ATOM 0 H ARG A 14 22.308 4.319 -13.855 1.00 0.00 H new ATOM 0 HA ARG A 14 21.601 4.366 -11.763 1.00 0.00 H new ATOM 0 HB2 ARG A 14 21.321 7.334 -12.383 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.329 6.659 -10.766 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.606 5.622 -11.307 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.594 6.526 -12.808 1.00 0.00 H new ATOM 0 HD2 ARG A 14 23.424 7.782 -10.028 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.893 7.657 -10.975 1.00 0.00 H new ATOM 0 HE ARG A 14 22.704 9.558 -11.339 1.00 0.00 H new ATOM 0 HH11 ARG A 14 25.585 8.232 -12.871 1.00 0.00 H new ATOM 0 HH12 ARG A 14 25.560 9.465 -14.136 1.00 0.00 H new ATOM 0 HH21 ARG A 14 22.655 10.958 -13.042 1.00 0.00 H new ATOM 0 HH22 ARG A 14 23.963 10.950 -14.229 1.00 0.00 H new ATOM 248 N SER A 15 18.780 5.860 -12.427 1.00 0.00 N ATOM 249 CA SER A 15 17.297 5.770 -12.352 1.00 0.00 C ATOM 250 C SER A 15 16.733 4.441 -12.860 1.00 0.00 C ATOM 251 O SER A 15 15.894 3.816 -12.222 1.00 0.00 O ATOM 252 CB SER A 15 16.703 6.931 -13.167 1.00 0.00 C ATOM 253 OG SER A 15 17.165 6.882 -14.521 1.00 0.00 O ATOM 0 H SER A 15 19.089 6.757 -12.802 1.00 0.00 H new ATOM 0 HA SER A 15 17.018 5.831 -11.300 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.614 6.878 -13.146 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.985 7.882 -12.715 1.00 0.00 H new ATOM 0 HG SER A 15 18.145 6.877 -14.532 1.00 0.00 H new ATOM 259 N GLN A 16 17.259 3.958 -13.987 1.00 0.00 N ATOM 260 CA GLN A 16 16.830 2.695 -14.620 1.00 0.00 C ATOM 261 C GLN A 16 17.265 1.457 -13.807 1.00 0.00 C ATOM 262 O GLN A 16 16.504 0.497 -13.706 1.00 0.00 O ATOM 263 CB GLN A 16 17.366 2.676 -16.067 1.00 0.00 C ATOM 264 CG GLN A 16 16.835 3.827 -16.959 1.00 0.00 C ATOM 265 CD GLN A 16 15.386 3.659 -17.420 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.659 2.775 -16.998 1.00 0.00 O ATOM 267 NE2 GLN A 16 14.927 4.503 -18.310 1.00 0.00 N ATOM 0 H GLN A 16 18.004 4.433 -14.497 1.00 0.00 H new ATOM 0 HA GLN A 16 15.741 2.646 -14.641 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.455 2.726 -16.040 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.102 1.724 -16.527 1.00 0.00 H new ATOM 0 HG2 GLN A 16 16.921 4.764 -16.409 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.474 3.913 -17.838 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.529 5.245 -18.667 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.968 4.419 -18.646 1.00 0.00 H new ATOM 276 N MET A 17 18.437 1.504 -13.153 1.00 0.00 N ATOM 277 CA MET A 17 18.883 0.492 -12.170 1.00 0.00 C ATOM 278 C MET A 17 18.082 0.570 -10.866 1.00 0.00 C ATOM 279 O MET A 17 17.787 -0.459 -10.271 1.00 0.00 O ATOM 280 CB MET A 17 20.377 0.673 -11.833 1.00 0.00 C ATOM 281 CG MET A 17 21.355 0.375 -12.973 1.00 0.00 C ATOM 282 SD MET A 17 23.063 0.628 -12.423 1.00 0.00 S ATOM 283 CE MET A 17 23.944 -0.368 -13.651 1.00 0.00 C ATOM 0 H MET A 17 19.114 2.255 -13.291 1.00 0.00 H new ATOM 0 HA MET A 17 18.718 -0.481 -12.633 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.534 1.700 -11.503 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.622 0.026 -10.990 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.224 -0.652 -13.313 1.00 0.00 H new ATOM 0 HG3 MET A 17 21.140 1.022 -13.823 1.00 0.00 H new ATOM 0 HE1 MET A 17 25.015 -0.321 -13.456 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.609 -1.403 -13.588 1.00 0.00 H new ATOM 0 HE3 MET A 17 23.739 0.020 -14.649 1.00 0.00 H new ATOM 293 N ALA A 18 17.682 1.772 -10.438 1.00 0.00 N ATOM 294 CA ALA A 18 16.880 1.971 -9.225 1.00 0.00 C ATOM 295 C ALA A 18 15.507 1.301 -9.359 1.00 0.00 C ATOM 296 O ALA A 18 15.087 0.577 -8.459 1.00 0.00 O ATOM 297 CB ALA A 18 16.782 3.472 -8.938 1.00 0.00 C ATOM 0 H ALA A 18 17.906 2.639 -10.926 1.00 0.00 H new ATOM 0 HA ALA A 18 17.364 1.493 -8.373 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.188 3.632 -8.038 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.782 3.880 -8.790 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.306 3.973 -9.781 1.00 0.00 H new ATOM 303 N GLU A 19 14.867 1.426 -10.527 1.00 0.00 N ATOM 304 CA GLU A 19 13.663 0.649 -10.853 1.00 0.00 C ATOM 305 C GLU A 19 13.967 -0.855 -10.869 1.00 0.00 C ATOM 306 O GLU A 19 13.196 -1.620 -10.307 1.00 0.00 O ATOM 307 CB GLU A 19 13.052 1.134 -12.184 1.00 0.00 C ATOM 308 CG GLU A 19 11.664 0.517 -12.418 1.00 0.00 C ATOM 309 CD GLU A 19 11.029 0.916 -13.768 1.00 0.00 C ATOM 310 OE1 GLU A 19 10.990 2.126 -14.094 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.513 0.020 -14.479 1.00 0.00 O ATOM 0 H GLU A 19 15.164 2.062 -11.267 1.00 0.00 H new ATOM 0 HA GLU A 19 12.919 0.813 -10.073 1.00 0.00 H new ATOM 0 HB2 GLU A 19 12.973 2.221 -12.176 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.714 0.869 -13.009 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.746 -0.569 -12.372 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.999 0.821 -11.609 1.00 0.00 H new ATOM 318 N GLY A 20 15.117 -1.283 -11.404 1.00 0.00 N ATOM 319 CA GLY A 20 15.584 -2.680 -11.386 1.00 0.00 C ATOM 320 C GLY A 20 15.687 -3.306 -9.992 1.00 0.00 C ATOM 321 O GLY A 20 15.152 -4.387 -9.752 1.00 0.00 O ATOM 0 H GLY A 20 15.767 -0.653 -11.874 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.906 -3.283 -11.990 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.563 -2.727 -11.863 1.00 0.00 H new ATOM 325 N PHE A 21 16.331 -2.634 -9.039 1.00 0.00 N ATOM 326 CA PHE A 21 16.403 -3.139 -7.661 1.00 0.00 C ATOM 327 C PHE A 21 15.054 -3.051 -6.959 1.00 0.00 C ATOM 328 O PHE A 21 14.629 -4.013 -6.331 1.00 0.00 O ATOM 329 CB PHE A 21 17.518 -2.413 -6.899 1.00 0.00 C ATOM 330 CG PHE A 21 18.879 -2.821 -7.402 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.306 -4.152 -7.240 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.688 -1.902 -8.092 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.527 -4.571 -7.787 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.918 -2.319 -8.626 1.00 0.00 C ATOM 335 CZ PHE A 21 21.337 -3.654 -8.473 1.00 0.00 C ATOM 0 H PHE A 21 16.808 -1.745 -9.190 1.00 0.00 H new ATOM 0 HA PHE A 21 16.654 -4.199 -7.685 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.395 -1.336 -7.009 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.439 -2.636 -5.835 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.692 -4.852 -6.693 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.365 -0.878 -8.211 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.843 -5.598 -7.680 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.543 -1.615 -9.155 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.283 -3.973 -8.884 1.00 0.00 H new ATOM 345 N ALA A 22 14.330 -1.945 -7.117 1.00 0.00 N ATOM 346 CA ALA A 22 13.043 -1.757 -6.450 1.00 0.00 C ATOM 347 C ALA A 22 11.947 -2.714 -6.961 1.00 0.00 C ATOM 348 O ALA A 22 11.228 -3.281 -6.146 1.00 0.00 O ATOM 349 CB ALA A 22 12.673 -0.279 -6.570 1.00 0.00 C ATOM 0 H ALA A 22 14.615 -1.161 -7.704 1.00 0.00 H new ATOM 0 HA ALA A 22 13.131 -2.022 -5.396 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.715 -0.103 -6.081 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.441 0.328 -6.092 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.599 -0.007 -7.623 1.00 0.00 H new ATOM 355 N LYS A 23 11.862 -2.999 -8.269 1.00 0.00 N ATOM 356 CA LYS A 23 10.865 -3.949 -8.829 1.00 0.00 C ATOM 357 C LYS A 23 11.069 -5.391 -8.348 1.00 0.00 C ATOM 358 O LYS A 23 10.117 -6.158 -8.256 1.00 0.00 O ATOM 359 CB LYS A 23 10.825 -3.858 -10.371 1.00 0.00 C ATOM 360 CG LYS A 23 12.041 -4.464 -11.100 1.00 0.00 C ATOM 361 CD LYS A 23 12.127 -4.076 -12.592 1.00 0.00 C ATOM 362 CE LYS A 23 11.210 -4.888 -13.521 1.00 0.00 C ATOM 363 NZ LYS A 23 11.801 -6.212 -13.890 1.00 0.00 N ATOM 0 H LYS A 23 12.474 -2.585 -8.972 1.00 0.00 H new ATOM 0 HA LYS A 23 9.891 -3.646 -8.444 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.924 -4.359 -10.725 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.738 -2.809 -10.654 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.953 -4.142 -10.597 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.998 -5.550 -11.018 1.00 0.00 H new ATOM 0 HD2 LYS A 23 11.880 -3.019 -12.693 1.00 0.00 H new ATOM 0 HD3 LYS A 23 13.158 -4.196 -12.926 1.00 0.00 H new ATOM 0 HE2 LYS A 23 10.249 -5.046 -13.031 1.00 0.00 H new ATOM 0 HE3 LYS A 23 11.016 -4.315 -14.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 11.146 -6.722 -14.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 12.706 -6.064 -14.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 11.963 -6.772 -13.029 1.00 0.00 H new ATOM 377 N THR A 24 12.315 -5.724 -8.016 1.00 0.00 N ATOM 378 CA THR A 24 12.735 -7.040 -7.492 1.00 0.00 C ATOM 379 C THR A 24 12.604 -7.138 -5.966 1.00 0.00 C ATOM 380 O THR A 24 11.944 -8.040 -5.456 1.00 0.00 O ATOM 381 CB THR A 24 14.181 -7.342 -7.916 1.00 0.00 C ATOM 382 OG1 THR A 24 14.339 -7.136 -9.304 1.00 0.00 O ATOM 383 CG2 THR A 24 14.578 -8.789 -7.634 1.00 0.00 C ATOM 0 H THR A 24 13.092 -5.069 -8.104 1.00 0.00 H new ATOM 0 HA THR A 24 12.062 -7.783 -7.921 1.00 0.00 H new ATOM 0 HB THR A 24 14.813 -6.670 -7.336 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.612 -6.209 -9.468 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.608 -8.952 -7.951 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.491 -8.989 -6.566 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.918 -9.461 -8.183 1.00 0.00 H new ATOM 391 N LEU A 25 13.215 -6.203 -5.223 1.00 0.00 N ATOM 392 CA LEU A 25 13.339 -6.231 -3.749 1.00 0.00 C ATOM 393 C LEU A 25 12.104 -5.651 -3.044 1.00 0.00 C ATOM 394 O LEU A 25 11.825 -5.962 -1.887 1.00 0.00 O ATOM 395 CB LEU A 25 14.630 -5.475 -3.347 1.00 0.00 C ATOM 396 CG LEU A 25 15.914 -5.995 -4.028 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.091 -5.120 -3.619 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.235 -7.440 -3.652 1.00 0.00 C ATOM 0 H LEU A 25 13.651 -5.380 -5.639 1.00 0.00 H new ATOM 0 HA LEU A 25 13.403 -7.269 -3.423 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.508 -4.419 -3.588 1.00 0.00 H new ATOM 0 HB3 LEU A 25 14.754 -5.543 -2.266 1.00 0.00 H new ATOM 0 HG LEU A 25 15.744 -5.956 -5.104 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.999 -5.485 -4.098 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.905 -4.092 -3.929 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.212 -5.156 -2.536 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.147 -7.754 -4.159 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.376 -7.513 -2.574 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.411 -8.086 -3.955 1.00 0.00 H new ATOM 410 N GLY A 26 11.353 -4.808 -3.755 1.00 0.00 N ATOM 411 CA GLY A 26 10.080 -4.224 -3.340 1.00 0.00 C ATOM 412 C GLY A 26 8.848 -4.883 -3.962 1.00 0.00 C ATOM 413 O GLY A 26 7.754 -4.350 -3.802 1.00 0.00 O ATOM 0 H GLY A 26 11.633 -4.499 -4.686 1.00 0.00 H new ATOM 0 HA2 GLY A 26 10.002 -4.288 -2.255 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.079 -3.165 -3.598 1.00 0.00 H new ATOM 417 N ALA A 27 8.987 -6.016 -4.659 1.00 0.00 N ATOM 418 CA ALA A 27 7.872 -6.729 -5.302 1.00 0.00 C ATOM 419 C ALA A 27 6.700 -6.998 -4.329 1.00 0.00 C ATOM 420 O ALA A 27 6.829 -7.787 -3.391 1.00 0.00 O ATOM 421 CB ALA A 27 8.410 -8.043 -5.892 1.00 0.00 C ATOM 0 H ALA A 27 9.889 -6.472 -4.796 1.00 0.00 H new ATOM 0 HA ALA A 27 7.466 -6.098 -6.093 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.596 -8.586 -6.373 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.184 -7.822 -6.627 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.832 -8.654 -5.094 1.00 0.00 H new ATOM 427 N GLY A 28 5.560 -6.321 -4.532 1.00 0.00 N ATOM 428 CA GLY A 28 4.355 -6.451 -3.693 1.00 0.00 C ATOM 429 C GLY A 28 4.338 -5.518 -2.472 1.00 0.00 C ATOM 430 O GLY A 28 3.282 -5.300 -1.874 1.00 0.00 O ATOM 0 H GLY A 28 5.446 -5.656 -5.297 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.476 -6.248 -4.304 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.273 -7.482 -3.350 1.00 0.00 H new ATOM 434 N LYS A 29 5.488 -4.912 -2.139 1.00 0.00 N ATOM 435 CA LYS A 29 5.628 -3.827 -1.153 1.00 0.00 C ATOM 436 C LYS A 29 5.373 -2.468 -1.798 1.00 0.00 C ATOM 437 O LYS A 29 4.705 -1.625 -1.209 1.00 0.00 O ATOM 438 CB LYS A 29 7.030 -3.876 -0.516 1.00 0.00 C ATOM 439 CG LYS A 29 7.181 -5.033 0.483 1.00 0.00 C ATOM 440 CD LYS A 29 8.533 -5.759 0.402 1.00 0.00 C ATOM 441 CE LYS A 29 9.701 -4.927 0.956 1.00 0.00 C ATOM 442 NZ LYS A 29 10.981 -5.696 0.898 1.00 0.00 N ATOM 0 H LYS A 29 6.378 -5.173 -2.563 1.00 0.00 H new ATOM 0 HA LYS A 29 4.882 -3.968 -0.371 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.779 -3.978 -1.301 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.228 -2.933 -0.007 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.048 -4.646 1.493 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.382 -5.754 0.311 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.469 -6.696 0.955 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.739 -6.015 -0.637 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.800 -4.005 0.382 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.491 -4.640 1.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.712 -5.195 1.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.836 -6.643 1.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.287 -5.787 -0.092 1.00 0.00 H new ATOM 456 N ILE A 30 5.896 -2.248 -3.008 1.00 0.00 N ATOM 457 CA ILE A 30 5.880 -0.948 -3.704 1.00 0.00 C ATOM 458 C ILE A 30 5.589 -1.072 -5.208 1.00 0.00 C ATOM 459 O ILE A 30 5.513 -2.169 -5.759 1.00 0.00 O ATOM 460 CB ILE A 30 7.196 -0.163 -3.427 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.517 -0.827 -3.863 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.365 0.113 -1.926 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.658 -1.188 -5.342 1.00 0.00 C ATOM 0 H ILE A 30 6.354 -2.983 -3.547 1.00 0.00 H new ATOM 0 HA ILE A 30 5.048 -0.376 -3.294 1.00 0.00 H new ATOM 0 HB ILE A 30 7.052 0.729 -4.037 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.336 -0.158 -3.598 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.647 -1.738 -3.278 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.292 0.662 -1.759 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.523 0.705 -1.568 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.401 -0.832 -1.384 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.632 -1.647 -5.513 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.872 -1.889 -5.622 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.571 -0.285 -5.947 1.00 0.00 H new ATOM 475 N ALA A 31 5.448 0.081 -5.868 1.00 0.00 N ATOM 476 CA ALA A 31 5.403 0.212 -7.329 1.00 0.00 C ATOM 477 C ALA A 31 6.357 1.349 -7.753 1.00 0.00 C ATOM 478 O ALA A 31 6.515 2.330 -7.020 1.00 0.00 O ATOM 479 CB ALA A 31 3.954 0.399 -7.795 1.00 0.00 C ATOM 0 H ALA A 31 5.359 0.976 -5.387 1.00 0.00 H new ATOM 0 HA ALA A 31 5.752 -0.696 -7.821 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.930 0.495 -8.880 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.361 -0.465 -7.494 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.539 1.299 -7.342 1.00 0.00 H new ATOM 485 N VAL A 32 7.044 1.215 -8.892 1.00 0.00 N ATOM 486 CA VAL A 32 8.137 2.105 -9.298 1.00 0.00 C ATOM 487 C VAL A 32 8.110 2.510 -10.769 1.00 0.00 C ATOM 488 O VAL A 32 7.711 1.735 -11.640 1.00 0.00 O ATOM 489 CB VAL A 32 9.499 1.472 -8.976 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.931 1.931 -7.586 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.571 -0.057 -9.078 1.00 0.00 C ATOM 0 H VAL A 32 6.854 0.475 -9.568 1.00 0.00 H new ATOM 0 HA VAL A 32 7.987 3.017 -8.720 1.00 0.00 H new ATOM 0 HB VAL A 32 10.180 1.819 -9.753 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.897 1.490 -7.341 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.014 3.018 -7.571 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.191 1.613 -6.852 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.578 -0.391 -8.829 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.859 -0.502 -8.383 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.327 -0.366 -10.094 1.00 0.00 H new ATOM 501 N THR A 33 8.601 3.727 -11.024 1.00 0.00 N ATOM 502 CA THR A 33 8.770 4.312 -12.362 1.00 0.00 C ATOM 503 C THR A 33 10.125 5.024 -12.459 1.00 0.00 C ATOM 504 O THR A 33 10.599 5.600 -11.476 1.00 0.00 O ATOM 505 CB THR A 33 7.620 5.295 -12.670 1.00 0.00 C ATOM 506 OG1 THR A 33 6.357 4.709 -12.411 1.00 0.00 O ATOM 507 CG2 THR A 33 7.565 5.719 -14.139 1.00 0.00 C ATOM 0 H THR A 33 8.903 4.356 -10.280 1.00 0.00 H new ATOM 0 HA THR A 33 8.743 3.510 -13.100 1.00 0.00 H new ATOM 0 HB THR A 33 7.823 6.153 -12.029 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.649 5.355 -12.614 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.735 6.409 -14.288 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.499 6.211 -14.411 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.422 4.839 -14.766 1.00 0.00 H new ATOM 515 N SER A 34 10.757 5.008 -13.633 1.00 0.00 N ATOM 516 CA SER A 34 11.990 5.730 -13.947 1.00 0.00 C ATOM 517 C SER A 34 11.764 6.789 -15.038 1.00 0.00 C ATOM 518 O SER A 34 11.085 6.533 -16.036 1.00 0.00 O ATOM 519 CB SER A 34 13.049 4.718 -14.366 1.00 0.00 C ATOM 520 OG SER A 34 14.255 5.408 -14.601 1.00 0.00 O ATOM 0 H SER A 34 10.408 4.468 -14.425 1.00 0.00 H new ATOM 0 HA SER A 34 12.329 6.269 -13.062 1.00 0.00 H new ATOM 0 HB2 SER A 34 13.187 3.968 -13.587 1.00 0.00 H new ATOM 0 HB3 SER A 34 12.733 4.189 -15.265 1.00 0.00 H new ATOM 0 HG SER A 34 14.949 4.771 -14.871 1.00 0.00 H new ATOM 526 N CYS A 35 12.338 7.981 -14.844 1.00 0.00 N ATOM 527 CA CYS A 35 12.256 9.126 -15.752 1.00 0.00 C ATOM 528 C CYS A 35 13.500 10.027 -15.661 1.00 0.00 C ATOM 529 O CYS A 35 14.467 9.746 -14.948 1.00 0.00 O ATOM 530 CB CYS A 35 10.951 9.886 -15.473 1.00 0.00 C ATOM 531 SG CYS A 35 11.041 10.899 -13.979 1.00 0.00 S ATOM 0 H CYS A 35 12.896 8.181 -14.014 1.00 0.00 H new ATOM 0 HA CYS A 35 12.238 8.769 -16.782 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.717 10.523 -16.326 1.00 0.00 H new ATOM 0 HB3 CYS A 35 10.133 9.172 -15.374 1.00 0.00 H new ATOM 0 HG CYS A 35 10.505 10.255 -12.985 1.00 0.00 H new ATOM 537 N GLY A 36 13.516 11.129 -16.405 1.00 0.00 N ATOM 538 CA GLY A 36 14.544 12.165 -16.281 1.00 0.00 C ATOM 539 C GLY A 36 14.046 13.526 -16.723 1.00 0.00 C ATOM 540 O GLY A 36 12.991 13.612 -17.334 1.00 0.00 O ATOM 0 H GLY A 36 12.813 11.332 -17.116 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.876 12.221 -15.244 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.411 11.886 -16.879 1.00 0.00 H new ATOM 544 N LEU A 37 14.798 14.602 -16.478 1.00 0.00 N ATOM 545 CA LEU A 37 14.399 15.927 -16.996 1.00 0.00 C ATOM 546 C LEU A 37 14.389 15.993 -18.539 1.00 0.00 C ATOM 547 O LEU A 37 13.788 16.889 -19.129 1.00 0.00 O ATOM 548 CB LEU A 37 15.155 17.088 -16.332 1.00 0.00 C ATOM 549 CG LEU A 37 16.690 16.970 -16.272 1.00 0.00 C ATOM 550 CD1 LEU A 37 17.341 18.351 -16.309 1.00 0.00 C ATOM 551 CD2 LEU A 37 17.125 16.308 -14.959 1.00 0.00 C ATOM 0 H LEU A 37 15.665 14.593 -15.940 1.00 0.00 H new ATOM 0 HA LEU A 37 13.359 16.062 -16.698 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.905 18.006 -16.864 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.782 17.199 -15.314 1.00 0.00 H new ATOM 0 HG LEU A 37 17.000 16.375 -17.131 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.425 18.244 -16.266 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.063 18.859 -17.232 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.000 18.937 -15.456 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.212 16.232 -14.932 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.783 16.910 -14.117 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.690 15.311 -14.893 1.00 0.00 H new ATOM 563 N GLU A 38 15.012 15.001 -19.173 1.00 0.00 N ATOM 564 CA GLU A 38 14.964 14.690 -20.604 1.00 0.00 C ATOM 565 C GLU A 38 15.259 13.188 -20.806 1.00 0.00 C ATOM 566 O GLU A 38 15.712 12.502 -19.884 1.00 0.00 O ATOM 567 CB GLU A 38 15.896 15.604 -21.428 1.00 0.00 C ATOM 568 CG GLU A 38 17.375 15.563 -21.039 1.00 0.00 C ATOM 569 CD GLU A 38 18.208 16.435 -21.997 1.00 0.00 C ATOM 570 OE1 GLU A 38 18.336 17.661 -21.759 1.00 0.00 O ATOM 571 OE2 GLU A 38 18.742 15.904 -23.001 1.00 0.00 O ATOM 0 H GLU A 38 15.606 14.346 -18.665 1.00 0.00 H new ATOM 0 HA GLU A 38 13.962 14.894 -20.982 1.00 0.00 H new ATOM 0 HB2 GLU A 38 15.808 15.330 -22.479 1.00 0.00 H new ATOM 0 HB3 GLU A 38 15.543 16.631 -21.336 1.00 0.00 H new ATOM 0 HG2 GLU A 38 17.498 15.917 -20.015 1.00 0.00 H new ATOM 0 HG3 GLU A 38 17.736 14.535 -21.066 1.00 0.00 H new ATOM 578 N SER A 39 14.972 12.665 -21.997 1.00 0.00 N ATOM 579 CA SER A 39 15.124 11.248 -22.366 1.00 0.00 C ATOM 580 C SER A 39 16.166 11.036 -23.473 1.00 0.00 C ATOM 581 O SER A 39 16.487 11.947 -24.240 1.00 0.00 O ATOM 582 CB SER A 39 13.763 10.683 -22.792 1.00 0.00 C ATOM 583 OG SER A 39 13.196 11.470 -23.833 1.00 0.00 O ATOM 0 H SER A 39 14.613 13.233 -22.764 1.00 0.00 H new ATOM 0 HA SER A 39 15.489 10.713 -21.489 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.881 9.654 -23.130 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.088 10.662 -21.936 1.00 0.00 H new ATOM 0 HG SER A 39 12.329 11.093 -24.093 1.00 0.00 H new ATOM 589 N SER A 40 16.688 9.809 -23.561 1.00 0.00 N ATOM 590 CA SER A 40 17.535 9.333 -24.663 1.00 0.00 C ATOM 591 C SER A 40 17.213 7.865 -25.002 1.00 0.00 C ATOM 592 O SER A 40 16.431 7.593 -25.917 1.00 0.00 O ATOM 593 CB SER A 40 19.014 9.564 -24.315 1.00 0.00 C ATOM 594 OG SER A 40 19.853 9.001 -25.314 1.00 0.00 O ATOM 0 H SER A 40 16.529 9.097 -22.848 1.00 0.00 H new ATOM 0 HA SER A 40 17.324 9.905 -25.567 1.00 0.00 H new ATOM 0 HB2 SER A 40 19.210 10.632 -24.226 1.00 0.00 H new ATOM 0 HB3 SER A 40 19.240 9.117 -23.347 1.00 0.00 H new ATOM 0 HG SER A 40 20.606 9.604 -25.487 1.00 0.00 H new ATOM 600 N ARG A 41 17.786 6.923 -24.236 1.00 0.00 N ATOM 601 CA ARG A 41 17.534 5.467 -24.245 1.00 0.00 C ATOM 602 C ARG A 41 18.115 4.848 -22.971 1.00 0.00 C ATOM 603 O ARG A 41 19.008 5.453 -22.389 1.00 0.00 O ATOM 604 CB ARG A 41 18.137 4.818 -25.521 1.00 0.00 C ATOM 605 CG ARG A 41 19.500 5.331 -26.036 1.00 0.00 C ATOM 606 CD ARG A 41 20.655 5.293 -25.024 1.00 0.00 C ATOM 607 NE ARG A 41 21.973 5.323 -25.692 1.00 0.00 N ATOM 608 CZ ARG A 41 22.711 6.372 -26.009 1.00 0.00 C ATOM 609 NH1 ARG A 41 22.325 7.599 -25.810 1.00 0.00 N ATOM 610 NH2 ARG A 41 23.885 6.199 -26.547 1.00 0.00 N ATOM 0 H ARG A 41 18.490 7.174 -23.542 1.00 0.00 H new ATOM 0 HA ARG A 41 16.460 5.280 -24.264 1.00 0.00 H new ATOM 0 HB2 ARG A 41 18.235 3.749 -25.334 1.00 0.00 H new ATOM 0 HB3 ARG A 41 17.413 4.936 -26.327 1.00 0.00 H new ATOM 0 HG2 ARG A 41 19.785 4.739 -26.906 1.00 0.00 H new ATOM 0 HG3 ARG A 41 19.375 6.359 -26.377 1.00 0.00 H new ATOM 0 HD2 ARG A 41 20.572 6.142 -24.346 1.00 0.00 H new ATOM 0 HD3 ARG A 41 20.576 4.391 -24.416 1.00 0.00 H new ATOM 0 HE ARG A 41 22.364 4.415 -25.941 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.414 7.785 -25.391 1.00 0.00 H new ATOM 0 HH12 ARG A 41 22.934 8.374 -26.073 1.00 0.00 H new ATOM 0 HH21 ARG A 41 24.232 5.256 -26.722 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.457 7.007 -26.793 1.00 0.00 H new ATOM 624 N VAL A 42 17.675 3.663 -22.530 1.00 0.00 N ATOM 625 CA VAL A 42 18.395 2.956 -21.432 1.00 0.00 C ATOM 626 C VAL A 42 19.822 2.657 -21.895 1.00 0.00 C ATOM 627 O VAL A 42 20.015 2.217 -23.030 1.00 0.00 O ATOM 628 CB VAL A 42 17.732 1.646 -20.949 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.399 1.147 -19.658 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.260 1.842 -20.622 1.00 0.00 C ATOM 0 H VAL A 42 16.855 3.177 -22.893 1.00 0.00 H new ATOM 0 HA VAL A 42 18.370 3.628 -20.574 1.00 0.00 H new ATOM 0 HB VAL A 42 17.847 0.931 -21.764 1.00 0.00 H new ATOM 0 HG11 VAL A 42 17.919 0.224 -19.334 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.457 0.960 -19.844 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.296 1.903 -18.879 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.833 0.897 -20.287 1.00 0.00 H new ATOM 0 HG22 VAL A 42 16.159 2.587 -19.832 1.00 0.00 H new ATOM 0 HG23 VAL A 42 15.732 2.183 -21.512 1.00 0.00 H new ATOM 640 N HIS A 43 20.823 2.878 -21.036 1.00 0.00 N ATOM 641 CA HIS A 43 22.207 2.524 -21.365 1.00 0.00 C ATOM 642 C HIS A 43 22.298 1.001 -21.497 1.00 0.00 C ATOM 643 O HIS A 43 21.929 0.299 -20.553 1.00 0.00 O ATOM 644 CB HIS A 43 23.164 3.074 -20.300 1.00 0.00 C ATOM 645 CG HIS A 43 24.576 3.125 -20.809 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.429 2.033 -20.966 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.192 4.246 -21.273 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.561 2.534 -21.497 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.435 3.855 -21.703 1.00 0.00 N ATOM 0 H HIS A 43 20.702 3.297 -20.114 1.00 0.00 H new ATOM 0 HA HIS A 43 22.504 2.973 -22.313 1.00 0.00 H new ATOM 0 HB2 HIS A 43 22.846 4.073 -20.003 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.119 2.448 -19.409 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.784 5.245 -21.298 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.444 1.956 -21.725 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.144 4.465 -22.110 1.00 0.00 H new ATOM 657 N PRO A 44 22.763 0.447 -22.626 1.00 0.00 N ATOM 658 CA PRO A 44 22.632 -0.987 -22.856 1.00 0.00 C ATOM 659 C PRO A 44 23.543 -1.815 -21.928 1.00 0.00 C ATOM 660 O PRO A 44 23.216 -2.954 -21.597 1.00 0.00 O ATOM 661 CB PRO A 44 22.965 -1.169 -24.338 1.00 0.00 C ATOM 662 CG PRO A 44 23.949 -0.036 -24.627 1.00 0.00 C ATOM 663 CD PRO A 44 23.410 1.099 -23.758 1.00 0.00 C ATOM 0 HA PRO A 44 21.631 -1.352 -22.623 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.409 -2.145 -24.532 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.074 -1.095 -24.961 1.00 0.00 H new ATOM 0 HG2 PRO A 44 24.970 -0.306 -24.355 1.00 0.00 H new ATOM 0 HG3 PRO A 44 23.961 0.232 -25.683 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.214 1.755 -23.426 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.703 1.716 -24.312 1.00 0.00 H new ATOM 671 N THR A 45 24.633 -1.229 -21.412 1.00 0.00 N ATOM 672 CA THR A 45 25.495 -1.868 -20.399 1.00 0.00 C ATOM 673 C THR A 45 24.802 -1.959 -19.039 1.00 0.00 C ATOM 674 O THR A 45 25.079 -2.881 -18.278 1.00 0.00 O ATOM 675 CB THR A 45 26.845 -1.136 -20.288 1.00 0.00 C ATOM 676 OG1 THR A 45 27.446 -1.076 -21.569 1.00 0.00 O ATOM 677 CG2 THR A 45 27.826 -1.850 -19.358 1.00 0.00 C ATOM 0 H THR A 45 24.945 -0.297 -21.684 1.00 0.00 H new ATOM 0 HA THR A 45 25.688 -2.889 -20.730 1.00 0.00 H new ATOM 0 HB THR A 45 26.637 -0.146 -19.883 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.305 -0.609 -21.506 1.00 0.00 H new ATOM 0 HG21 THR A 45 28.761 -1.291 -19.317 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.398 -1.915 -18.358 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.020 -2.854 -19.735 1.00 0.00 H new ATOM 685 N ALA A 46 23.826 -1.092 -18.737 1.00 0.00 N ATOM 686 CA ALA A 46 23.036 -1.202 -17.508 1.00 0.00 C ATOM 687 C ALA A 46 22.217 -2.499 -17.471 1.00 0.00 C ATOM 688 O ALA A 46 22.193 -3.164 -16.443 1.00 0.00 O ATOM 689 CB ALA A 46 22.137 0.029 -17.371 1.00 0.00 C ATOM 0 H ALA A 46 23.566 -0.305 -19.331 1.00 0.00 H new ATOM 0 HA ALA A 46 23.718 -1.242 -16.658 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.548 -0.050 -16.457 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.754 0.927 -17.328 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.468 0.088 -18.230 1.00 0.00 H new ATOM 695 N ILE A 47 21.632 -2.920 -18.602 1.00 0.00 N ATOM 696 CA ILE A 47 20.946 -4.224 -18.719 1.00 0.00 C ATOM 697 C ILE A 47 21.921 -5.342 -18.322 1.00 0.00 C ATOM 698 O ILE A 47 21.597 -6.167 -17.470 1.00 0.00 O ATOM 699 CB ILE A 47 20.377 -4.455 -20.147 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.135 -3.609 -20.494 1.00 0.00 C ATOM 701 CG2 ILE A 47 19.958 -5.925 -20.353 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.298 -2.089 -20.445 1.00 0.00 C ATOM 0 H ILE A 47 21.619 -2.371 -19.462 1.00 0.00 H new ATOM 0 HA ILE A 47 20.092 -4.231 -18.042 1.00 0.00 H new ATOM 0 HB ILE A 47 21.201 -4.158 -20.796 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.807 -3.883 -21.497 1.00 0.00 H new ATOM 0 HG13 ILE A 47 18.333 -3.887 -19.810 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.564 -6.053 -21.361 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.824 -6.573 -20.216 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.189 -6.189 -19.627 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.354 -1.613 -20.709 1.00 0.00 H new ATOM 0 HD12 ILE A 47 19.588 -1.786 -19.439 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.069 -1.783 -21.152 1.00 0.00 H new ATOM 714 N ALA A 48 23.147 -5.313 -18.854 1.00 0.00 N ATOM 715 CA ALA A 48 24.155 -6.333 -18.554 1.00 0.00 C ATOM 716 C ALA A 48 24.550 -6.327 -17.068 1.00 0.00 C ATOM 717 O ALA A 48 24.613 -7.374 -16.429 1.00 0.00 O ATOM 718 CB ALA A 48 25.368 -6.130 -19.467 1.00 0.00 C ATOM 0 H ALA A 48 23.466 -4.589 -19.498 1.00 0.00 H new ATOM 0 HA ALA A 48 23.729 -7.317 -18.750 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.120 -6.887 -19.246 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.058 -6.218 -20.508 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.790 -5.139 -19.297 1.00 0.00 H new ATOM 724 N MET A 49 24.738 -5.139 -16.489 1.00 0.00 N ATOM 725 CA MET A 49 25.133 -4.952 -15.087 1.00 0.00 C ATOM 726 C MET A 49 24.028 -5.328 -14.094 1.00 0.00 C ATOM 727 O MET A 49 24.340 -5.690 -12.962 1.00 0.00 O ATOM 728 CB MET A 49 25.602 -3.506 -14.893 1.00 0.00 C ATOM 729 CG MET A 49 26.903 -3.225 -15.652 1.00 0.00 C ATOM 730 SD MET A 49 28.412 -3.698 -14.757 1.00 0.00 S ATOM 731 CE MET A 49 28.786 -5.312 -15.482 1.00 0.00 C ATOM 0 H MET A 49 24.618 -4.259 -16.991 1.00 0.00 H new ATOM 0 HA MET A 49 25.953 -5.637 -14.871 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.826 -2.823 -15.237 1.00 0.00 H new ATOM 0 HB3 MET A 49 25.751 -3.311 -13.831 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.877 -3.758 -16.603 1.00 0.00 H new ATOM 0 HG3 MET A 49 26.951 -2.161 -15.884 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.111 -5.996 -14.698 1.00 0.00 H new ATOM 0 HE2 MET A 49 27.893 -5.710 -15.964 1.00 0.00 H new ATOM 0 HE3 MET A 49 29.580 -5.204 -16.221 1.00 0.00 H new ATOM 741 N MET A 50 22.761 -5.289 -14.510 1.00 0.00 N ATOM 742 CA MET A 50 21.638 -5.833 -13.741 1.00 0.00 C ATOM 743 C MET A 50 21.514 -7.357 -13.920 1.00 0.00 C ATOM 744 O MET A 50 21.225 -8.061 -12.954 1.00 0.00 O ATOM 745 CB MET A 50 20.342 -5.106 -14.131 1.00 0.00 C ATOM 746 CG MET A 50 20.351 -3.610 -13.761 1.00 0.00 C ATOM 747 SD MET A 50 20.718 -3.185 -12.034 1.00 0.00 S ATOM 748 CE MET A 50 19.479 -4.197 -11.192 1.00 0.00 C ATOM 0 H MET A 50 22.482 -4.875 -15.399 1.00 0.00 H new ATOM 0 HA MET A 50 21.825 -5.661 -12.681 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.185 -5.207 -15.205 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.499 -5.590 -13.639 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.083 -3.110 -14.395 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.375 -3.194 -14.011 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.094 -3.656 -10.327 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.660 -4.415 -11.878 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.935 -5.131 -10.863 1.00 0.00 H new ATOM 758 N GLU A 51 21.834 -7.902 -15.100 1.00 0.00 N ATOM 759 CA GLU A 51 21.844 -9.356 -15.321 1.00 0.00 C ATOM 760 C GLU A 51 22.961 -10.075 -14.538 1.00 0.00 C ATOM 761 O GLU A 51 22.772 -11.226 -14.143 1.00 0.00 O ATOM 762 CB GLU A 51 21.943 -9.688 -16.819 1.00 0.00 C ATOM 763 CG GLU A 51 20.621 -9.473 -17.565 1.00 0.00 C ATOM 764 CD GLU A 51 20.735 -9.977 -19.017 1.00 0.00 C ATOM 765 OE1 GLU A 51 21.478 -9.371 -19.828 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.085 -10.998 -19.358 1.00 0.00 O ATOM 0 H GLU A 51 22.091 -7.355 -15.922 1.00 0.00 H new ATOM 0 HA GLU A 51 20.894 -9.728 -14.937 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.716 -9.068 -17.273 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.256 -10.725 -16.936 1.00 0.00 H new ATOM 0 HG2 GLU A 51 19.817 -10.001 -17.052 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.361 -8.414 -17.560 1.00 0.00 H new ATOM 773 N GLU A 52 24.079 -9.405 -14.217 1.00 0.00 N ATOM 774 CA GLU A 52 25.123 -9.946 -13.318 1.00 0.00 C ATOM 775 C GLU A 52 24.582 -10.318 -11.925 1.00 0.00 C ATOM 776 O GLU A 52 25.095 -11.228 -11.272 1.00 0.00 O ATOM 777 CB GLU A 52 26.224 -8.899 -13.084 1.00 0.00 C ATOM 778 CG GLU A 52 27.120 -8.599 -14.279 1.00 0.00 C ATOM 779 CD GLU A 52 27.944 -9.828 -14.716 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.977 -10.130 -14.070 1.00 0.00 O ATOM 781 OE2 GLU A 52 27.570 -10.501 -15.707 1.00 0.00 O ATOM 0 H GLU A 52 24.289 -8.472 -14.571 1.00 0.00 H new ATOM 0 HA GLU A 52 25.501 -10.839 -13.816 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.753 -7.969 -12.765 1.00 0.00 H new ATOM 0 HB3 GLU A 52 26.852 -9.238 -12.260 1.00 0.00 H new ATOM 0 HG2 GLU A 52 26.507 -8.260 -15.114 1.00 0.00 H new ATOM 0 HG3 GLU A 52 27.796 -7.782 -14.027 1.00 0.00 H new ATOM 788 N VAL A 53 23.545 -9.600 -11.476 1.00 0.00 N ATOM 789 CA VAL A 53 22.854 -9.759 -10.184 1.00 0.00 C ATOM 790 C VAL A 53 21.456 -10.397 -10.370 1.00 0.00 C ATOM 791 O VAL A 53 20.643 -10.446 -9.450 1.00 0.00 O ATOM 792 CB VAL A 53 22.946 -8.428 -9.396 1.00 0.00 C ATOM 793 CG1 VAL A 53 22.411 -7.218 -10.173 1.00 0.00 C ATOM 794 CG2 VAL A 53 22.328 -8.444 -7.996 1.00 0.00 C ATOM 0 H VAL A 53 23.140 -8.849 -12.034 1.00 0.00 H new ATOM 0 HA VAL A 53 23.347 -10.489 -9.542 1.00 0.00 H new ATOM 0 HB VAL A 53 24.023 -8.321 -9.263 1.00 0.00 H new ATOM 0 HG11 VAL A 53 22.507 -6.321 -9.561 1.00 0.00 H new ATOM 0 HG12 VAL A 53 22.984 -7.093 -11.092 1.00 0.00 H new ATOM 0 HG13 VAL A 53 21.361 -7.379 -10.419 1.00 0.00 H new ATOM 0 HG21 VAL A 53 22.448 -7.464 -7.534 1.00 0.00 H new ATOM 0 HG22 VAL A 53 21.267 -8.684 -8.069 1.00 0.00 H new ATOM 0 HG23 VAL A 53 22.828 -9.196 -7.386 1.00 0.00 H new ATOM 804 N GLY A 54 21.193 -10.955 -11.560 1.00 0.00 N ATOM 805 CA GLY A 54 20.006 -11.757 -11.879 1.00 0.00 C ATOM 806 C GLY A 54 18.705 -10.961 -12.051 1.00 0.00 C ATOM 807 O GLY A 54 17.619 -11.531 -11.925 1.00 0.00 O ATOM 0 H GLY A 54 21.825 -10.856 -12.355 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.198 -12.311 -12.798 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.861 -12.492 -11.088 1.00 0.00 H new ATOM 811 N ILE A 55 18.797 -9.655 -12.325 1.00 0.00 N ATOM 812 CA ILE A 55 17.662 -8.730 -12.478 1.00 0.00 C ATOM 813 C ILE A 55 17.534 -8.287 -13.942 1.00 0.00 C ATOM 814 O ILE A 55 18.530 -8.000 -14.605 1.00 0.00 O ATOM 815 CB ILE A 55 17.824 -7.544 -11.500 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.731 -8.040 -10.039 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.773 -6.449 -11.765 1.00 0.00 C ATOM 818 CD1 ILE A 55 17.924 -6.960 -8.965 1.00 0.00 C ATOM 0 H ILE A 55 19.697 -9.193 -12.452 1.00 0.00 H new ATOM 0 HA ILE A 55 16.729 -9.233 -12.222 1.00 0.00 H new ATOM 0 HB ILE A 55 18.808 -7.105 -11.663 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.756 -8.505 -9.892 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.481 -8.817 -9.888 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.915 -5.630 -11.060 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.885 -6.075 -12.783 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.774 -6.866 -11.640 1.00 0.00 H new ATOM 0 HD11 ILE A 55 17.840 -7.411 -7.976 1.00 0.00 H new ATOM 0 HD12 ILE A 55 18.910 -6.509 -9.076 1.00 0.00 H new ATOM 0 HD13 ILE A 55 17.159 -6.192 -9.080 1.00 0.00 H new ATOM 830 N ASP A 56 16.299 -8.177 -14.436 1.00 0.00 N ATOM 831 CA ASP A 56 16.008 -7.734 -15.801 1.00 0.00 C ATOM 832 C ASP A 56 15.422 -6.314 -15.843 1.00 0.00 C ATOM 833 O ASP A 56 14.379 -6.047 -15.239 1.00 0.00 O ATOM 834 CB ASP A 56 15.070 -8.748 -16.475 1.00 0.00 C ATOM 835 CG ASP A 56 14.673 -8.314 -17.897 1.00 0.00 C ATOM 836 OD1 ASP A 56 15.517 -7.705 -18.594 1.00 0.00 O ATOM 837 OD2 ASP A 56 13.512 -8.558 -18.304 1.00 0.00 O ATOM 0 H ASP A 56 15.463 -8.396 -13.893 1.00 0.00 H new ATOM 0 HA ASP A 56 16.947 -7.689 -16.353 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.559 -9.721 -16.517 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.172 -8.868 -15.869 1.00 0.00 H new ATOM 842 N ILE A 57 16.077 -5.424 -16.601 1.00 0.00 N ATOM 843 CA ILE A 57 15.577 -4.083 -16.960 1.00 0.00 C ATOM 844 C ILE A 57 15.460 -3.877 -18.486 1.00 0.00 C ATOM 845 O ILE A 57 15.252 -2.756 -18.940 1.00 0.00 O ATOM 846 CB ILE A 57 16.380 -2.948 -16.274 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.837 -2.829 -16.769 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.345 -3.091 -14.738 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.437 -1.436 -16.528 1.00 0.00 C ATOM 0 H ILE A 57 16.997 -5.620 -16.995 1.00 0.00 H new ATOM 0 HA ILE A 57 14.562 -4.027 -16.567 1.00 0.00 H new ATOM 0 HB ILE A 57 15.881 -2.023 -16.561 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.449 -3.576 -16.263 1.00 0.00 H new ATOM 0 HG13 ILE A 57 17.873 -3.056 -17.835 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.916 -2.281 -14.284 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.312 -3.045 -14.392 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.781 -4.048 -14.452 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.463 -1.413 -16.896 1.00 0.00 H new ATOM 0 HD12 ILE A 57 17.845 -0.688 -17.056 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.430 -1.217 -15.460 1.00 0.00 H new ATOM 861 N SER A 58 15.603 -4.929 -19.304 1.00 0.00 N ATOM 862 CA SER A 58 15.617 -4.826 -20.779 1.00 0.00 C ATOM 863 C SER A 58 14.270 -4.355 -21.359 1.00 0.00 C ATOM 864 O SER A 58 14.227 -3.699 -22.402 1.00 0.00 O ATOM 865 CB SER A 58 16.023 -6.178 -21.381 1.00 0.00 C ATOM 866 OG SER A 58 16.347 -6.039 -22.756 1.00 0.00 O ATOM 0 H SER A 58 15.713 -5.884 -18.963 1.00 0.00 H new ATOM 0 HA SER A 58 16.349 -4.064 -21.049 1.00 0.00 H new ATOM 0 HB2 SER A 58 16.879 -6.580 -20.840 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.208 -6.893 -21.265 1.00 0.00 H new ATOM 0 HG SER A 58 16.605 -6.911 -23.121 1.00 0.00 H new ATOM 872 N GLY A 59 13.168 -4.616 -20.644 1.00 0.00 N ATOM 873 CA GLY A 59 11.830 -4.107 -20.963 1.00 0.00 C ATOM 874 C GLY A 59 11.600 -2.618 -20.648 1.00 0.00 C ATOM 875 O GLY A 59 10.500 -2.123 -20.905 1.00 0.00 O ATOM 0 H GLY A 59 13.184 -5.201 -19.808 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.641 -4.270 -22.024 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.095 -4.695 -20.414 1.00 0.00 H new ATOM 879 N GLN A 60 12.589 -1.895 -20.099 1.00 0.00 N ATOM 880 CA GLN A 60 12.479 -0.460 -19.807 1.00 0.00 C ATOM 881 C GLN A 60 12.938 0.391 -21.003 1.00 0.00 C ATOM 882 O GLN A 60 13.748 -0.021 -21.833 1.00 0.00 O ATOM 883 CB GLN A 60 13.248 -0.103 -18.518 1.00 0.00 C ATOM 884 CG GLN A 60 12.498 -0.558 -17.253 1.00 0.00 C ATOM 885 CD GLN A 60 13.393 -0.679 -16.018 1.00 0.00 C ATOM 886 OE1 GLN A 60 13.404 -1.692 -15.336 1.00 0.00 O ATOM 887 NE2 GLN A 60 14.192 0.315 -15.682 1.00 0.00 N ATOM 0 H GLN A 60 13.493 -2.294 -19.844 1.00 0.00 H new ATOM 0 HA GLN A 60 11.428 -0.228 -19.637 1.00 0.00 H new ATOM 0 HB2 GLN A 60 14.233 -0.569 -18.543 1.00 0.00 H new ATOM 0 HB3 GLN A 60 13.407 0.975 -18.477 1.00 0.00 H new ATOM 0 HG2 GLN A 60 11.696 0.150 -17.042 1.00 0.00 H new ATOM 0 HG3 GLN A 60 12.029 -1.523 -17.447 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.201 1.172 -16.236 1.00 0.00 H new ATOM 0 HE22 GLN A 60 14.801 0.227 -14.868 1.00 0.00 H new ATOM 896 N THR A 61 12.421 1.614 -21.049 1.00 0.00 N ATOM 897 CA THR A 61 12.723 2.682 -22.016 1.00 0.00 C ATOM 898 C THR A 61 12.918 3.991 -21.240 1.00 0.00 C ATOM 899 O THR A 61 12.583 4.064 -20.052 1.00 0.00 O ATOM 900 CB THR A 61 11.603 2.830 -23.069 1.00 0.00 C ATOM 901 OG1 THR A 61 10.336 2.921 -22.448 1.00 0.00 O ATOM 902 CG2 THR A 61 11.565 1.639 -24.031 1.00 0.00 C ATOM 0 H THR A 61 11.728 1.915 -20.364 1.00 0.00 H new ATOM 0 HA THR A 61 13.633 2.429 -22.561 1.00 0.00 H new ATOM 0 HB THR A 61 11.823 3.742 -23.624 1.00 0.00 H new ATOM 0 HG1 THR A 61 9.642 3.016 -23.133 1.00 0.00 H new ATOM 0 HG21 THR A 61 10.763 1.782 -24.756 1.00 0.00 H new ATOM 0 HG22 THR A 61 12.518 1.563 -24.554 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.386 0.723 -23.469 1.00 0.00 H new ATOM 910 N SER A 62 13.511 5.015 -21.864 1.00 0.00 N ATOM 911 CA SER A 62 13.655 6.325 -21.213 1.00 0.00 C ATOM 912 C SER A 62 12.510 7.297 -21.533 1.00 0.00 C ATOM 913 O SER A 62 12.043 7.364 -22.672 1.00 0.00 O ATOM 914 CB SER A 62 15.038 6.911 -21.460 1.00 0.00 C ATOM 915 OG SER A 62 15.144 7.523 -22.725 1.00 0.00 O ATOM 0 H SER A 62 13.895 4.965 -22.808 1.00 0.00 H new ATOM 0 HA SER A 62 13.569 6.158 -20.139 1.00 0.00 H new ATOM 0 HB2 SER A 62 15.263 7.644 -20.685 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.784 6.121 -21.378 1.00 0.00 H new ATOM 0 HG SER A 62 15.128 6.836 -23.423 1.00 0.00 H new ATOM 921 N ASP A 63 12.067 8.062 -20.532 1.00 0.00 N ATOM 922 CA ASP A 63 10.935 9.005 -20.638 1.00 0.00 C ATOM 923 C ASP A 63 11.126 10.313 -19.825 1.00 0.00 C ATOM 924 O ASP A 63 11.745 10.292 -18.756 1.00 0.00 O ATOM 925 CB ASP A 63 9.630 8.315 -20.214 1.00 0.00 C ATOM 926 CG ASP A 63 9.061 7.409 -21.317 1.00 0.00 C ATOM 927 OD1 ASP A 63 8.585 7.940 -22.349 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.029 6.167 -21.134 1.00 0.00 O ATOM 0 H ASP A 63 12.489 8.048 -19.604 1.00 0.00 H new ATOM 0 HA ASP A 63 10.887 9.299 -21.686 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.811 7.722 -19.318 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.891 9.072 -19.952 1.00 0.00 H new ATOM 933 N PRO A 64 10.588 11.459 -20.301 1.00 0.00 N ATOM 934 CA PRO A 64 10.795 12.774 -19.694 1.00 0.00 C ATOM 935 C PRO A 64 9.825 13.088 -18.541 1.00 0.00 C ATOM 936 O PRO A 64 8.646 12.730 -18.570 1.00 0.00 O ATOM 937 CB PRO A 64 10.644 13.769 -20.852 1.00 0.00 C ATOM 938 CG PRO A 64 9.583 13.103 -21.727 1.00 0.00 C ATOM 939 CD PRO A 64 9.910 11.615 -21.584 1.00 0.00 C ATOM 0 HA PRO A 64 11.775 12.826 -19.220 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.324 14.751 -20.504 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.582 13.911 -21.389 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.574 13.330 -21.383 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.648 13.434 -22.764 1.00 0.00 H new ATOM 0 HD2 PRO A 64 9.002 11.014 -21.618 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.546 11.278 -22.402 1.00 0.00 H new ATOM 947 N ILE A 65 10.300 13.852 -17.556 1.00 0.00 N ATOM 948 CA ILE A 65 9.592 14.286 -16.338 1.00 0.00 C ATOM 949 C ILE A 65 8.296 15.048 -16.663 1.00 0.00 C ATOM 950 O ILE A 65 7.280 14.875 -16.000 1.00 0.00 O ATOM 951 CB ILE A 65 10.580 15.137 -15.490 1.00 0.00 C ATOM 952 CG1 ILE A 65 10.109 15.235 -14.037 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.842 16.546 -16.066 1.00 0.00 C ATOM 954 CD1 ILE A 65 11.063 16.017 -13.130 1.00 0.00 C ATOM 0 H ILE A 65 11.254 14.211 -17.585 1.00 0.00 H new ATOM 0 HA ILE A 65 9.274 13.415 -15.765 1.00 0.00 H new ATOM 0 HB ILE A 65 11.532 14.608 -15.528 1.00 0.00 H new ATOM 0 HG12 ILE A 65 9.129 15.711 -14.014 1.00 0.00 H new ATOM 0 HG13 ILE A 65 9.985 14.229 -13.636 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.540 17.079 -15.420 1.00 0.00 H new ATOM 0 HG22 ILE A 65 11.268 16.457 -17.066 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.903 17.098 -16.119 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.662 16.043 -12.117 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.038 15.530 -13.122 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.169 17.035 -13.505 1.00 0.00 H new ATOM 966 N GLU A 66 8.311 15.826 -17.752 1.00 0.00 N ATOM 967 CA GLU A 66 7.183 16.667 -18.187 1.00 0.00 C ATOM 968 C GLU A 66 5.912 15.874 -18.561 1.00 0.00 C ATOM 969 O GLU A 66 4.812 16.429 -18.510 1.00 0.00 O ATOM 970 CB GLU A 66 7.615 17.537 -19.382 1.00 0.00 C ATOM 971 CG GLU A 66 8.760 18.498 -19.044 1.00 0.00 C ATOM 972 CD GLU A 66 9.010 19.472 -20.211 1.00 0.00 C ATOM 973 OE1 GLU A 66 9.733 19.110 -21.171 1.00 0.00 O ATOM 974 OE2 GLU A 66 8.486 20.614 -20.177 1.00 0.00 O ATOM 0 H GLU A 66 9.121 15.892 -18.369 1.00 0.00 H new ATOM 0 HA GLU A 66 6.918 17.284 -17.329 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.923 16.889 -20.203 1.00 0.00 H new ATOM 0 HB3 GLU A 66 6.758 18.112 -19.734 1.00 0.00 H new ATOM 0 HG2 GLU A 66 8.518 19.058 -18.141 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.668 17.932 -18.834 1.00 0.00 H new ATOM 981 N ASN A 67 6.034 14.584 -18.909 1.00 0.00 N ATOM 982 CA ASN A 67 4.886 13.712 -19.209 1.00 0.00 C ATOM 983 C ASN A 67 4.289 13.022 -17.956 1.00 0.00 C ATOM 984 O ASN A 67 3.195 12.457 -18.034 1.00 0.00 O ATOM 985 CB ASN A 67 5.272 12.722 -20.334 1.00 0.00 C ATOM 986 CG ASN A 67 5.439 11.282 -19.865 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.637 10.407 -20.157 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.461 10.999 -19.096 1.00 0.00 N ATOM 0 H ASN A 67 6.935 14.113 -18.991 1.00 0.00 H new ATOM 0 HA ASN A 67 4.069 14.337 -19.571 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.507 12.754 -21.110 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.204 13.054 -20.792 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.586 10.050 -18.742 1.00 0.00 H new ATOM 0 HD22 ASN A 67 7.132 11.727 -18.851 1.00 0.00 H new ATOM 995 N PHE A 68 4.997 13.043 -16.821 1.00 0.00 N ATOM 996 CA PHE A 68 4.682 12.268 -15.615 1.00 0.00 C ATOM 997 C PHE A 68 3.934 13.078 -14.538 1.00 0.00 C ATOM 998 O PHE A 68 3.787 14.299 -14.634 1.00 0.00 O ATOM 999 CB PHE A 68 5.976 11.622 -15.096 1.00 0.00 C ATOM 1000 CG PHE A 68 6.460 10.425 -15.895 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.619 9.314 -16.094 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.765 10.406 -16.419 1.00 0.00 C ATOM 1003 CE1 PHE A 68 6.070 8.202 -16.825 1.00 0.00 C ATOM 1004 CE2 PHE A 68 8.212 9.295 -17.159 1.00 0.00 C ATOM 1005 CZ PHE A 68 7.368 8.190 -17.358 1.00 0.00 C ATOM 0 H PHE A 68 5.832 13.619 -16.713 1.00 0.00 H new ATOM 0 HA PHE A 68 3.974 11.483 -15.881 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.763 12.376 -15.087 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.820 11.312 -14.063 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.621 9.316 -15.682 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.425 11.245 -16.253 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.417 7.355 -16.977 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.208 9.292 -17.576 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.716 7.335 -17.919 1.00 0.00 H new ATOM 1015 N ASN A 69 3.440 12.381 -13.507 1.00 0.00 N ATOM 1016 CA ASN A 69 2.522 12.910 -12.490 1.00 0.00 C ATOM 1017 C ASN A 69 3.100 12.837 -11.061 1.00 0.00 C ATOM 1018 O ASN A 69 2.797 11.906 -10.315 1.00 0.00 O ATOM 1019 CB ASN A 69 1.144 12.221 -12.653 1.00 0.00 C ATOM 1020 CG ASN A 69 1.166 10.702 -12.817 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.854 10.168 -13.871 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.520 9.960 -11.792 1.00 0.00 N ATOM 0 H ASN A 69 3.676 11.401 -13.353 1.00 0.00 H new ATOM 0 HA ASN A 69 2.384 13.979 -12.651 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.535 12.463 -11.782 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.645 12.652 -13.521 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.533 8.944 -11.879 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.781 10.400 -10.910 1.00 0.00 H new ATOM 1029 N ALA A 70 3.880 13.850 -10.653 1.00 0.00 N ATOM 1030 CA ALA A 70 4.499 13.917 -9.319 1.00 0.00 C ATOM 1031 C ALA A 70 3.509 13.650 -8.171 1.00 0.00 C ATOM 1032 O ALA A 70 3.870 13.017 -7.185 1.00 0.00 O ATOM 1033 CB ALA A 70 5.110 15.304 -9.104 1.00 0.00 C ATOM 0 H ALA A 70 4.101 14.652 -11.244 1.00 0.00 H new ATOM 0 HA ALA A 70 5.257 13.134 -9.296 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.567 15.351 -8.116 1.00 0.00 H new ATOM 0 HB2 ALA A 70 5.869 15.489 -9.864 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.329 16.061 -9.179 1.00 0.00 H new ATOM 1039 N ASP A 71 2.260 14.104 -8.328 1.00 0.00 N ATOM 1040 CA ASP A 71 1.197 14.024 -7.321 1.00 0.00 C ATOM 1041 C ASP A 71 0.863 12.588 -6.871 1.00 0.00 C ATOM 1042 O ASP A 71 0.382 12.385 -5.754 1.00 0.00 O ATOM 1043 CB ASP A 71 -0.055 14.685 -7.915 1.00 0.00 C ATOM 1044 CG ASP A 71 -1.198 14.801 -6.891 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -1.071 15.594 -5.926 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -2.247 14.136 -7.074 1.00 0.00 O ATOM 0 H ASP A 71 1.952 14.553 -9.190 1.00 0.00 H new ATOM 0 HA ASP A 71 1.549 14.536 -6.425 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.202 15.678 -8.283 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.396 14.106 -8.773 1.00 0.00 H new ATOM 1051 N ASP A 72 1.123 11.585 -7.721 1.00 0.00 N ATOM 1052 CA ASP A 72 0.917 10.174 -7.377 1.00 0.00 C ATOM 1053 C ASP A 72 2.122 9.541 -6.671 1.00 0.00 C ATOM 1054 O ASP A 72 1.954 8.631 -5.859 1.00 0.00 O ATOM 1055 CB ASP A 72 0.579 9.378 -8.639 1.00 0.00 C ATOM 1056 CG ASP A 72 0.120 7.948 -8.303 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -0.919 7.794 -7.617 1.00 0.00 O ATOM 1058 OD2 ASP A 72 0.784 6.979 -8.744 1.00 0.00 O ATOM 0 H ASP A 72 1.482 11.730 -8.665 1.00 0.00 H new ATOM 0 HA ASP A 72 0.087 10.140 -6.672 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.206 9.891 -9.194 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.453 9.337 -9.288 1.00 0.00 H new ATOM 1063 N TYR A 73 3.340 9.998 -6.964 1.00 0.00 N ATOM 1064 CA TYR A 73 4.567 9.390 -6.470 1.00 0.00 C ATOM 1065 C TYR A 73 4.819 9.850 -5.029 1.00 0.00 C ATOM 1066 O TYR A 73 5.333 10.942 -4.790 1.00 0.00 O ATOM 1067 CB TYR A 73 5.738 9.722 -7.410 1.00 0.00 C ATOM 1068 CG TYR A 73 5.458 9.582 -8.896 1.00 0.00 C ATOM 1069 CD1 TYR A 73 4.729 8.486 -9.403 1.00 0.00 C ATOM 1070 CD2 TYR A 73 5.921 10.579 -9.775 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.418 8.421 -10.776 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.608 10.519 -11.143 1.00 0.00 C ATOM 1073 CZ TYR A 73 4.835 9.451 -11.643 1.00 0.00 C ATOM 1074 OH TYR A 73 4.494 9.426 -12.958 1.00 0.00 O ATOM 0 H TYR A 73 3.500 10.811 -7.559 1.00 0.00 H new ATOM 0 HA TYR A 73 4.471 8.304 -6.457 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.055 10.746 -7.215 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.577 9.074 -7.156 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.409 7.697 -8.739 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.520 11.394 -9.396 1.00 0.00 H new ATOM 0 HE1 TYR A 73 3.860 7.582 -11.164 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.959 11.291 -11.812 1.00 0.00 H new ATOM 0 HH TYR A 73 3.634 8.968 -13.064 1.00 0.00 H new ATOM 1084 N ASP A 74 4.466 9.004 -4.056 1.00 0.00 N ATOM 1085 CA ASP A 74 4.668 9.274 -2.625 1.00 0.00 C ATOM 1086 C ASP A 74 6.125 9.676 -2.321 1.00 0.00 C ATOM 1087 O ASP A 74 6.377 10.525 -1.464 1.00 0.00 O ATOM 1088 CB ASP A 74 4.309 8.016 -1.821 1.00 0.00 C ATOM 1089 CG ASP A 74 2.880 7.535 -2.079 1.00 0.00 C ATOM 1090 OD1 ASP A 74 1.920 8.122 -1.531 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.731 6.556 -2.847 1.00 0.00 O ATOM 0 H ASP A 74 4.027 8.102 -4.240 1.00 0.00 H new ATOM 0 HA ASP A 74 4.024 10.107 -2.342 1.00 0.00 H new ATOM 0 HB2 ASP A 74 5.007 7.218 -2.073 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.431 8.223 -0.758 1.00 0.00 H new ATOM 1096 N VAL A 75 7.080 9.118 -3.071 1.00 0.00 N ATOM 1097 CA VAL A 75 8.500 9.468 -2.995 1.00 0.00 C ATOM 1098 C VAL A 75 9.057 9.803 -4.379 1.00 0.00 C ATOM 1099 O VAL A 75 8.838 9.062 -5.339 1.00 0.00 O ATOM 1100 CB VAL A 75 9.309 8.328 -2.362 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.777 8.736 -2.186 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.724 7.890 -1.012 1.00 0.00 C ATOM 0 H VAL A 75 6.882 8.395 -3.763 1.00 0.00 H new ATOM 0 HA VAL A 75 8.591 10.352 -2.364 1.00 0.00 H new ATOM 0 HB VAL A 75 9.252 7.480 -3.044 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.332 7.913 -1.736 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.207 8.975 -3.159 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.836 9.611 -1.538 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.327 7.081 -0.599 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.728 8.734 -0.323 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.701 7.543 -1.154 1.00 0.00 H new ATOM 1112 N VAL A 76 9.852 10.869 -4.472 1.00 0.00 N ATOM 1113 CA VAL A 76 10.630 11.219 -5.672 1.00 0.00 C ATOM 1114 C VAL A 76 12.117 11.269 -5.337 1.00 0.00 C ATOM 1115 O VAL A 76 12.513 11.793 -4.302 1.00 0.00 O ATOM 1116 CB VAL A 76 10.151 12.545 -6.290 1.00 0.00 C ATOM 1117 CG1 VAL A 76 11.100 13.105 -7.362 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.781 12.356 -6.947 1.00 0.00 C ATOM 0 H VAL A 76 9.979 11.529 -3.704 1.00 0.00 H new ATOM 0 HA VAL A 76 10.470 10.443 -6.421 1.00 0.00 H new ATOM 0 HB VAL A 76 10.113 13.253 -5.462 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.697 14.040 -7.752 1.00 0.00 H new ATOM 0 HG12 VAL A 76 12.080 13.288 -6.921 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.197 12.385 -8.174 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.452 13.300 -7.381 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.854 11.603 -7.731 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.060 12.030 -6.197 1.00 0.00 H new ATOM 1128 N ILE A 77 12.950 10.745 -6.226 1.00 0.00 N ATOM 1129 CA ILE A 77 14.403 10.677 -6.070 1.00 0.00 C ATOM 1130 C ILE A 77 15.062 11.320 -7.287 1.00 0.00 C ATOM 1131 O ILE A 77 14.712 10.967 -8.409 1.00 0.00 O ATOM 1132 CB ILE A 77 14.842 9.203 -5.955 1.00 0.00 C ATOM 1133 CG1 ILE A 77 14.047 8.348 -4.941 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.345 9.109 -5.676 1.00 0.00 C ATOM 1135 CD1 ILE A 77 14.152 8.786 -3.478 1.00 0.00 C ATOM 0 H ILE A 77 12.626 10.342 -7.105 1.00 0.00 H new ATOM 0 HA ILE A 77 14.704 11.208 -5.167 1.00 0.00 H new ATOM 0 HB ILE A 77 14.609 8.768 -6.927 1.00 0.00 H new ATOM 0 HG12 ILE A 77 12.996 8.359 -5.230 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.388 7.316 -5.018 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.636 8.061 -5.598 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.896 9.579 -6.490 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.574 9.620 -4.741 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.557 8.118 -2.855 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.194 8.746 -3.160 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.780 9.805 -3.376 1.00 0.00 H new ATOM 1147 N SER A 78 16.029 12.215 -7.099 1.00 0.00 N ATOM 1148 CA SER A 78 16.884 12.724 -8.180 1.00 0.00 C ATOM 1149 C SER A 78 18.286 12.099 -8.104 1.00 0.00 C ATOM 1150 O SER A 78 18.777 11.743 -7.035 1.00 0.00 O ATOM 1151 CB SER A 78 16.901 14.255 -8.218 1.00 0.00 C ATOM 1152 OG SER A 78 17.603 14.790 -7.114 1.00 0.00 O ATOM 0 H SER A 78 16.247 12.614 -6.186 1.00 0.00 H new ATOM 0 HA SER A 78 16.456 12.415 -9.134 1.00 0.00 H new ATOM 0 HB2 SER A 78 17.365 14.592 -9.145 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.878 14.632 -8.218 1.00 0.00 H new ATOM 0 HG SER A 78 17.598 15.769 -7.166 1.00 0.00 H new ATOM 1158 N LEU A 79 18.900 11.870 -9.271 1.00 0.00 N ATOM 1159 CA LEU A 79 20.167 11.140 -9.443 1.00 0.00 C ATOM 1160 C LEU A 79 21.033 11.842 -10.506 1.00 0.00 C ATOM 1161 O LEU A 79 21.592 11.197 -11.393 1.00 0.00 O ATOM 1162 CB LEU A 79 19.895 9.647 -9.782 1.00 0.00 C ATOM 1163 CG LEU A 79 18.954 8.861 -8.838 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.492 8.928 -9.289 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.296 7.371 -8.834 1.00 0.00 C ATOM 0 H LEU A 79 18.515 12.200 -10.156 1.00 0.00 H new ATOM 0 HA LEU A 79 20.726 11.150 -8.508 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.478 9.601 -10.788 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.853 9.128 -9.810 1.00 0.00 H new ATOM 0 HG LEU A 79 19.087 9.320 -7.859 1.00 0.00 H new ATOM 0 HD11 LEU A 79 16.871 8.362 -8.595 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.163 9.967 -9.305 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.400 8.503 -10.288 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.619 6.844 -8.162 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.191 6.971 -9.842 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.323 7.234 -8.495 1.00 0.00 H new ATOM 1177 N CYS A 80 21.077 13.177 -10.468 1.00 0.00 N ATOM 1178 CA CYS A 80 21.655 14.024 -11.526 1.00 0.00 C ATOM 1179 C CYS A 80 22.929 14.808 -11.150 1.00 0.00 C ATOM 1180 O CYS A 80 23.602 15.321 -12.046 1.00 0.00 O ATOM 1181 CB CYS A 80 20.571 15.023 -11.958 1.00 0.00 C ATOM 1182 SG CYS A 80 19.023 14.181 -12.403 1.00 0.00 S ATOM 0 H CYS A 80 20.705 13.715 -9.685 1.00 0.00 H new ATOM 0 HA CYS A 80 21.971 13.345 -12.318 1.00 0.00 H new ATOM 0 HB2 CYS A 80 20.382 15.728 -11.149 1.00 0.00 H new ATOM 0 HB3 CYS A 80 20.928 15.603 -12.809 1.00 0.00 H new ATOM 0 HG CYS A 80 18.136 15.063 -12.759 1.00 0.00 H new ATOM 1188 N GLY A 81 23.256 14.938 -9.860 1.00 0.00 N ATOM 1189 CA GLY A 81 24.314 15.845 -9.388 1.00 0.00 C ATOM 1190 C GLY A 81 23.834 17.300 -9.234 1.00 0.00 C ATOM 1191 O GLY A 81 22.661 17.623 -9.436 1.00 0.00 O ATOM 0 H GLY A 81 22.796 14.419 -9.112 1.00 0.00 H new ATOM 0 HA2 GLY A 81 24.689 15.489 -8.429 1.00 0.00 H new ATOM 0 HA3 GLY A 81 25.149 15.816 -10.088 1.00 0.00 H new ATOM 1195 N CYS A 82 24.757 18.193 -8.873 1.00 0.00 N ATOM 1196 CA CYS A 82 24.454 19.583 -8.481 1.00 0.00 C ATOM 1197 C CYS A 82 23.918 20.497 -9.600 1.00 0.00 C ATOM 1198 O CYS A 82 23.370 21.561 -9.306 1.00 0.00 O ATOM 1199 CB CYS A 82 25.731 20.217 -7.927 1.00 0.00 C ATOM 1200 SG CYS A 82 26.156 19.556 -6.287 1.00 0.00 S ATOM 0 H CYS A 82 25.753 17.974 -8.842 1.00 0.00 H new ATOM 0 HA CYS A 82 23.650 19.507 -7.750 1.00 0.00 H new ATOM 0 HB2 CYS A 82 26.555 20.036 -8.617 1.00 0.00 H new ATOM 0 HB3 CYS A 82 25.602 21.297 -7.861 1.00 0.00 H new ATOM 0 HG CYS A 82 26.023 18.263 -6.293 1.00 0.00 H new ATOM 1206 N GLY A 83 24.053 20.109 -10.872 1.00 0.00 N ATOM 1207 CA GLY A 83 23.548 20.879 -12.021 1.00 0.00 C ATOM 1208 C GLY A 83 22.015 20.964 -12.120 1.00 0.00 C ATOM 1209 O GLY A 83 21.501 21.591 -13.049 1.00 0.00 O ATOM 0 H GLY A 83 24.520 19.243 -11.139 1.00 0.00 H new ATOM 0 HA2 GLY A 83 23.951 21.890 -11.967 1.00 0.00 H new ATOM 0 HA3 GLY A 83 23.932 20.431 -12.937 1.00 0.00 H new ATOM 1213 N VAL A 84 21.287 20.317 -11.197 1.00 0.00 N ATOM 1214 CA VAL A 84 19.833 20.103 -11.253 1.00 0.00 C ATOM 1215 C VAL A 84 19.129 20.367 -9.926 1.00 0.00 C ATOM 1216 O VAL A 84 19.642 20.078 -8.844 1.00 0.00 O ATOM 1217 CB VAL A 84 19.555 18.653 -11.702 1.00 0.00 C ATOM 1218 CG1 VAL A 84 18.070 18.266 -11.737 1.00 0.00 C ATOM 1219 CG2 VAL A 84 20.111 18.434 -13.107 1.00 0.00 C ATOM 0 H VAL A 84 21.710 19.914 -10.361 1.00 0.00 H new ATOM 0 HA VAL A 84 19.431 20.822 -11.967 1.00 0.00 H new ATOM 0 HB VAL A 84 20.041 18.028 -10.953 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.971 17.231 -12.064 1.00 0.00 H new ATOM 0 HG12 VAL A 84 17.642 18.374 -10.740 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.540 18.918 -12.432 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.913 17.409 -13.421 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.631 19.125 -13.800 1.00 0.00 H new ATOM 0 HG23 VAL A 84 21.186 18.611 -13.104 1.00 0.00 H new ATOM 1229 N ASN A 85 17.903 20.873 -10.048 1.00 0.00 N ATOM 1230 CA ASN A 85 16.915 21.004 -8.984 1.00 0.00 C ATOM 1231 C ASN A 85 15.517 20.808 -9.603 1.00 0.00 C ATOM 1232 O ASN A 85 15.341 21.039 -10.801 1.00 0.00 O ATOM 1233 CB ASN A 85 17.102 22.361 -8.274 1.00 0.00 C ATOM 1234 CG ASN A 85 16.719 22.264 -6.809 1.00 0.00 C ATOM 1235 OD1 ASN A 85 15.642 22.661 -6.387 1.00 0.00 O ATOM 1236 ND2 ASN A 85 17.576 21.664 -6.009 1.00 0.00 N ATOM 0 H ASN A 85 17.556 21.221 -10.942 1.00 0.00 H new ATOM 0 HA ASN A 85 17.039 20.243 -8.213 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.140 22.682 -8.362 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.491 23.119 -8.764 1.00 0.00 H new ATOM 0 HD21 ASN A 85 17.345 21.526 -5.025 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.471 21.337 -6.373 1.00 0.00 H new ATOM 1243 N LEU A 86 14.528 20.374 -8.815 1.00 0.00 N ATOM 1244 CA LEU A 86 13.158 20.103 -9.283 1.00 0.00 C ATOM 1245 C LEU A 86 12.138 21.046 -8.595 1.00 0.00 C ATOM 1246 O LEU A 86 11.317 20.570 -7.815 1.00 0.00 O ATOM 1247 CB LEU A 86 12.827 18.610 -9.046 1.00 0.00 C ATOM 1248 CG LEU A 86 13.605 17.544 -9.817 1.00 0.00 C ATOM 1249 CD1 LEU A 86 13.020 16.183 -9.423 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.422 17.734 -11.319 1.00 0.00 C ATOM 0 H LEU A 86 14.655 20.197 -7.818 1.00 0.00 H new ATOM 0 HA LEU A 86 13.090 20.305 -10.352 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.960 18.409 -7.983 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.769 18.469 -9.267 1.00 0.00 H new ATOM 0 HG LEU A 86 14.667 17.613 -9.582 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.550 15.392 -9.954 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.131 16.037 -8.349 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.963 16.151 -9.686 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.982 16.967 -11.854 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.364 17.652 -11.570 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.788 18.719 -11.608 1.00 0.00 H new ATOM 1262 N PRO A 87 12.148 22.368 -8.857 1.00 0.00 N ATOM 1263 CA PRO A 87 11.291 23.331 -8.152 1.00 0.00 C ATOM 1264 C PRO A 87 9.747 23.154 -8.232 1.00 0.00 C ATOM 1265 O PRO A 87 9.085 23.771 -7.390 1.00 0.00 O ATOM 1266 CB PRO A 87 11.734 24.712 -8.650 1.00 0.00 C ATOM 1267 CG PRO A 87 12.383 24.443 -10.005 1.00 0.00 C ATOM 1268 CD PRO A 87 13.008 23.064 -9.808 1.00 0.00 C ATOM 0 HA PRO A 87 11.441 23.167 -7.085 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.886 25.390 -8.744 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.438 25.176 -7.959 1.00 0.00 H new ATOM 0 HG2 PRO A 87 11.651 24.444 -10.812 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.132 25.196 -10.252 1.00 0.00 H new ATOM 0 HD2 PRO A 87 13.065 22.522 -10.752 1.00 0.00 H new ATOM 0 HD3 PRO A 87 14.026 23.147 -9.426 1.00 0.00 H new ATOM 1276 N PRO A 88 9.130 22.368 -9.153 1.00 0.00 N ATOM 1277 CA PRO A 88 7.674 22.137 -9.138 1.00 0.00 C ATOM 1278 C PRO A 88 7.199 21.184 -8.015 1.00 0.00 C ATOM 1279 O PRO A 88 7.914 20.909 -7.051 1.00 0.00 O ATOM 1280 CB PRO A 88 7.330 21.601 -10.539 1.00 0.00 C ATOM 1281 CG PRO A 88 8.543 21.901 -11.407 1.00 0.00 C ATOM 1282 CD PRO A 88 9.678 21.832 -10.397 1.00 0.00 C ATOM 0 HA PRO A 88 7.148 23.065 -8.914 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.126 20.531 -10.509 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.437 22.085 -10.934 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.663 21.170 -12.207 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.475 22.881 -11.878 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.022 20.806 -10.264 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.536 22.416 -10.731 1.00 0.00 H new ATOM 1290 N GLU A 89 6.001 20.603 -8.152 1.00 0.00 N ATOM 1291 CA GLU A 89 5.451 19.594 -7.225 1.00 0.00 C ATOM 1292 C GLU A 89 6.310 18.313 -7.079 1.00 0.00 C ATOM 1293 O GLU A 89 6.109 17.515 -6.164 1.00 0.00 O ATOM 1294 CB GLU A 89 3.994 19.248 -7.588 1.00 0.00 C ATOM 1295 CG GLU A 89 3.754 18.847 -9.053 1.00 0.00 C ATOM 1296 CD GLU A 89 3.259 20.037 -9.898 1.00 0.00 C ATOM 1297 OE1 GLU A 89 4.068 20.941 -10.215 1.00 0.00 O ATOM 1298 OE2 GLU A 89 2.053 20.077 -10.244 1.00 0.00 O ATOM 0 H GLU A 89 5.371 20.822 -8.924 1.00 0.00 H new ATOM 0 HA GLU A 89 5.475 20.064 -6.242 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.662 18.431 -6.947 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.366 20.109 -7.358 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.679 18.458 -9.480 1.00 0.00 H new ATOM 0 HG3 GLU A 89 3.020 18.042 -9.094 1.00 0.00 H new ATOM 1305 N TRP A 90 7.334 18.134 -7.915 1.00 0.00 N ATOM 1306 CA TRP A 90 8.338 17.064 -7.823 1.00 0.00 C ATOM 1307 C TRP A 90 9.127 17.026 -6.503 1.00 0.00 C ATOM 1308 O TRP A 90 9.683 15.982 -6.165 1.00 0.00 O ATOM 1309 CB TRP A 90 9.257 17.185 -9.037 1.00 0.00 C ATOM 1310 CG TRP A 90 8.576 16.748 -10.295 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.910 17.535 -11.171 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.451 15.393 -10.814 1.00 0.00 C ATOM 1313 NE1 TRP A 90 7.271 16.742 -12.108 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.579 15.409 -11.940 1.00 0.00 C ATOM 1315 CE3 TRP A 90 9.029 14.158 -10.464 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 7.258 14.246 -12.657 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 8.776 13.003 -11.218 1.00 0.00 C ATOM 1318 CH2 TRP A 90 7.891 13.042 -12.307 1.00 0.00 C ATOM 0 H TRP A 90 7.496 18.754 -8.708 1.00 0.00 H new ATOM 0 HA TRP A 90 7.811 16.110 -7.824 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.586 18.219 -9.142 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.150 16.581 -8.878 1.00 0.00 H new ATOM 0 HD1 TRP A 90 7.881 18.614 -11.143 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.649 17.100 -12.833 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.677 14.099 -9.602 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.539 14.276 -13.462 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.266 12.076 -10.959 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.697 12.145 -12.876 1.00 0.00 H new ATOM 1329 N VAL A 91 9.135 18.117 -5.726 1.00 0.00 N ATOM 1330 CA VAL A 91 9.760 18.186 -4.384 1.00 0.00 C ATOM 1331 C VAL A 91 8.758 18.432 -3.245 1.00 0.00 C ATOM 1332 O VAL A 91 9.160 18.490 -2.083 1.00 0.00 O ATOM 1333 CB VAL A 91 10.923 19.199 -4.338 1.00 0.00 C ATOM 1334 CG1 VAL A 91 12.042 18.796 -5.298 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.471 20.643 -4.605 1.00 0.00 C ATOM 0 H VAL A 91 8.702 18.995 -6.011 1.00 0.00 H new ATOM 0 HA VAL A 91 10.173 17.192 -4.210 1.00 0.00 H new ATOM 0 HB VAL A 91 11.310 19.175 -3.319 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.848 19.528 -5.245 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.424 17.814 -5.020 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.653 18.759 -6.315 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.333 21.308 -4.559 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.017 20.705 -5.594 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.742 20.941 -3.851 1.00 0.00 H new ATOM 1345 N THR A 92 7.453 18.533 -3.545 1.00 0.00 N ATOM 1346 CA THR A 92 6.381 18.729 -2.541 1.00 0.00 C ATOM 1347 C THR A 92 5.737 17.409 -2.079 1.00 0.00 C ATOM 1348 O THR A 92 4.803 17.417 -1.272 1.00 0.00 O ATOM 1349 CB THR A 92 5.300 19.703 -3.036 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.584 19.133 -4.108 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.877 21.031 -3.532 1.00 0.00 C ATOM 0 H THR A 92 7.103 18.481 -4.502 1.00 0.00 H new ATOM 0 HA THR A 92 6.874 19.170 -1.675 1.00 0.00 H new ATOM 0 HB THR A 92 4.656 19.895 -2.178 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.190 18.591 -4.655 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.066 21.677 -3.869 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.417 21.519 -2.720 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.560 20.844 -4.361 1.00 0.00 H new ATOM 1359 N GLN A 93 6.241 16.267 -2.572 1.00 0.00 N ATOM 1360 CA GLN A 93 5.785 14.923 -2.204 1.00 0.00 C ATOM 1361 C GLN A 93 6.254 14.523 -0.791 1.00 0.00 C ATOM 1362 O GLN A 93 6.974 15.271 -0.121 1.00 0.00 O ATOM 1363 CB GLN A 93 6.194 13.909 -3.290 1.00 0.00 C ATOM 1364 CG GLN A 93 5.700 14.299 -4.697 1.00 0.00 C ATOM 1365 CD GLN A 93 4.238 14.764 -4.715 1.00 0.00 C ATOM 1366 OE1 GLN A 93 3.323 14.106 -4.229 1.00 0.00 O ATOM 1367 NE2 GLN A 93 3.971 15.960 -5.202 1.00 0.00 N ATOM 0 H GLN A 93 6.998 16.256 -3.256 1.00 0.00 H new ATOM 0 HA GLN A 93 4.696 14.924 -2.156 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.280 13.819 -3.305 1.00 0.00 H new ATOM 0 HB3 GLN A 93 5.797 12.928 -3.031 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.333 15.095 -5.090 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.811 13.444 -5.364 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.717 16.523 -5.610 1.00 0.00 H new ATOM 0 HE22 GLN A 93 3.018 16.322 -5.170 1.00 0.00 H new ATOM 1376 N GLU A 94 5.836 13.348 -0.311 1.00 0.00 N ATOM 1377 CA GLU A 94 6.030 12.950 1.097 1.00 0.00 C ATOM 1378 C GLU A 94 7.520 12.780 1.467 1.00 0.00 C ATOM 1379 O GLU A 94 7.926 13.190 2.561 1.00 0.00 O ATOM 1380 CB GLU A 94 5.194 11.700 1.422 1.00 0.00 C ATOM 1381 CG GLU A 94 5.353 11.254 2.877 1.00 0.00 C ATOM 1382 CD GLU A 94 4.365 10.129 3.226 1.00 0.00 C ATOM 1383 OE1 GLU A 94 4.708 8.936 3.045 1.00 0.00 O ATOM 1384 OE2 GLU A 94 3.242 10.417 3.703 1.00 0.00 O ATOM 0 H GLU A 94 5.357 12.648 -0.877 1.00 0.00 H new ATOM 0 HA GLU A 94 5.668 13.764 1.725 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.143 11.907 1.221 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.491 10.886 0.761 1.00 0.00 H new ATOM 0 HG2 GLU A 94 6.374 10.910 3.045 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.190 12.103 3.540 1.00 0.00 H new ATOM 1391 N ILE A 95 8.343 12.252 0.550 1.00 0.00 N ATOM 1392 CA ILE A 95 9.810 12.227 0.680 1.00 0.00 C ATOM 1393 C ILE A 95 10.464 12.629 -0.650 1.00 0.00 C ATOM 1394 O ILE A 95 10.051 12.173 -1.721 1.00 0.00 O ATOM 1395 CB ILE A 95 10.329 10.845 1.171 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.575 10.324 2.421 1.00 0.00 C ATOM 1397 CG2 ILE A 95 11.849 10.900 1.443 1.00 0.00 C ATOM 1398 CD1 ILE A 95 10.038 8.944 2.913 1.00 0.00 C ATOM 0 H ILE A 95 8.007 11.825 -0.313 1.00 0.00 H new ATOM 0 HA ILE A 95 10.092 12.954 1.442 1.00 0.00 H new ATOM 0 HB ILE A 95 10.132 10.136 0.367 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.697 11.044 3.230 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.510 10.277 2.194 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.193 9.924 1.785 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.373 11.168 0.526 1.00 0.00 H new ATOM 0 HG23 ILE A 95 12.055 11.647 2.210 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.458 8.657 3.790 1.00 0.00 H new ATOM 0 HD12 ILE A 95 9.890 8.208 2.123 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.095 8.987 3.175 1.00 0.00 H new ATOM 1410 N PHE A 96 11.504 13.462 -0.577 1.00 0.00 N ATOM 1411 CA PHE A 96 12.395 13.778 -1.695 1.00 0.00 C ATOM 1412 C PHE A 96 13.859 13.536 -1.284 1.00 0.00 C ATOM 1413 O PHE A 96 14.269 13.934 -0.190 1.00 0.00 O ATOM 1414 CB PHE A 96 12.149 15.196 -2.232 1.00 0.00 C ATOM 1415 CG PHE A 96 13.161 15.605 -3.291 1.00 0.00 C ATOM 1416 CD1 PHE A 96 12.996 15.223 -4.640 1.00 0.00 C ATOM 1417 CD2 PHE A 96 14.316 16.317 -2.904 1.00 0.00 C ATOM 1418 CE1 PHE A 96 13.999 15.518 -5.581 1.00 0.00 C ATOM 1419 CE2 PHE A 96 15.303 16.634 -3.854 1.00 0.00 C ATOM 1420 CZ PHE A 96 15.146 16.229 -5.189 1.00 0.00 C ATOM 0 H PHE A 96 11.756 13.948 0.284 1.00 0.00 H new ATOM 0 HA PHE A 96 12.173 13.107 -2.525 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.145 15.252 -2.653 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.187 15.905 -1.405 1.00 0.00 H new ATOM 0 HD1 PHE A 96 12.100 14.705 -4.949 1.00 0.00 H new ATOM 0 HD2 PHE A 96 14.442 16.619 -1.875 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.887 15.198 -6.606 1.00 0.00 H new ATOM 0 HE2 PHE A 96 16.181 17.188 -3.557 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.909 16.464 -5.917 1.00 0.00 H new ATOM 1430 N GLU A 97 14.650 12.902 -2.154 1.00 0.00 N ATOM 1431 CA GLU A 97 16.087 12.654 -1.944 1.00 0.00 C ATOM 1432 C GLU A 97 16.913 12.931 -3.215 1.00 0.00 C ATOM 1433 O GLU A 97 16.410 12.780 -4.328 1.00 0.00 O ATOM 1434 CB GLU A 97 16.358 11.210 -1.485 1.00 0.00 C ATOM 1435 CG GLU A 97 15.651 10.785 -0.185 1.00 0.00 C ATOM 1436 CD GLU A 97 16.085 9.384 0.295 1.00 0.00 C ATOM 1437 OE1 GLU A 97 17.283 9.029 0.157 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.237 8.639 0.840 1.00 0.00 O ATOM 0 H GLU A 97 14.307 12.538 -3.043 1.00 0.00 H new ATOM 0 HA GLU A 97 16.396 13.345 -1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 97 16.055 10.531 -2.282 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.433 11.085 -1.351 1.00 0.00 H new ATOM 0 HG2 GLU A 97 15.864 11.515 0.596 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.573 10.793 -0.343 1.00 0.00 H new ATOM 1445 N ASP A 98 18.194 13.277 -3.051 1.00 0.00 N ATOM 1446 CA ASP A 98 19.140 13.540 -4.149 1.00 0.00 C ATOM 1447 C ASP A 98 20.388 12.648 -4.001 1.00 0.00 C ATOM 1448 O ASP A 98 21.288 12.932 -3.205 1.00 0.00 O ATOM 1449 CB ASP A 98 19.481 15.037 -4.153 1.00 0.00 C ATOM 1450 CG ASP A 98 20.581 15.428 -5.160 1.00 0.00 C ATOM 1451 OD1 ASP A 98 20.802 14.725 -6.176 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.238 16.472 -4.923 1.00 0.00 O ATOM 0 H ASP A 98 18.616 13.386 -2.129 1.00 0.00 H new ATOM 0 HA ASP A 98 18.693 13.290 -5.111 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.578 15.604 -4.379 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.799 15.329 -3.152 1.00 0.00 H new ATOM 1457 N TRP A 99 20.424 11.539 -4.746 1.00 0.00 N ATOM 1458 CA TRP A 99 21.488 10.529 -4.721 1.00 0.00 C ATOM 1459 C TRP A 99 22.571 10.862 -5.754 1.00 0.00 C ATOM 1460 O TRP A 99 22.613 10.301 -6.853 1.00 0.00 O ATOM 1461 CB TRP A 99 20.903 9.123 -4.935 1.00 0.00 C ATOM 1462 CG TRP A 99 19.806 8.658 -4.023 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.419 9.221 -2.855 1.00 0.00 C ATOM 1464 CD2 TRP A 99 18.923 7.512 -4.219 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.338 8.526 -2.347 1.00 0.00 N ATOM 1466 CE2 TRP A 99 17.971 7.482 -3.160 1.00 0.00 C ATOM 1467 CE3 TRP A 99 18.830 6.492 -5.191 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 16.965 6.509 -3.075 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 17.820 5.511 -5.124 1.00 0.00 C ATOM 1470 CH2 TRP A 99 16.887 5.519 -4.069 1.00 0.00 C ATOM 0 H TRP A 99 19.684 11.311 -5.409 1.00 0.00 H new ATOM 0 HA TRP A 99 21.960 10.539 -3.739 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.528 9.072 -5.957 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.722 8.408 -4.860 1.00 0.00 H new ATOM 0 HD1 TRP A 99 19.883 10.080 -2.392 1.00 0.00 H new ATOM 0 HE1 TRP A 99 17.869 8.761 -1.472 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.545 6.463 -6.000 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.260 6.520 -2.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.761 4.748 -5.887 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.114 4.766 -4.024 1.00 0.00 H new ATOM 1481 N GLN A 100 23.460 11.789 -5.397 1.00 0.00 N ATOM 1482 CA GLN A 100 24.571 12.191 -6.259 1.00 0.00 C ATOM 1483 C GLN A 100 25.633 11.076 -6.333 1.00 0.00 C ATOM 1484 O GLN A 100 26.253 10.726 -5.328 1.00 0.00 O ATOM 1485 CB GLN A 100 25.170 13.524 -5.776 1.00 0.00 C ATOM 1486 CG GLN A 100 24.131 14.661 -5.720 1.00 0.00 C ATOM 1487 CD GLN A 100 24.742 16.057 -5.597 1.00 0.00 C ATOM 1488 OE1 GLN A 100 25.932 16.288 -5.768 1.00 0.00 O ATOM 1489 NE2 GLN A 100 23.934 17.060 -5.336 1.00 0.00 N ATOM 0 H GLN A 100 23.430 12.281 -4.504 1.00 0.00 H new ATOM 0 HA GLN A 100 24.195 12.347 -7.270 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.603 13.385 -4.785 1.00 0.00 H new ATOM 0 HB3 GLN A 100 25.983 13.814 -6.441 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.517 14.623 -6.620 1.00 0.00 H new ATOM 0 HG3 GLN A 100 23.467 14.491 -4.873 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.939 16.889 -5.190 1.00 0.00 H new ATOM 0 HE22 GLN A 100 24.302 18.010 -5.279 1.00 0.00 H new ATOM 1498 N LEU A 101 25.834 10.520 -7.532 1.00 0.00 N ATOM 1499 CA LEU A 101 26.805 9.462 -7.859 1.00 0.00 C ATOM 1500 C LEU A 101 27.494 9.783 -9.203 1.00 0.00 C ATOM 1501 O LEU A 101 27.042 10.661 -9.944 1.00 0.00 O ATOM 1502 CB LEU A 101 26.083 8.091 -7.911 1.00 0.00 C ATOM 1503 CG LEU A 101 25.522 7.541 -6.582 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.777 6.232 -6.837 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.621 7.252 -5.562 1.00 0.00 C ATOM 0 H LEU A 101 25.295 10.810 -8.348 1.00 0.00 H new ATOM 0 HA LEU A 101 27.573 9.415 -7.087 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.258 8.170 -8.620 1.00 0.00 H new ATOM 0 HB3 LEU A 101 26.780 7.356 -8.314 1.00 0.00 H new ATOM 0 HG LEU A 101 24.860 8.309 -6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.383 5.848 -5.896 1.00 0.00 H new ATOM 0 HD12 LEU A 101 23.954 6.411 -7.529 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.462 5.502 -7.268 1.00 0.00 H new ATOM 0 HD21 LEU A 101 26.174 6.867 -4.645 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.309 6.511 -5.969 1.00 0.00 H new ATOM 0 HD23 LEU A 101 27.165 8.171 -5.343 1.00 0.00 H new ATOM 1517 N GLU A 102 28.575 9.070 -9.537 1.00 0.00 N ATOM 1518 CA GLU A 102 29.293 9.257 -10.806 1.00 0.00 C ATOM 1519 C GLU A 102 28.544 8.665 -12.010 1.00 0.00 C ATOM 1520 O GLU A 102 27.448 8.112 -11.891 1.00 0.00 O ATOM 1521 CB GLU A 102 30.750 8.768 -10.682 1.00 0.00 C ATOM 1522 CG GLU A 102 30.925 7.255 -10.494 1.00 0.00 C ATOM 1523 CD GLU A 102 32.406 6.895 -10.256 1.00 0.00 C ATOM 1524 OE1 GLU A 102 33.251 7.152 -11.147 1.00 0.00 O ATOM 1525 OE2 GLU A 102 32.733 6.359 -9.170 1.00 0.00 O ATOM 0 H GLU A 102 28.977 8.349 -8.938 1.00 0.00 H new ATOM 0 HA GLU A 102 29.333 10.327 -11.012 1.00 0.00 H new ATOM 0 HB2 GLU A 102 31.294 9.071 -11.577 1.00 0.00 H new ATOM 0 HB3 GLU A 102 31.215 9.278 -9.838 1.00 0.00 H new ATOM 0 HG2 GLU A 102 30.325 6.918 -9.649 1.00 0.00 H new ATOM 0 HG3 GLU A 102 30.557 6.730 -11.376 1.00 0.00 H new ATOM 1532 N ASP A 103 29.128 8.817 -13.198 1.00 0.00 N ATOM 1533 CA ASP A 103 28.483 8.515 -14.477 1.00 0.00 C ATOM 1534 C ASP A 103 29.219 7.409 -15.263 1.00 0.00 C ATOM 1535 O ASP A 103 30.223 7.701 -15.918 1.00 0.00 O ATOM 1536 CB ASP A 103 28.309 9.829 -15.253 1.00 0.00 C ATOM 1537 CG ASP A 103 27.202 9.681 -16.297 1.00 0.00 C ATOM 1538 OD1 ASP A 103 26.026 9.587 -15.876 1.00 0.00 O ATOM 1539 OD2 ASP A 103 27.468 9.639 -17.516 1.00 0.00 O ATOM 0 H ASP A 103 30.083 9.161 -13.301 1.00 0.00 H new ATOM 0 HA ASP A 103 27.494 8.090 -14.304 1.00 0.00 H new ATOM 0 HB2 ASP A 103 28.064 10.637 -14.564 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.246 10.099 -15.741 1.00 0.00 H new ATOM 1544 N PRO A 104 28.747 6.139 -15.210 1.00 0.00 N ATOM 1545 CA PRO A 104 29.429 4.979 -15.805 1.00 0.00 C ATOM 1546 C PRO A 104 29.455 4.907 -17.339 1.00 0.00 C ATOM 1547 O PRO A 104 30.198 4.100 -17.891 1.00 0.00 O ATOM 1548 CB PRO A 104 28.722 3.754 -15.231 1.00 0.00 C ATOM 1549 CG PRO A 104 28.116 4.246 -13.930 1.00 0.00 C ATOM 1550 CD PRO A 104 27.691 5.655 -14.324 1.00 0.00 C ATOM 0 HA PRO A 104 30.487 5.050 -15.551 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.956 3.382 -15.911 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.421 2.935 -15.060 1.00 0.00 H new ATOM 0 HG2 PRO A 104 27.272 3.635 -13.611 1.00 0.00 H new ATOM 0 HG3 PRO A 104 28.837 4.246 -13.113 1.00 0.00 H new ATOM 0 HD2 PRO A 104 26.725 5.648 -14.829 1.00 0.00 H new ATOM 0 HD3 PRO A 104 27.588 6.295 -13.448 1.00 0.00 H new ATOM 1558 N ASP A 105 28.674 5.737 -18.031 1.00 0.00 N ATOM 1559 CA ASP A 105 28.580 5.774 -19.494 1.00 0.00 C ATOM 1560 C ASP A 105 29.965 5.976 -20.149 1.00 0.00 C ATOM 1561 O ASP A 105 30.557 7.056 -20.072 1.00 0.00 O ATOM 1562 CB ASP A 105 27.588 6.886 -19.868 1.00 0.00 C ATOM 1563 CG ASP A 105 27.358 7.090 -21.375 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.833 6.271 -22.201 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.666 8.080 -21.719 1.00 0.00 O ATOM 0 H ASP A 105 28.071 6.423 -17.577 1.00 0.00 H new ATOM 0 HA ASP A 105 28.218 4.819 -19.874 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.629 6.666 -19.399 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.944 7.824 -19.442 1.00 0.00 H new ATOM 1570 N GLY A 106 30.486 4.914 -20.780 1.00 0.00 N ATOM 1571 CA GLY A 106 31.800 4.903 -21.436 1.00 0.00 C ATOM 1572 C GLY A 106 32.998 4.770 -20.484 1.00 0.00 C ATOM 1573 O GLY A 106 34.128 5.034 -20.904 1.00 0.00 O ATOM 0 H GLY A 106 29.996 4.022 -20.850 1.00 0.00 H new ATOM 0 HA2 GLY A 106 31.827 4.078 -22.148 1.00 0.00 H new ATOM 0 HA3 GLY A 106 31.911 5.823 -22.010 1.00 0.00 H new ATOM 1577 N GLN A 107 32.778 4.383 -19.219 1.00 0.00 N ATOM 1578 CA GLN A 107 33.836 4.234 -18.205 1.00 0.00 C ATOM 1579 C GLN A 107 34.417 2.804 -18.196 1.00 0.00 C ATOM 1580 O GLN A 107 35.291 2.475 -19.001 1.00 0.00 O ATOM 1581 CB GLN A 107 33.357 4.682 -16.809 1.00 0.00 C ATOM 1582 CG GLN A 107 32.707 6.065 -16.717 1.00 0.00 C ATOM 1583 CD GLN A 107 33.596 7.274 -16.992 1.00 0.00 C ATOM 1584 OE1 GLN A 107 34.788 7.197 -17.268 1.00 0.00 O ATOM 1585 NE2 GLN A 107 33.023 8.456 -16.903 1.00 0.00 N ATOM 0 H GLN A 107 31.847 4.161 -18.865 1.00 0.00 H new ATOM 0 HA GLN A 107 34.651 4.902 -18.483 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.643 3.945 -16.441 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.212 4.662 -16.133 1.00 0.00 H new ATOM 0 HG2 GLN A 107 31.873 6.093 -17.418 1.00 0.00 H new ATOM 0 HG3 GLN A 107 32.287 6.175 -15.717 1.00 0.00 H new ATOM 0 HE21 GLN A 107 32.032 8.526 -16.674 1.00 0.00 H new ATOM 0 HE22 GLN A 107 33.570 9.302 -17.063 1.00 0.00 H new ATOM 1594 N SER A 108 33.925 1.952 -17.289 1.00 0.00 N ATOM 1595 CA SER A 108 34.268 0.530 -17.150 1.00 0.00 C ATOM 1596 C SER A 108 33.156 -0.211 -16.403 1.00 0.00 C ATOM 1597 O SER A 108 32.347 0.406 -15.705 1.00 0.00 O ATOM 1598 CB SER A 108 35.601 0.363 -16.401 1.00 0.00 C ATOM 1599 OG SER A 108 35.448 0.659 -15.018 1.00 0.00 O ATOM 0 H SER A 108 33.240 2.251 -16.595 1.00 0.00 H new ATOM 0 HA SER A 108 34.374 0.105 -18.148 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.964 -0.658 -16.520 1.00 0.00 H new ATOM 0 HB3 SER A 108 36.352 1.022 -16.837 1.00 0.00 H new ATOM 0 HG SER A 108 36.308 0.544 -14.562 1.00 0.00 H new ATOM 1605 N LEU A 109 33.132 -1.544 -16.492 1.00 0.00 N ATOM 1606 CA LEU A 109 32.147 -2.369 -15.773 1.00 0.00 C ATOM 1607 C LEU A 109 32.321 -2.279 -14.256 1.00 0.00 C ATOM 1608 O LEU A 109 31.347 -2.261 -13.515 1.00 0.00 O ATOM 1609 CB LEU A 109 32.251 -3.825 -16.247 1.00 0.00 C ATOM 1610 CG LEU A 109 32.113 -4.033 -17.764 1.00 0.00 C ATOM 1611 CD1 LEU A 109 32.134 -5.533 -18.030 1.00 0.00 C ATOM 1612 CD2 LEU A 109 30.842 -3.412 -18.345 1.00 0.00 C ATOM 0 H LEU A 109 33.788 -2.082 -17.059 1.00 0.00 H new ATOM 0 HA LEU A 109 31.153 -1.984 -16.000 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.213 -4.226 -15.928 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.480 -4.409 -15.745 1.00 0.00 H new ATOM 0 HG LEU A 109 32.943 -3.527 -18.257 1.00 0.00 H new ATOM 0 HD11 LEU A 109 32.038 -5.714 -19.101 1.00 0.00 H new ATOM 0 HD12 LEU A 109 33.075 -5.952 -17.674 1.00 0.00 H new ATOM 0 HD13 LEU A 109 31.304 -6.007 -17.506 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.806 -3.595 -19.419 1.00 0.00 H new ATOM 0 HD22 LEU A 109 29.969 -3.860 -17.871 1.00 0.00 H new ATOM 0 HD23 LEU A 109 30.844 -2.338 -18.160 1.00 0.00 H new ATOM 1624 N GLU A 110 33.559 -2.136 -13.791 1.00 0.00 N ATOM 1625 CA GLU A 110 33.859 -1.861 -12.379 1.00 0.00 C ATOM 1626 C GLU A 110 33.264 -0.523 -11.906 1.00 0.00 C ATOM 1627 O GLU A 110 32.705 -0.445 -10.812 1.00 0.00 O ATOM 1628 CB GLU A 110 35.379 -1.903 -12.170 1.00 0.00 C ATOM 1629 CG GLU A 110 35.793 -1.855 -10.694 1.00 0.00 C ATOM 1630 CD GLU A 110 35.587 -3.213 -9.990 1.00 0.00 C ATOM 1631 OE1 GLU A 110 34.430 -3.572 -9.660 1.00 0.00 O ATOM 1632 OE2 GLU A 110 36.580 -3.948 -9.773 1.00 0.00 O ATOM 0 H GLU A 110 34.389 -2.207 -14.380 1.00 0.00 H new ATOM 0 HA GLU A 110 33.388 -2.633 -11.770 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.775 -2.813 -12.621 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.834 -1.063 -12.695 1.00 0.00 H new ATOM 0 HG2 GLU A 110 36.841 -1.564 -10.621 1.00 0.00 H new ATOM 0 HG3 GLU A 110 35.213 -1.089 -10.180 1.00 0.00 H new ATOM 1639 N VAL A 111 33.291 0.525 -12.736 1.00 0.00 N ATOM 1640 CA VAL A 111 32.631 1.805 -12.416 1.00 0.00 C ATOM 1641 C VAL A 111 31.108 1.669 -12.448 1.00 0.00 C ATOM 1642 O VAL A 111 30.438 2.203 -11.564 1.00 0.00 O ATOM 1643 CB VAL A 111 33.140 2.933 -13.328 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.341 4.229 -13.182 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.597 3.270 -12.987 1.00 0.00 C ATOM 0 H VAL A 111 33.764 0.516 -13.640 1.00 0.00 H new ATOM 0 HA VAL A 111 32.898 2.079 -11.395 1.00 0.00 H new ATOM 0 HB VAL A 111 33.032 2.560 -14.347 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.750 4.986 -13.852 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.298 4.044 -13.437 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.406 4.582 -12.153 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.948 4.070 -13.639 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.662 3.594 -11.948 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.218 2.386 -13.131 1.00 0.00 H new ATOM 1655 N PHE A 112 30.544 0.888 -13.381 1.00 0.00 N ATOM 1656 CA PHE A 112 29.113 0.544 -13.341 1.00 0.00 C ATOM 1657 C PHE A 112 28.747 -0.175 -12.041 1.00 0.00 C ATOM 1658 O PHE A 112 27.847 0.273 -11.342 1.00 0.00 O ATOM 1659 CB PHE A 112 28.711 -0.305 -14.552 1.00 0.00 C ATOM 1660 CG PHE A 112 28.224 0.457 -15.765 1.00 0.00 C ATOM 1661 CD1 PHE A 112 26.881 0.872 -15.838 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.094 0.730 -16.835 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.403 1.539 -16.979 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.621 1.404 -17.974 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.278 1.815 -18.042 1.00 0.00 C ATOM 0 H PHE A 112 31.052 0.484 -14.168 1.00 0.00 H new ATOM 0 HA PHE A 112 28.556 1.480 -13.379 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.569 -0.909 -14.848 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.926 -0.995 -14.242 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.213 0.677 -15.012 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.128 0.421 -16.782 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.367 1.838 -17.038 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.290 1.606 -18.798 1.00 0.00 H new ATOM 0 HZ PHE A 112 26.919 2.344 -18.913 1.00 0.00 H new ATOM 1675 N ARG A 113 29.483 -1.224 -11.656 1.00 0.00 N ATOM 1676 CA ARG A 113 29.326 -1.952 -10.376 1.00 0.00 C ATOM 1677 C ARG A 113 29.420 -1.021 -9.159 1.00 0.00 C ATOM 1678 O ARG A 113 28.593 -1.105 -8.254 1.00 0.00 O ATOM 1679 CB ARG A 113 30.412 -3.042 -10.296 1.00 0.00 C ATOM 1680 CG ARG A 113 30.084 -4.280 -11.152 1.00 0.00 C ATOM 1681 CD ARG A 113 31.333 -5.063 -11.588 1.00 0.00 C ATOM 1682 NE ARG A 113 32.332 -5.214 -10.508 1.00 0.00 N ATOM 1683 CZ ARG A 113 32.582 -6.240 -9.720 1.00 0.00 C ATOM 1684 NH1 ARG A 113 31.903 -7.351 -9.750 1.00 0.00 N ATOM 1685 NH2 ARG A 113 33.566 -6.121 -8.884 1.00 0.00 N ATOM 0 H ARG A 113 30.228 -1.607 -12.238 1.00 0.00 H new ATOM 0 HA ARG A 113 28.331 -2.397 -10.354 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.364 -2.623 -10.622 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.537 -3.348 -9.257 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.428 -4.941 -10.586 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.533 -3.965 -12.038 1.00 0.00 H new ATOM 0 HD2 ARG A 113 31.031 -6.051 -11.936 1.00 0.00 H new ATOM 0 HD3 ARG A 113 31.796 -4.555 -12.434 1.00 0.00 H new ATOM 0 HE ARG A 113 32.920 -4.396 -10.348 1.00 0.00 H new ATOM 0 HH11 ARG A 113 31.132 -7.460 -10.409 1.00 0.00 H new ATOM 0 HH12 ARG A 113 32.143 -8.112 -9.115 1.00 0.00 H new ATOM 0 HH21 ARG A 113 34.110 -5.259 -8.856 1.00 0.00 H new ATOM 0 HH22 ARG A 113 33.796 -6.890 -8.254 1.00 0.00 H new ATOM 1699 N THR A 114 30.368 -0.080 -9.180 1.00 0.00 N ATOM 1700 CA THR A 114 30.591 0.913 -8.107 1.00 0.00 C ATOM 1701 C THR A 114 29.388 1.850 -7.921 1.00 0.00 C ATOM 1702 O THR A 114 29.022 2.175 -6.790 1.00 0.00 O ATOM 1703 CB THR A 114 31.872 1.723 -8.388 1.00 0.00 C ATOM 1704 OG1 THR A 114 32.994 0.863 -8.396 1.00 0.00 O ATOM 1705 CG2 THR A 114 32.152 2.798 -7.338 1.00 0.00 C ATOM 0 H THR A 114 31.020 0.021 -9.958 1.00 0.00 H new ATOM 0 HA THR A 114 30.713 0.363 -7.174 1.00 0.00 H new ATOM 0 HB THR A 114 31.709 2.204 -9.353 1.00 0.00 H new ATOM 0 HG1 THR A 114 32.996 0.336 -9.222 1.00 0.00 H new ATOM 0 HG21 THR A 114 33.068 3.330 -7.597 1.00 0.00 H new ATOM 0 HG22 THR A 114 31.320 3.502 -7.307 1.00 0.00 H new ATOM 0 HG23 THR A 114 32.268 2.330 -6.360 1.00 0.00 H new ATOM 1713 N VAL A 115 28.731 2.257 -9.013 1.00 0.00 N ATOM 1714 CA VAL A 115 27.490 3.059 -8.964 1.00 0.00 C ATOM 1715 C VAL A 115 26.273 2.191 -8.624 1.00 0.00 C ATOM 1716 O VAL A 115 25.504 2.540 -7.731 1.00 0.00 O ATOM 1717 CB VAL A 115 27.333 3.847 -10.280 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.976 4.539 -10.430 1.00 0.00 C ATOM 1719 CG2 VAL A 115 28.406 4.941 -10.333 1.00 0.00 C ATOM 0 H VAL A 115 29.041 2.042 -9.961 1.00 0.00 H new ATOM 0 HA VAL A 115 27.558 3.786 -8.155 1.00 0.00 H new ATOM 0 HB VAL A 115 27.428 3.117 -11.084 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.942 5.072 -11.380 1.00 0.00 H new ATOM 0 HG12 VAL A 115 25.182 3.793 -10.404 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.836 5.246 -9.612 1.00 0.00 H new ATOM 0 HG21 VAL A 115 28.305 5.505 -11.260 1.00 0.00 H new ATOM 0 HG22 VAL A 115 28.283 5.613 -9.484 1.00 0.00 H new ATOM 0 HG23 VAL A 115 29.394 4.483 -10.293 1.00 0.00 H new ATOM 1729 N ARG A 116 26.130 1.027 -9.271 1.00 0.00 N ATOM 1730 CA ARG A 116 25.024 0.060 -9.110 1.00 0.00 C ATOM 1731 C ARG A 116 24.795 -0.323 -7.646 1.00 0.00 C ATOM 1732 O ARG A 116 23.666 -0.253 -7.177 1.00 0.00 O ATOM 1733 CB ARG A 116 25.339 -1.176 -9.989 1.00 0.00 C ATOM 1734 CG ARG A 116 24.192 -2.200 -10.064 1.00 0.00 C ATOM 1735 CD ARG A 116 24.663 -3.572 -10.563 1.00 0.00 C ATOM 1736 NE ARG A 116 25.446 -4.277 -9.516 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.087 -5.428 -9.630 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.050 -6.137 -10.720 1.00 0.00 N ATOM 1739 NH2 ARG A 116 26.784 -5.892 -8.637 1.00 0.00 N ATOM 0 H ARG A 116 26.816 0.713 -9.958 1.00 0.00 H new ATOM 0 HA ARG A 116 24.090 0.518 -9.436 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.579 -0.840 -10.998 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.228 -1.670 -9.598 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.742 -2.310 -9.077 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.415 -1.822 -10.728 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.801 -4.176 -10.846 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.273 -3.448 -11.458 1.00 0.00 H new ATOM 0 HE ARG A 116 25.495 -3.821 -8.605 1.00 0.00 H new ATOM 0 HH11 ARG A 116 25.514 -5.810 -11.523 1.00 0.00 H new ATOM 0 HH12 ARG A 116 26.557 -7.020 -10.771 1.00 0.00 H new ATOM 0 HH21 ARG A 116 26.839 -5.368 -7.764 1.00 0.00 H new ATOM 0 HH22 ARG A 116 27.276 -6.780 -8.731 1.00 0.00 H new ATOM 1753 N GLY A 117 25.857 -0.663 -6.914 1.00 0.00 N ATOM 1754 CA GLY A 117 25.781 -1.048 -5.491 1.00 0.00 C ATOM 1755 C GLY A 117 25.237 0.066 -4.587 1.00 0.00 C ATOM 1756 O GLY A 117 24.466 -0.200 -3.667 1.00 0.00 O ATOM 0 H GLY A 117 26.805 -0.681 -7.289 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.145 -1.928 -5.394 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.775 -1.333 -5.146 1.00 0.00 H new ATOM 1760 N GLN A 118 25.550 1.329 -4.898 1.00 0.00 N ATOM 1761 CA GLN A 118 25.045 2.483 -4.143 1.00 0.00 C ATOM 1762 C GLN A 118 23.585 2.803 -4.504 1.00 0.00 C ATOM 1763 O GLN A 118 22.761 2.962 -3.610 1.00 0.00 O ATOM 1764 CB GLN A 118 25.995 3.679 -4.320 1.00 0.00 C ATOM 1765 CG GLN A 118 27.360 3.401 -3.663 1.00 0.00 C ATOM 1766 CD GLN A 118 28.373 4.515 -3.921 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.488 5.476 -3.173 1.00 0.00 O ATOM 1768 NE2 GLN A 118 29.139 4.436 -4.991 1.00 0.00 N ATOM 0 H GLN A 118 26.158 1.580 -5.677 1.00 0.00 H new ATOM 0 HA GLN A 118 25.030 2.237 -3.081 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.133 3.884 -5.382 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.550 4.570 -3.878 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.224 3.280 -2.588 1.00 0.00 H new ATOM 0 HG3 GLN A 118 27.757 2.459 -4.042 1.00 0.00 H new ATOM 0 HE21 GLN A 118 29.053 3.640 -5.622 1.00 0.00 H new ATOM 0 HE22 GLN A 118 29.818 5.171 -5.187 1.00 0.00 H new ATOM 1777 N VAL A 119 23.217 2.788 -5.793 1.00 0.00 N ATOM 1778 CA VAL A 119 21.801 2.890 -6.227 1.00 0.00 C ATOM 1779 C VAL A 119 20.938 1.786 -5.585 1.00 0.00 C ATOM 1780 O VAL A 119 19.865 2.075 -5.056 1.00 0.00 O ATOM 1781 CB VAL A 119 21.678 2.865 -7.766 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.226 2.995 -8.227 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.436 4.027 -8.414 1.00 0.00 C ATOM 0 H VAL A 119 23.880 2.706 -6.564 1.00 0.00 H new ATOM 0 HA VAL A 119 21.423 3.852 -5.881 1.00 0.00 H new ATOM 0 HB VAL A 119 22.096 1.905 -8.069 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.187 2.973 -9.316 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.641 2.167 -7.826 1.00 0.00 H new ATOM 0 HG13 VAL A 119 19.813 3.938 -7.868 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.325 3.975 -9.497 1.00 0.00 H new ATOM 0 HG22 VAL A 119 22.030 4.972 -8.053 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.492 3.962 -8.154 1.00 0.00 H new ATOM 1793 N LYS A 120 21.438 0.542 -5.557 1.00 0.00 N ATOM 1794 CA LYS A 120 20.810 -0.594 -4.862 1.00 0.00 C ATOM 1795 C LYS A 120 20.597 -0.301 -3.375 1.00 0.00 C ATOM 1796 O LYS A 120 19.471 -0.401 -2.900 1.00 0.00 O ATOM 1797 CB LYS A 120 21.673 -1.855 -5.059 1.00 0.00 C ATOM 1798 CG LYS A 120 21.057 -3.065 -4.344 1.00 0.00 C ATOM 1799 CD LYS A 120 21.883 -4.341 -4.545 1.00 0.00 C ATOM 1800 CE LYS A 120 21.147 -5.521 -3.894 1.00 0.00 C ATOM 1801 NZ LYS A 120 21.589 -5.766 -2.490 1.00 0.00 N ATOM 0 H LYS A 120 22.308 0.291 -6.026 1.00 0.00 H new ATOM 0 HA LYS A 120 19.824 -0.762 -5.295 1.00 0.00 H new ATOM 0 HB2 LYS A 120 21.771 -2.069 -6.123 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.677 -1.675 -4.676 1.00 0.00 H new ATOM 0 HG2 LYS A 120 20.975 -2.852 -3.278 1.00 0.00 H new ATOM 0 HG3 LYS A 120 20.045 -3.227 -4.715 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.031 -4.530 -5.608 1.00 0.00 H new ATOM 0 HD3 LYS A 120 22.872 -4.223 -4.102 1.00 0.00 H new ATOM 0 HE2 LYS A 120 20.075 -5.327 -3.905 1.00 0.00 H new ATOM 0 HE3 LYS A 120 21.314 -6.421 -4.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.126 -6.622 -2.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.621 -5.895 -2.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 21.329 -4.952 -1.897 1.00 0.00 H new ATOM 1815 N GLU A 121 21.648 0.070 -2.641 1.00 0.00 N ATOM 1816 CA GLU A 121 21.542 0.252 -1.186 1.00 0.00 C ATOM 1817 C GLU A 121 20.635 1.412 -0.808 1.00 0.00 C ATOM 1818 O GLU A 121 19.869 1.274 0.142 1.00 0.00 O ATOM 1819 CB GLU A 121 22.926 0.294 -0.504 1.00 0.00 C ATOM 1820 CG GLU A 121 23.586 1.674 -0.403 1.00 0.00 C ATOM 1821 CD GLU A 121 24.967 1.571 0.274 1.00 0.00 C ATOM 1822 OE1 GLU A 121 25.030 1.541 1.528 1.00 0.00 O ATOM 1823 OE2 GLU A 121 25.999 1.529 -0.438 1.00 0.00 O ATOM 0 H GLU A 121 22.576 0.250 -3.023 1.00 0.00 H new ATOM 0 HA GLU A 121 21.047 -0.634 -0.788 1.00 0.00 H new ATOM 0 HB2 GLU A 121 22.825 -0.113 0.502 1.00 0.00 H new ATOM 0 HB3 GLU A 121 23.598 -0.369 -1.050 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.695 2.104 -1.399 1.00 0.00 H new ATOM 0 HG3 GLU A 121 22.946 2.348 0.167 1.00 0.00 H new ATOM 1830 N ARG A 122 20.607 2.506 -1.584 1.00 0.00 N ATOM 1831 CA ARG A 122 19.643 3.587 -1.330 1.00 0.00 C ATOM 1832 C ARG A 122 18.205 3.098 -1.519 1.00 0.00 C ATOM 1833 O ARG A 122 17.390 3.337 -0.635 1.00 0.00 O ATOM 1834 CB ARG A 122 19.948 4.821 -2.190 1.00 0.00 C ATOM 1835 CG ARG A 122 21.292 5.519 -1.924 1.00 0.00 C ATOM 1836 CD ARG A 122 21.534 5.965 -0.477 1.00 0.00 C ATOM 1837 NE ARG A 122 20.483 6.873 0.042 1.00 0.00 N ATOM 1838 CZ ARG A 122 20.361 7.289 1.294 1.00 0.00 C ATOM 1839 NH1 ARG A 122 21.213 6.947 2.218 1.00 0.00 N ATOM 1840 NH2 ARG A 122 19.375 8.055 1.660 1.00 0.00 N ATOM 0 H ARG A 122 21.228 2.665 -2.378 1.00 0.00 H new ATOM 0 HA ARG A 122 19.747 3.892 -0.289 1.00 0.00 H new ATOM 0 HB2 ARG A 122 19.918 4.524 -3.238 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.149 5.548 -2.042 1.00 0.00 H new ATOM 0 HG2 ARG A 122 22.096 4.843 -2.216 1.00 0.00 H new ATOM 0 HG3 ARG A 122 21.361 6.394 -2.571 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.591 5.084 0.162 1.00 0.00 H new ATOM 0 HD3 ARG A 122 22.500 6.466 -0.416 1.00 0.00 H new ATOM 0 HE ARG A 122 19.790 7.208 -0.627 1.00 0.00 H new ATOM 0 HH11 ARG A 122 22.001 6.343 1.986 1.00 0.00 H new ATOM 0 HH12 ARG A 122 21.092 7.284 3.173 1.00 0.00 H new ATOM 0 HH21 ARG A 122 18.676 8.347 0.977 1.00 0.00 H new ATOM 0 HH22 ARG A 122 19.301 8.363 2.630 1.00 0.00 H new ATOM 1854 N VAL A 123 17.905 2.321 -2.563 1.00 0.00 N ATOM 1855 CA VAL A 123 16.594 1.664 -2.713 1.00 0.00 C ATOM 1856 C VAL A 123 16.259 0.713 -1.566 1.00 0.00 C ATOM 1857 O VAL A 123 15.185 0.863 -0.990 1.00 0.00 O ATOM 1858 CB VAL A 123 16.478 0.970 -4.084 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.355 -0.066 -4.152 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.252 2.008 -5.182 1.00 0.00 C ATOM 0 H VAL A 123 18.555 2.128 -3.325 1.00 0.00 H new ATOM 0 HA VAL A 123 15.845 2.454 -2.667 1.00 0.00 H new ATOM 0 HB VAL A 123 17.420 0.442 -4.232 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.333 -0.514 -5.146 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.531 -0.843 -3.408 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.400 0.419 -3.951 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.172 1.506 -6.146 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.332 2.556 -4.980 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.091 2.703 -5.204 1.00 0.00 H new ATOM 1870 N GLU A 124 17.127 -0.229 -1.188 1.00 0.00 N ATOM 1871 CA GLU A 124 16.823 -1.141 -0.067 1.00 0.00 C ATOM 1872 C GLU A 124 16.574 -0.399 1.244 1.00 0.00 C ATOM 1873 O GLU A 124 15.679 -0.774 2.004 1.00 0.00 O ATOM 1874 CB GLU A 124 17.936 -2.171 0.142 1.00 0.00 C ATOM 1875 CG GLU A 124 18.116 -3.103 -1.049 1.00 0.00 C ATOM 1876 CD GLU A 124 19.199 -4.147 -0.731 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.405 -3.846 -0.905 1.00 0.00 O ATOM 1878 OE2 GLU A 124 18.864 -5.281 -0.317 1.00 0.00 O ATOM 0 H GLU A 124 18.033 -0.384 -1.629 1.00 0.00 H new ATOM 0 HA GLU A 124 15.904 -1.655 -0.349 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.874 -1.650 0.334 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.713 -2.763 1.029 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.174 -3.601 -1.279 1.00 0.00 H new ATOM 0 HG3 GLU A 124 18.398 -2.530 -1.932 1.00 0.00 H new ATOM 1885 N ASN A 125 17.297 0.699 1.472 1.00 0.00 N ATOM 1886 CA ASN A 125 17.097 1.504 2.670 1.00 0.00 C ATOM 1887 C ASN A 125 15.793 2.324 2.625 1.00 0.00 C ATOM 1888 O ASN A 125 15.187 2.572 3.664 1.00 0.00 O ATOM 1889 CB ASN A 125 18.365 2.333 2.968 1.00 0.00 C ATOM 1890 CG ASN A 125 18.157 3.836 3.019 1.00 0.00 C ATOM 1891 OD1 ASN A 125 18.094 4.455 4.071 1.00 0.00 O ATOM 1892 ND2 ASN A 125 18.032 4.463 1.873 1.00 0.00 N ATOM 0 H ASN A 125 18.022 1.047 0.844 1.00 0.00 H new ATOM 0 HA ASN A 125 16.952 0.837 3.520 1.00 0.00 H new ATOM 0 HB2 ASN A 125 18.777 2.007 3.923 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.112 2.111 2.206 1.00 0.00 H new ATOM 0 HD21 ASN A 125 17.881 5.472 1.857 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.085 3.942 0.998 1.00 0.00 H new ATOM 1899 N LEU A 126 15.350 2.714 1.426 1.00 0.00 N ATOM 1900 CA LEU A 126 14.115 3.460 1.215 1.00 0.00 C ATOM 1901 C LEU A 126 12.891 2.560 1.329 1.00 0.00 C ATOM 1902 O LEU A 126 11.976 2.890 2.079 1.00 0.00 O ATOM 1903 CB LEU A 126 14.198 4.176 -0.147 1.00 0.00 C ATOM 1904 CG LEU A 126 12.895 4.852 -0.597 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.412 5.921 0.381 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.127 5.492 -1.959 1.00 0.00 C ATOM 0 H LEU A 126 15.852 2.514 0.561 1.00 0.00 H new ATOM 0 HA LEU A 126 14.000 4.211 1.997 1.00 0.00 H new ATOM 0 HB2 LEU A 126 14.984 4.929 -0.099 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.496 3.452 -0.905 1.00 0.00 H new ATOM 0 HG LEU A 126 12.122 4.085 -0.641 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.488 6.363 0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.231 5.468 1.356 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.172 6.696 0.477 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.210 5.977 -2.294 1.00 0.00 H new ATOM 0 HD22 LEU A 126 13.923 6.233 -1.882 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.415 4.724 -2.677 1.00 0.00 H new ATOM 1918 N ILE A 127 12.850 1.416 0.634 1.00 0.00 N ATOM 1919 CA ILE A 127 11.639 0.575 0.632 1.00 0.00 C ATOM 1920 C ILE A 127 11.298 0.071 2.027 1.00 0.00 C ATOM 1921 O ILE A 127 10.123 0.033 2.370 1.00 0.00 O ATOM 1922 CB ILE A 127 11.692 -0.563 -0.411 1.00 0.00 C ATOM 1923 CG1 ILE A 127 12.836 -1.580 -0.175 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.721 0.063 -1.819 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.101 -2.533 -1.343 1.00 0.00 C ATOM 0 H ILE A 127 13.623 1.054 0.075 1.00 0.00 H new ATOM 0 HA ILE A 127 10.819 1.221 0.317 1.00 0.00 H new ATOM 0 HB ILE A 127 10.792 -1.168 -0.304 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.752 -1.031 0.042 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.601 -2.170 0.711 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.759 -0.728 -2.568 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.823 0.663 -1.969 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.602 0.698 -1.917 1.00 0.00 H new ATOM 0 HD11 ILE A 127 13.918 -3.207 -1.085 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.202 -3.115 -1.549 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.371 -1.957 -2.228 1.00 0.00 H new ATOM 1937 N ALA A 128 12.290 -0.190 2.879 1.00 0.00 N ATOM 1938 CA ALA A 128 12.036 -0.592 4.261 1.00 0.00 C ATOM 1939 C ALA A 128 11.361 0.513 5.116 1.00 0.00 C ATOM 1940 O ALA A 128 10.716 0.197 6.120 1.00 0.00 O ATOM 1941 CB ALA A 128 13.366 -1.050 4.870 1.00 0.00 C ATOM 0 H ALA A 128 13.278 -0.130 2.635 1.00 0.00 H new ATOM 0 HA ALA A 128 11.315 -1.410 4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.206 -1.357 5.904 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.757 -1.891 4.298 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.081 -0.228 4.842 1.00 0.00 H new ATOM 1947 N LYS A 129 11.467 1.794 4.710 1.00 0.00 N ATOM 1948 CA LYS A 129 10.790 2.938 5.354 1.00 0.00 C ATOM 1949 C LYS A 129 9.361 3.151 4.841 1.00 0.00 C ATOM 1950 O LYS A 129 8.476 3.458 5.639 1.00 0.00 O ATOM 1951 CB LYS A 129 11.609 4.229 5.154 1.00 0.00 C ATOM 1952 CG LYS A 129 12.996 4.177 5.810 1.00 0.00 C ATOM 1953 CD LYS A 129 13.802 5.440 5.463 1.00 0.00 C ATOM 1954 CE LYS A 129 15.259 5.384 5.950 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.375 5.426 7.438 1.00 0.00 N ATOM 0 H LYS A 129 12.037 2.068 3.910 1.00 0.00 H new ATOM 0 HA LYS A 129 10.722 2.700 6.416 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.727 4.414 4.086 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.052 5.071 5.564 1.00 0.00 H new ATOM 0 HG2 LYS A 129 12.891 4.091 6.891 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.533 3.291 5.471 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.793 5.583 4.382 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.312 6.308 5.904 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.726 4.471 5.580 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.812 6.221 5.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.378 5.385 7.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 14.955 6.308 7.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.872 4.613 7.848 1.00 0.00 H new ATOM 1969 N ILE A 130 9.138 3.012 3.524 1.00 0.00 N ATOM 1970 CA ILE A 130 7.869 3.395 2.861 1.00 0.00 C ATOM 1971 C ILE A 130 6.949 2.231 2.430 1.00 0.00 C ATOM 1972 O ILE A 130 5.869 2.492 1.901 1.00 0.00 O ATOM 1973 CB ILE A 130 8.095 4.453 1.751 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.026 4.044 0.590 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.660 5.739 2.380 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.490 2.942 -0.318 1.00 0.00 C ATOM 0 H ILE A 130 9.832 2.630 2.882 1.00 0.00 H new ATOM 0 HA ILE A 130 7.284 3.869 3.649 1.00 0.00 H new ATOM 0 HB ILE A 130 7.109 4.587 1.306 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.230 4.925 -0.018 1.00 0.00 H new ATOM 0 HG13 ILE A 130 9.978 3.717 1.008 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.820 6.485 1.601 1.00 0.00 H new ATOM 0 HG22 ILE A 130 7.953 6.126 3.114 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.608 5.518 2.871 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.218 2.729 -1.100 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.314 2.041 0.269 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.554 3.268 -0.772 1.00 0.00 H new ATOM 1988 N SER A 131 7.339 0.969 2.658 1.00 0.00 N ATOM 1989 CA SER A 131 6.497 -0.223 2.401 1.00 0.00 C ATOM 1990 C SER A 131 5.141 -0.149 3.123 1.00 0.00 C ATOM 1991 O SER A 131 4.097 -0.260 2.438 1.00 0.00 O ATOM 1992 CB SER A 131 7.221 -1.497 2.832 1.00 0.00 C ATOM 1993 OG SER A 131 8.279 -1.771 1.938 1.00 0.00 O ATOM 1994 OXT SER A 131 5.119 0.002 4.369 1.00 0.00 O ATOM 0 H SER A 131 8.260 0.737 3.031 1.00 0.00 H new ATOM 0 HA SER A 131 6.311 -0.244 1.327 1.00 0.00 H new ATOM 0 HB2 SER A 131 7.609 -1.381 3.844 1.00 0.00 H new ATOM 0 HB3 SER A 131 6.523 -2.334 2.852 1.00 0.00 H new ATOM 0 HG SER A 131 8.850 -0.979 1.855 1.00 0.00 H new TER 2000 SER A 131