USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 976 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 5 MET CE :methyl 170:sc= -0.868 (180deg=-1.4) USER MOD Set 1.2: A 35 CYS SG : rot -82:sc= 0.0171 USER MOD Set 1.3: A 73 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 11 ASN : amide:sc= 0.666 K(o=2.8,f=-3.2!) USER MOD Set 2.2: A 15 SER OG : rot -68:sc= 0.677 USER MOD Set 2.3: A 34 SER OG : rot -90:sc= 1.45 USER MOD Set 3.1: A 16 GLN : amide:sc= 2.13 K(o=3.5,f=-3!) USER MOD Set 3.2: A 60 GLN : amide:sc= 1.34 K(o=3.5,f=0.16) USER MOD Single : A 1 MET CE :methyl -170:sc= 0 (180deg=-0.0517) USER MOD Single : A 1 MET N :NH3+ 148:sc= 1.26 (180deg=0.6) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -179:sc= 1.27 (180deg=1.26) USER MOD Single : A 8 CYS SG : rot 176:sc= 0.0727 USER MOD Single : A 9 LYS NZ :NH3+ 168:sc= 1.23 (180deg=1.13) USER MOD Single : A 12 SER OG : rot 150:sc= 0.0581 USER MOD Single : A 13 CYS SG : rot 134:sc= 0.611 USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -177:sc= 1.12 (180deg=1.11) USER MOD Single : A 24 THR OG1 : rot 91:sc= 0.875 USER MOD Single : A 29 LYS NZ :NH3+ -173:sc= 0.896 (180deg=0.859) USER MOD Single : A 33 THR OG1 : rot 137:sc= 0.00123 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 34:sc= 0.674 USER MOD Single : A 43 HIS : no HD1:sc= 0.239 K(o=0.24,f=-4.4!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 172:sc= -1.08 (180deg=-1.21) USER MOD Single : A 50 MET CE :methyl -138:sc= -0.261 (180deg=-3.31) USER MOD Single : A 58 SER OG : rot 180:sc= 0.00341 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -70:sc= 0.68 USER MOD Single : A 67 ASN : amide:sc= 1.14 K(o=1.1,f=-0.07) USER MOD Single : A 69 ASN : amide:sc= 0.706 K(o=0.71,f=-0.099) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot -39:sc= 0.298 USER MOD Single : A 93 GLN : amide:sc= 0.991 K(o=0.99,f=-0.22) USER MOD Single : A 100 GLN : amide:sc= 1.17 K(o=1.2,f=-0.47) USER MOD Single : A 107 GLN : amide:sc= 0.215 K(o=0.22,f=-0.85) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 77:sc= 1.19 USER MOD Single : A 118 GLN : amide:sc= 0.901 K(o=0.9,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -173:sc= 1.21 (180deg=1.15) USER MOD Single : A 125 ASN : amide:sc= 0.302 X(o=0.3,f=-0.0037) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 83:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.811 -0.009 1.217 1.00 0.00 N ATOM 2 CA MET A 1 2.219 0.189 -0.203 1.00 0.00 C ATOM 3 C MET A 1 2.275 1.679 -0.562 1.00 0.00 C ATOM 4 O MET A 1 1.267 2.374 -0.451 1.00 0.00 O ATOM 5 CB MET A 1 1.322 -0.604 -1.185 1.00 0.00 C ATOM 6 CG MET A 1 1.902 -0.644 -2.606 1.00 0.00 C ATOM 7 SD MET A 1 0.946 -1.671 -3.756 1.00 0.00 S ATOM 8 CE MET A 1 2.192 -1.925 -5.047 1.00 0.00 C ATOM 0 H1 MET A 1 1.273 -0.895 1.303 1.00 0.00 H new ATOM 0 H2 MET A 1 2.658 -0.058 1.818 1.00 0.00 H new ATOM 0 H3 MET A 1 1.216 0.788 1.522 1.00 0.00 H new ATOM 0 HA MET A 1 3.226 -0.214 -0.307 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.198 -1.623 -0.817 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.331 -0.152 -1.213 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.953 0.372 -2.997 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.924 -1.020 -2.561 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.725 -2.386 -5.918 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.622 -0.965 -5.332 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.979 -2.577 -4.669 1.00 0.00 H new ATOM 18 N LYS A 2 3.437 2.156 -1.030 1.00 0.00 N ATOM 19 CA LYS A 2 3.652 3.498 -1.629 1.00 0.00 C ATOM 20 C LYS A 2 4.360 3.389 -2.985 1.00 0.00 C ATOM 21 O LYS A 2 4.870 2.325 -3.327 1.00 0.00 O ATOM 22 CB LYS A 2 4.422 4.396 -0.633 1.00 0.00 C ATOM 23 CG LYS A 2 3.490 4.961 0.455 1.00 0.00 C ATOM 24 CD LYS A 2 4.241 5.877 1.438 1.00 0.00 C ATOM 25 CE LYS A 2 3.296 6.667 2.363 1.00 0.00 C ATOM 26 NZ LYS A 2 2.575 5.802 3.343 1.00 0.00 N ATOM 0 H LYS A 2 4.293 1.602 -1.005 1.00 0.00 H new ATOM 0 HA LYS A 2 2.686 3.965 -1.822 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.221 3.821 -0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.894 5.218 -1.172 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.681 5.520 -0.015 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.032 4.138 1.004 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.915 5.274 2.046 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.859 6.577 0.875 1.00 0.00 H new ATOM 0 HE2 LYS A 2 3.872 7.417 2.905 1.00 0.00 H new ATOM 0 HE3 LYS A 2 2.567 7.203 1.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 1.956 6.391 3.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 2.001 5.102 2.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.265 5.310 3.945 1.00 0.00 H new ATOM 40 N LYS A 3 4.381 4.472 -3.767 1.00 0.00 N ATOM 41 CA LYS A 3 5.021 4.530 -5.097 1.00 0.00 C ATOM 42 C LYS A 3 6.279 5.397 -5.074 1.00 0.00 C ATOM 43 O LYS A 3 6.300 6.451 -4.442 1.00 0.00 O ATOM 44 CB LYS A 3 4.030 4.977 -6.194 1.00 0.00 C ATOM 45 CG LYS A 3 2.856 3.994 -6.397 1.00 0.00 C ATOM 46 CD LYS A 3 1.631 4.195 -5.484 1.00 0.00 C ATOM 47 CE LYS A 3 0.979 5.548 -5.770 1.00 0.00 C ATOM 48 NZ LYS A 3 0.284 6.112 -4.584 1.00 0.00 N ATOM 0 H LYS A 3 3.947 5.354 -3.494 1.00 0.00 H new ATOM 0 HA LYS A 3 5.333 3.517 -5.351 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.632 5.958 -5.936 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.568 5.089 -7.136 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.526 4.065 -7.433 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.229 2.980 -6.250 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.911 3.394 -5.647 1.00 0.00 H new ATOM 0 HD3 LYS A 3 1.934 4.143 -4.438 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.742 6.250 -6.107 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.265 5.437 -6.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.154 7.020 -4.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.452 5.450 -4.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.971 6.261 -3.818 1.00 0.00 H new ATOM 62 N VAL A 4 7.314 4.958 -5.788 1.00 0.00 N ATOM 63 CA VAL A 4 8.612 5.658 -5.885 1.00 0.00 C ATOM 64 C VAL A 4 8.936 5.960 -7.352 1.00 0.00 C ATOM 65 O VAL A 4 8.686 5.140 -8.234 1.00 0.00 O ATOM 66 CB VAL A 4 9.760 4.902 -5.174 1.00 0.00 C ATOM 67 CG1 VAL A 4 11.018 5.771 -5.053 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.375 4.407 -3.773 1.00 0.00 C ATOM 0 H VAL A 4 7.283 4.093 -6.327 1.00 0.00 H new ATOM 0 HA VAL A 4 8.519 6.604 -5.351 1.00 0.00 H new ATOM 0 HB VAL A 4 9.964 4.036 -5.803 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.803 5.207 -4.549 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.359 6.058 -6.048 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.787 6.667 -4.476 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.221 3.885 -3.326 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.103 5.258 -3.149 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.527 3.726 -3.848 1.00 0.00 H new ATOM 78 N MET A 5 9.512 7.130 -7.614 1.00 0.00 N ATOM 79 CA MET A 5 9.929 7.554 -8.953 1.00 0.00 C ATOM 80 C MET A 5 11.357 8.088 -8.924 1.00 0.00 C ATOM 81 O MET A 5 11.716 8.870 -8.049 1.00 0.00 O ATOM 82 CB MET A 5 8.914 8.550 -9.530 1.00 0.00 C ATOM 83 CG MET A 5 9.397 9.355 -10.747 1.00 0.00 C ATOM 84 SD MET A 5 9.968 8.423 -12.191 1.00 0.00 S ATOM 85 CE MET A 5 8.528 8.597 -13.272 1.00 0.00 C ATOM 0 H MET A 5 9.707 7.824 -6.892 1.00 0.00 H new ATOM 0 HA MET A 5 9.941 6.697 -9.626 1.00 0.00 H new ATOM 0 HB2 MET A 5 8.014 8.003 -9.812 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.629 9.249 -8.743 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.582 10.004 -11.066 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.211 10.002 -10.421 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.776 8.235 -14.270 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.699 8.014 -12.870 1.00 0.00 H new ATOM 0 HE3 MET A 5 8.240 9.647 -13.328 1.00 0.00 H new ATOM 95 N PHE A 6 12.153 7.671 -9.905 1.00 0.00 N ATOM 96 CA PHE A 6 13.574 8.008 -10.036 1.00 0.00 C ATOM 97 C PHE A 6 13.826 8.922 -11.242 1.00 0.00 C ATOM 98 O PHE A 6 13.652 8.492 -12.380 1.00 0.00 O ATOM 99 CB PHE A 6 14.397 6.710 -10.127 1.00 0.00 C ATOM 100 CG PHE A 6 14.063 5.687 -9.062 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.585 5.805 -7.761 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.206 4.621 -9.378 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.202 4.893 -6.761 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.822 3.711 -8.380 1.00 0.00 C ATOM 105 CZ PHE A 6 13.299 3.860 -7.066 1.00 0.00 C ATOM 0 H PHE A 6 11.819 7.069 -10.657 1.00 0.00 H new ATOM 0 HA PHE A 6 13.889 8.565 -9.154 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.240 6.261 -11.108 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.456 6.959 -10.056 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.281 6.597 -7.530 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.842 4.501 -10.388 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.601 4.986 -5.762 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.158 2.894 -8.623 1.00 0.00 H new ATOM 0 HZ PHE A 6 12.972 3.182 -6.292 1.00 0.00 H new ATOM 115 N VAL A 7 14.278 10.154 -11.004 1.00 0.00 N ATOM 116 CA VAL A 7 14.720 11.130 -12.014 1.00 0.00 C ATOM 117 C VAL A 7 16.238 11.074 -12.200 1.00 0.00 C ATOM 118 O VAL A 7 16.985 11.154 -11.235 1.00 0.00 O ATOM 119 CB VAL A 7 14.208 12.553 -11.665 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.083 13.697 -12.199 1.00 0.00 C ATOM 121 CG2 VAL A 7 12.822 12.751 -12.284 1.00 0.00 C ATOM 0 H VAL A 7 14.351 10.521 -10.055 1.00 0.00 H new ATOM 0 HA VAL A 7 14.279 10.865 -12.975 1.00 0.00 H new ATOM 0 HB VAL A 7 14.215 12.601 -10.576 1.00 0.00 H new ATOM 0 HG11 VAL A 7 14.649 14.653 -11.908 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.087 13.612 -11.783 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.135 13.638 -13.286 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.455 13.749 -12.043 1.00 0.00 H new ATOM 0 HG22 VAL A 7 12.888 12.640 -13.366 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.135 12.005 -11.884 1.00 0.00 H new ATOM 131 N CYS A 8 16.709 10.995 -13.445 1.00 0.00 N ATOM 132 CA CYS A 8 18.124 11.150 -13.829 1.00 0.00 C ATOM 133 C CYS A 8 18.231 12.202 -14.951 1.00 0.00 C ATOM 134 O CYS A 8 17.208 12.675 -15.439 1.00 0.00 O ATOM 135 CB CYS A 8 18.633 9.736 -14.167 1.00 0.00 C ATOM 136 SG CYS A 8 20.356 9.665 -14.755 1.00 0.00 S ATOM 0 H CYS A 8 16.101 10.816 -14.244 1.00 0.00 H new ATOM 0 HA CYS A 8 18.767 11.541 -13.041 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.541 9.110 -13.279 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.985 9.305 -14.930 1.00 0.00 H new ATOM 0 HG CYS A 8 20.702 8.425 -14.935 1.00 0.00 H new ATOM 142 N LYS A 9 19.440 12.580 -15.394 1.00 0.00 N ATOM 143 CA LYS A 9 19.598 13.649 -16.407 1.00 0.00 C ATOM 144 C LYS A 9 18.970 13.258 -17.755 1.00 0.00 C ATOM 145 O LYS A 9 18.075 13.949 -18.216 1.00 0.00 O ATOM 146 CB LYS A 9 21.079 14.092 -16.506 1.00 0.00 C ATOM 147 CG LYS A 9 21.184 15.601 -16.808 1.00 0.00 C ATOM 148 CD LYS A 9 22.606 16.041 -17.198 1.00 0.00 C ATOM 149 CE LYS A 9 23.019 15.665 -18.637 1.00 0.00 C ATOM 150 NZ LYS A 9 22.440 16.580 -19.666 1.00 0.00 N ATOM 0 H LYS A 9 20.317 12.170 -15.074 1.00 0.00 H new ATOM 0 HA LYS A 9 19.038 14.525 -16.081 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.593 13.868 -15.571 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.581 13.525 -17.290 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.498 15.852 -17.617 1.00 0.00 H new ATOM 0 HG3 LYS A 9 20.863 16.164 -15.931 1.00 0.00 H new ATOM 0 HD2 LYS A 9 22.683 17.122 -17.082 1.00 0.00 H new ATOM 0 HD3 LYS A 9 23.315 15.594 -16.501 1.00 0.00 H new ATOM 0 HE2 LYS A 9 24.106 15.682 -18.714 1.00 0.00 H new ATOM 0 HE3 LYS A 9 22.701 14.644 -18.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.905 16.412 -20.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.420 16.399 -19.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.592 17.568 -19.377 1.00 0.00 H new ATOM 164 N ARG A 10 19.367 12.098 -18.311 1.00 0.00 N ATOM 165 CA ARG A 10 18.823 11.523 -19.581 1.00 0.00 C ATOM 166 C ARG A 10 18.094 10.170 -19.476 1.00 0.00 C ATOM 167 O ARG A 10 17.754 9.576 -20.491 1.00 0.00 O ATOM 168 CB ARG A 10 19.849 11.644 -20.738 1.00 0.00 C ATOM 169 CG ARG A 10 21.006 10.627 -20.857 1.00 0.00 C ATOM 170 CD ARG A 10 22.030 10.664 -19.711 1.00 0.00 C ATOM 171 NE ARG A 10 23.321 10.040 -20.096 1.00 0.00 N ATOM 172 CZ ARG A 10 24.345 9.780 -19.296 1.00 0.00 C ATOM 173 NH1 ARG A 10 24.306 9.946 -18.010 1.00 0.00 N ATOM 174 NH2 ARG A 10 25.472 9.319 -19.732 1.00 0.00 N ATOM 0 H ARG A 10 20.089 11.513 -17.890 1.00 0.00 H new ATOM 0 HA ARG A 10 17.978 12.160 -19.843 1.00 0.00 H new ATOM 0 HB2 ARG A 10 19.289 11.608 -21.672 1.00 0.00 H new ATOM 0 HB3 ARG A 10 20.296 12.636 -20.672 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.583 9.624 -20.912 1.00 0.00 H new ATOM 0 HG3 ARG A 10 21.529 10.804 -21.797 1.00 0.00 H new ATOM 0 HD2 ARG A 10 22.202 11.698 -19.413 1.00 0.00 H new ATOM 0 HD3 ARG A 10 21.622 10.146 -18.843 1.00 0.00 H new ATOM 0 HE ARG A 10 23.431 9.785 -21.077 1.00 0.00 H new ATOM 0 HH11 ARG A 10 23.456 10.293 -17.566 1.00 0.00 H new ATOM 0 HH12 ARG A 10 25.126 9.729 -17.443 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.599 9.141 -20.728 1.00 0.00 H new ATOM 0 HH22 ARG A 10 26.234 9.133 -19.080 1.00 0.00 H new ATOM 188 N ASN A 11 17.862 9.686 -18.247 1.00 0.00 N ATOM 189 CA ASN A 11 17.178 8.415 -17.900 1.00 0.00 C ATOM 190 C ASN A 11 17.743 7.177 -18.616 1.00 0.00 C ATOM 191 O ASN A 11 17.008 6.262 -18.975 1.00 0.00 O ATOM 192 CB ASN A 11 15.657 8.643 -18.020 1.00 0.00 C ATOM 193 CG ASN A 11 14.742 7.508 -17.563 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.793 7.185 -18.252 1.00 0.00 O ATOM 195 ND2 ASN A 11 14.925 6.889 -16.414 1.00 0.00 N ATOM 0 H ASN A 11 18.161 10.195 -17.415 1.00 0.00 H new ATOM 0 HA ASN A 11 17.388 8.150 -16.864 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.403 9.534 -17.446 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.429 8.861 -19.063 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.278 6.157 -16.120 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.714 7.142 -15.818 1.00 0.00 H new ATOM 202 N SER A 12 19.061 7.156 -18.814 1.00 0.00 N ATOM 203 CA SER A 12 19.808 6.058 -19.440 1.00 0.00 C ATOM 204 C SER A 12 20.391 5.092 -18.409 1.00 0.00 C ATOM 205 O SER A 12 20.293 3.880 -18.576 1.00 0.00 O ATOM 206 CB SER A 12 20.921 6.676 -20.283 1.00 0.00 C ATOM 207 OG SER A 12 21.623 7.566 -19.432 1.00 0.00 O ATOM 0 H SER A 12 19.663 7.930 -18.533 1.00 0.00 H new ATOM 0 HA SER A 12 19.130 5.471 -20.059 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.586 5.905 -20.672 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.509 7.205 -21.142 1.00 0.00 H new ATOM 0 HG SER A 12 22.560 7.617 -19.713 1.00 0.00 H new ATOM 213 N CYS A 13 20.971 5.636 -17.336 1.00 0.00 N ATOM 214 CA CYS A 13 21.598 4.912 -16.224 1.00 0.00 C ATOM 215 C CYS A 13 21.115 5.475 -14.872 1.00 0.00 C ATOM 216 O CYS A 13 20.241 6.339 -14.828 1.00 0.00 O ATOM 217 CB CYS A 13 23.123 4.984 -16.458 1.00 0.00 C ATOM 218 SG CYS A 13 23.999 3.727 -15.473 1.00 0.00 S ATOM 0 H CYS A 13 21.019 6.647 -17.212 1.00 0.00 H new ATOM 0 HA CYS A 13 21.311 3.861 -16.186 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.339 4.836 -17.516 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.488 5.977 -16.194 1.00 0.00 H new ATOM 0 HG CYS A 13 24.875 3.123 -16.220 1.00 0.00 H new ATOM 224 N ARG A 14 21.648 4.982 -13.747 1.00 0.00 N ATOM 225 CA ARG A 14 21.203 5.247 -12.351 1.00 0.00 C ATOM 226 C ARG A 14 19.727 4.893 -12.107 1.00 0.00 C ATOM 227 O ARG A 14 19.406 3.812 -11.643 1.00 0.00 O ATOM 228 CB ARG A 14 21.584 6.686 -11.895 1.00 0.00 C ATOM 229 CG ARG A 14 23.014 7.153 -12.213 1.00 0.00 C ATOM 230 CD ARG A 14 23.193 8.599 -11.719 1.00 0.00 C ATOM 231 NE ARG A 14 24.458 9.194 -12.205 1.00 0.00 N ATOM 232 CZ ARG A 14 24.632 10.374 -12.779 1.00 0.00 C ATOM 233 NH1 ARG A 14 23.670 11.234 -12.947 1.00 0.00 N ATOM 234 NH2 ARG A 14 25.807 10.719 -13.200 1.00 0.00 N ATOM 0 H ARG A 14 22.448 4.350 -13.776 1.00 0.00 H new ATOM 0 HA ARG A 14 21.755 4.563 -11.707 1.00 0.00 H new ATOM 0 HB2 ARG A 14 20.887 7.385 -12.356 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.436 6.752 -10.817 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.739 6.498 -11.730 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.198 7.097 -13.286 1.00 0.00 H new ATOM 0 HD2 ARG A 14 22.353 9.205 -12.057 1.00 0.00 H new ATOM 0 HD3 ARG A 14 23.179 8.615 -10.629 1.00 0.00 H new ATOM 0 HE ARG A 14 25.297 8.626 -12.083 1.00 0.00 H new ATOM 0 HH11 ARG A 14 22.726 11.012 -12.630 1.00 0.00 H new ATOM 0 HH12 ARG A 14 23.860 12.130 -13.396 1.00 0.00 H new ATOM 0 HH21 ARG A 14 26.596 10.082 -13.089 1.00 0.00 H new ATOM 0 HH22 ARG A 14 25.944 11.628 -13.643 1.00 0.00 H new ATOM 248 N SER A 15 18.821 5.780 -12.513 1.00 0.00 N ATOM 249 CA SER A 15 17.348 5.678 -12.389 1.00 0.00 C ATOM 250 C SER A 15 16.762 4.367 -12.926 1.00 0.00 C ATOM 251 O SER A 15 15.915 3.756 -12.284 1.00 0.00 O ATOM 252 CB SER A 15 16.726 6.870 -13.125 1.00 0.00 C ATOM 253 OG SER A 15 17.097 6.854 -14.506 1.00 0.00 O ATOM 0 H SER A 15 19.102 6.649 -12.968 1.00 0.00 H new ATOM 0 HA SER A 15 17.108 5.688 -11.326 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.640 6.835 -13.033 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.055 7.801 -12.665 1.00 0.00 H new ATOM 0 HG SER A 15 18.056 7.035 -14.589 1.00 0.00 H new ATOM 259 N GLN A 16 17.278 3.883 -14.058 1.00 0.00 N ATOM 260 CA GLN A 16 16.833 2.622 -14.680 1.00 0.00 C ATOM 261 C GLN A 16 17.243 1.394 -13.841 1.00 0.00 C ATOM 262 O GLN A 16 16.459 0.457 -13.710 1.00 0.00 O ATOM 263 CB GLN A 16 17.404 2.549 -16.112 1.00 0.00 C ATOM 264 CG GLN A 16 16.881 3.658 -17.054 1.00 0.00 C ATOM 265 CD GLN A 16 15.459 3.431 -17.568 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.780 2.482 -17.214 1.00 0.00 O ATOM 267 NE2 GLN A 16 14.988 4.272 -18.457 1.00 0.00 N ATOM 0 H GLN A 16 18.020 4.353 -14.576 1.00 0.00 H new ATOM 0 HA GLN A 16 15.744 2.608 -14.724 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.491 2.611 -16.062 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.160 1.577 -16.541 1.00 0.00 H new ATOM 0 HG2 GLN A 16 16.916 4.612 -16.527 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.554 3.740 -17.907 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.552 5.067 -18.756 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.057 4.131 -18.849 1.00 0.00 H new ATOM 276 N MET A 17 18.423 1.432 -13.194 1.00 0.00 N ATOM 277 CA MET A 17 18.859 0.416 -12.210 1.00 0.00 C ATOM 278 C MET A 17 18.038 0.492 -10.919 1.00 0.00 C ATOM 279 O MET A 17 17.685 -0.538 -10.359 1.00 0.00 O ATOM 280 CB MET A 17 20.354 0.585 -11.855 1.00 0.00 C ATOM 281 CG MET A 17 21.337 0.341 -13.004 1.00 0.00 C ATOM 282 SD MET A 17 23.050 0.526 -12.436 1.00 0.00 S ATOM 283 CE MET A 17 23.918 -0.230 -13.830 1.00 0.00 C ATOM 0 H MET A 17 19.108 2.174 -13.339 1.00 0.00 H new ATOM 0 HA MET A 17 18.702 -0.556 -12.678 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.508 1.596 -11.477 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.596 -0.099 -11.042 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.189 -0.660 -13.409 1.00 0.00 H new ATOM 0 HG3 MET A 17 21.139 1.044 -13.813 1.00 0.00 H new ATOM 0 HE1 MET A 17 24.992 -0.202 -13.648 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.596 -1.265 -13.941 1.00 0.00 H new ATOM 0 HE3 MET A 17 23.690 0.321 -14.743 1.00 0.00 H new ATOM 293 N ALA A 18 17.685 1.700 -10.464 1.00 0.00 N ATOM 294 CA ALA A 18 16.863 1.901 -9.264 1.00 0.00 C ATOM 295 C ALA A 18 15.474 1.266 -9.415 1.00 0.00 C ATOM 296 O ALA A 18 15.015 0.567 -8.516 1.00 0.00 O ATOM 297 CB ALA A 18 16.773 3.407 -8.983 1.00 0.00 C ATOM 0 H ALA A 18 17.962 2.569 -10.919 1.00 0.00 H new ATOM 0 HA ALA A 18 17.331 1.402 -8.415 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.165 3.576 -8.094 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.774 3.807 -8.820 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.316 3.910 -9.835 1.00 0.00 H new ATOM 303 N GLU A 19 14.862 1.397 -10.597 1.00 0.00 N ATOM 304 CA GLU A 19 13.635 0.681 -10.966 1.00 0.00 C ATOM 305 C GLU A 19 13.843 -0.840 -10.967 1.00 0.00 C ATOM 306 O GLU A 19 13.024 -1.560 -10.406 1.00 0.00 O ATOM 307 CB GLU A 19 13.161 1.223 -12.324 1.00 0.00 C ATOM 308 CG GLU A 19 11.750 0.756 -12.704 1.00 0.00 C ATOM 309 CD GLU A 19 11.296 1.298 -14.079 1.00 0.00 C ATOM 310 OE1 GLU A 19 11.785 2.365 -14.523 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.403 0.668 -14.695 1.00 0.00 O ATOM 0 H GLU A 19 15.209 2.011 -11.334 1.00 0.00 H new ATOM 0 HA GLU A 19 12.857 0.857 -10.223 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.182 2.313 -12.300 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.861 0.908 -13.098 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.724 -0.334 -12.720 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.045 1.081 -11.939 1.00 0.00 H new ATOM 318 N GLY A 20 14.976 -1.325 -11.488 1.00 0.00 N ATOM 319 CA GLY A 20 15.358 -2.743 -11.449 1.00 0.00 C ATOM 320 C GLY A 20 15.493 -3.326 -10.040 1.00 0.00 C ATOM 321 O GLY A 20 14.933 -4.383 -9.756 1.00 0.00 O ATOM 0 H GLY A 20 15.664 -0.735 -11.956 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.615 -3.321 -11.998 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.307 -2.865 -11.971 1.00 0.00 H new ATOM 325 N PHE A 21 16.178 -2.644 -9.118 1.00 0.00 N ATOM 326 CA PHE A 21 16.282 -3.111 -7.729 1.00 0.00 C ATOM 327 C PHE A 21 14.952 -3.008 -7.001 1.00 0.00 C ATOM 328 O PHE A 21 14.503 -3.973 -6.394 1.00 0.00 O ATOM 329 CB PHE A 21 17.389 -2.343 -6.994 1.00 0.00 C ATOM 330 CG PHE A 21 18.765 -2.776 -7.430 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.176 -4.096 -7.176 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.611 -1.895 -8.123 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.421 -4.542 -7.634 1.00 0.00 C ATOM 334 CE2 PHE A 21 20.861 -2.342 -8.577 1.00 0.00 C ATOM 335 CZ PHE A 21 21.264 -3.670 -8.338 1.00 0.00 C ATOM 0 H PHE A 21 16.668 -1.769 -9.305 1.00 0.00 H new ATOM 0 HA PHE A 21 16.550 -4.167 -7.744 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.271 -1.275 -7.176 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.284 -2.497 -5.920 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.531 -4.766 -6.627 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.300 -0.877 -8.306 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.733 -5.559 -7.445 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.514 -1.667 -9.110 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.222 -4.017 -8.697 1.00 0.00 H new ATOM 345 N ALA A 22 14.276 -1.867 -7.103 1.00 0.00 N ATOM 346 CA ALA A 22 13.026 -1.637 -6.385 1.00 0.00 C ATOM 347 C ALA A 22 11.883 -2.545 -6.862 1.00 0.00 C ATOM 348 O ALA A 22 11.161 -3.065 -6.019 1.00 0.00 O ATOM 349 CB ALA A 22 12.701 -0.145 -6.488 1.00 0.00 C ATOM 0 H ALA A 22 14.576 -1.082 -7.681 1.00 0.00 H new ATOM 0 HA ALA A 22 13.147 -1.909 -5.337 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.770 0.062 -5.960 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.508 0.435 -6.041 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.593 0.132 -7.537 1.00 0.00 H new ATOM 355 N LYS A 23 11.759 -2.849 -8.162 1.00 0.00 N ATOM 356 CA LYS A 23 10.700 -3.761 -8.654 1.00 0.00 C ATOM 357 C LYS A 23 10.875 -5.203 -8.158 1.00 0.00 C ATOM 358 O LYS A 23 9.897 -5.924 -7.986 1.00 0.00 O ATOM 359 CB LYS A 23 10.591 -3.679 -10.188 1.00 0.00 C ATOM 360 CG LYS A 23 11.657 -4.477 -10.962 1.00 0.00 C ATOM 361 CD LYS A 23 11.653 -4.118 -12.457 1.00 0.00 C ATOM 362 CE LYS A 23 12.554 -5.052 -13.284 1.00 0.00 C ATOM 363 NZ LYS A 23 11.975 -6.414 -13.475 1.00 0.00 N ATOM 0 H LYS A 23 12.371 -2.483 -8.892 1.00 0.00 H new ATOM 0 HA LYS A 23 9.755 -3.423 -8.229 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.605 -4.035 -10.486 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.655 -2.632 -10.486 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.642 -4.275 -10.541 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.472 -5.545 -10.842 1.00 0.00 H new ATOM 0 HD2 LYS A 23 10.633 -4.169 -12.838 1.00 0.00 H new ATOM 0 HD3 LYS A 23 11.988 -3.088 -12.582 1.00 0.00 H new ATOM 0 HE2 LYS A 23 12.734 -4.601 -14.260 1.00 0.00 H new ATOM 0 HE3 LYS A 23 13.522 -5.142 -12.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 12.651 -7.009 -13.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 11.780 -6.842 -12.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 11.090 -6.342 -14.016 1.00 0.00 H new ATOM 377 N THR A 24 12.127 -5.588 -7.903 1.00 0.00 N ATOM 378 CA THR A 24 12.523 -6.923 -7.414 1.00 0.00 C ATOM 379 C THR A 24 12.458 -7.028 -5.881 1.00 0.00 C ATOM 380 O THR A 24 11.814 -7.927 -5.347 1.00 0.00 O ATOM 381 CB THR A 24 13.937 -7.278 -7.905 1.00 0.00 C ATOM 382 OG1 THR A 24 14.036 -7.066 -9.298 1.00 0.00 O ATOM 383 CG2 THR A 24 14.297 -8.739 -7.651 1.00 0.00 C ATOM 0 H THR A 24 12.923 -4.964 -8.033 1.00 0.00 H new ATOM 0 HA THR A 24 11.806 -7.636 -7.822 1.00 0.00 H new ATOM 0 HB THR A 24 14.620 -6.636 -7.348 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.341 -6.150 -9.469 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.305 -8.934 -8.017 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.253 -8.944 -6.581 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.590 -9.384 -8.173 1.00 0.00 H new ATOM 391 N LEU A 25 13.102 -6.098 -5.162 1.00 0.00 N ATOM 392 CA LEU A 25 13.256 -6.110 -3.692 1.00 0.00 C ATOM 393 C LEU A 25 12.036 -5.512 -2.974 1.00 0.00 C ATOM 394 O LEU A 25 11.761 -5.823 -1.816 1.00 0.00 O ATOM 395 CB LEU A 25 14.562 -5.367 -3.317 1.00 0.00 C ATOM 396 CG LEU A 25 15.826 -5.905 -4.022 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.020 -5.049 -3.621 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.129 -7.357 -3.664 1.00 0.00 C ATOM 0 H LEU A 25 13.546 -5.289 -5.597 1.00 0.00 H new ATOM 0 HA LEU A 25 13.321 -7.145 -3.356 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.447 -4.311 -3.560 1.00 0.00 H new ATOM 0 HB3 LEU A 25 14.706 -5.433 -2.239 1.00 0.00 H new ATOM 0 HG LEU A 25 15.642 -5.859 -5.095 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.917 -5.422 -4.115 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.844 -4.016 -3.921 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.154 -5.095 -2.540 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.028 -7.681 -4.189 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.286 -7.441 -2.589 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.290 -7.987 -3.959 1.00 0.00 H new ATOM 410 N GLY A 26 11.297 -4.646 -3.671 1.00 0.00 N ATOM 411 CA GLY A 26 10.034 -4.039 -3.252 1.00 0.00 C ATOM 412 C GLY A 26 8.786 -4.691 -3.850 1.00 0.00 C ATOM 413 O GLY A 26 7.707 -4.133 -3.692 1.00 0.00 O ATOM 0 H GLY A 26 11.582 -4.332 -4.598 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.967 -4.085 -2.165 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.044 -2.984 -3.526 1.00 0.00 H new ATOM 417 N ALA A 27 8.898 -5.842 -4.523 1.00 0.00 N ATOM 418 CA ALA A 27 7.763 -6.541 -5.148 1.00 0.00 C ATOM 419 C ALA A 27 6.568 -6.724 -4.182 1.00 0.00 C ATOM 420 O ALA A 27 6.663 -7.446 -3.187 1.00 0.00 O ATOM 421 CB ALA A 27 8.252 -7.900 -5.672 1.00 0.00 C ATOM 0 H ALA A 27 9.789 -6.322 -4.652 1.00 0.00 H new ATOM 0 HA ALA A 27 7.395 -5.928 -5.970 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.422 -8.430 -6.138 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.041 -7.744 -6.407 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.640 -8.491 -4.843 1.00 0.00 H new ATOM 427 N GLY A 28 5.451 -6.038 -4.454 1.00 0.00 N ATOM 428 CA GLY A 28 4.224 -6.057 -3.637 1.00 0.00 C ATOM 429 C GLY A 28 4.241 -5.097 -2.437 1.00 0.00 C ATOM 430 O GLY A 28 3.181 -4.671 -1.972 1.00 0.00 O ATOM 0 H GLY A 28 5.370 -5.435 -5.273 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.375 -5.807 -4.274 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.061 -7.071 -3.272 1.00 0.00 H new ATOM 434 N LYS A 29 5.433 -4.690 -1.978 1.00 0.00 N ATOM 435 CA LYS A 29 5.636 -3.615 -0.990 1.00 0.00 C ATOM 436 C LYS A 29 5.426 -2.243 -1.620 1.00 0.00 C ATOM 437 O LYS A 29 4.853 -1.363 -0.988 1.00 0.00 O ATOM 438 CB LYS A 29 7.055 -3.713 -0.395 1.00 0.00 C ATOM 439 CG LYS A 29 7.220 -4.906 0.560 1.00 0.00 C ATOM 440 CD LYS A 29 8.583 -5.609 0.453 1.00 0.00 C ATOM 441 CE LYS A 29 9.733 -4.787 1.057 1.00 0.00 C ATOM 442 NZ LYS A 29 11.022 -5.547 0.990 1.00 0.00 N ATOM 0 H LYS A 29 6.308 -5.110 -2.291 1.00 0.00 H new ATOM 0 HA LYS A 29 4.901 -3.737 -0.195 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.779 -3.800 -1.206 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.284 -2.791 0.140 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.081 -4.560 1.584 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.432 -5.631 0.358 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.529 -6.573 0.958 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.800 -5.811 -0.596 1.00 0.00 H new ATOM 0 HE2 LYS A 29 9.833 -3.844 0.520 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.504 -4.540 2.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.759 -5.027 1.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.894 -6.485 1.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.309 -5.657 -0.004 1.00 0.00 H new ATOM 456 N ILE A 30 5.882 -2.057 -2.861 1.00 0.00 N ATOM 457 CA ILE A 30 5.828 -0.791 -3.605 1.00 0.00 C ATOM 458 C ILE A 30 5.581 -0.996 -5.109 1.00 0.00 C ATOM 459 O ILE A 30 5.593 -2.117 -5.612 1.00 0.00 O ATOM 460 CB ILE A 30 7.125 0.037 -3.360 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.472 -0.611 -3.745 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.278 0.410 -1.879 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.657 -1.014 -5.207 1.00 0.00 C ATOM 0 H ILE A 30 6.315 -2.809 -3.397 1.00 0.00 H new ATOM 0 HA ILE A 30 4.973 -0.232 -3.226 1.00 0.00 H new ATOM 0 HB ILE A 30 6.958 0.883 -4.027 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.269 0.084 -3.482 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.608 -1.500 -3.129 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.192 0.987 -1.742 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.422 1.006 -1.564 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.328 -0.498 -1.278 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.644 -1.456 -5.340 1.00 0.00 H new ATOM 0 HD12 ILE A 30 7.894 -1.741 -5.483 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.565 -0.133 -5.842 1.00 0.00 H new ATOM 475 N ALA A 31 5.367 0.112 -5.826 1.00 0.00 N ATOM 476 CA ALA A 31 5.354 0.174 -7.294 1.00 0.00 C ATOM 477 C ALA A 31 6.308 1.295 -7.750 1.00 0.00 C ATOM 478 O ALA A 31 6.455 2.302 -7.055 1.00 0.00 O ATOM 479 CB ALA A 31 3.923 0.303 -7.828 1.00 0.00 C ATOM 0 H ALA A 31 5.193 1.017 -5.390 1.00 0.00 H new ATOM 0 HA ALA A 31 5.724 -0.757 -7.723 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.944 0.347 -8.917 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.337 -0.560 -7.510 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.469 1.214 -7.437 1.00 0.00 H new ATOM 485 N VAL A 32 7.008 1.122 -8.876 1.00 0.00 N ATOM 486 CA VAL A 32 8.103 1.999 -9.299 1.00 0.00 C ATOM 487 C VAL A 32 8.121 2.340 -10.784 1.00 0.00 C ATOM 488 O VAL A 32 7.691 1.561 -11.635 1.00 0.00 O ATOM 489 CB VAL A 32 9.456 1.383 -8.919 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.833 1.897 -7.533 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.537 -0.147 -8.975 1.00 0.00 C ATOM 0 H VAL A 32 6.827 0.358 -9.527 1.00 0.00 H new ATOM 0 HA VAL A 32 7.926 2.936 -8.770 1.00 0.00 H new ATOM 0 HB VAL A 32 10.167 1.700 -9.682 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.793 1.474 -7.237 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.907 2.984 -7.556 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.069 1.600 -6.815 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.538 -0.469 -8.687 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.806 -0.575 -8.289 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.325 -0.486 -9.989 1.00 0.00 H new ATOM 501 N THR A 33 8.695 3.511 -11.068 1.00 0.00 N ATOM 502 CA THR A 33 8.868 4.090 -12.409 1.00 0.00 C ATOM 503 C THR A 33 10.178 4.887 -12.441 1.00 0.00 C ATOM 504 O THR A 33 10.619 5.384 -11.403 1.00 0.00 O ATOM 505 CB THR A 33 7.679 5.026 -12.723 1.00 0.00 C ATOM 506 OG1 THR A 33 6.431 4.441 -12.386 1.00 0.00 O ATOM 507 CG2 THR A 33 7.572 5.429 -14.193 1.00 0.00 C ATOM 0 H THR A 33 9.071 4.113 -10.336 1.00 0.00 H new ATOM 0 HA THR A 33 8.904 3.296 -13.155 1.00 0.00 H new ATOM 0 HB THR A 33 7.889 5.906 -12.115 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.867 5.107 -11.939 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.712 6.085 -14.329 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.479 5.953 -14.494 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.448 4.537 -14.807 1.00 0.00 H new ATOM 515 N SER A 34 10.814 5.039 -13.599 1.00 0.00 N ATOM 516 CA SER A 34 11.946 5.956 -13.791 1.00 0.00 C ATOM 517 C SER A 34 11.703 6.917 -14.961 1.00 0.00 C ATOM 518 O SER A 34 10.988 6.601 -15.915 1.00 0.00 O ATOM 519 CB SER A 34 13.270 5.204 -13.932 1.00 0.00 C ATOM 520 OG SER A 34 13.328 4.450 -15.121 1.00 0.00 O ATOM 0 H SER A 34 10.559 4.526 -14.443 1.00 0.00 H new ATOM 0 HA SER A 34 12.024 6.564 -12.890 1.00 0.00 H new ATOM 0 HB2 SER A 34 14.095 5.917 -13.915 1.00 0.00 H new ATOM 0 HB3 SER A 34 13.403 4.542 -13.077 1.00 0.00 H new ATOM 0 HG SER A 34 12.982 3.548 -14.954 1.00 0.00 H new ATOM 526 N CYS A 35 12.270 8.122 -14.863 1.00 0.00 N ATOM 527 CA CYS A 35 12.217 9.155 -15.895 1.00 0.00 C ATOM 528 C CYS A 35 13.446 10.066 -15.807 1.00 0.00 C ATOM 529 O CYS A 35 14.372 9.814 -15.034 1.00 0.00 O ATOM 530 CB CYS A 35 10.888 9.921 -15.780 1.00 0.00 C ATOM 531 SG CYS A 35 10.851 11.072 -14.387 1.00 0.00 S ATOM 0 H CYS A 35 12.794 8.412 -14.037 1.00 0.00 H new ATOM 0 HA CYS A 35 12.247 8.700 -16.885 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.712 10.472 -16.704 1.00 0.00 H new ATOM 0 HB3 CYS A 35 10.072 9.206 -15.675 1.00 0.00 H new ATOM 0 HG CYS A 35 10.556 10.426 -13.298 1.00 0.00 H new ATOM 537 N GLY A 36 13.506 11.127 -16.601 1.00 0.00 N ATOM 538 CA GLY A 36 14.519 12.168 -16.442 1.00 0.00 C ATOM 539 C GLY A 36 14.039 13.540 -16.870 1.00 0.00 C ATOM 540 O GLY A 36 13.022 13.659 -17.542 1.00 0.00 O ATOM 0 H GLY A 36 12.858 11.292 -17.371 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.828 12.208 -15.398 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.400 11.900 -17.025 1.00 0.00 H new ATOM 544 N LEU A 37 14.776 14.594 -16.521 1.00 0.00 N ATOM 545 CA LEU A 37 14.504 15.937 -17.074 1.00 0.00 C ATOM 546 C LEU A 37 14.764 16.015 -18.594 1.00 0.00 C ATOM 547 O LEU A 37 14.346 16.955 -19.267 1.00 0.00 O ATOM 548 CB LEU A 37 15.202 17.047 -16.280 1.00 0.00 C ATOM 549 CG LEU A 37 16.716 16.856 -16.073 1.00 0.00 C ATOM 550 CD1 LEU A 37 17.441 18.200 -16.043 1.00 0.00 C ATOM 551 CD2 LEU A 37 16.971 16.163 -14.735 1.00 0.00 C ATOM 0 H LEU A 37 15.558 14.555 -15.867 1.00 0.00 H new ATOM 0 HA LEU A 37 13.435 16.115 -16.952 1.00 0.00 H new ATOM 0 HB2 LEU A 37 15.039 17.995 -16.792 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.726 17.127 -15.303 1.00 0.00 H new ATOM 0 HG LEU A 37 17.089 16.255 -16.903 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.508 18.034 -15.896 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.282 18.721 -16.987 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.051 18.805 -15.225 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.043 16.030 -14.593 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.571 16.775 -13.926 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.481 15.189 -14.730 1.00 0.00 H new ATOM 563 N GLU A 38 15.413 14.977 -19.117 1.00 0.00 N ATOM 564 CA GLU A 38 15.613 14.665 -20.533 1.00 0.00 C ATOM 565 C GLU A 38 15.455 13.143 -20.717 1.00 0.00 C ATOM 566 O GLU A 38 15.513 12.380 -19.747 1.00 0.00 O ATOM 567 CB GLU A 38 17.002 15.120 -21.036 1.00 0.00 C ATOM 568 CG GLU A 38 17.394 16.562 -20.686 1.00 0.00 C ATOM 569 CD GLU A 38 18.813 16.874 -21.201 1.00 0.00 C ATOM 570 OE1 GLU A 38 18.958 17.326 -22.364 1.00 0.00 O ATOM 571 OE2 GLU A 38 19.796 16.671 -20.446 1.00 0.00 O ATOM 0 H GLU A 38 15.847 14.277 -18.516 1.00 0.00 H new ATOM 0 HA GLU A 38 14.871 15.205 -21.121 1.00 0.00 H new ATOM 0 HB2 GLU A 38 17.755 14.448 -20.625 1.00 0.00 H new ATOM 0 HB3 GLU A 38 17.031 15.007 -22.120 1.00 0.00 H new ATOM 0 HG2 GLU A 38 16.679 17.257 -21.127 1.00 0.00 H new ATOM 0 HG3 GLU A 38 17.353 16.705 -19.606 1.00 0.00 H new ATOM 578 N SER A 39 15.287 12.678 -21.955 1.00 0.00 N ATOM 579 CA SER A 39 15.204 11.250 -22.298 1.00 0.00 C ATOM 580 C SER A 39 16.106 10.905 -23.494 1.00 0.00 C ATOM 581 O SER A 39 16.211 11.679 -24.448 1.00 0.00 O ATOM 582 CB SER A 39 13.743 10.847 -22.561 1.00 0.00 C ATOM 583 OG SER A 39 13.164 11.647 -23.584 1.00 0.00 O ATOM 0 H SER A 39 15.203 13.291 -22.766 1.00 0.00 H new ATOM 0 HA SER A 39 15.568 10.674 -21.447 1.00 0.00 H new ATOM 0 HB2 SER A 39 13.699 9.797 -22.849 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.164 10.951 -21.643 1.00 0.00 H new ATOM 0 HG SER A 39 12.236 11.368 -23.732 1.00 0.00 H new ATOM 589 N SER A 40 16.762 9.737 -23.442 1.00 0.00 N ATOM 590 CA SER A 40 17.564 9.204 -24.555 1.00 0.00 C ATOM 591 C SER A 40 17.253 7.718 -24.817 1.00 0.00 C ATOM 592 O SER A 40 16.261 7.417 -25.485 1.00 0.00 O ATOM 593 CB SER A 40 19.042 9.543 -24.331 1.00 0.00 C ATOM 594 OG SER A 40 19.796 9.153 -25.465 1.00 0.00 O ATOM 0 H SER A 40 16.752 9.131 -22.622 1.00 0.00 H new ATOM 0 HA SER A 40 17.286 9.691 -25.490 1.00 0.00 H new ATOM 0 HB2 SER A 40 19.158 10.612 -24.155 1.00 0.00 H new ATOM 0 HB3 SER A 40 19.412 9.032 -23.442 1.00 0.00 H new ATOM 0 HG SER A 40 19.256 9.272 -26.274 1.00 0.00 H new ATOM 600 N ARG A 41 18.051 6.787 -24.269 1.00 0.00 N ATOM 601 CA ARG A 41 17.792 5.328 -24.266 1.00 0.00 C ATOM 602 C ARG A 41 18.402 4.675 -23.022 1.00 0.00 C ATOM 603 O ARG A 41 19.375 5.214 -22.499 1.00 0.00 O ATOM 604 CB ARG A 41 18.293 4.687 -25.584 1.00 0.00 C ATOM 605 CG ARG A 41 19.810 4.438 -25.732 1.00 0.00 C ATOM 606 CD ARG A 41 20.729 5.667 -25.666 1.00 0.00 C ATOM 607 NE ARG A 41 20.412 6.668 -26.702 1.00 0.00 N ATOM 608 CZ ARG A 41 20.739 6.672 -27.982 1.00 0.00 C ATOM 609 NH1 ARG A 41 21.398 5.699 -28.544 1.00 0.00 N ATOM 610 NH2 ARG A 41 20.401 7.682 -28.729 1.00 0.00 N ATOM 0 H ARG A 41 18.923 7.031 -23.800 1.00 0.00 H new ATOM 0 HA ARG A 41 16.717 5.155 -24.217 1.00 0.00 H new ATOM 0 HB2 ARG A 41 17.783 3.731 -25.707 1.00 0.00 H new ATOM 0 HB3 ARG A 41 17.976 5.326 -26.409 1.00 0.00 H new ATOM 0 HG2 ARG A 41 20.117 3.743 -24.950 1.00 0.00 H new ATOM 0 HG3 ARG A 41 19.980 3.939 -26.686 1.00 0.00 H new ATOM 0 HD2 ARG A 41 20.643 6.128 -24.682 1.00 0.00 H new ATOM 0 HD3 ARG A 41 21.765 5.348 -25.779 1.00 0.00 H new ATOM 0 HE ARG A 41 19.864 7.468 -26.386 1.00 0.00 H new ATOM 0 HH11 ARG A 41 21.683 4.890 -27.992 1.00 0.00 H new ATOM 0 HH12 ARG A 41 21.629 5.746 -29.537 1.00 0.00 H new ATOM 0 HH21 ARG A 41 19.886 8.465 -28.326 1.00 0.00 H new ATOM 0 HH22 ARG A 41 20.651 7.691 -29.718 1.00 0.00 H new ATOM 624 N VAL A 42 17.906 3.515 -22.565 1.00 0.00 N ATOM 625 CA VAL A 42 18.599 2.756 -21.491 1.00 0.00 C ATOM 626 C VAL A 42 20.008 2.411 -21.967 1.00 0.00 C ATOM 627 O VAL A 42 20.173 1.919 -23.085 1.00 0.00 O ATOM 628 CB VAL A 42 17.902 1.454 -21.037 1.00 0.00 C ATOM 629 CG1 VAL A 42 18.529 0.940 -19.732 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.424 1.660 -20.757 1.00 0.00 C ATOM 0 H VAL A 42 17.048 3.083 -22.907 1.00 0.00 H new ATOM 0 HA VAL A 42 18.592 3.412 -20.621 1.00 0.00 H new ATOM 0 HB VAL A 42 18.028 0.743 -21.854 1.00 0.00 H new ATOM 0 HG11 VAL A 42 18.028 0.022 -19.424 1.00 0.00 H new ATOM 0 HG12 VAL A 42 19.588 0.739 -19.892 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.416 1.694 -18.953 1.00 0.00 H new ATOM 0 HG21 VAL A 42 15.979 0.717 -20.441 1.00 0.00 H new ATOM 0 HG22 VAL A 42 16.303 2.401 -19.967 1.00 0.00 H new ATOM 0 HG23 VAL A 42 15.928 2.011 -21.662 1.00 0.00 H new ATOM 640 N HIS A 43 21.022 2.648 -21.131 1.00 0.00 N ATOM 641 CA HIS A 43 22.396 2.292 -21.488 1.00 0.00 C ATOM 642 C HIS A 43 22.486 0.769 -21.599 1.00 0.00 C ATOM 643 O HIS A 43 22.127 0.079 -20.645 1.00 0.00 O ATOM 644 CB HIS A 43 23.377 2.865 -20.459 1.00 0.00 C ATOM 645 CG HIS A 43 24.765 2.912 -21.020 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.621 1.822 -21.174 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.352 4.025 -21.535 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.733 2.323 -21.746 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.587 3.636 -21.990 1.00 0.00 N ATOM 0 H HIS A 43 20.919 3.080 -20.213 1.00 0.00 H new ATOM 0 HA HIS A 43 22.670 2.724 -22.450 1.00 0.00 H new ATOM 0 HB2 HIS A 43 23.063 3.867 -20.168 1.00 0.00 H new ATOM 0 HB3 HIS A 43 23.364 2.253 -19.557 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.930 5.018 -21.578 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.618 1.749 -21.976 1.00 0.00 H new ATOM 0 HE2 HIS A 43 27.276 4.241 -22.437 1.00 0.00 H new ATOM 657 N PRO A 44 22.945 0.197 -22.724 1.00 0.00 N ATOM 658 CA PRO A 44 22.814 -1.239 -22.930 1.00 0.00 C ATOM 659 C PRO A 44 23.752 -2.047 -22.010 1.00 0.00 C ATOM 660 O PRO A 44 23.471 -3.206 -21.703 1.00 0.00 O ATOM 661 CB PRO A 44 23.111 -1.441 -24.419 1.00 0.00 C ATOM 662 CG PRO A 44 24.076 -0.303 -24.750 1.00 0.00 C ATOM 663 CD PRO A 44 23.564 0.842 -23.879 1.00 0.00 C ATOM 0 HA PRO A 44 21.821 -1.606 -22.669 1.00 0.00 H new ATOM 0 HB2 PRO A 44 23.560 -2.416 -24.610 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.204 -1.385 -25.020 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.107 -0.564 -24.509 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.051 -0.047 -25.809 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.378 1.499 -23.574 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.844 1.457 -24.420 1.00 0.00 H new ATOM 671 N THR A 45 24.818 -1.427 -21.478 1.00 0.00 N ATOM 672 CA THR A 45 25.677 -2.041 -20.445 1.00 0.00 C ATOM 673 C THR A 45 24.975 -2.110 -19.086 1.00 0.00 C ATOM 674 O THR A 45 25.228 -3.035 -18.318 1.00 0.00 O ATOM 675 CB THR A 45 27.027 -1.310 -20.342 1.00 0.00 C ATOM 676 OG1 THR A 45 27.717 -1.401 -21.578 1.00 0.00 O ATOM 677 CG2 THR A 45 27.955 -1.915 -19.290 1.00 0.00 C ATOM 0 H THR A 45 25.110 -0.488 -21.749 1.00 0.00 H new ATOM 0 HA THR A 45 25.874 -3.067 -20.755 1.00 0.00 H new ATOM 0 HB THR A 45 26.789 -0.282 -20.068 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.575 -0.933 -21.509 1.00 0.00 H new ATOM 0 HG21 THR A 45 28.890 -1.356 -19.265 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.477 -1.866 -18.312 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.161 -2.955 -19.541 1.00 0.00 H new ATOM 685 N ALA A 46 24.015 -1.224 -18.792 1.00 0.00 N ATOM 686 CA ALA A 46 23.224 -1.307 -17.563 1.00 0.00 C ATOM 687 C ALA A 46 22.400 -2.601 -17.496 1.00 0.00 C ATOM 688 O ALA A 46 22.349 -3.226 -16.442 1.00 0.00 O ATOM 689 CB ALA A 46 22.324 -0.074 -17.459 1.00 0.00 C ATOM 0 H ALA A 46 23.768 -0.438 -19.394 1.00 0.00 H new ATOM 0 HA ALA A 46 23.906 -1.330 -16.713 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.733 -0.131 -16.545 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.940 0.825 -17.437 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.657 -0.036 -18.321 1.00 0.00 H new ATOM 695 N ILE A 47 21.839 -3.062 -18.622 1.00 0.00 N ATOM 696 CA ILE A 47 21.161 -4.370 -18.712 1.00 0.00 C ATOM 697 C ILE A 47 22.138 -5.473 -18.276 1.00 0.00 C ATOM 698 O ILE A 47 21.811 -6.275 -17.406 1.00 0.00 O ATOM 699 CB ILE A 47 20.605 -4.632 -20.138 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.332 -3.825 -20.484 1.00 0.00 C ATOM 701 CG2 ILE A 47 20.230 -6.112 -20.334 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.476 -2.300 -20.493 1.00 0.00 C ATOM 0 H ILE A 47 21.840 -2.541 -19.499 1.00 0.00 H new ATOM 0 HA ILE A 47 20.301 -4.370 -18.043 1.00 0.00 H new ATOM 0 HB ILE A 47 21.420 -4.320 -20.791 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.983 -4.141 -21.467 1.00 0.00 H new ATOM 0 HG13 ILE A 47 18.554 -4.091 -19.769 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.845 -6.259 -21.343 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.114 -6.734 -20.189 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.466 -6.393 -19.609 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.519 -1.846 -20.749 1.00 0.00 H new ATOM 0 HD12 ILE A 47 19.788 -1.958 -19.506 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.224 -2.010 -21.231 1.00 0.00 H new ATOM 714 N ALA A 48 23.370 -5.451 -18.793 1.00 0.00 N ATOM 715 CA ALA A 48 24.375 -6.470 -18.468 1.00 0.00 C ATOM 716 C ALA A 48 24.788 -6.434 -16.985 1.00 0.00 C ATOM 717 O ALA A 48 24.954 -7.471 -16.345 1.00 0.00 O ATOM 718 CB ALA A 48 25.585 -6.280 -19.386 1.00 0.00 C ATOM 0 H ALA A 48 23.697 -4.735 -19.442 1.00 0.00 H new ATOM 0 HA ALA A 48 23.938 -7.455 -18.634 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.339 -7.032 -19.154 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.274 -6.387 -20.425 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.005 -5.286 -19.233 1.00 0.00 H new ATOM 724 N MET A 49 24.902 -5.231 -16.418 1.00 0.00 N ATOM 725 CA MET A 49 25.261 -5.003 -15.016 1.00 0.00 C ATOM 726 C MET A 49 24.130 -5.361 -14.051 1.00 0.00 C ATOM 727 O MET A 49 24.417 -5.757 -12.926 1.00 0.00 O ATOM 728 CB MET A 49 25.717 -3.548 -14.847 1.00 0.00 C ATOM 729 CG MET A 49 26.961 -3.222 -15.682 1.00 0.00 C ATOM 730 SD MET A 49 28.555 -3.540 -14.876 1.00 0.00 S ATOM 731 CE MET A 49 28.882 -5.266 -15.298 1.00 0.00 C ATOM 0 H MET A 49 24.743 -4.366 -16.934 1.00 0.00 H new ATOM 0 HA MET A 49 26.083 -5.671 -14.758 1.00 0.00 H new ATOM 0 HB2 MET A 49 24.905 -2.880 -15.135 1.00 0.00 H new ATOM 0 HB3 MET A 49 25.929 -3.357 -13.795 1.00 0.00 H new ATOM 0 HG2 MET A 49 26.919 -3.801 -16.604 1.00 0.00 H new ATOM 0 HG3 MET A 49 26.921 -2.170 -15.964 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.891 -5.533 -14.983 1.00 0.00 H new ATOM 0 HE2 MET A 49 28.162 -5.908 -14.790 1.00 0.00 H new ATOM 0 HE3 MET A 49 28.790 -5.401 -16.376 1.00 0.00 H new ATOM 741 N MET A 50 22.864 -5.275 -14.468 1.00 0.00 N ATOM 742 CA MET A 50 21.730 -5.804 -13.696 1.00 0.00 C ATOM 743 C MET A 50 21.619 -7.331 -13.843 1.00 0.00 C ATOM 744 O MET A 50 21.276 -8.015 -12.878 1.00 0.00 O ATOM 745 CB MET A 50 20.432 -5.097 -14.110 1.00 0.00 C ATOM 746 CG MET A 50 20.429 -3.598 -13.768 1.00 0.00 C ATOM 747 SD MET A 50 20.754 -3.143 -12.039 1.00 0.00 S ATOM 748 CE MET A 50 19.476 -4.118 -11.213 1.00 0.00 C ATOM 0 H MET A 50 22.594 -4.838 -15.349 1.00 0.00 H new ATOM 0 HA MET A 50 21.904 -5.599 -12.640 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.284 -5.220 -15.183 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.589 -5.579 -13.615 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.175 -3.107 -14.393 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.459 -3.189 -14.049 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.014 -3.521 -10.427 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.717 -4.412 -11.938 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.925 -5.010 -10.775 1.00 0.00 H new ATOM 758 N GLU A 51 22.008 -7.902 -14.988 1.00 0.00 N ATOM 759 CA GLU A 51 22.034 -9.361 -15.160 1.00 0.00 C ATOM 760 C GLU A 51 23.102 -10.048 -14.287 1.00 0.00 C ATOM 761 O GLU A 51 22.906 -11.201 -13.904 1.00 0.00 O ATOM 762 CB GLU A 51 22.216 -9.751 -16.637 1.00 0.00 C ATOM 763 CG GLU A 51 20.934 -9.586 -17.464 1.00 0.00 C ATOM 764 CD GLU A 51 21.144 -10.119 -18.894 1.00 0.00 C ATOM 765 OE1 GLU A 51 21.917 -9.514 -19.677 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.543 -11.164 -19.244 1.00 0.00 O ATOM 0 H GLU A 51 22.309 -7.378 -15.810 1.00 0.00 H new ATOM 0 HA GLU A 51 21.062 -9.721 -14.821 1.00 0.00 H new ATOM 0 HB2 GLU A 51 23.005 -9.139 -17.074 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.548 -10.788 -16.695 1.00 0.00 H new ATOM 0 HG2 GLU A 51 20.114 -10.122 -16.986 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.649 -8.534 -17.499 1.00 0.00 H new ATOM 773 N GLU A 52 24.180 -9.356 -13.881 1.00 0.00 N ATOM 774 CA GLU A 52 25.153 -9.902 -12.914 1.00 0.00 C ATOM 775 C GLU A 52 24.506 -10.265 -11.562 1.00 0.00 C ATOM 776 O GLU A 52 24.940 -11.207 -10.895 1.00 0.00 O ATOM 777 CB GLU A 52 26.270 -8.897 -12.604 1.00 0.00 C ATOM 778 CG GLU A 52 27.200 -8.543 -13.769 1.00 0.00 C ATOM 779 CD GLU A 52 28.547 -8.014 -13.234 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.539 -7.143 -12.326 1.00 0.00 O ATOM 781 OE2 GLU A 52 29.615 -8.477 -13.694 1.00 0.00 O ATOM 0 H GLU A 52 24.402 -8.415 -14.207 1.00 0.00 H new ATOM 0 HA GLU A 52 25.550 -10.796 -13.394 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.813 -7.978 -12.238 1.00 0.00 H new ATOM 0 HB3 GLU A 52 26.876 -9.297 -11.791 1.00 0.00 H new ATOM 0 HG2 GLU A 52 27.367 -9.423 -14.390 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.731 -7.790 -14.402 1.00 0.00 H new ATOM 788 N VAL A 53 23.458 -9.527 -11.169 1.00 0.00 N ATOM 789 CA VAL A 53 22.672 -9.737 -9.936 1.00 0.00 C ATOM 790 C VAL A 53 21.327 -10.441 -10.201 1.00 0.00 C ATOM 791 O VAL A 53 20.481 -10.534 -9.311 1.00 0.00 O ATOM 792 CB VAL A 53 22.524 -8.426 -9.127 1.00 0.00 C ATOM 793 CG1 VAL A 53 23.890 -7.913 -8.656 1.00 0.00 C ATOM 794 CG2 VAL A 53 21.856 -7.299 -9.922 1.00 0.00 C ATOM 0 H VAL A 53 23.119 -8.737 -11.718 1.00 0.00 H new ATOM 0 HA VAL A 53 23.237 -10.427 -9.309 1.00 0.00 H new ATOM 0 HB VAL A 53 21.889 -8.683 -8.280 1.00 0.00 H new ATOM 0 HG11 VAL A 53 23.757 -6.991 -8.090 1.00 0.00 H new ATOM 0 HG12 VAL A 53 24.361 -8.663 -8.021 1.00 0.00 H new ATOM 0 HG13 VAL A 53 24.524 -7.719 -9.521 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.782 -6.408 -9.298 1.00 0.00 H new ATOM 0 HG22 VAL A 53 22.452 -7.075 -10.806 1.00 0.00 H new ATOM 0 HG23 VAL A 53 20.858 -7.612 -10.228 1.00 0.00 H new ATOM 804 N GLY A 54 21.131 -10.960 -11.420 1.00 0.00 N ATOM 805 CA GLY A 54 19.942 -11.727 -11.825 1.00 0.00 C ATOM 806 C GLY A 54 18.657 -10.903 -11.980 1.00 0.00 C ATOM 807 O GLY A 54 17.561 -11.455 -11.879 1.00 0.00 O ATOM 0 H GLY A 54 21.812 -10.856 -12.173 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.154 -12.222 -12.773 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.766 -12.511 -11.088 1.00 0.00 H new ATOM 811 N ILE A 55 18.777 -9.590 -12.209 1.00 0.00 N ATOM 812 CA ILE A 55 17.663 -8.644 -12.385 1.00 0.00 C ATOM 813 C ILE A 55 17.607 -8.175 -13.844 1.00 0.00 C ATOM 814 O ILE A 55 18.633 -7.922 -14.472 1.00 0.00 O ATOM 815 CB ILE A 55 17.796 -7.474 -11.387 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.648 -7.997 -9.938 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.764 -6.363 -11.659 1.00 0.00 C ATOM 818 CD1 ILE A 55 17.765 -6.930 -8.839 1.00 0.00 C ATOM 0 H ILE A 55 19.688 -9.137 -12.280 1.00 0.00 H new ATOM 0 HA ILE A 55 16.716 -9.138 -12.167 1.00 0.00 H new ATOM 0 HB ILE A 55 18.786 -7.038 -11.519 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.679 -8.487 -9.844 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.409 -8.758 -9.765 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.894 -5.560 -10.933 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.909 -5.970 -12.665 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.757 -6.772 -11.571 1.00 0.00 H new ATOM 0 HD11 ILE A 55 17.647 -7.399 -7.862 1.00 0.00 H new ATOM 0 HD12 ILE A 55 18.744 -6.454 -8.897 1.00 0.00 H new ATOM 0 HD13 ILE A 55 16.987 -6.179 -8.977 1.00 0.00 H new ATOM 830 N ASP A 56 16.398 -8.024 -14.381 1.00 0.00 N ATOM 831 CA ASP A 56 16.151 -7.561 -15.747 1.00 0.00 C ATOM 832 C ASP A 56 15.674 -6.100 -15.791 1.00 0.00 C ATOM 833 O ASP A 56 14.816 -5.695 -15.010 1.00 0.00 O ATOM 834 CB ASP A 56 15.149 -8.504 -16.436 1.00 0.00 C ATOM 835 CG ASP A 56 13.690 -8.277 -15.987 1.00 0.00 C ATOM 836 OD1 ASP A 56 13.370 -8.476 -14.789 1.00 0.00 O ATOM 837 OD2 ASP A 56 12.853 -7.892 -16.838 1.00 0.00 O ATOM 0 H ASP A 56 15.541 -8.225 -13.866 1.00 0.00 H new ATOM 0 HA ASP A 56 17.095 -7.586 -16.291 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.215 -8.367 -17.515 1.00 0.00 H new ATOM 0 HB3 ASP A 56 15.430 -9.536 -16.227 1.00 0.00 H new ATOM 842 N ILE A 57 16.215 -5.307 -16.723 1.00 0.00 N ATOM 843 CA ILE A 57 15.712 -3.956 -17.059 1.00 0.00 C ATOM 844 C ILE A 57 15.529 -3.778 -18.584 1.00 0.00 C ATOM 845 O ILE A 57 15.320 -2.671 -19.069 1.00 0.00 O ATOM 846 CB ILE A 57 16.528 -2.816 -16.397 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.988 -2.753 -16.888 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.477 -2.906 -14.858 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.654 -1.396 -16.624 1.00 0.00 C ATOM 0 H ILE A 57 17.026 -5.583 -17.277 1.00 0.00 H new ATOM 0 HA ILE A 57 14.719 -3.873 -16.618 1.00 0.00 H new ATOM 0 HB ILE A 57 16.050 -1.887 -16.708 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.565 -3.536 -16.396 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.015 -2.962 -17.957 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.059 -2.092 -14.426 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.443 -2.829 -14.523 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.893 -3.860 -14.535 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.680 -1.416 -16.993 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.099 -0.612 -17.139 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.657 -1.195 -15.553 1.00 0.00 H new ATOM 861 N SER A 58 15.607 -4.869 -19.353 1.00 0.00 N ATOM 862 CA SER A 58 15.641 -4.873 -20.830 1.00 0.00 C ATOM 863 C SER A 58 14.337 -4.375 -21.472 1.00 0.00 C ATOM 864 O SER A 58 14.351 -3.839 -22.579 1.00 0.00 O ATOM 865 CB SER A 58 15.932 -6.295 -21.329 1.00 0.00 C ATOM 866 OG SER A 58 16.988 -6.874 -20.574 1.00 0.00 O ATOM 0 H SER A 58 15.650 -5.808 -18.957 1.00 0.00 H new ATOM 0 HA SER A 58 16.429 -4.180 -21.127 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.035 -6.909 -21.244 1.00 0.00 H new ATOM 0 HB3 SER A 58 16.202 -6.270 -22.385 1.00 0.00 H new ATOM 0 HG SER A 58 17.164 -7.781 -20.900 1.00 0.00 H new ATOM 872 N GLY A 59 13.210 -4.527 -20.762 1.00 0.00 N ATOM 873 CA GLY A 59 11.889 -4.030 -21.163 1.00 0.00 C ATOM 874 C GLY A 59 11.643 -2.544 -20.861 1.00 0.00 C ATOM 875 O GLY A 59 10.559 -2.040 -21.166 1.00 0.00 O ATOM 0 H GLY A 59 13.194 -5.014 -19.866 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.763 -4.195 -22.233 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.125 -4.621 -20.658 1.00 0.00 H new ATOM 879 N GLN A 60 12.611 -1.832 -20.260 1.00 0.00 N ATOM 880 CA GLN A 60 12.521 -0.394 -19.991 1.00 0.00 C ATOM 881 C GLN A 60 13.062 0.418 -21.181 1.00 0.00 C ATOM 882 O GLN A 60 13.804 -0.080 -22.031 1.00 0.00 O ATOM 883 CB GLN A 60 13.234 -0.057 -18.667 1.00 0.00 C ATOM 884 CG GLN A 60 12.461 -0.557 -17.431 1.00 0.00 C ATOM 885 CD GLN A 60 13.328 -0.775 -16.189 1.00 0.00 C ATOM 886 OE1 GLN A 60 13.280 -1.819 -15.553 1.00 0.00 O ATOM 887 NE2 GLN A 60 14.147 0.170 -15.781 1.00 0.00 N ATOM 0 H GLN A 60 13.487 -2.248 -19.945 1.00 0.00 H new ATOM 0 HA GLN A 60 11.474 -0.113 -19.874 1.00 0.00 H new ATOM 0 HB2 GLN A 60 14.229 -0.501 -18.672 1.00 0.00 H new ATOM 0 HB3 GLN A 60 13.367 1.022 -18.595 1.00 0.00 H new ATOM 0 HG2 GLN A 60 11.679 0.163 -17.191 1.00 0.00 H new ATOM 0 HG3 GLN A 60 11.965 -1.495 -17.682 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.206 1.050 -16.293 1.00 0.00 H new ATOM 0 HE22 GLN A 60 14.723 0.023 -14.952 1.00 0.00 H new ATOM 896 N THR A 61 12.686 1.691 -21.230 1.00 0.00 N ATOM 897 CA THR A 61 13.019 2.702 -22.232 1.00 0.00 C ATOM 898 C THR A 61 13.119 4.019 -21.465 1.00 0.00 C ATOM 899 O THR A 61 12.692 4.117 -20.306 1.00 0.00 O ATOM 900 CB THR A 61 11.951 2.806 -23.343 1.00 0.00 C ATOM 901 OG1 THR A 61 10.656 2.938 -22.792 1.00 0.00 O ATOM 902 CG2 THR A 61 11.946 1.585 -24.265 1.00 0.00 C ATOM 0 H THR A 61 12.085 2.079 -20.503 1.00 0.00 H new ATOM 0 HA THR A 61 13.947 2.443 -22.741 1.00 0.00 H new ATOM 0 HB THR A 61 12.212 3.691 -23.923 1.00 0.00 H new ATOM 0 HG1 THR A 61 9.998 3.004 -23.515 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.177 1.708 -25.028 1.00 0.00 H new ATOM 0 HG22 THR A 61 12.920 1.487 -24.744 1.00 0.00 H new ATOM 0 HG23 THR A 61 11.737 0.689 -23.681 1.00 0.00 H new ATOM 910 N SER A 62 13.729 5.033 -22.067 1.00 0.00 N ATOM 911 CA SER A 62 13.832 6.335 -21.420 1.00 0.00 C ATOM 912 C SER A 62 12.566 7.177 -21.619 1.00 0.00 C ATOM 913 O SER A 62 12.044 7.258 -22.731 1.00 0.00 O ATOM 914 CB SER A 62 15.025 7.079 -21.970 1.00 0.00 C ATOM 915 OG SER A 62 16.215 6.344 -21.763 1.00 0.00 O ATOM 0 H SER A 62 14.156 4.981 -22.992 1.00 0.00 H new ATOM 0 HA SER A 62 13.953 6.165 -20.350 1.00 0.00 H new ATOM 0 HB2 SER A 62 14.886 7.261 -23.036 1.00 0.00 H new ATOM 0 HB3 SER A 62 15.106 8.053 -21.488 1.00 0.00 H new ATOM 0 HG SER A 62 16.431 6.334 -20.807 1.00 0.00 H new ATOM 921 N ASP A 63 12.121 7.866 -20.565 1.00 0.00 N ATOM 922 CA ASP A 63 10.939 8.753 -20.594 1.00 0.00 C ATOM 923 C ASP A 63 11.158 10.098 -19.865 1.00 0.00 C ATOM 924 O ASP A 63 11.898 10.147 -18.880 1.00 0.00 O ATOM 925 CB ASP A 63 9.711 8.037 -20.012 1.00 0.00 C ATOM 926 CG ASP A 63 9.130 6.986 -20.972 1.00 0.00 C ATOM 927 OD1 ASP A 63 8.605 7.380 -22.041 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.137 5.777 -20.637 1.00 0.00 O ATOM 0 H ASP A 63 12.573 7.828 -19.651 1.00 0.00 H new ATOM 0 HA ASP A 63 10.768 8.989 -21.644 1.00 0.00 H new ATOM 0 HB2 ASP A 63 9.987 7.554 -19.074 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.943 8.774 -19.777 1.00 0.00 H new ATOM 933 N PRO A 64 10.517 11.201 -20.312 1.00 0.00 N ATOM 934 CA PRO A 64 10.715 12.534 -19.739 1.00 0.00 C ATOM 935 C PRO A 64 9.773 12.833 -18.559 1.00 0.00 C ATOM 936 O PRO A 64 8.588 12.501 -18.583 1.00 0.00 O ATOM 937 CB PRO A 64 10.484 13.494 -20.910 1.00 0.00 C ATOM 938 CG PRO A 64 9.383 12.793 -21.707 1.00 0.00 C ATOM 939 CD PRO A 64 9.709 11.307 -21.525 1.00 0.00 C ATOM 0 HA PRO A 64 11.711 12.633 -19.307 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.171 14.481 -20.569 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.387 13.633 -21.504 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.392 13.037 -21.325 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.400 13.083 -22.758 1.00 0.00 H new ATOM 0 HD2 PRO A 64 8.796 10.719 -21.435 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.253 10.921 -22.387 1.00 0.00 H new ATOM 947 N ILE A 65 10.275 13.556 -17.556 1.00 0.00 N ATOM 948 CA ILE A 65 9.539 14.012 -16.363 1.00 0.00 C ATOM 949 C ILE A 65 8.308 14.852 -16.733 1.00 0.00 C ATOM 950 O ILE A 65 7.258 14.725 -16.111 1.00 0.00 O ATOM 951 CB ILE A 65 10.526 14.772 -15.437 1.00 0.00 C ATOM 952 CG1 ILE A 65 9.946 14.895 -14.019 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.928 16.163 -15.977 1.00 0.00 C ATOM 954 CD1 ILE A 65 10.840 15.673 -13.048 1.00 0.00 C ATOM 0 H ILE A 65 11.250 13.856 -17.548 1.00 0.00 H new ATOM 0 HA ILE A 65 9.144 13.150 -15.825 1.00 0.00 H new ATOM 0 HB ILE A 65 11.439 14.177 -15.409 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.974 15.386 -14.076 1.00 0.00 H new ATOM 0 HG13 ILE A 65 9.775 13.896 -13.619 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.619 16.638 -15.280 1.00 0.00 H new ATOM 0 HG22 ILE A 65 11.411 16.051 -16.948 1.00 0.00 H new ATOM 0 HG23 ILE A 65 10.038 16.783 -16.084 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.362 15.717 -12.069 1.00 0.00 H new ATOM 0 HD12 ILE A 65 11.804 15.172 -12.960 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.991 16.685 -13.424 1.00 0.00 H new ATOM 966 N GLU A 66 8.412 15.638 -17.811 1.00 0.00 N ATOM 967 CA GLU A 66 7.361 16.548 -18.296 1.00 0.00 C ATOM 968 C GLU A 66 6.028 15.853 -18.648 1.00 0.00 C ATOM 969 O GLU A 66 4.977 16.498 -18.619 1.00 0.00 O ATOM 970 CB GLU A 66 7.877 17.306 -19.530 1.00 0.00 C ATOM 971 CG GLU A 66 9.163 18.107 -19.273 1.00 0.00 C ATOM 972 CD GLU A 66 9.481 19.018 -20.476 1.00 0.00 C ATOM 973 OE1 GLU A 66 10.080 18.536 -21.468 1.00 0.00 O ATOM 974 OE2 GLU A 66 9.134 20.224 -20.436 1.00 0.00 O ATOM 0 H GLU A 66 9.253 15.661 -18.388 1.00 0.00 H new ATOM 0 HA GLU A 66 7.142 17.225 -17.470 1.00 0.00 H new ATOM 0 HB2 GLU A 66 8.059 16.592 -20.333 1.00 0.00 H new ATOM 0 HB3 GLU A 66 7.100 17.986 -19.878 1.00 0.00 H new ATOM 0 HG2 GLU A 66 9.049 18.710 -18.372 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.994 17.425 -19.096 1.00 0.00 H new ATOM 981 N ASN A 67 6.048 14.545 -18.961 1.00 0.00 N ATOM 982 CA ASN A 67 4.837 13.771 -19.288 1.00 0.00 C ATOM 983 C ASN A 67 4.151 13.123 -18.060 1.00 0.00 C ATOM 984 O ASN A 67 3.008 12.675 -18.174 1.00 0.00 O ATOM 985 CB ASN A 67 5.160 12.753 -20.407 1.00 0.00 C ATOM 986 CG ASN A 67 5.272 11.311 -19.926 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.431 10.467 -20.202 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.283 10.985 -19.160 1.00 0.00 N ATOM 0 H ASN A 67 6.906 13.994 -18.994 1.00 0.00 H new ATOM 0 HA ASN A 67 4.090 14.473 -19.659 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.384 12.810 -21.170 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.098 13.039 -20.884 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.364 10.034 -18.799 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.990 11.682 -18.924 1.00 0.00 H new ATOM 995 N PHE A 68 4.832 13.041 -16.911 1.00 0.00 N ATOM 996 CA PHE A 68 4.397 12.273 -15.743 1.00 0.00 C ATOM 997 C PHE A 68 3.722 13.126 -14.649 1.00 0.00 C ATOM 998 O PHE A 68 3.654 14.355 -14.720 1.00 0.00 O ATOM 999 CB PHE A 68 5.603 11.484 -15.200 1.00 0.00 C ATOM 1000 CG PHE A 68 6.064 10.306 -16.038 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.161 9.287 -16.394 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.415 10.197 -16.417 1.00 0.00 C ATOM 1003 CE1 PHE A 68 5.597 8.181 -17.145 1.00 0.00 C ATOM 1004 CE2 PHE A 68 7.848 9.093 -17.172 1.00 0.00 C ATOM 1005 CZ PHE A 68 6.941 8.086 -17.538 1.00 0.00 C ATOM 0 H PHE A 68 5.721 13.519 -16.766 1.00 0.00 H new ATOM 0 HA PHE A 68 3.615 11.585 -16.064 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.440 12.173 -15.087 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.353 11.119 -14.204 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.127 9.355 -16.089 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.120 10.962 -16.127 1.00 0.00 H new ATOM 0 HE1 PHE A 68 4.898 7.405 -17.419 1.00 0.00 H new ATOM 0 HE2 PHE A 68 8.883 9.019 -17.472 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.276 7.241 -18.120 1.00 0.00 H new ATOM 1015 N ASN A 69 3.213 12.437 -13.621 1.00 0.00 N ATOM 1016 CA ASN A 69 2.437 12.988 -12.506 1.00 0.00 C ATOM 1017 C ASN A 69 3.197 12.888 -11.167 1.00 0.00 C ATOM 1018 O ASN A 69 3.166 11.846 -10.513 1.00 0.00 O ATOM 1019 CB ASN A 69 1.052 12.291 -12.486 1.00 0.00 C ATOM 1020 CG ASN A 69 1.056 10.780 -12.735 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.496 10.296 -13.708 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.694 9.990 -11.897 1.00 0.00 N ATOM 0 H ASN A 69 3.338 11.428 -13.541 1.00 0.00 H new ATOM 0 HA ASN A 69 2.282 14.057 -12.650 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.587 12.478 -11.518 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.420 12.761 -13.239 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.718 8.984 -12.063 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.164 10.384 -11.082 1.00 0.00 H new ATOM 1029 N ALA A 70 3.809 13.982 -10.701 1.00 0.00 N ATOM 1030 CA ALA A 70 4.455 14.027 -9.378 1.00 0.00 C ATOM 1031 C ALA A 70 3.501 13.594 -8.244 1.00 0.00 C ATOM 1032 O ALA A 70 3.922 12.940 -7.295 1.00 0.00 O ATOM 1033 CB ALA A 70 4.924 15.458 -9.101 1.00 0.00 C ATOM 0 H ALA A 70 3.872 14.856 -11.223 1.00 0.00 H new ATOM 0 HA ALA A 70 5.293 13.330 -9.397 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.404 15.501 -8.123 1.00 0.00 H new ATOM 0 HB2 ALA A 70 5.636 15.762 -9.868 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.067 16.131 -9.114 1.00 0.00 H new ATOM 1039 N ASP A 71 2.215 13.944 -8.372 1.00 0.00 N ATOM 1040 CA ASP A 71 1.179 13.780 -7.346 1.00 0.00 C ATOM 1041 C ASP A 71 0.930 12.322 -6.919 1.00 0.00 C ATOM 1042 O ASP A 71 0.577 12.065 -5.764 1.00 0.00 O ATOM 1043 CB ASP A 71 -0.117 14.381 -7.900 1.00 0.00 C ATOM 1044 CG ASP A 71 -1.244 14.392 -6.854 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -1.165 15.190 -5.891 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -2.227 13.627 -7.009 1.00 0.00 O ATOM 0 H ASP A 71 1.854 14.366 -9.228 1.00 0.00 H new ATOM 0 HA ASP A 71 1.525 14.289 -6.446 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.072 15.400 -8.239 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.437 13.810 -8.771 1.00 0.00 H new ATOM 1051 N ASP A 72 1.116 11.363 -7.835 1.00 0.00 N ATOM 1052 CA ASP A 72 0.921 9.939 -7.534 1.00 0.00 C ATOM 1053 C ASP A 72 2.164 9.287 -6.918 1.00 0.00 C ATOM 1054 O ASP A 72 2.039 8.348 -6.135 1.00 0.00 O ATOM 1055 CB ASP A 72 0.489 9.175 -8.791 1.00 0.00 C ATOM 1056 CG ASP A 72 -0.013 7.760 -8.447 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -0.990 7.634 -7.666 1.00 0.00 O ATOM 1058 OD2 ASP A 72 0.551 6.774 -8.978 1.00 0.00 O ATOM 0 H ASP A 72 1.403 11.549 -8.796 1.00 0.00 H new ATOM 0 HA ASP A 72 0.128 9.884 -6.788 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.300 9.728 -9.301 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.329 9.106 -9.483 1.00 0.00 H new ATOM 1063 N TYR A 73 3.366 9.767 -7.243 1.00 0.00 N ATOM 1064 CA TYR A 73 4.612 9.217 -6.730 1.00 0.00 C ATOM 1065 C TYR A 73 4.850 9.736 -5.307 1.00 0.00 C ATOM 1066 O TYR A 73 5.445 10.796 -5.106 1.00 0.00 O ATOM 1067 CB TYR A 73 5.765 9.540 -7.687 1.00 0.00 C ATOM 1068 CG TYR A 73 5.560 9.104 -9.126 1.00 0.00 C ATOM 1069 CD1 TYR A 73 5.154 7.788 -9.433 1.00 0.00 C ATOM 1070 CD2 TYR A 73 5.825 10.012 -10.167 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.974 7.400 -10.775 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.690 9.614 -11.512 1.00 0.00 C ATOM 1073 CZ TYR A 73 5.226 8.315 -11.817 1.00 0.00 C ATOM 1074 OH TYR A 73 5.040 7.924 -13.109 1.00 0.00 O ATOM 0 H TYR A 73 3.498 10.556 -7.876 1.00 0.00 H new ATOM 0 HA TYR A 73 4.552 8.130 -6.673 1.00 0.00 H new ATOM 0 HB2 TYR A 73 5.936 10.616 -7.672 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.672 9.068 -7.308 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.981 7.078 -8.638 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.134 11.020 -9.934 1.00 0.00 H new ATOM 0 HE1 TYR A 73 4.642 6.399 -11.006 1.00 0.00 H new ATOM 0 HE2 TYR A 73 5.941 10.300 -12.307 1.00 0.00 H new ATOM 0 HH TYR A 73 5.255 8.668 -13.710 1.00 0.00 H new ATOM 1084 N ASP A 74 4.382 8.965 -4.321 1.00 0.00 N ATOM 1085 CA ASP A 74 4.508 9.262 -2.889 1.00 0.00 C ATOM 1086 C ASP A 74 5.942 9.662 -2.504 1.00 0.00 C ATOM 1087 O ASP A 74 6.140 10.539 -1.664 1.00 0.00 O ATOM 1088 CB ASP A 74 4.105 8.017 -2.085 1.00 0.00 C ATOM 1089 CG ASP A 74 2.681 7.541 -2.377 1.00 0.00 C ATOM 1090 OD1 ASP A 74 1.703 8.195 -1.944 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.552 6.488 -3.045 1.00 0.00 O ATOM 0 H ASP A 74 3.890 8.090 -4.502 1.00 0.00 H new ATOM 0 HA ASP A 74 3.854 10.104 -2.663 1.00 0.00 H new ATOM 0 HB2 ASP A 74 4.803 7.209 -2.306 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.196 8.235 -1.021 1.00 0.00 H new ATOM 1096 N VAL A 75 6.940 9.060 -3.156 1.00 0.00 N ATOM 1097 CA VAL A 75 8.351 9.431 -3.035 1.00 0.00 C ATOM 1098 C VAL A 75 8.950 9.735 -4.410 1.00 0.00 C ATOM 1099 O VAL A 75 8.757 8.975 -5.363 1.00 0.00 O ATOM 1100 CB VAL A 75 9.150 8.319 -2.341 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.618 8.714 -2.157 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.542 7.968 -0.976 1.00 0.00 C ATOM 0 H VAL A 75 6.785 8.283 -3.798 1.00 0.00 H new ATOM 0 HA VAL A 75 8.411 10.331 -2.424 1.00 0.00 H new ATOM 0 HB VAL A 75 9.101 7.443 -2.988 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.154 7.904 -1.663 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.068 8.905 -3.131 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.679 9.615 -1.546 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.129 7.178 -0.509 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.548 8.851 -0.337 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.516 7.626 -1.112 1.00 0.00 H new ATOM 1112 N VAL A 76 9.758 10.793 -4.506 1.00 0.00 N ATOM 1113 CA VAL A 76 10.555 11.109 -5.703 1.00 0.00 C ATOM 1114 C VAL A 76 12.031 11.195 -5.341 1.00 0.00 C ATOM 1115 O VAL A 76 12.406 11.800 -4.345 1.00 0.00 O ATOM 1116 CB VAL A 76 10.059 12.399 -6.379 1.00 0.00 C ATOM 1117 CG1 VAL A 76 10.993 12.899 -7.494 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.686 12.168 -7.017 1.00 0.00 C ATOM 0 H VAL A 76 9.882 11.465 -3.748 1.00 0.00 H new ATOM 0 HA VAL A 76 10.430 10.304 -6.427 1.00 0.00 H new ATOM 0 HB VAL A 76 10.022 13.148 -5.588 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.585 13.811 -7.929 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.979 13.105 -7.078 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.078 12.135 -8.267 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.346 13.088 -7.492 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.761 11.379 -7.766 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.973 11.872 -6.248 1.00 0.00 H new ATOM 1128 N ILE A 77 12.884 10.603 -6.169 1.00 0.00 N ATOM 1129 CA ILE A 77 14.332 10.576 -5.989 1.00 0.00 C ATOM 1130 C ILE A 77 14.985 11.213 -7.211 1.00 0.00 C ATOM 1131 O ILE A 77 14.686 10.808 -8.331 1.00 0.00 O ATOM 1132 CB ILE A 77 14.826 9.123 -5.836 1.00 0.00 C ATOM 1133 CG1 ILE A 77 14.023 8.257 -4.836 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.320 9.098 -5.481 1.00 0.00 C ATOM 1135 CD1 ILE A 77 14.029 8.750 -3.385 1.00 0.00 C ATOM 0 H ILE A 77 12.578 10.113 -7.010 1.00 0.00 H new ATOM 0 HA ILE A 77 14.598 11.128 -5.088 1.00 0.00 H new ATOM 0 HB ILE A 77 14.659 8.664 -6.811 1.00 0.00 H new ATOM 0 HG12 ILE A 77 12.990 8.201 -5.178 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.421 7.243 -4.859 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.652 8.065 -5.377 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.890 9.584 -6.272 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.480 9.627 -4.541 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.438 8.073 -2.768 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.054 8.777 -3.014 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.600 9.751 -3.339 1.00 0.00 H new ATOM 1147 N SER A 78 15.878 12.179 -7.026 1.00 0.00 N ATOM 1148 CA SER A 78 16.731 12.691 -8.100 1.00 0.00 C ATOM 1149 C SER A 78 18.107 12.033 -8.013 1.00 0.00 C ATOM 1150 O SER A 78 18.597 11.722 -6.932 1.00 0.00 O ATOM 1151 CB SER A 78 16.833 14.210 -8.080 1.00 0.00 C ATOM 1152 OG SER A 78 17.469 14.617 -9.282 1.00 0.00 O ATOM 0 H SER A 78 16.034 12.632 -6.126 1.00 0.00 H new ATOM 0 HA SER A 78 16.273 12.433 -9.055 1.00 0.00 H new ATOM 0 HB2 SER A 78 15.843 14.659 -8.001 1.00 0.00 H new ATOM 0 HB3 SER A 78 17.404 14.543 -7.214 1.00 0.00 H new ATOM 0 HG SER A 78 17.546 15.594 -9.297 1.00 0.00 H new ATOM 1158 N LEU A 79 18.716 11.772 -9.166 1.00 0.00 N ATOM 1159 CA LEU A 79 20.034 11.158 -9.319 1.00 0.00 C ATOM 1160 C LEU A 79 20.863 11.996 -10.297 1.00 0.00 C ATOM 1161 O LEU A 79 21.483 11.477 -11.222 1.00 0.00 O ATOM 1162 CB LEU A 79 19.898 9.657 -9.686 1.00 0.00 C ATOM 1163 CG LEU A 79 19.042 8.804 -8.719 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.567 8.727 -9.132 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.522 7.352 -8.697 1.00 0.00 C ATOM 0 H LEU A 79 18.284 11.993 -10.063 1.00 0.00 H new ATOM 0 HA LEU A 79 20.582 11.159 -8.377 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.467 9.584 -10.684 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.896 9.223 -9.737 1.00 0.00 H new ATOM 0 HG LEU A 79 19.146 9.297 -7.752 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.020 8.115 -8.415 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.142 9.730 -9.152 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.490 8.280 -10.123 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.904 6.775 -8.010 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.445 6.928 -9.698 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.560 7.317 -8.367 1.00 0.00 H new ATOM 1213 N VAL A 84 20.710 20.417 -11.049 1.00 0.00 N ATOM 1214 CA VAL A 84 19.271 20.097 -11.012 1.00 0.00 C ATOM 1215 C VAL A 84 18.705 20.243 -9.593 1.00 0.00 C ATOM 1216 O VAL A 84 19.350 19.833 -8.628 1.00 0.00 O ATOM 1217 CB VAL A 84 19.063 18.651 -11.520 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.587 18.229 -11.561 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.649 18.462 -12.926 1.00 0.00 C ATOM 0 HA VAL A 84 18.739 20.798 -11.655 1.00 0.00 H new ATOM 0 HB VAL A 84 19.585 18.021 -10.799 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.511 17.205 -11.926 1.00 0.00 H new ATOM 0 HG12 VAL A 84 17.163 18.289 -10.558 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.037 18.893 -12.227 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.486 17.435 -13.253 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.159 19.146 -13.619 1.00 0.00 H new ATOM 0 HG23 VAL A 84 20.719 18.671 -12.905 1.00 0.00 H new ATOM 1229 N ASN A 85 17.481 20.782 -9.469 1.00 0.00 N ATOM 1230 CA ASN A 85 16.796 20.929 -8.169 1.00 0.00 C ATOM 1231 C ASN A 85 15.289 20.564 -8.151 1.00 0.00 C ATOM 1232 O ASN A 85 14.672 20.615 -7.091 1.00 0.00 O ATOM 1233 CB ASN A 85 17.065 22.368 -7.677 1.00 0.00 C ATOM 1234 CG ASN A 85 17.041 22.480 -6.161 1.00 0.00 C ATOM 1235 OD1 ASN A 85 16.157 23.072 -5.559 1.00 0.00 O ATOM 1236 ND2 ASN A 85 18.033 21.920 -5.501 1.00 0.00 N ATOM 0 H ASN A 85 16.939 21.127 -10.261 1.00 0.00 H new ATOM 0 HA ASN A 85 17.211 20.188 -7.486 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.035 22.699 -8.047 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.317 23.039 -8.099 1.00 0.00 H new ATOM 0 HD21 ASN A 85 18.066 21.979 -4.483 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.768 21.427 -6.007 1.00 0.00 H new ATOM 1243 N LEU A 86 14.696 20.199 -9.306 1.00 0.00 N ATOM 1244 CA LEU A 86 13.250 19.952 -9.504 1.00 0.00 C ATOM 1245 C LEU A 86 12.313 20.986 -8.811 1.00 0.00 C ATOM 1246 O LEU A 86 11.537 20.608 -7.934 1.00 0.00 O ATOM 1247 CB LEU A 86 12.902 18.488 -9.131 1.00 0.00 C ATOM 1248 CG LEU A 86 13.550 17.356 -9.934 1.00 0.00 C ATOM 1249 CD1 LEU A 86 12.922 16.034 -9.489 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.298 17.528 -11.431 1.00 0.00 C ATOM 0 H LEU A 86 15.232 20.062 -10.163 1.00 0.00 H new ATOM 0 HA LEU A 86 13.054 20.100 -10.566 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.162 18.342 -8.083 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.821 18.374 -9.210 1.00 0.00 H new ATOM 0 HG LEU A 86 14.625 17.370 -9.757 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.369 15.212 -10.049 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.100 15.887 -8.424 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.849 16.060 -9.677 1.00 0.00 H new ATOM 0 HD21 LEU A 86 13.770 16.710 -11.976 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.225 17.520 -11.623 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.719 18.476 -11.764 1.00 0.00 H new ATOM 1262 N PRO A 87 12.321 22.276 -9.212 1.00 0.00 N ATOM 1263 CA PRO A 87 11.472 23.318 -8.611 1.00 0.00 C ATOM 1264 C PRO A 87 9.944 23.065 -8.483 1.00 0.00 C ATOM 1265 O PRO A 87 9.362 23.649 -7.561 1.00 0.00 O ATOM 1266 CB PRO A 87 11.723 24.574 -9.452 1.00 0.00 C ATOM 1267 CG PRO A 87 13.146 24.381 -9.966 1.00 0.00 C ATOM 1268 CD PRO A 87 13.208 22.875 -10.204 1.00 0.00 C ATOM 0 HA PRO A 87 11.763 23.379 -7.562 1.00 0.00 H new ATOM 0 HB2 PRO A 87 11.009 24.658 -10.271 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.632 25.481 -8.855 1.00 0.00 H new ATOM 0 HG2 PRO A 87 13.327 24.945 -10.881 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.889 24.708 -9.238 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.887 22.626 -11.216 1.00 0.00 H new ATOM 0 HD3 PRO A 87 14.227 22.504 -10.092 1.00 0.00 H new ATOM 1276 N PRO A 88 9.261 22.271 -9.346 1.00 0.00 N ATOM 1277 CA PRO A 88 7.802 22.081 -9.268 1.00 0.00 C ATOM 1278 C PRO A 88 7.330 21.145 -8.130 1.00 0.00 C ATOM 1279 O PRO A 88 8.062 20.848 -7.185 1.00 0.00 O ATOM 1280 CB PRO A 88 7.378 21.578 -10.661 1.00 0.00 C ATOM 1281 CG PRO A 88 8.558 21.882 -11.575 1.00 0.00 C ATOM 1282 CD PRO A 88 9.736 21.752 -10.624 1.00 0.00 C ATOM 0 HA PRO A 88 7.320 23.024 -9.008 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.159 20.510 -10.644 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.475 22.083 -11.003 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.624 21.178 -12.404 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.492 22.880 -12.009 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.054 20.714 -10.532 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.595 22.318 -10.983 1.00 0.00 H new ATOM 1290 N GLU A 89 6.106 20.606 -8.225 1.00 0.00 N ATOM 1291 CA GLU A 89 5.534 19.641 -7.263 1.00 0.00 C ATOM 1292 C GLU A 89 6.311 18.309 -7.141 1.00 0.00 C ATOM 1293 O GLU A 89 6.064 17.502 -6.246 1.00 0.00 O ATOM 1294 CB GLU A 89 4.039 19.397 -7.555 1.00 0.00 C ATOM 1295 CG GLU A 89 3.711 18.971 -8.995 1.00 0.00 C ATOM 1296 CD GLU A 89 3.260 20.168 -9.852 1.00 0.00 C ATOM 1297 OE1 GLU A 89 4.117 21.000 -10.233 1.00 0.00 O ATOM 1298 OE2 GLU A 89 2.044 20.288 -10.144 1.00 0.00 O ATOM 0 H GLU A 89 5.468 20.831 -8.989 1.00 0.00 H new ATOM 0 HA GLU A 89 5.636 20.111 -6.285 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.674 18.628 -6.874 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.488 20.310 -7.330 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.589 18.509 -9.447 1.00 0.00 H new ATOM 0 HG3 GLU A 89 2.925 18.216 -8.981 1.00 0.00 H new ATOM 1305 N TRP A 90 7.323 18.090 -7.979 1.00 0.00 N ATOM 1306 CA TRP A 90 8.268 16.971 -7.903 1.00 0.00 C ATOM 1307 C TRP A 90 9.072 16.893 -6.592 1.00 0.00 C ATOM 1308 O TRP A 90 9.598 15.827 -6.271 1.00 0.00 O ATOM 1309 CB TRP A 90 9.176 17.052 -9.129 1.00 0.00 C ATOM 1310 CG TRP A 90 8.449 16.690 -10.389 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.949 17.533 -11.322 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.094 15.354 -10.840 1.00 0.00 C ATOM 1313 NE1 TRP A 90 7.251 16.808 -12.274 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.324 15.454 -12.035 1.00 0.00 C ATOM 1315 CE3 TRP A 90 8.368 14.066 -10.351 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 6.867 14.323 -12.728 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 7.925 12.926 -11.037 1.00 0.00 C ATOM 1318 CH2 TRP A 90 7.189 13.053 -12.229 1.00 0.00 C ATOM 0 H TRP A 90 7.517 18.712 -8.763 1.00 0.00 H new ATOM 0 HA TRP A 90 7.696 16.043 -7.899 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.576 18.062 -9.218 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.026 16.383 -8.996 1.00 0.00 H new ATOM 0 HD1 TRP A 90 8.075 18.606 -11.324 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.746 17.226 -13.055 1.00 0.00 H new ATOM 0 HE3 TRP A 90 8.927 13.952 -9.434 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.279 14.429 -13.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 8.150 11.944 -10.648 1.00 0.00 H new ATOM 0 HH2 TRP A 90 6.871 12.169 -12.762 1.00 0.00 H new ATOM 1329 N VAL A 91 9.124 17.975 -5.803 1.00 0.00 N ATOM 1330 CA VAL A 91 9.764 18.017 -4.468 1.00 0.00 C ATOM 1331 C VAL A 91 8.780 18.237 -3.310 1.00 0.00 C ATOM 1332 O VAL A 91 9.199 18.266 -2.154 1.00 0.00 O ATOM 1333 CB VAL A 91 10.926 19.034 -4.416 1.00 0.00 C ATOM 1334 CG1 VAL A 91 12.029 18.657 -5.402 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.474 20.478 -4.670 1.00 0.00 C ATOM 0 H VAL A 91 8.715 18.869 -6.075 1.00 0.00 H new ATOM 0 HA VAL A 91 10.178 17.019 -4.321 1.00 0.00 H new ATOM 0 HB VAL A 91 11.316 18.991 -3.399 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.834 19.389 -5.345 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.418 17.670 -5.153 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.623 18.642 -6.414 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.336 21.143 -4.620 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.018 20.548 -5.658 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.746 20.770 -3.913 1.00 0.00 H new ATOM 1345 N THR A 92 7.475 18.356 -3.587 1.00 0.00 N ATOM 1346 CA THR A 92 6.416 18.582 -2.575 1.00 0.00 C ATOM 1347 C THR A 92 5.716 17.287 -2.130 1.00 0.00 C ATOM 1348 O THR A 92 4.737 17.330 -1.378 1.00 0.00 O ATOM 1349 CB THR A 92 5.392 19.631 -3.045 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.652 19.130 -4.134 1.00 0.00 O ATOM 1351 CG2 THR A 92 6.050 20.935 -3.504 1.00 0.00 C ATOM 0 H THR A 92 7.111 18.298 -4.538 1.00 0.00 H new ATOM 0 HA THR A 92 6.926 18.976 -1.696 1.00 0.00 H new ATOM 0 HB THR A 92 4.754 19.838 -2.186 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.243 18.614 -4.721 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.281 21.638 -3.824 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.615 21.367 -2.679 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.723 20.730 -4.336 1.00 0.00 H new ATOM 1359 N GLN A 93 6.220 16.127 -2.574 1.00 0.00 N ATOM 1360 CA GLN A 93 5.714 14.798 -2.220 1.00 0.00 C ATOM 1361 C GLN A 93 6.139 14.382 -0.790 1.00 0.00 C ATOM 1362 O GLN A 93 6.799 15.144 -0.077 1.00 0.00 O ATOM 1363 CB GLN A 93 6.139 13.789 -3.309 1.00 0.00 C ATOM 1364 CG GLN A 93 5.718 14.219 -4.727 1.00 0.00 C ATOM 1365 CD GLN A 93 4.252 14.659 -4.806 1.00 0.00 C ATOM 1366 OE1 GLN A 93 3.331 14.000 -4.333 1.00 0.00 O ATOM 1367 NE2 GLN A 93 3.981 15.831 -5.345 1.00 0.00 N ATOM 0 H GLN A 93 7.017 16.089 -3.210 1.00 0.00 H new ATOM 0 HA GLN A 93 4.625 14.816 -2.191 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.222 13.666 -3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 93 5.701 12.816 -3.086 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.356 15.038 -5.057 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.881 13.390 -5.416 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.732 16.395 -5.744 1.00 0.00 H new ATOM 0 HE22 GLN A 93 3.021 16.174 -5.363 1.00 0.00 H new ATOM 1376 N GLU A 94 5.750 13.183 -0.345 1.00 0.00 N ATOM 1377 CA GLU A 94 5.914 12.752 1.058 1.00 0.00 C ATOM 1378 C GLU A 94 7.395 12.679 1.474 1.00 0.00 C ATOM 1379 O GLU A 94 7.751 13.122 2.567 1.00 0.00 O ATOM 1380 CB GLU A 94 5.216 11.396 1.271 1.00 0.00 C ATOM 1381 CG GLU A 94 5.097 10.960 2.733 1.00 0.00 C ATOM 1382 CD GLU A 94 4.098 11.834 3.521 1.00 0.00 C ATOM 1383 OE1 GLU A 94 2.884 11.515 3.528 1.00 0.00 O ATOM 1384 OE2 GLU A 94 4.517 12.841 4.142 1.00 0.00 O ATOM 0 H GLU A 94 5.313 12.481 -0.942 1.00 0.00 H new ATOM 0 HA GLU A 94 5.446 13.502 1.696 1.00 0.00 H new ATOM 0 HB2 GLU A 94 4.217 11.445 0.838 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.764 10.631 0.721 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.778 9.918 2.775 1.00 0.00 H new ATOM 0 HG3 GLU A 94 6.077 11.013 3.207 1.00 0.00 H new ATOM 1391 N ILE A 95 8.262 12.184 0.576 1.00 0.00 N ATOM 1392 CA ILE A 95 9.728 12.220 0.718 1.00 0.00 C ATOM 1393 C ILE A 95 10.374 12.597 -0.625 1.00 0.00 C ATOM 1394 O ILE A 95 9.957 12.112 -1.681 1.00 0.00 O ATOM 1395 CB ILE A 95 10.284 10.867 1.249 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.597 10.419 2.563 1.00 0.00 C ATOM 1397 CG2 ILE A 95 11.814 10.941 1.441 1.00 0.00 C ATOM 1398 CD1 ILE A 95 10.130 9.110 3.164 1.00 0.00 C ATOM 0 H ILE A 95 7.957 11.737 -0.289 1.00 0.00 H new ATOM 0 HA ILE A 95 9.983 12.981 1.456 1.00 0.00 H new ATOM 0 HB ILE A 95 10.056 10.115 0.493 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.709 11.212 3.302 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.529 10.306 2.376 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.181 9.984 1.813 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.290 11.166 0.487 1.00 0.00 H new ATOM 0 HG23 ILE A 95 12.053 11.725 2.159 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.586 8.882 4.081 1.00 0.00 H new ATOM 0 HD12 ILE A 95 9.992 8.299 2.449 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.191 9.219 3.389 1.00 0.00 H new ATOM 1410 N PHE A 96 11.405 13.444 -0.580 1.00 0.00 N ATOM 1411 CA PHE A 96 12.284 13.731 -1.714 1.00 0.00 C ATOM 1412 C PHE A 96 13.757 13.564 -1.295 1.00 0.00 C ATOM 1413 O PHE A 96 14.149 14.022 -0.219 1.00 0.00 O ATOM 1414 CB PHE A 96 12.002 15.107 -2.342 1.00 0.00 C ATOM 1415 CG PHE A 96 13.018 15.486 -3.411 1.00 0.00 C ATOM 1416 CD1 PHE A 96 12.867 15.050 -4.746 1.00 0.00 C ATOM 1417 CD2 PHE A 96 14.167 16.216 -3.046 1.00 0.00 C ATOM 1418 CE1 PHE A 96 13.882 15.305 -5.686 1.00 0.00 C ATOM 1419 CE2 PHE A 96 15.166 16.491 -3.996 1.00 0.00 C ATOM 1420 CZ PHE A 96 15.029 16.028 -5.315 1.00 0.00 C ATOM 0 H PHE A 96 11.656 13.960 0.263 1.00 0.00 H new ATOM 0 HA PHE A 96 12.072 13.006 -2.500 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.004 15.104 -2.780 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.004 15.866 -1.560 1.00 0.00 H new ATOM 0 HD1 PHE A 96 11.974 14.522 -5.045 1.00 0.00 H new ATOM 0 HD2 PHE A 96 14.281 16.566 -2.031 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.779 14.943 -6.698 1.00 0.00 H new ATOM 0 HE2 PHE A 96 16.040 17.059 -3.711 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.803 16.227 -6.042 1.00 0.00 H new ATOM 1430 N GLU A 97 14.568 12.917 -2.137 1.00 0.00 N ATOM 1431 CA GLU A 97 16.009 12.723 -1.918 1.00 0.00 C ATOM 1432 C GLU A 97 16.826 12.985 -3.198 1.00 0.00 C ATOM 1433 O GLU A 97 16.313 12.843 -4.307 1.00 0.00 O ATOM 1434 CB GLU A 97 16.307 11.298 -1.419 1.00 0.00 C ATOM 1435 CG GLU A 97 15.646 10.931 -0.085 1.00 0.00 C ATOM 1436 CD GLU A 97 16.138 9.562 0.431 1.00 0.00 C ATOM 1437 OE1 GLU A 97 17.373 9.344 0.504 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.295 8.705 0.788 1.00 0.00 O ATOM 0 H GLU A 97 14.237 12.504 -3.009 1.00 0.00 H new ATOM 0 HA GLU A 97 16.306 13.446 -1.158 1.00 0.00 H new ATOM 0 HB2 GLU A 97 15.980 10.587 -2.178 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.386 11.182 -1.317 1.00 0.00 H new ATOM 0 HG2 GLU A 97 15.866 11.700 0.655 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.563 10.907 -0.208 1.00 0.00 H new ATOM 1445 N ASP A 98 18.114 13.308 -3.046 1.00 0.00 N ATOM 1446 CA ASP A 98 19.050 13.549 -4.153 1.00 0.00 C ATOM 1447 C ASP A 98 20.322 12.691 -4.005 1.00 0.00 C ATOM 1448 O ASP A 98 21.190 12.974 -3.174 1.00 0.00 O ATOM 1449 CB ASP A 98 19.352 15.052 -4.229 1.00 0.00 C ATOM 1450 CG ASP A 98 20.392 15.385 -5.313 1.00 0.00 C ATOM 1451 OD1 ASP A 98 20.385 14.740 -6.388 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.208 16.311 -5.084 1.00 0.00 O ATOM 0 H ASP A 98 18.547 13.412 -2.128 1.00 0.00 H new ATOM 0 HA ASP A 98 18.596 13.244 -5.096 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.430 15.596 -4.434 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.716 15.396 -3.261 1.00 0.00 H new ATOM 1457 N TRP A 99 20.415 11.614 -4.792 1.00 0.00 N ATOM 1458 CA TRP A 99 21.482 10.605 -4.758 1.00 0.00 C ATOM 1459 C TRP A 99 22.495 10.836 -5.891 1.00 0.00 C ATOM 1460 O TRP A 99 22.427 10.219 -6.956 1.00 0.00 O ATOM 1461 CB TRP A 99 20.872 9.192 -4.817 1.00 0.00 C ATOM 1462 CG TRP A 99 19.824 8.804 -3.810 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.501 9.446 -2.664 1.00 0.00 C ATOM 1464 CD2 TRP A 99 18.934 7.648 -3.870 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.466 8.780 -2.032 1.00 0.00 N ATOM 1466 CE2 TRP A 99 18.055 7.683 -2.749 1.00 0.00 C ATOM 1467 CE3 TRP A 99 18.780 6.571 -4.769 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.057 6.720 -2.543 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 17.777 5.600 -4.579 1.00 0.00 C ATOM 1470 CH2 TRP A 99 16.912 5.672 -3.469 1.00 0.00 C ATOM 0 H TRP A 99 19.715 11.411 -5.505 1.00 0.00 H new ATOM 0 HA TRP A 99 22.027 10.699 -3.819 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.438 9.063 -5.809 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.690 8.477 -4.731 1.00 0.00 H new ATOM 0 HD1 TRP A 99 19.979 10.343 -2.298 1.00 0.00 H new ATOM 0 HE1 TRP A 99 18.058 9.068 -1.143 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.443 6.490 -5.618 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.407 6.783 -1.683 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.670 4.794 -5.290 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.143 4.927 -3.330 1.00 0.00 H new ATOM 1481 N GLN A 100 23.443 11.750 -5.671 1.00 0.00 N ATOM 1482 CA GLN A 100 24.477 12.089 -6.657 1.00 0.00 C ATOM 1483 C GLN A 100 25.548 10.981 -6.744 1.00 0.00 C ATOM 1484 O GLN A 100 26.125 10.588 -5.728 1.00 0.00 O ATOM 1485 CB GLN A 100 25.089 13.462 -6.328 1.00 0.00 C ATOM 1486 CG GLN A 100 24.036 14.588 -6.324 1.00 0.00 C ATOM 1487 CD GLN A 100 24.627 15.994 -6.177 1.00 0.00 C ATOM 1488 OE1 GLN A 100 25.799 16.254 -6.406 1.00 0.00 O ATOM 1489 NE2 GLN A 100 23.818 16.968 -5.826 1.00 0.00 N ATOM 0 H GLN A 100 23.517 12.279 -4.802 1.00 0.00 H new ATOM 0 HA GLN A 100 24.016 12.156 -7.643 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.573 13.417 -5.352 1.00 0.00 H new ATOM 0 HB3 GLN A 100 25.864 13.696 -7.058 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.465 14.540 -7.251 1.00 0.00 H new ATOM 0 HG3 GLN A 100 23.335 14.413 -5.508 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.837 16.770 -5.631 1.00 0.00 H new ATOM 0 HE22 GLN A 100 24.171 17.922 -5.749 1.00 0.00 H new ATOM 1498 N LEU A 101 25.805 10.478 -7.959 1.00 0.00 N ATOM 1499 CA LEU A 101 26.735 9.376 -8.269 1.00 0.00 C ATOM 1500 C LEU A 101 27.496 9.651 -9.587 1.00 0.00 C ATOM 1501 O LEU A 101 27.175 10.588 -10.318 1.00 0.00 O ATOM 1502 CB LEU A 101 25.936 8.046 -8.346 1.00 0.00 C ATOM 1503 CG LEU A 101 25.377 7.494 -7.014 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.595 6.208 -7.274 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.479 7.150 -6.011 1.00 0.00 C ATOM 0 H LEU A 101 25.350 10.844 -8.795 1.00 0.00 H new ATOM 0 HA LEU A 101 27.481 9.297 -7.478 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.101 8.190 -9.032 1.00 0.00 H new ATOM 0 HB3 LEU A 101 26.582 7.286 -8.785 1.00 0.00 H new ATOM 0 HG LEU A 101 24.746 8.280 -6.598 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.204 5.824 -6.332 1.00 0.00 H new ATOM 0 HD12 LEU A 101 23.768 6.416 -7.953 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.255 5.465 -7.723 1.00 0.00 H new ATOM 0 HD21 LEU A 101 26.030 6.767 -5.094 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.136 6.392 -6.438 1.00 0.00 H new ATOM 0 HD23 LEU A 101 27.058 8.046 -5.785 1.00 0.00 H new ATOM 1517 N GLU A 102 28.487 8.810 -9.910 1.00 0.00 N ATOM 1518 CA GLU A 102 29.235 8.832 -11.174 1.00 0.00 C ATOM 1519 C GLU A 102 28.350 8.634 -12.406 1.00 0.00 C ATOM 1520 O GLU A 102 27.162 8.318 -12.330 1.00 0.00 O ATOM 1521 CB GLU A 102 30.331 7.747 -11.146 1.00 0.00 C ATOM 1522 CG GLU A 102 31.584 8.145 -10.365 1.00 0.00 C ATOM 1523 CD GLU A 102 32.271 9.418 -10.909 1.00 0.00 C ATOM 1524 OE1 GLU A 102 32.325 9.612 -12.148 1.00 0.00 O ATOM 1525 OE2 GLU A 102 32.763 10.235 -10.093 1.00 0.00 O ATOM 0 H GLU A 102 28.800 8.072 -9.279 1.00 0.00 H new ATOM 0 HA GLU A 102 29.677 9.825 -11.260 1.00 0.00 H new ATOM 0 HB2 GLU A 102 29.917 6.839 -10.709 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.616 7.507 -12.170 1.00 0.00 H new ATOM 0 HG2 GLU A 102 31.316 8.304 -9.321 1.00 0.00 H new ATOM 0 HG3 GLU A 102 32.295 7.319 -10.389 1.00 0.00 H new ATOM 1532 N ASP A 103 28.935 8.845 -13.578 1.00 0.00 N ATOM 1533 CA ASP A 103 28.333 8.623 -14.899 1.00 0.00 C ATOM 1534 C ASP A 103 29.059 7.471 -15.627 1.00 0.00 C ATOM 1535 O ASP A 103 30.089 7.724 -16.256 1.00 0.00 O ATOM 1536 CB ASP A 103 28.395 9.940 -15.684 1.00 0.00 C ATOM 1537 CG ASP A 103 27.778 9.806 -17.089 1.00 0.00 C ATOM 1538 OD1 ASP A 103 26.792 9.047 -17.245 1.00 0.00 O ATOM 1539 OD2 ASP A 103 28.227 10.497 -18.031 1.00 0.00 O ATOM 0 H ASP A 103 29.891 9.194 -13.643 1.00 0.00 H new ATOM 0 HA ASP A 103 27.289 8.324 -14.804 1.00 0.00 H new ATOM 0 HB2 ASP A 103 27.869 10.717 -15.130 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.433 10.260 -15.773 1.00 0.00 H new ATOM 1544 N PRO A 104 28.572 6.214 -15.533 1.00 0.00 N ATOM 1545 CA PRO A 104 29.268 5.034 -16.069 1.00 0.00 C ATOM 1546 C PRO A 104 29.347 4.938 -17.598 1.00 0.00 C ATOM 1547 O PRO A 104 30.147 4.165 -18.121 1.00 0.00 O ATOM 1548 CB PRO A 104 28.519 3.833 -15.502 1.00 0.00 C ATOM 1549 CG PRO A 104 27.859 4.364 -14.239 1.00 0.00 C ATOM 1550 CD PRO A 104 27.478 5.774 -14.673 1.00 0.00 C ATOM 0 HA PRO A 104 30.315 5.089 -15.770 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.780 3.455 -16.209 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.198 3.009 -15.280 1.00 0.00 H new ATOM 0 HG2 PRO A 104 26.990 3.774 -13.950 1.00 0.00 H new ATOM 0 HG3 PRO A 104 28.540 4.366 -13.388 1.00 0.00 H new ATOM 0 HD2 PRO A 104 26.529 5.779 -15.209 1.00 0.00 H new ATOM 0 HD3 PRO A 104 27.362 6.434 -13.813 1.00 0.00 H new ATOM 1558 N ASP A 105 28.534 5.712 -18.318 1.00 0.00 N ATOM 1559 CA ASP A 105 28.477 5.738 -19.781 1.00 0.00 C ATOM 1560 C ASP A 105 29.863 6.016 -20.408 1.00 0.00 C ATOM 1561 O ASP A 105 30.393 7.130 -20.327 1.00 0.00 O ATOM 1562 CB ASP A 105 27.440 6.804 -20.168 1.00 0.00 C ATOM 1563 CG ASP A 105 27.249 7.029 -21.679 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.758 6.231 -22.505 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.541 8.009 -22.024 1.00 0.00 O ATOM 0 H ASP A 105 27.875 6.359 -17.885 1.00 0.00 H new ATOM 0 HA ASP A 105 28.181 4.764 -20.170 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.479 6.524 -19.736 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.731 7.750 -19.712 1.00 0.00 H new ATOM 1570 N GLY A 106 30.458 4.982 -21.021 1.00 0.00 N ATOM 1571 CA GLY A 106 31.786 5.045 -21.648 1.00 0.00 C ATOM 1572 C GLY A 106 32.966 4.922 -20.668 1.00 0.00 C ATOM 1573 O GLY A 106 34.100 5.219 -21.054 1.00 0.00 O ATOM 0 H GLY A 106 30.022 4.063 -21.096 1.00 0.00 H new ATOM 0 HA2 GLY A 106 31.862 4.248 -22.388 1.00 0.00 H new ATOM 0 HA3 GLY A 106 31.875 5.989 -22.186 1.00 0.00 H new ATOM 1577 N GLN A 107 32.721 4.502 -19.418 1.00 0.00 N ATOM 1578 CA GLN A 107 33.747 4.324 -18.380 1.00 0.00 C ATOM 1579 C GLN A 107 34.299 2.882 -18.393 1.00 0.00 C ATOM 1580 O GLN A 107 35.120 2.533 -19.246 1.00 0.00 O ATOM 1581 CB GLN A 107 33.229 4.752 -16.992 1.00 0.00 C ATOM 1582 CG GLN A 107 32.605 6.147 -16.899 1.00 0.00 C ATOM 1583 CD GLN A 107 33.546 7.338 -17.025 1.00 0.00 C ATOM 1584 OE1 GLN A 107 34.742 7.240 -17.273 1.00 0.00 O ATOM 1585 NE2 GLN A 107 33.011 8.525 -16.823 1.00 0.00 N ATOM 0 H GLN A 107 31.782 4.271 -19.093 1.00 0.00 H new ATOM 0 HA GLN A 107 34.583 4.985 -18.609 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.487 4.023 -16.665 1.00 0.00 H new ATOM 0 HB3 GLN A 107 34.059 4.701 -16.287 1.00 0.00 H new ATOM 0 HG2 GLN A 107 31.847 6.231 -17.678 1.00 0.00 H new ATOM 0 HG3 GLN A 107 32.089 6.224 -15.942 1.00 0.00 H new ATOM 0 HE21 GLN A 107 32.016 8.607 -16.617 1.00 0.00 H new ATOM 0 HE22 GLN A 107 33.592 9.362 -16.873 1.00 0.00 H new ATOM 1594 N SER A 108 33.848 2.044 -17.451 1.00 0.00 N ATOM 1595 CA SER A 108 34.261 0.650 -17.252 1.00 0.00 C ATOM 1596 C SER A 108 33.224 -0.102 -16.411 1.00 0.00 C ATOM 1597 O SER A 108 32.417 0.512 -15.707 1.00 0.00 O ATOM 1598 CB SER A 108 35.632 0.599 -16.555 1.00 0.00 C ATOM 1599 OG SER A 108 35.551 1.198 -15.272 1.00 0.00 O ATOM 0 H SER A 108 33.147 2.337 -16.770 1.00 0.00 H new ATOM 0 HA SER A 108 34.337 0.170 -18.228 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.962 -0.435 -16.461 1.00 0.00 H new ATOM 0 HB3 SER A 108 36.376 1.118 -17.160 1.00 0.00 H new ATOM 0 HG SER A 108 36.428 1.159 -14.837 1.00 0.00 H new ATOM 1605 N LEU A 109 33.248 -1.438 -16.442 1.00 0.00 N ATOM 1606 CA LEU A 109 32.278 -2.265 -15.704 1.00 0.00 C ATOM 1607 C LEU A 109 32.407 -2.101 -14.189 1.00 0.00 C ATOM 1608 O LEU A 109 31.409 -2.042 -13.482 1.00 0.00 O ATOM 1609 CB LEU A 109 32.432 -3.740 -16.104 1.00 0.00 C ATOM 1610 CG LEU A 109 32.275 -4.037 -17.606 1.00 0.00 C ATOM 1611 CD1 LEU A 109 32.398 -5.544 -17.804 1.00 0.00 C ATOM 1612 CD2 LEU A 109 30.944 -3.550 -18.176 1.00 0.00 C ATOM 0 H LEU A 109 33.932 -1.976 -16.973 1.00 0.00 H new ATOM 0 HA LEU A 109 31.280 -1.920 -15.975 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.415 -4.085 -15.784 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.694 -4.326 -15.556 1.00 0.00 H new ATOM 0 HG LEU A 109 33.055 -3.497 -18.142 1.00 0.00 H new ATOM 0 HD11 LEU A 109 32.290 -5.782 -18.862 1.00 0.00 H new ATOM 0 HD12 LEU A 109 33.375 -5.878 -17.455 1.00 0.00 H new ATOM 0 HD13 LEU A 109 31.617 -6.050 -17.237 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.894 -3.789 -19.238 1.00 0.00 H new ATOM 0 HD22 LEU A 109 30.123 -4.042 -17.654 1.00 0.00 H new ATOM 0 HD23 LEU A 109 30.864 -2.471 -18.043 1.00 0.00 H new ATOM 1624 N GLU A 110 33.626 -1.934 -13.687 1.00 0.00 N ATOM 1625 CA GLU A 110 33.861 -1.617 -12.267 1.00 0.00 C ATOM 1626 C GLU A 110 33.269 -0.259 -11.846 1.00 0.00 C ATOM 1627 O GLU A 110 32.770 -0.127 -10.726 1.00 0.00 O ATOM 1628 CB GLU A 110 35.352 -1.757 -11.909 1.00 0.00 C ATOM 1629 CG GLU A 110 36.290 -0.802 -12.656 1.00 0.00 C ATOM 1630 CD GLU A 110 37.751 -1.009 -12.204 1.00 0.00 C ATOM 1631 OE1 GLU A 110 38.193 -0.359 -11.223 1.00 0.00 O ATOM 1632 OE2 GLU A 110 38.473 -1.828 -12.825 1.00 0.00 O ATOM 0 H GLU A 110 34.479 -2.012 -14.241 1.00 0.00 H new ATOM 0 HA GLU A 110 33.316 -2.356 -11.680 1.00 0.00 H new ATOM 0 HB2 GLU A 110 35.470 -1.594 -10.838 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.664 -2.781 -12.112 1.00 0.00 H new ATOM 0 HG2 GLU A 110 36.209 -0.970 -13.730 1.00 0.00 H new ATOM 0 HG3 GLU A 110 35.990 0.229 -12.471 1.00 0.00 H new ATOM 1639 N VAL A 111 33.201 0.728 -12.749 1.00 0.00 N ATOM 1640 CA VAL A 111 32.505 2.004 -12.493 1.00 0.00 C ATOM 1641 C VAL A 111 30.983 1.838 -12.556 1.00 0.00 C ATOM 1642 O VAL A 111 30.288 2.367 -11.687 1.00 0.00 O ATOM 1643 CB VAL A 111 33.025 3.110 -13.429 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.202 4.401 -13.344 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.467 3.485 -13.066 1.00 0.00 C ATOM 0 H VAL A 111 33.624 0.669 -13.675 1.00 0.00 H new ATOM 0 HA VAL A 111 32.733 2.319 -11.475 1.00 0.00 H new ATOM 0 HB VAL A 111 32.951 2.698 -14.436 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.617 5.143 -14.026 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.168 4.192 -13.620 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.235 4.787 -12.325 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.819 4.268 -13.737 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.501 3.846 -12.038 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.107 2.608 -13.164 1.00 0.00 H new ATOM 1655 N PHE A 112 30.443 1.039 -13.491 1.00 0.00 N ATOM 1656 CA PHE A 112 29.018 0.669 -13.469 1.00 0.00 C ATOM 1657 C PHE A 112 28.648 -0.046 -12.166 1.00 0.00 C ATOM 1658 O PHE A 112 27.671 0.329 -11.525 1.00 0.00 O ATOM 1659 CB PHE A 112 28.666 -0.222 -14.668 1.00 0.00 C ATOM 1660 CG PHE A 112 28.240 0.485 -15.937 1.00 0.00 C ATOM 1661 CD1 PHE A 112 26.895 0.859 -16.108 1.00 0.00 C ATOM 1662 CD2 PHE A 112 29.169 0.742 -16.960 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.476 1.485 -17.293 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.759 1.387 -18.137 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.417 1.769 -18.296 1.00 0.00 C ATOM 0 H PHE A 112 30.969 0.639 -14.268 1.00 0.00 H new ATOM 0 HA PHE A 112 28.442 1.592 -13.532 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.533 -0.842 -14.898 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.863 -0.896 -14.368 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.180 0.663 -15.323 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.200 0.443 -16.840 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.437 1.746 -17.432 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.475 1.589 -18.920 1.00 0.00 H new ATOM 0 HZ PHE A 112 27.107 2.283 -19.194 1.00 0.00 H new ATOM 1675 N ARG A 113 29.453 -1.017 -11.721 1.00 0.00 N ATOM 1676 CA ARG A 113 29.270 -1.746 -10.448 1.00 0.00 C ATOM 1677 C ARG A 113 29.346 -0.814 -9.233 1.00 0.00 C ATOM 1678 O ARG A 113 28.513 -0.918 -8.336 1.00 0.00 O ATOM 1679 CB ARG A 113 30.317 -2.876 -10.366 1.00 0.00 C ATOM 1680 CG ARG A 113 29.987 -4.020 -11.345 1.00 0.00 C ATOM 1681 CD ARG A 113 31.165 -4.958 -11.628 1.00 0.00 C ATOM 1682 NE ARG A 113 31.688 -5.593 -10.399 1.00 0.00 N ATOM 1683 CZ ARG A 113 31.434 -6.809 -9.945 1.00 0.00 C ATOM 1684 NH1 ARG A 113 30.570 -7.606 -10.503 1.00 0.00 N ATOM 1685 NH2 ARG A 113 32.056 -7.252 -8.890 1.00 0.00 N ATOM 0 H ARG A 113 30.271 -1.330 -12.244 1.00 0.00 H new ATOM 0 HA ARG A 113 28.270 -2.179 -10.430 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.305 -2.476 -10.592 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.356 -3.265 -9.349 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.160 -4.604 -10.940 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.643 -3.591 -12.286 1.00 0.00 H new ATOM 0 HD2 ARG A 113 30.850 -5.732 -12.328 1.00 0.00 H new ATOM 0 HD3 ARG A 113 31.964 -4.397 -12.112 1.00 0.00 H new ATOM 0 HE ARG A 113 32.320 -5.026 -9.834 1.00 0.00 H new ATOM 0 HH11 ARG A 113 30.054 -7.301 -11.328 1.00 0.00 H new ATOM 0 HH12 ARG A 113 30.409 -8.536 -10.115 1.00 0.00 H new ATOM 0 HH21 ARG A 113 32.738 -6.661 -8.415 1.00 0.00 H new ATOM 0 HH22 ARG A 113 31.861 -8.190 -8.539 1.00 0.00 H new ATOM 1699 N THR A 114 30.262 0.158 -9.259 1.00 0.00 N ATOM 1700 CA THR A 114 30.408 1.196 -8.214 1.00 0.00 C ATOM 1701 C THR A 114 29.149 2.062 -8.075 1.00 0.00 C ATOM 1702 O THR A 114 28.717 2.348 -6.960 1.00 0.00 O ATOM 1703 CB THR A 114 31.647 2.067 -8.497 1.00 0.00 C ATOM 1704 OG1 THR A 114 32.821 1.293 -8.363 1.00 0.00 O ATOM 1705 CG2 THR A 114 31.793 3.258 -7.552 1.00 0.00 C ATOM 0 H THR A 114 30.938 0.254 -10.016 1.00 0.00 H new ATOM 0 HA THR A 114 30.545 0.685 -7.261 1.00 0.00 H new ATOM 0 HB THR A 114 31.509 2.444 -9.510 1.00 0.00 H new ATOM 0 HG1 THR A 114 32.930 0.724 -9.153 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.688 3.823 -7.814 1.00 0.00 H new ATOM 0 HG22 THR A 114 30.918 3.902 -7.641 1.00 0.00 H new ATOM 0 HG23 THR A 114 31.877 2.900 -6.526 1.00 0.00 H new ATOM 1713 N VAL A 115 28.517 2.446 -9.189 1.00 0.00 N ATOM 1714 CA VAL A 115 27.207 3.133 -9.186 1.00 0.00 C ATOM 1715 C VAL A 115 26.079 2.185 -8.764 1.00 0.00 C ATOM 1716 O VAL A 115 25.327 2.511 -7.849 1.00 0.00 O ATOM 1717 CB VAL A 115 26.965 3.806 -10.555 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.545 4.355 -10.750 1.00 0.00 C ATOM 1719 CG2 VAL A 115 27.935 4.983 -10.700 1.00 0.00 C ATOM 0 H VAL A 115 28.895 2.292 -10.124 1.00 0.00 H new ATOM 0 HA VAL A 115 27.216 3.924 -8.436 1.00 0.00 H new ATOM 0 HB VAL A 115 27.117 3.029 -11.304 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.463 4.810 -11.737 1.00 0.00 H new ATOM 0 HG12 VAL A 115 24.825 3.541 -10.665 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.337 5.105 -9.987 1.00 0.00 H new ATOM 0 HG21 VAL A 115 27.776 5.469 -11.663 1.00 0.00 H new ATOM 0 HG22 VAL A 115 27.759 5.700 -9.898 1.00 0.00 H new ATOM 0 HG23 VAL A 115 28.961 4.618 -10.642 1.00 0.00 H new ATOM 1729 N ARG A 116 25.987 0.996 -9.377 1.00 0.00 N ATOM 1730 CA ARG A 116 24.929 -0.011 -9.153 1.00 0.00 C ATOM 1731 C ARG A 116 24.755 -0.361 -7.675 1.00 0.00 C ATOM 1732 O ARG A 116 23.635 -0.340 -7.182 1.00 0.00 O ATOM 1733 CB ARG A 116 25.261 -1.264 -9.999 1.00 0.00 C ATOM 1734 CG ARG A 116 24.132 -2.309 -9.996 1.00 0.00 C ATOM 1735 CD ARG A 116 24.586 -3.663 -10.550 1.00 0.00 C ATOM 1736 NE ARG A 116 25.528 -4.335 -9.618 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.461 -5.215 -9.937 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.556 -5.684 -11.141 1.00 0.00 N ATOM 1739 NH2 ARG A 116 27.319 -5.637 -9.057 1.00 0.00 N ATOM 0 H ARG A 116 26.672 0.694 -10.070 1.00 0.00 H new ATOM 0 HA ARG A 116 23.973 0.407 -9.468 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.463 -0.959 -11.026 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.173 -1.722 -9.617 1.00 0.00 H new ATOM 0 HG2 ARG A 116 23.766 -2.441 -8.978 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.296 -1.938 -10.590 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.718 -4.301 -10.716 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.067 -3.520 -11.518 1.00 0.00 H new ATOM 0 HE ARG A 116 25.446 -4.092 -8.631 1.00 0.00 H new ATOM 0 HH11 ARG A 116 25.904 -5.375 -11.862 1.00 0.00 H new ATOM 0 HH12 ARG A 116 27.283 -6.363 -11.368 1.00 0.00 H new ATOM 0 HH21 ARG A 116 27.280 -5.289 -8.099 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.031 -6.317 -9.324 1.00 0.00 H new ATOM 1753 N GLY A 117 25.848 -0.624 -6.959 1.00 0.00 N ATOM 1754 CA GLY A 117 25.815 -0.983 -5.530 1.00 0.00 C ATOM 1755 C GLY A 117 25.233 0.121 -4.643 1.00 0.00 C ATOM 1756 O GLY A 117 24.446 -0.157 -3.740 1.00 0.00 O ATOM 0 H GLY A 117 26.789 -0.595 -7.351 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.224 -1.890 -5.404 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.827 -1.212 -5.196 1.00 0.00 H new ATOM 1760 N GLN A 118 25.529 1.387 -4.952 1.00 0.00 N ATOM 1761 CA GLN A 118 25.010 2.538 -4.200 1.00 0.00 C ATOM 1762 C GLN A 118 23.539 2.827 -4.538 1.00 0.00 C ATOM 1763 O GLN A 118 22.732 3.038 -3.637 1.00 0.00 O ATOM 1764 CB GLN A 118 25.927 3.751 -4.424 1.00 0.00 C ATOM 1765 CG GLN A 118 27.310 3.525 -3.786 1.00 0.00 C ATOM 1766 CD GLN A 118 28.273 4.668 -4.075 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.387 5.631 -3.330 1.00 0.00 O ATOM 1768 NE2 GLN A 118 29.001 4.609 -5.173 1.00 0.00 N ATOM 0 H GLN A 118 26.135 1.645 -5.731 1.00 0.00 H new ATOM 0 HA GLN A 118 25.019 2.303 -3.136 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.041 3.932 -5.493 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.467 4.642 -3.997 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.196 3.412 -2.708 1.00 0.00 H new ATOM 0 HG3 GLN A 118 27.733 2.593 -4.161 1.00 0.00 H new ATOM 0 HE21 GLN A 118 28.913 3.810 -5.801 1.00 0.00 H new ATOM 0 HE22 GLN A 118 29.652 5.362 -5.394 1.00 0.00 H new ATOM 1777 N VAL A 119 23.147 2.742 -5.817 1.00 0.00 N ATOM 1778 CA VAL A 119 21.724 2.791 -6.227 1.00 0.00 C ATOM 1779 C VAL A 119 20.907 1.681 -5.546 1.00 0.00 C ATOM 1780 O VAL A 119 19.847 1.959 -4.982 1.00 0.00 O ATOM 1781 CB VAL A 119 21.581 2.722 -7.763 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.112 2.765 -8.190 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.260 3.909 -8.452 1.00 0.00 C ATOM 0 H VAL A 119 23.797 2.638 -6.596 1.00 0.00 H new ATOM 0 HA VAL A 119 21.321 3.749 -5.898 1.00 0.00 H new ATOM 0 HB VAL A 119 22.050 1.783 -8.057 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.047 2.715 -9.277 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.582 1.918 -7.755 1.00 0.00 H new ATOM 0 HG13 VAL A 119 19.659 3.693 -7.842 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.136 3.822 -9.532 1.00 0.00 H new ATOM 0 HG22 VAL A 119 21.805 4.838 -8.108 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.322 3.913 -8.208 1.00 0.00 H new ATOM 1793 N LYS A 120 21.417 0.439 -5.531 1.00 0.00 N ATOM 1794 CA LYS A 120 20.797 -0.701 -4.831 1.00 0.00 C ATOM 1795 C LYS A 120 20.609 -0.403 -3.344 1.00 0.00 C ATOM 1796 O LYS A 120 19.490 -0.486 -2.849 1.00 0.00 O ATOM 1797 CB LYS A 120 21.663 -1.962 -5.029 1.00 0.00 C ATOM 1798 CG LYS A 120 21.047 -3.166 -4.305 1.00 0.00 C ATOM 1799 CD LYS A 120 21.880 -4.441 -4.469 1.00 0.00 C ATOM 1800 CE LYS A 120 21.138 -5.607 -3.793 1.00 0.00 C ATOM 1801 NZ LYS A 120 21.575 -5.815 -2.381 1.00 0.00 N ATOM 0 H LYS A 120 22.283 0.194 -6.011 1.00 0.00 H new ATOM 0 HA LYS A 120 19.809 -0.874 -5.257 1.00 0.00 H new ATOM 0 HB2 LYS A 120 21.757 -2.181 -6.093 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.669 -1.781 -4.651 1.00 0.00 H new ATOM 0 HG2 LYS A 120 20.947 -2.935 -3.244 1.00 0.00 H new ATOM 0 HG3 LYS A 120 20.042 -3.341 -4.689 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.038 -4.656 -5.526 1.00 0.00 H new ATOM 0 HD3 LYS A 120 22.865 -4.309 -4.020 1.00 0.00 H new ATOM 0 HE2 LYS A 120 20.066 -5.413 -3.814 1.00 0.00 H new ATOM 0 HE3 LYS A 120 21.308 -6.521 -4.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.137 -6.681 -2.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.610 -5.909 -2.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 21.283 -5.001 -1.804 1.00 0.00 H new ATOM 1815 N GLU A 121 21.682 -0.048 -2.633 1.00 0.00 N ATOM 1816 CA GLU A 121 21.617 0.147 -1.179 1.00 0.00 C ATOM 1817 C GLU A 121 20.703 1.300 -0.797 1.00 0.00 C ATOM 1818 O GLU A 121 19.930 1.154 0.147 1.00 0.00 O ATOM 1819 CB GLU A 121 23.023 0.225 -0.546 1.00 0.00 C ATOM 1820 CG GLU A 121 23.629 1.629 -0.438 1.00 0.00 C ATOM 1821 CD GLU A 121 25.042 1.567 0.174 1.00 0.00 C ATOM 1822 OE1 GLU A 121 25.162 1.495 1.423 1.00 0.00 O ATOM 1823 OE2 GLU A 121 26.046 1.606 -0.577 1.00 0.00 O ATOM 0 H GLU A 121 22.605 0.110 -3.037 1.00 0.00 H new ATOM 0 HA GLU A 121 21.153 -0.740 -0.748 1.00 0.00 H new ATOM 0 HB2 GLU A 121 22.975 -0.208 0.453 1.00 0.00 H new ATOM 0 HB3 GLU A 121 23.699 -0.398 -1.131 1.00 0.00 H new ATOM 0 HG2 GLU A 121 23.675 2.088 -1.426 1.00 0.00 H new ATOM 0 HG3 GLU A 121 22.988 2.261 0.177 1.00 0.00 H new ATOM 1830 N ARG A 122 20.669 2.393 -1.571 1.00 0.00 N ATOM 1831 CA ARG A 122 19.727 3.477 -1.283 1.00 0.00 C ATOM 1832 C ARG A 122 18.282 3.051 -1.534 1.00 0.00 C ATOM 1833 O ARG A 122 17.445 3.346 -0.689 1.00 0.00 O ATOM 1834 CB ARG A 122 20.142 4.781 -1.965 1.00 0.00 C ATOM 1835 CG ARG A 122 21.458 5.311 -1.360 1.00 0.00 C ATOM 1836 CD ARG A 122 21.562 6.824 -1.541 1.00 0.00 C ATOM 1837 NE ARG A 122 22.817 7.350 -0.962 1.00 0.00 N ATOM 1838 CZ ARG A 122 22.975 8.445 -0.237 1.00 0.00 C ATOM 1839 NH1 ARG A 122 21.978 9.225 0.076 1.00 0.00 N ATOM 1840 NH2 ARG A 122 24.158 8.789 0.183 1.00 0.00 N ATOM 0 H ARG A 122 21.268 2.547 -2.382 1.00 0.00 H new ATOM 0 HA ARG A 122 19.769 3.697 -0.216 1.00 0.00 H new ATOM 0 HB2 ARG A 122 20.268 4.615 -3.035 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.355 5.526 -1.848 1.00 0.00 H new ATOM 0 HG2 ARG A 122 21.503 5.062 -0.300 1.00 0.00 H new ATOM 0 HG3 ARG A 122 22.307 4.823 -1.838 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.518 7.069 -2.602 1.00 0.00 H new ATOM 0 HD3 ARG A 122 20.709 7.309 -1.066 1.00 0.00 H new ATOM 0 HE ARG A 122 23.660 6.804 -1.143 1.00 0.00 H new ATOM 0 HH11 ARG A 122 21.035 8.999 -0.240 1.00 0.00 H new ATOM 0 HH12 ARG A 122 22.141 10.061 0.637 1.00 0.00 H new ATOM 0 HH21 ARG A 122 24.968 8.213 -0.047 1.00 0.00 H new ATOM 0 HH22 ARG A 122 24.275 9.634 0.742 1.00 0.00 H new ATOM 1854 N VAL A 123 17.990 2.252 -2.565 1.00 0.00 N ATOM 1855 CA VAL A 123 16.660 1.629 -2.723 1.00 0.00 C ATOM 1856 C VAL A 123 16.304 0.701 -1.560 1.00 0.00 C ATOM 1857 O VAL A 123 15.230 0.870 -0.991 1.00 0.00 O ATOM 1858 CB VAL A 123 16.525 0.927 -4.092 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.379 -0.085 -4.129 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.305 1.969 -5.188 1.00 0.00 C ATOM 0 H VAL A 123 18.652 2.018 -3.305 1.00 0.00 H new ATOM 0 HA VAL A 123 15.928 2.436 -2.699 1.00 0.00 H new ATOM 0 HB VAL A 123 17.453 0.380 -4.259 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.333 -0.546 -5.115 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.549 -0.855 -3.376 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.438 0.424 -3.922 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.210 1.469 -6.152 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.394 2.530 -4.979 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.154 2.653 -5.216 1.00 0.00 H new ATOM 1870 N GLU A 124 17.158 -0.243 -1.156 1.00 0.00 N ATOM 1871 CA GLU A 124 16.850 -1.127 -0.015 1.00 0.00 C ATOM 1872 C GLU A 124 16.632 -0.359 1.285 1.00 0.00 C ATOM 1873 O GLU A 124 15.744 -0.707 2.067 1.00 0.00 O ATOM 1874 CB GLU A 124 17.945 -2.179 0.192 1.00 0.00 C ATOM 1875 CG GLU A 124 18.081 -3.120 -0.994 1.00 0.00 C ATOM 1876 CD GLU A 124 19.154 -4.183 -0.691 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.362 -3.883 -0.836 1.00 0.00 O ATOM 1878 OE2 GLU A 124 18.806 -5.331 -0.325 1.00 0.00 O ATOM 0 H GLU A 124 18.062 -0.419 -1.594 1.00 0.00 H new ATOM 0 HA GLU A 124 15.915 -1.625 -0.272 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.897 -1.678 0.365 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.722 -2.759 1.088 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.125 -3.602 -1.200 1.00 0.00 H new ATOM 0 HG3 GLU A 124 18.354 -2.558 -1.887 1.00 0.00 H new ATOM 1885 N ASN A 125 17.380 0.727 1.487 1.00 0.00 N ATOM 1886 CA ASN A 125 17.206 1.560 2.668 1.00 0.00 C ATOM 1887 C ASN A 125 15.910 2.388 2.609 1.00 0.00 C ATOM 1888 O ASN A 125 15.311 2.660 3.645 1.00 0.00 O ATOM 1889 CB ASN A 125 18.487 2.397 2.908 1.00 0.00 C ATOM 1890 CG ASN A 125 18.281 3.899 2.939 1.00 0.00 C ATOM 1891 OD1 ASN A 125 18.206 4.531 3.982 1.00 0.00 O ATOM 1892 ND2 ASN A 125 18.185 4.501 1.776 1.00 0.00 N ATOM 0 H ASN A 125 18.108 1.046 0.848 1.00 0.00 H new ATOM 0 HA ASN A 125 17.074 0.923 3.543 1.00 0.00 H new ATOM 0 HB2 ASN A 125 18.932 2.088 3.854 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.208 2.161 2.125 1.00 0.00 H new ATOM 0 HD21 ASN A 125 18.046 5.511 1.734 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.250 3.959 0.914 1.00 0.00 H new ATOM 1899 N LEU A 126 15.467 2.764 1.405 1.00 0.00 N ATOM 1900 CA LEU A 126 14.232 3.510 1.190 1.00 0.00 C ATOM 1901 C LEU A 126 13.006 2.620 1.352 1.00 0.00 C ATOM 1902 O LEU A 126 12.115 2.970 2.118 1.00 0.00 O ATOM 1903 CB LEU A 126 14.297 4.181 -0.193 1.00 0.00 C ATOM 1904 CG LEU A 126 12.984 4.846 -0.646 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.519 5.953 0.298 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.195 5.433 -2.035 1.00 0.00 C ATOM 0 H LEU A 126 15.967 2.553 0.542 1.00 0.00 H new ATOM 0 HA LEU A 126 14.133 4.286 1.949 1.00 0.00 H new ATOM 0 HB2 LEU A 126 15.085 4.934 -0.180 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.584 3.433 -0.932 1.00 0.00 H new ATOM 0 HG LEU A 126 12.209 4.080 -0.646 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.589 6.383 -0.075 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.354 5.538 1.292 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.282 6.730 0.352 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.274 5.909 -2.373 1.00 0.00 H new ATOM 0 HD22 LEU A 126 13.994 6.173 -2.000 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.468 4.638 -2.729 1.00 0.00 H new ATOM 1918 N ILE A 127 12.935 1.462 0.684 1.00 0.00 N ATOM 1919 CA ILE A 127 11.716 0.633 0.745 1.00 0.00 C ATOM 1920 C ILE A 127 11.407 0.175 2.168 1.00 0.00 C ATOM 1921 O ILE A 127 10.242 0.177 2.551 1.00 0.00 O ATOM 1922 CB ILE A 127 11.725 -0.543 -0.257 1.00 0.00 C ATOM 1923 CG1 ILE A 127 12.873 -1.553 -0.027 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.701 0.033 -1.686 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.110 -2.539 -1.175 1.00 0.00 C ATOM 0 H ILE A 127 13.685 1.081 0.107 1.00 0.00 H new ATOM 0 HA ILE A 127 10.898 1.281 0.430 1.00 0.00 H new ATOM 0 HB ILE A 127 10.829 -1.142 -0.095 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.794 -0.998 0.151 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.662 -2.119 0.880 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.707 -0.784 -2.408 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.800 0.631 -1.822 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.579 0.660 -1.840 1.00 0.00 H new ATOM 0 HD11 ILE A 127 13.934 -3.205 -0.919 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.207 -3.127 -1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.357 -1.988 -2.082 1.00 0.00 H new ATOM 1937 N ALA A 128 12.417 -0.084 2.997 1.00 0.00 N ATOM 1938 CA ALA A 128 12.201 -0.435 4.400 1.00 0.00 C ATOM 1939 C ALA A 128 11.552 0.700 5.235 1.00 0.00 C ATOM 1940 O ALA A 128 10.929 0.426 6.266 1.00 0.00 O ATOM 1941 CB ALA A 128 13.544 -0.885 4.986 1.00 0.00 C ATOM 0 H ALA A 128 13.398 -0.057 2.719 1.00 0.00 H new ATOM 0 HA ALA A 128 11.476 -1.247 4.447 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.412 -1.153 6.034 1.00 0.00 H new ATOM 0 HB2 ALA A 128 13.911 -1.750 4.433 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.266 -0.072 4.908 1.00 0.00 H new ATOM 1947 N LYS A 129 11.657 1.968 4.787 1.00 0.00 N ATOM 1948 CA LYS A 129 11.014 3.143 5.413 1.00 0.00 C ATOM 1949 C LYS A 129 9.571 3.368 4.936 1.00 0.00 C ATOM 1950 O LYS A 129 8.725 3.741 5.748 1.00 0.00 O ATOM 1951 CB LYS A 129 11.843 4.414 5.130 1.00 0.00 C ATOM 1952 CG LYS A 129 13.250 4.373 5.742 1.00 0.00 C ATOM 1953 CD LYS A 129 14.087 5.567 5.251 1.00 0.00 C ATOM 1954 CE LYS A 129 15.530 5.560 5.777 1.00 0.00 C ATOM 1955 NZ LYS A 129 15.619 5.790 7.248 1.00 0.00 N ATOM 0 H LYS A 129 12.204 2.210 3.961 1.00 0.00 H new ATOM 0 HA LYS A 129 10.976 2.939 6.483 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.928 4.551 4.052 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.310 5.281 5.521 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.180 4.393 6.830 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.744 3.440 5.471 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.106 5.564 4.161 1.00 0.00 H new ATOM 0 HD3 LYS A 129 13.601 6.493 5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.993 4.603 5.537 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.102 6.330 5.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.616 5.774 7.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.204 6.715 7.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.098 5.042 7.749 1.00 0.00 H new ATOM 1969 N ILE A 130 9.295 3.160 3.638 1.00 0.00 N ATOM 1970 CA ILE A 130 8.015 3.546 2.995 1.00 0.00 C ATOM 1971 C ILE A 130 7.089 2.393 2.555 1.00 0.00 C ATOM 1972 O ILE A 130 6.007 2.668 2.031 1.00 0.00 O ATOM 1973 CB ILE A 130 8.234 4.611 1.891 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.178 4.210 0.738 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.780 5.899 2.530 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.654 3.112 -0.184 1.00 0.00 C ATOM 0 H ILE A 130 9.953 2.717 2.997 1.00 0.00 H new ATOM 0 HA ILE A 130 7.439 4.003 3.800 1.00 0.00 H new ATOM 0 HB ILE A 130 7.251 4.742 1.438 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.388 5.095 0.138 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.126 3.882 1.164 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.936 6.651 1.757 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.064 6.274 3.262 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.728 5.686 3.025 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.392 2.905 -0.959 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.472 2.207 0.395 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.723 3.439 -0.647 1.00 0.00 H new ATOM 1988 N SER A 131 7.474 1.127 2.772 1.00 0.00 N ATOM 1989 CA SER A 131 6.617 -0.056 2.517 1.00 0.00 C ATOM 1990 C SER A 131 5.282 0.017 3.274 1.00 0.00 C ATOM 1991 O SER A 131 4.218 -0.083 2.618 1.00 0.00 O ATOM 1992 CB SER A 131 7.337 -1.343 2.908 1.00 0.00 C ATOM 1993 OG SER A 131 8.400 -1.584 2.007 1.00 0.00 O ATOM 1994 OXT SER A 131 5.296 0.154 4.520 1.00 0.00 O ATOM 0 H SER A 131 8.397 0.886 3.133 1.00 0.00 H new ATOM 0 HA SER A 131 6.407 -0.058 1.447 1.00 0.00 H new ATOM 0 HB2 SER A 131 7.720 -1.263 3.925 1.00 0.00 H new ATOM 0 HB3 SER A 131 6.639 -2.180 2.895 1.00 0.00 H new ATOM 0 HG SER A 131 9.185 -1.065 2.281 1.00 0.00 H new