USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 901 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 22 LYS NZ :NH3+ -158:sc= 0.242 (180deg=0) USER MOD Set 1.2: A 99 GLN : amide:sc= -0.97 K(o=-0.73,f=-5.4!) USER MOD Set 2.1: A 79 CYS SG : rot -131:sc= 0.465 USER MOD Set 2.2: A 83 ASN : amide:sc= -0.0785 X(o=0.39,f=0.46) USER MOD Set 3.1: A 56 ASN : amide:sc= 0.0924 K(o=-0.47,f=-1.8) USER MOD Set 3.2: A 62 TYR OH : rot -9:sc= -0.56! USER MOD Set 4.1: A 20 GLN : amide:sc= -0.576 K(o=0.17,f=-1.4!) USER MOD Set 4.2: A 29 SER OG : rot 180:sc= 0.743 USER MOD Set 5.1: A 18 GLN : amide:sc= -0.945 K(o=-1.7,f=0.65) USER MOD Set 5.2: A 106 GLN : amide:sc= -0.787 K(o=-1.7,f=0.65) USER MOD Set 6.1: A 14 LYS NZ :NH3+ -148:sc= 0.0472 (180deg=0) USER MOD Set 6.2: A 110 GLN : amide:sc= 0.0424 K(o=0.09,f=-0.8) USER MOD Single : A 6 SER OG : rot -26:sc= 0.22 USER MOD Single : A 15 THR OG1 : rot 74:sc= 1.24 USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.0159 USER MOD Single : A 26 ASN : amide:sc= -2.83 K(o=-2.8,f=-4.4!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=-0.0012) USER MOD Single : A 45 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00522) USER MOD Single : A 46 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.036) USER MOD Single : A 48 MET CE :methyl 166:sc= -1.78! (180deg=-2.37!) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 MET CE :methyl -165:sc= -0.283 (180deg=-1.14) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -1.71 K(o=-1.7,f=-2.8) USER MOD Single : A 73 ASN : amide:sc= -0.662 K(o=-0.66,f=-2.3) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -2.49! C(o=-2.5!,f=-5.8!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 30:sc= -2.3! USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot -58:sc= -0.724 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl 159:sc= -0.0158 (180deg=-0.813) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -0.314 20.321 1.971 1.00 0.00 N ATOM 49 CA SER A 6 -0.110 19.487 3.149 1.00 0.00 C ATOM 50 C SER A 6 -1.349 18.644 3.440 1.00 0.00 C ATOM 51 O SER A 6 -1.254 17.441 3.674 1.00 0.00 O ATOM 52 CB SER A 6 0.226 20.355 4.363 1.00 0.00 C ATOM 53 OG SER A 6 -0.682 21.437 4.484 1.00 0.00 O ATOM 0 HA SER A 6 0.726 18.817 2.948 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.196 19.748 5.268 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.242 20.738 4.270 1.00 0.00 H new ATOM 0 HG SER A 6 -1.054 21.652 3.603 1.00 0.00 H new ATOM 59 N GLY A 7 -2.512 19.289 3.421 1.00 0.00 N ATOM 60 CA GLY A 7 -3.754 18.585 3.684 1.00 0.00 C ATOM 61 C GLY A 7 -3.786 17.209 3.049 1.00 0.00 C ATOM 62 O GLY A 7 -4.214 16.239 3.675 1.00 0.00 O ATOM 0 H GLY A 7 -2.616 20.285 3.228 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.892 18.488 4.761 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.589 19.175 3.307 1.00 0.00 H new ATOM 66 N PHE A 8 -3.332 17.123 1.804 1.00 0.00 N ATOM 67 CA PHE A 8 -3.313 15.857 1.082 1.00 0.00 C ATOM 68 C PHE A 8 -2.421 14.841 1.790 1.00 0.00 C ATOM 69 O PHE A 8 -2.780 13.671 1.926 1.00 0.00 O ATOM 70 CB PHE A 8 -2.825 16.068 -0.352 1.00 0.00 C ATOM 71 CG PHE A 8 -2.524 14.789 -1.079 1.00 0.00 C ATOM 72 CD1 PHE A 8 -3.521 14.119 -1.770 1.00 0.00 C ATOM 73 CD2 PHE A 8 -1.244 14.257 -1.072 1.00 0.00 C ATOM 74 CE1 PHE A 8 -3.246 12.940 -2.439 1.00 0.00 C ATOM 75 CE2 PHE A 8 -0.964 13.079 -1.739 1.00 0.00 C ATOM 76 CZ PHE A 8 -1.966 12.421 -2.424 1.00 0.00 C ATOM 0 H PHE A 8 -2.972 17.916 1.273 1.00 0.00 H new ATOM 0 HA PHE A 8 -4.331 15.467 1.057 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -3.582 16.622 -0.907 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -1.927 16.686 -0.334 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -4.523 14.522 -1.786 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -0.456 14.769 -0.539 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -4.031 12.426 -2.973 1.00 0.00 H new ATOM 0 HE2 PHE A 8 0.037 12.674 -1.724 1.00 0.00 H new ATOM 0 HZ PHE A 8 -1.749 11.502 -2.947 1.00 0.00 H new ATOM 86 N LEU A 9 -1.257 15.298 2.238 1.00 0.00 N ATOM 87 CA LEU A 9 -0.311 14.430 2.932 1.00 0.00 C ATOM 88 C LEU A 9 -0.983 13.716 4.101 1.00 0.00 C ATOM 89 O LEU A 9 -0.761 12.526 4.324 1.00 0.00 O ATOM 90 CB LEU A 9 0.883 15.243 3.435 1.00 0.00 C ATOM 91 CG LEU A 9 1.673 16.005 2.370 1.00 0.00 C ATOM 92 CD1 LEU A 9 2.727 16.888 3.019 1.00 0.00 C ATOM 93 CD2 LEU A 9 2.316 15.035 1.389 1.00 0.00 C ATOM 0 H LEU A 9 -0.945 16.264 2.133 1.00 0.00 H new ATOM 0 HA LEU A 9 0.041 13.679 2.225 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.524 15.959 4.174 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.565 14.568 3.951 1.00 0.00 H new ATOM 0 HG LEU A 9 0.983 16.644 1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.280 17.423 2.246 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.243 17.606 3.681 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.415 16.270 3.595 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.874 15.594 0.638 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.994 14.371 1.925 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.541 14.445 0.900 1.00 0.00 H new ATOM 105 N ILE A 10 -1.807 14.450 4.841 1.00 0.00 N ATOM 106 CA ILE A 10 -2.515 13.885 5.984 1.00 0.00 C ATOM 107 C ILE A 10 -3.455 12.766 5.550 1.00 0.00 C ATOM 108 O ILE A 10 -3.524 11.716 6.190 1.00 0.00 O ATOM 109 CB ILE A 10 -3.325 14.961 6.731 1.00 0.00 C ATOM 110 CG1 ILE A 10 -2.387 16.005 7.342 1.00 0.00 C ATOM 111 CG2 ILE A 10 -4.187 14.321 7.808 1.00 0.00 C ATOM 112 CD1 ILE A 10 -2.013 17.115 6.386 1.00 0.00 C ATOM 0 H ILE A 10 -2.001 15.437 4.670 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.758 13.480 6.656 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.980 15.462 6.018 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.863 16.439 8.221 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.478 15.509 7.684 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.754 15.094 8.327 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.876 13.612 7.349 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.550 13.797 8.521 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -1.347 17.818 6.887 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -1.508 16.692 5.517 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -2.914 17.636 6.063 1.00 0.00 H new ATOM 124 N LEU A 11 -4.177 12.996 4.459 1.00 0.00 N ATOM 125 CA LEU A 11 -5.112 12.007 3.938 1.00 0.00 C ATOM 126 C LEU A 11 -4.427 10.659 3.744 1.00 0.00 C ATOM 127 O LEU A 11 -5.013 9.608 4.013 1.00 0.00 O ATOM 128 CB LEU A 11 -5.705 12.486 2.611 1.00 0.00 C ATOM 129 CG LEU A 11 -6.522 11.456 1.830 1.00 0.00 C ATOM 130 CD1 LEU A 11 -7.746 11.031 2.626 1.00 0.00 C ATOM 131 CD2 LEU A 11 -6.932 12.015 0.475 1.00 0.00 C ATOM 0 H LEU A 11 -4.132 13.860 3.918 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.915 11.884 4.665 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.341 13.349 2.811 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.890 12.831 1.975 1.00 0.00 H new ATOM 0 HG LEU A 11 -5.899 10.577 1.664 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.315 10.298 2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.430 10.589 3.571 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -8.371 11.901 2.824 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -7.512 11.268 -0.066 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -7.537 12.910 0.619 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.041 12.268 -0.099 1.00 0.00 H new ATOM 143 N LEU A 12 -3.184 10.694 3.278 1.00 0.00 N ATOM 144 CA LEU A 12 -2.417 9.474 3.051 1.00 0.00 C ATOM 145 C LEU A 12 -2.033 8.818 4.373 1.00 0.00 C ATOM 146 O LEU A 12 -2.259 7.624 4.574 1.00 0.00 O ATOM 147 CB LEU A 12 -1.158 9.784 2.239 1.00 0.00 C ATOM 148 CG LEU A 12 -1.334 9.828 0.721 1.00 0.00 C ATOM 149 CD1 LEU A 12 -2.498 10.730 0.343 1.00 0.00 C ATOM 150 CD2 LEU A 12 -0.052 10.299 0.049 1.00 0.00 C ATOM 0 H LEU A 12 -2.685 11.554 3.050 1.00 0.00 H new ATOM 0 HA LEU A 12 -3.043 8.780 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.766 10.746 2.567 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.403 9.034 2.476 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.555 8.820 0.372 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.607 10.748 -0.741 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.415 10.349 0.794 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.308 11.740 0.706 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.195 10.324 -1.031 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.200 11.298 0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.759 9.612 0.291 1.00 0.00 H new ATOM 162 N ARG A 13 -1.454 9.606 5.274 1.00 0.00 N ATOM 163 CA ARG A 13 -1.040 9.101 6.577 1.00 0.00 C ATOM 164 C ARG A 13 -2.189 8.370 7.267 1.00 0.00 C ATOM 165 O ARG A 13 -1.996 7.313 7.865 1.00 0.00 O ATOM 166 CB ARG A 13 -0.549 10.250 7.460 1.00 0.00 C ATOM 167 CG ARG A 13 0.669 10.968 6.903 1.00 0.00 C ATOM 168 CD ARG A 13 1.152 12.059 7.846 1.00 0.00 C ATOM 169 NE ARG A 13 2.558 12.389 7.627 1.00 0.00 N ATOM 170 CZ ARG A 13 3.182 13.387 8.241 1.00 0.00 C ATOM 171 NH1 ARG A 13 2.530 14.149 9.108 1.00 0.00 N ATOM 172 NH2 ARG A 13 4.463 13.625 7.989 1.00 0.00 N ATOM 0 H ARG A 13 -1.261 10.596 5.125 1.00 0.00 H new ATOM 0 HA ARG A 13 -0.224 8.395 6.423 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -1.358 10.970 7.588 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -0.310 9.860 8.449 1.00 0.00 H new ATOM 0 HG2 ARG A 13 1.471 10.249 6.735 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.424 11.405 5.935 1.00 0.00 H new ATOM 0 HD2 ARG A 13 0.544 12.953 7.708 1.00 0.00 H new ATOM 0 HD3 ARG A 13 1.012 11.735 8.877 1.00 0.00 H new ATOM 0 HE ARG A 13 3.089 11.822 6.966 1.00 0.00 H new ATOM 0 HH11 ARG A 13 1.546 13.969 9.305 1.00 0.00 H new ATOM 0 HH12 ARG A 13 3.013 14.915 9.578 1.00 0.00 H new ATOM 0 HH21 ARG A 13 4.969 13.041 7.323 1.00 0.00 H new ATOM 0 HH22 ARG A 13 4.942 14.392 8.461 1.00 0.00 H new ATOM 186 N LYS A 14 -3.385 8.943 7.179 1.00 0.00 N ATOM 187 CA LYS A 14 -4.566 8.347 7.793 1.00 0.00 C ATOM 188 C LYS A 14 -4.994 7.090 7.042 1.00 0.00 C ATOM 189 O LYS A 14 -5.380 6.092 7.651 1.00 0.00 O ATOM 190 CB LYS A 14 -5.716 9.356 7.817 1.00 0.00 C ATOM 191 CG LYS A 14 -7.057 8.740 8.180 1.00 0.00 C ATOM 192 CD LYS A 14 -7.803 8.263 6.947 1.00 0.00 C ATOM 193 CE LYS A 14 -8.465 9.419 6.213 1.00 0.00 C ATOM 194 NZ LYS A 14 -9.776 9.782 6.818 1.00 0.00 N ATOM 0 H LYS A 14 -3.562 9.820 6.688 1.00 0.00 H new ATOM 0 HA LYS A 14 -4.313 8.069 8.816 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -5.482 10.144 8.532 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.795 9.828 6.838 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -6.901 7.902 8.859 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -7.663 9.473 8.712 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.111 7.754 6.276 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.560 7.534 7.238 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -7.805 10.286 6.230 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.610 9.150 5.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.417 10.129 6.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.193 8.944 7.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -9.635 10.527 7.530 1.00 0.00 H new ATOM 208 N THR A 15 -4.922 7.145 5.715 1.00 0.00 N ATOM 209 CA THR A 15 -5.302 6.011 4.882 1.00 0.00 C ATOM 210 C THR A 15 -4.402 4.809 5.147 1.00 0.00 C ATOM 211 O THR A 15 -4.883 3.714 5.443 1.00 0.00 O ATOM 212 CB THR A 15 -5.236 6.367 3.386 1.00 0.00 C ATOM 213 OG1 THR A 15 -6.208 7.373 3.079 1.00 0.00 O ATOM 214 CG2 THR A 15 -5.484 5.137 2.526 1.00 0.00 C ATOM 0 H THR A 15 -4.604 7.963 5.195 1.00 0.00 H new ATOM 0 HA THR A 15 -6.329 5.757 5.142 1.00 0.00 H new ATOM 0 HB THR A 15 -4.238 6.748 3.169 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.910 8.236 3.435 1.00 0.00 H new ATOM 0 HG21 THR A 15 -5.433 5.413 1.473 1.00 0.00 H new ATOM 0 HG22 THR A 15 -4.726 4.384 2.741 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.471 4.732 2.747 1.00 0.00 H new ATOM 222 N LEU A 16 -3.095 5.019 5.038 1.00 0.00 N ATOM 223 CA LEU A 16 -2.127 3.951 5.267 1.00 0.00 C ATOM 224 C LEU A 16 -2.469 3.168 6.530 1.00 0.00 C ATOM 225 O LEU A 16 -2.468 1.937 6.526 1.00 0.00 O ATOM 226 CB LEU A 16 -0.716 4.532 5.379 1.00 0.00 C ATOM 227 CG LEU A 16 0.398 3.532 5.692 1.00 0.00 C ATOM 228 CD1 LEU A 16 0.573 2.551 4.543 1.00 0.00 C ATOM 229 CD2 LEU A 16 1.703 4.260 5.978 1.00 0.00 C ATOM 0 H LEU A 16 -2.681 5.918 4.793 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.167 3.269 4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.475 5.032 4.441 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.720 5.296 6.156 1.00 0.00 H new ATOM 0 HG LEU A 16 0.116 2.970 6.582 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.370 1.847 4.784 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.357 2.006 4.385 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.832 3.096 3.635 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.484 3.533 6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 16 1.990 4.848 5.106 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.571 4.921 6.834 1.00 0.00 H new ATOM 241 N GLU A 17 -2.761 3.889 7.607 1.00 0.00 N ATOM 242 CA GLU A 17 -3.106 3.260 8.876 1.00 0.00 C ATOM 243 C GLU A 17 -4.348 2.384 8.730 1.00 0.00 C ATOM 244 O GLU A 17 -4.413 1.286 9.280 1.00 0.00 O ATOM 245 CB GLU A 17 -3.343 4.324 9.951 1.00 0.00 C ATOM 246 CG GLU A 17 -2.103 5.136 10.286 1.00 0.00 C ATOM 247 CD GLU A 17 -2.311 6.055 11.474 1.00 0.00 C ATOM 248 OE1 GLU A 17 -3.418 6.618 11.602 1.00 0.00 O ATOM 249 OE2 GLU A 17 -1.367 6.210 12.276 1.00 0.00 O ATOM 0 H GLU A 17 -2.766 4.909 7.626 1.00 0.00 H new ATOM 0 HA GLU A 17 -2.270 2.629 9.178 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -4.130 4.999 9.615 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -3.705 3.839 10.857 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -1.275 4.458 10.496 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.817 5.730 9.418 1.00 0.00 H new ATOM 256 N GLN A 18 -5.331 2.882 7.986 1.00 0.00 N ATOM 257 CA GLN A 18 -6.571 2.147 7.769 1.00 0.00 C ATOM 258 C GLN A 18 -6.301 0.822 7.062 1.00 0.00 C ATOM 259 O GLN A 18 -6.906 -0.201 7.385 1.00 0.00 O ATOM 260 CB GLN A 18 -7.550 2.987 6.947 1.00 0.00 C ATOM 261 CG GLN A 18 -8.071 4.209 7.685 1.00 0.00 C ATOM 262 CD GLN A 18 -9.381 4.719 7.118 1.00 0.00 C ATOM 263 OE1 GLN A 18 -10.441 4.544 7.720 1.00 0.00 O ATOM 264 NE2 GLN A 18 -9.316 5.353 5.953 1.00 0.00 N ATOM 0 H GLN A 18 -5.292 3.791 7.524 1.00 0.00 H new ATOM 0 HA GLN A 18 -7.014 1.936 8.742 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -7.058 3.309 6.029 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -8.394 2.363 6.654 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -8.207 3.962 8.738 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -7.325 5.003 7.637 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -8.416 5.476 5.489 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -10.166 5.717 5.522 1.00 0.00 H new ATOM 273 N LEU A 19 -5.390 0.848 6.095 1.00 0.00 N ATOM 274 CA LEU A 19 -5.040 -0.351 5.341 1.00 0.00 C ATOM 275 C LEU A 19 -4.352 -1.376 6.237 1.00 0.00 C ATOM 276 O LEU A 19 -4.682 -2.561 6.207 1.00 0.00 O ATOM 277 CB LEU A 19 -4.129 0.009 4.167 1.00 0.00 C ATOM 278 CG LEU A 19 -4.795 0.742 3.001 1.00 0.00 C ATOM 279 CD1 LEU A 19 -3.750 1.425 2.134 1.00 0.00 C ATOM 280 CD2 LEU A 19 -5.632 -0.222 2.173 1.00 0.00 C ATOM 0 H LEU A 19 -4.881 1.686 5.815 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.961 -0.791 4.957 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.314 0.629 4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.682 -0.909 3.785 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.456 1.507 3.408 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.242 1.941 1.310 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -3.194 2.146 2.734 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -3.063 0.678 1.736 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -6.098 0.317 1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.993 -1.010 1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.406 -0.664 2.801 1.00 0.00 H new ATOM 292 N GLN A 20 -3.396 -0.910 7.035 1.00 0.00 N ATOM 293 CA GLN A 20 -2.664 -1.787 7.941 1.00 0.00 C ATOM 294 C GLN A 20 -3.620 -2.561 8.841 1.00 0.00 C ATOM 295 O GLN A 20 -3.485 -3.773 9.009 1.00 0.00 O ATOM 296 CB GLN A 20 -1.687 -0.974 8.792 1.00 0.00 C ATOM 297 CG GLN A 20 -0.309 -0.828 8.167 1.00 0.00 C ATOM 298 CD GLN A 20 0.571 -2.039 8.406 1.00 0.00 C ATOM 299 OE1 GLN A 20 0.133 -3.180 8.257 1.00 0.00 O ATOM 300 NE2 GLN A 20 1.822 -1.796 8.779 1.00 0.00 N ATOM 0 H GLN A 20 -3.111 0.069 7.072 1.00 0.00 H new ATOM 0 HA GLN A 20 -2.103 -2.502 7.340 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -2.106 0.018 8.963 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -1.585 -1.450 9.767 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -0.416 -0.667 7.094 1.00 0.00 H new ATOM 0 HG3 GLN A 20 0.179 0.057 8.575 1.00 0.00 H new ATOM 0 HE21 GLN A 20 2.143 -0.834 8.890 1.00 0.00 H new ATOM 0 HE22 GLN A 20 2.462 -2.571 8.954 1.00 0.00 H new ATOM 309 N GLU A 21 -4.586 -1.853 9.419 1.00 0.00 N ATOM 310 CA GLU A 21 -5.563 -2.475 10.304 1.00 0.00 C ATOM 311 C GLU A 21 -5.943 -3.865 9.803 1.00 0.00 C ATOM 312 O GLU A 21 -5.958 -4.830 10.567 1.00 0.00 O ATOM 313 CB GLU A 21 -6.815 -1.600 10.413 1.00 0.00 C ATOM 314 CG GLU A 21 -6.627 -0.376 11.294 1.00 0.00 C ATOM 315 CD GLU A 21 -7.935 0.138 11.863 1.00 0.00 C ATOM 316 OE1 GLU A 21 -8.726 -0.684 12.370 1.00 0.00 O ATOM 317 OE2 GLU A 21 -8.167 1.364 11.801 1.00 0.00 O ATOM 0 H GLU A 21 -4.712 -0.849 9.290 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.111 -2.574 11.291 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.110 -1.277 9.415 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.634 -2.200 10.809 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.951 -0.622 12.113 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.151 0.415 10.714 1.00 0.00 H new ATOM 324 N LYS A 22 -6.252 -3.960 8.514 1.00 0.00 N ATOM 325 CA LYS A 22 -6.631 -5.231 7.909 1.00 0.00 C ATOM 326 C LYS A 22 -5.569 -6.295 8.166 1.00 0.00 C ATOM 327 O LYS A 22 -5.888 -7.438 8.492 1.00 0.00 O ATOM 328 CB LYS A 22 -6.842 -5.059 6.403 1.00 0.00 C ATOM 329 CG LYS A 22 -7.841 -3.972 6.049 1.00 0.00 C ATOM 330 CD LYS A 22 -9.269 -4.415 6.324 1.00 0.00 C ATOM 331 CE LYS A 22 -10.232 -3.238 6.297 1.00 0.00 C ATOM 332 NZ LYS A 22 -11.477 -3.524 7.063 1.00 0.00 N ATOM 0 H LYS A 22 -6.247 -3.171 7.868 1.00 0.00 H new ATOM 0 HA LYS A 22 -7.565 -5.558 8.366 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -5.885 -4.828 5.935 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -7.183 -6.005 5.982 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.621 -3.073 6.625 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -7.737 -3.710 4.996 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.572 -5.152 5.580 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.318 -4.905 7.296 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -9.742 -2.358 6.715 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.487 -3.001 5.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -12.239 -2.898 6.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.755 -4.515 6.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.307 -3.359 8.076 1.00 0.00 H new ATOM 346 N ASP A 23 -4.305 -5.911 8.017 1.00 0.00 N ATOM 347 CA ASP A 23 -3.196 -6.832 8.237 1.00 0.00 C ATOM 348 C ASP A 23 -3.224 -7.388 9.658 1.00 0.00 C ATOM 349 O ASP A 23 -3.049 -6.651 10.628 1.00 0.00 O ATOM 350 CB ASP A 23 -1.863 -6.129 7.976 1.00 0.00 C ATOM 351 CG ASP A 23 -0.673 -7.041 8.206 1.00 0.00 C ATOM 352 OD1 ASP A 23 -0.855 -8.108 8.829 1.00 0.00 O ATOM 353 OD2 ASP A 23 0.439 -6.687 7.760 1.00 0.00 O ATOM 0 H ASP A 23 -4.024 -4.969 7.745 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.302 -7.663 7.540 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -1.843 -5.763 6.950 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -1.781 -5.258 8.627 1.00 0.00 H new ATOM 358 N THR A 24 -3.446 -8.694 9.772 1.00 0.00 N ATOM 359 CA THR A 24 -3.499 -9.348 11.073 1.00 0.00 C ATOM 360 C THR A 24 -2.224 -10.141 11.342 1.00 0.00 C ATOM 361 O THR A 24 -1.685 -10.111 12.447 1.00 0.00 O ATOM 362 CB THR A 24 -4.710 -10.294 11.177 1.00 0.00 C ATOM 363 OG1 THR A 24 -4.595 -11.345 10.212 1.00 0.00 O ATOM 364 CG2 THR A 24 -6.010 -9.535 10.956 1.00 0.00 C ATOM 0 H THR A 24 -3.592 -9.319 8.979 1.00 0.00 H new ATOM 0 HA THR A 24 -3.598 -8.560 11.819 1.00 0.00 H new ATOM 0 HB THR A 24 -4.724 -10.722 12.179 1.00 0.00 H new ATOM 0 HG1 THR A 24 -5.368 -11.943 10.286 1.00 0.00 H new ATOM 0 HG21 THR A 24 -6.851 -10.224 11.034 1.00 0.00 H new ATOM 0 HG22 THR A 24 -6.109 -8.755 11.711 1.00 0.00 H new ATOM 0 HG23 THR A 24 -6.003 -9.082 9.965 1.00 0.00 H new ATOM 372 N GLY A 25 -1.747 -10.849 10.322 1.00 0.00 N ATOM 373 CA GLY A 25 -0.540 -11.640 10.470 1.00 0.00 C ATOM 374 C GLY A 25 0.719 -10.810 10.316 1.00 0.00 C ATOM 375 O GLY A 25 1.818 -11.352 10.204 1.00 0.00 O ATOM 0 H GLY A 25 -2.175 -10.888 9.397 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.540 -12.117 11.450 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.539 -12.438 9.727 1.00 0.00 H new ATOM 379 N ASN A 26 0.558 -9.491 10.308 1.00 0.00 N ATOM 380 CA ASN A 26 1.692 -8.584 10.164 1.00 0.00 C ATOM 381 C ASN A 26 2.689 -9.117 9.140 1.00 0.00 C ATOM 382 O ASN A 26 3.896 -8.918 9.273 1.00 0.00 O ATOM 383 CB ASN A 26 2.386 -8.383 11.513 1.00 0.00 C ATOM 384 CG ASN A 26 2.950 -9.676 12.070 1.00 0.00 C ATOM 385 OD1 ASN A 26 2.213 -10.516 12.587 1.00 0.00 O ATOM 386 ND2 ASN A 26 4.264 -9.842 11.967 1.00 0.00 N ATOM 0 H ASN A 26 -0.345 -9.026 10.399 1.00 0.00 H new ATOM 0 HA ASN A 26 1.315 -7.624 9.811 1.00 0.00 H new ATOM 0 HB2 ASN A 26 3.191 -7.657 11.400 1.00 0.00 H new ATOM 0 HB3 ASN A 26 1.676 -7.963 12.225 1.00 0.00 H new ATOM 0 HD21 ASN A 26 4.700 -10.692 12.324 1.00 0.00 H new ATOM 0 HD22 ASN A 26 4.837 -9.119 11.531 1.00 0.00 H new ATOM 393 N ILE A 27 2.174 -9.796 8.119 1.00 0.00 N ATOM 394 CA ILE A 27 3.020 -10.356 7.073 1.00 0.00 C ATOM 395 C ILE A 27 3.565 -9.262 6.161 1.00 0.00 C ATOM 396 O ILE A 27 4.712 -9.321 5.720 1.00 0.00 O ATOM 397 CB ILE A 27 2.252 -11.385 6.220 1.00 0.00 C ATOM 398 CG1 ILE A 27 1.775 -12.548 7.092 1.00 0.00 C ATOM 399 CG2 ILE A 27 3.129 -11.891 5.084 1.00 0.00 C ATOM 400 CD1 ILE A 27 0.739 -13.421 6.419 1.00 0.00 C ATOM 0 H ILE A 27 1.177 -9.971 7.995 1.00 0.00 H new ATOM 0 HA ILE A 27 3.850 -10.856 7.572 1.00 0.00 H new ATOM 0 HB ILE A 27 1.378 -10.898 5.788 1.00 0.00 H new ATOM 0 HG12 ILE A 27 2.633 -13.162 7.366 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.358 -12.151 8.017 1.00 0.00 H new ATOM 0 HG21 ILE A 27 2.573 -12.617 4.491 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.423 -11.054 4.451 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.020 -12.365 5.496 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.446 -14.225 7.094 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.136 -12.821 6.169 1.00 0.00 H new ATOM 0 HD13 ILE A 27 1.159 -13.847 5.508 1.00 0.00 H new ATOM 412 N PHE A 28 2.734 -8.262 5.884 1.00 0.00 N ATOM 413 CA PHE A 28 3.132 -7.153 5.025 1.00 0.00 C ATOM 414 C PHE A 28 3.537 -5.939 5.857 1.00 0.00 C ATOM 415 O PHE A 28 4.191 -5.023 5.361 1.00 0.00 O ATOM 416 CB PHE A 28 1.991 -6.778 4.077 1.00 0.00 C ATOM 417 CG PHE A 28 1.256 -7.966 3.525 1.00 0.00 C ATOM 418 CD1 PHE A 28 0.179 -8.510 4.205 1.00 0.00 C ATOM 419 CD2 PHE A 28 1.644 -8.539 2.323 1.00 0.00 C ATOM 420 CE1 PHE A 28 -0.497 -9.603 3.699 1.00 0.00 C ATOM 421 CE2 PHE A 28 0.970 -9.632 1.812 1.00 0.00 C ATOM 422 CZ PHE A 28 -0.102 -10.165 2.500 1.00 0.00 C ATOM 0 H PHE A 28 1.781 -8.197 6.242 1.00 0.00 H new ATOM 0 HA PHE A 28 3.992 -7.473 4.437 1.00 0.00 H new ATOM 0 HB2 PHE A 28 1.285 -6.138 4.606 1.00 0.00 H new ATOM 0 HB3 PHE A 28 2.394 -6.193 3.250 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -0.136 -8.074 5.142 1.00 0.00 H new ATOM 0 HD2 PHE A 28 2.482 -8.127 1.780 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.334 -10.018 4.240 1.00 0.00 H new ATOM 0 HE2 PHE A 28 1.282 -10.069 0.875 1.00 0.00 H new ATOM 0 HZ PHE A 28 -0.630 -11.019 2.102 1.00 0.00 H new ATOM 432 N SER A 29 3.140 -5.940 7.126 1.00 0.00 N ATOM 433 CA SER A 29 3.457 -4.838 8.027 1.00 0.00 C ATOM 434 C SER A 29 4.961 -4.586 8.068 1.00 0.00 C ATOM 435 O SER A 29 5.411 -3.526 8.501 1.00 0.00 O ATOM 436 CB SER A 29 2.940 -5.139 9.435 1.00 0.00 C ATOM 437 OG SER A 29 2.664 -3.941 10.142 1.00 0.00 O ATOM 0 H SER A 29 2.598 -6.691 7.553 1.00 0.00 H new ATOM 0 HA SER A 29 2.966 -3.940 7.651 1.00 0.00 H new ATOM 0 HB2 SER A 29 2.036 -5.745 9.373 1.00 0.00 H new ATOM 0 HB3 SER A 29 3.680 -5.725 9.980 1.00 0.00 H new ATOM 0 HG SER A 29 2.333 -4.159 11.038 1.00 0.00 H new ATOM 443 N GLU A 30 5.733 -5.568 7.613 1.00 0.00 N ATOM 444 CA GLU A 30 7.186 -5.452 7.599 1.00 0.00 C ATOM 445 C GLU A 30 7.749 -5.844 6.236 1.00 0.00 C ATOM 446 O GLU A 30 7.166 -6.640 5.501 1.00 0.00 O ATOM 447 CB GLU A 30 7.801 -6.333 8.689 1.00 0.00 C ATOM 448 CG GLU A 30 7.083 -6.238 10.025 1.00 0.00 C ATOM 449 CD GLU A 30 7.910 -6.785 11.171 1.00 0.00 C ATOM 450 OE1 GLU A 30 7.829 -8.004 11.432 1.00 0.00 O ATOM 451 OE2 GLU A 30 8.638 -5.996 11.809 1.00 0.00 O ATOM 0 H GLU A 30 5.377 -6.452 7.250 1.00 0.00 H new ATOM 0 HA GLU A 30 7.444 -4.411 7.795 1.00 0.00 H new ATOM 0 HB2 GLU A 30 7.792 -7.370 8.354 1.00 0.00 H new ATOM 0 HB3 GLU A 30 8.845 -6.051 8.826 1.00 0.00 H new ATOM 0 HG2 GLU A 30 6.834 -5.196 10.226 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.142 -6.785 9.967 1.00 0.00 H new ATOM 458 N PRO A 31 8.913 -5.271 5.890 1.00 0.00 N ATOM 459 CA PRO A 31 9.581 -5.544 4.614 1.00 0.00 C ATOM 460 C PRO A 31 10.145 -6.960 4.547 1.00 0.00 C ATOM 461 O PRO A 31 10.730 -7.452 5.513 1.00 0.00 O ATOM 462 CB PRO A 31 10.713 -4.514 4.579 1.00 0.00 C ATOM 463 CG PRO A 31 10.986 -4.203 6.010 1.00 0.00 C ATOM 464 CD PRO A 31 9.664 -4.313 6.718 1.00 0.00 C ATOM 0 HA PRO A 31 8.895 -5.471 3.770 1.00 0.00 H new ATOM 0 HB2 PRO A 31 11.598 -4.915 4.085 1.00 0.00 H new ATOM 0 HB3 PRO A 31 10.418 -3.620 4.029 1.00 0.00 H new ATOM 0 HG2 PRO A 31 11.712 -4.900 6.429 1.00 0.00 H new ATOM 0 HG3 PRO A 31 11.405 -3.203 6.119 1.00 0.00 H new ATOM 0 HD2 PRO A 31 9.784 -4.673 7.740 1.00 0.00 H new ATOM 0 HD3 PRO A 31 9.158 -3.349 6.777 1.00 0.00 H new ATOM 472 N VAL A 32 9.969 -7.608 3.401 1.00 0.00 N ATOM 473 CA VAL A 32 10.463 -8.966 3.207 1.00 0.00 C ATOM 474 C VAL A 32 11.973 -9.034 3.398 1.00 0.00 C ATOM 475 O VAL A 32 12.748 -8.457 2.635 1.00 0.00 O ATOM 476 CB VAL A 32 10.110 -9.497 1.805 1.00 0.00 C ATOM 477 CG1 VAL A 32 10.697 -10.885 1.596 1.00 0.00 C ATOM 478 CG2 VAL A 32 8.602 -9.512 1.606 1.00 0.00 C ATOM 0 H VAL A 32 9.488 -7.215 2.592 1.00 0.00 H new ATOM 0 HA VAL A 32 9.976 -9.590 3.957 1.00 0.00 H new ATOM 0 HB VAL A 32 10.545 -8.829 1.062 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.437 -11.244 0.600 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.782 -10.840 1.694 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.293 -11.567 2.344 1.00 0.00 H new ATOM 0 HG21 VAL A 32 8.370 -9.890 0.610 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.143 -10.157 2.355 1.00 0.00 H new ATOM 0 HG23 VAL A 32 8.211 -8.500 1.710 1.00 0.00 H new ATOM 488 N PRO A 33 12.406 -9.757 4.442 1.00 0.00 N ATOM 489 CA PRO A 33 13.828 -9.919 4.759 1.00 0.00 C ATOM 490 C PRO A 33 14.555 -10.784 3.734 1.00 0.00 C ATOM 491 O PRO A 33 14.211 -11.950 3.534 1.00 0.00 O ATOM 492 CB PRO A 33 13.811 -10.610 6.124 1.00 0.00 C ATOM 493 CG PRO A 33 12.504 -11.323 6.173 1.00 0.00 C ATOM 494 CD PRO A 33 11.539 -10.473 5.394 1.00 0.00 C ATOM 0 HA PRO A 33 14.357 -8.966 4.755 1.00 0.00 H new ATOM 0 HB2 PRO A 33 14.645 -11.305 6.226 1.00 0.00 H new ATOM 0 HB3 PRO A 33 13.898 -9.887 6.935 1.00 0.00 H new ATOM 0 HG2 PRO A 33 12.586 -12.319 5.738 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.168 -11.452 7.202 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.793 -11.080 4.880 1.00 0.00 H new ATOM 0 HD3 PRO A 33 10.998 -9.783 6.042 1.00 0.00 H new ATOM 502 N LEU A 34 15.561 -10.206 3.086 1.00 0.00 N ATOM 503 CA LEU A 34 16.337 -10.924 2.082 1.00 0.00 C ATOM 504 C LEU A 34 17.036 -12.132 2.695 1.00 0.00 C ATOM 505 O LEU A 34 17.236 -13.150 2.031 1.00 0.00 O ATOM 506 CB LEU A 34 17.369 -9.992 1.445 1.00 0.00 C ATOM 507 CG LEU A 34 16.809 -8.824 0.633 1.00 0.00 C ATOM 508 CD1 LEU A 34 17.938 -8.003 0.029 1.00 0.00 C ATOM 509 CD2 LEU A 34 15.873 -9.330 -0.455 1.00 0.00 C ATOM 0 H LEU A 34 15.858 -9.242 3.238 1.00 0.00 H new ATOM 0 HA LEU A 34 15.651 -11.277 1.312 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.001 -9.588 2.236 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.012 -10.585 0.795 1.00 0.00 H new ATOM 0 HG LEU A 34 16.239 -8.181 1.304 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.520 -7.176 -0.545 1.00 0.00 H new ATOM 0 HD12 LEU A 34 18.568 -7.609 0.826 1.00 0.00 H new ATOM 0 HD13 LEU A 34 18.536 -8.635 -0.628 1.00 0.00 H new ATOM 0 HD21 LEU A 34 15.484 -8.485 -1.023 1.00 0.00 H new ATOM 0 HD22 LEU A 34 16.419 -9.996 -1.124 1.00 0.00 H new ATOM 0 HD23 LEU A 34 15.045 -9.873 0.001 1.00 0.00 H new ATOM 521 N SER A 35 17.404 -12.014 3.967 1.00 0.00 N ATOM 522 CA SER A 35 18.083 -13.097 4.670 1.00 0.00 C ATOM 523 C SER A 35 17.433 -14.441 4.354 1.00 0.00 C ATOM 524 O SER A 35 18.119 -15.447 4.180 1.00 0.00 O ATOM 525 CB SER A 35 18.058 -12.848 6.179 1.00 0.00 C ATOM 526 OG SER A 35 18.996 -13.672 6.849 1.00 0.00 O ATOM 0 H SER A 35 17.244 -11.180 4.532 1.00 0.00 H new ATOM 0 HA SER A 35 19.118 -13.125 4.331 1.00 0.00 H new ATOM 0 HB2 SER A 35 18.280 -11.800 6.381 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.058 -13.042 6.566 1.00 0.00 H new ATOM 0 HG SER A 35 18.961 -13.492 7.812 1.00 0.00 H new ATOM 532 N GLU A 36 16.106 -14.447 4.284 1.00 0.00 N ATOM 533 CA GLU A 36 15.363 -15.667 3.990 1.00 0.00 C ATOM 534 C GLU A 36 15.057 -15.772 2.498 1.00 0.00 C ATOM 535 O GLU A 36 14.985 -16.869 1.944 1.00 0.00 O ATOM 536 CB GLU A 36 14.060 -15.703 4.793 1.00 0.00 C ATOM 537 CG GLU A 36 13.542 -17.109 5.048 1.00 0.00 C ATOM 538 CD GLU A 36 14.517 -17.954 5.846 1.00 0.00 C ATOM 539 OE1 GLU A 36 14.839 -17.569 6.988 1.00 0.00 O ATOM 540 OE2 GLU A 36 14.957 -19.000 5.324 1.00 0.00 O ATOM 0 H GLU A 36 15.524 -13.622 4.427 1.00 0.00 H new ATOM 0 HA GLU A 36 15.982 -16.517 4.277 1.00 0.00 H new ATOM 0 HB2 GLU A 36 14.218 -15.204 5.749 1.00 0.00 H new ATOM 0 HB3 GLU A 36 13.298 -15.135 4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 36 12.594 -17.052 5.583 1.00 0.00 H new ATOM 0 HG3 GLU A 36 13.340 -17.597 4.094 1.00 0.00 H new ATOM 547 N VAL A 37 14.878 -14.623 1.854 1.00 0.00 N ATOM 548 CA VAL A 37 14.580 -14.585 0.427 1.00 0.00 C ATOM 549 C VAL A 37 15.739 -13.982 -0.359 1.00 0.00 C ATOM 550 O VAL A 37 15.781 -12.781 -0.628 1.00 0.00 O ATOM 551 CB VAL A 37 13.303 -13.774 0.142 1.00 0.00 C ATOM 552 CG1 VAL A 37 12.688 -14.195 -1.183 1.00 0.00 C ATOM 553 CG2 VAL A 37 12.304 -13.936 1.278 1.00 0.00 C ATOM 0 H VAL A 37 14.934 -13.706 2.298 1.00 0.00 H new ATOM 0 HA VAL A 37 14.425 -15.616 0.107 1.00 0.00 H new ATOM 0 HB VAL A 37 13.571 -12.720 0.072 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.786 -13.611 -1.368 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.403 -14.022 -1.987 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.433 -15.254 -1.146 1.00 0.00 H new ATOM 0 HG21 VAL A 37 11.407 -13.356 1.060 1.00 0.00 H new ATOM 0 HG22 VAL A 37 12.039 -14.988 1.382 1.00 0.00 H new ATOM 0 HG23 VAL A 37 12.749 -13.580 2.207 1.00 0.00 H new ATOM 563 N PRO A 38 16.704 -14.834 -0.738 1.00 0.00 N ATOM 564 CA PRO A 38 17.881 -14.407 -1.501 1.00 0.00 C ATOM 565 C PRO A 38 17.533 -14.011 -2.932 1.00 0.00 C ATOM 566 O PRO A 38 18.303 -13.322 -3.600 1.00 0.00 O ATOM 567 CB PRO A 38 18.777 -15.648 -1.492 1.00 0.00 C ATOM 568 CG PRO A 38 17.840 -16.792 -1.314 1.00 0.00 C ATOM 569 CD PRO A 38 16.720 -16.278 -0.452 1.00 0.00 C ATOM 0 HA PRO A 38 18.349 -13.523 -1.068 1.00 0.00 H new ATOM 0 HB2 PRO A 38 19.338 -15.737 -2.422 1.00 0.00 H new ATOM 0 HB3 PRO A 38 19.506 -15.604 -0.683 1.00 0.00 H new ATOM 0 HG2 PRO A 38 17.464 -17.142 -2.275 1.00 0.00 H new ATOM 0 HG3 PRO A 38 18.341 -17.637 -0.841 1.00 0.00 H new ATOM 0 HD2 PRO A 38 15.770 -16.748 -0.705 1.00 0.00 H new ATOM 0 HD3 PRO A 38 16.902 -16.476 0.604 1.00 0.00 H new ATOM 577 N ASP A 39 16.368 -14.450 -3.395 1.00 0.00 N ATOM 578 CA ASP A 39 15.916 -14.140 -4.746 1.00 0.00 C ATOM 579 C ASP A 39 14.606 -13.361 -4.717 1.00 0.00 C ATOM 580 O ASP A 39 13.750 -13.532 -5.585 1.00 0.00 O ATOM 581 CB ASP A 39 15.742 -15.426 -5.557 1.00 0.00 C ATOM 582 CG ASP A 39 17.011 -15.831 -6.281 1.00 0.00 C ATOM 583 OD1 ASP A 39 18.017 -16.118 -5.600 1.00 0.00 O ATOM 584 OD2 ASP A 39 16.996 -15.861 -7.529 1.00 0.00 O ATOM 0 H ASP A 39 15.719 -15.022 -2.854 1.00 0.00 H new ATOM 0 HA ASP A 39 16.675 -13.519 -5.222 1.00 0.00 H new ATOM 0 HB2 ASP A 39 15.434 -16.233 -4.892 1.00 0.00 H new ATOM 0 HB3 ASP A 39 14.941 -15.288 -6.283 1.00 0.00 H new ATOM 589 N TYR A 40 14.454 -12.506 -3.711 1.00 0.00 N ATOM 590 CA TYR A 40 13.246 -11.703 -3.565 1.00 0.00 C ATOM 591 C TYR A 40 13.009 -10.846 -4.804 1.00 0.00 C ATOM 592 O TYR A 40 11.947 -10.913 -5.427 1.00 0.00 O ATOM 593 CB TYR A 40 13.347 -10.811 -2.327 1.00 0.00 C ATOM 594 CG TYR A 40 12.135 -9.932 -2.113 1.00 0.00 C ATOM 595 CD1 TYR A 40 10.852 -10.462 -2.157 1.00 0.00 C ATOM 596 CD2 TYR A 40 12.275 -8.572 -1.865 1.00 0.00 C ATOM 597 CE1 TYR A 40 9.743 -9.663 -1.963 1.00 0.00 C ATOM 598 CE2 TYR A 40 11.171 -7.765 -1.669 1.00 0.00 C ATOM 599 CZ TYR A 40 9.907 -8.314 -1.719 1.00 0.00 C ATOM 600 OH TYR A 40 8.804 -7.515 -1.523 1.00 0.00 O ATOM 0 H TYR A 40 15.153 -12.352 -2.984 1.00 0.00 H new ATOM 0 HA TYR A 40 12.402 -12.382 -3.447 1.00 0.00 H new ATOM 0 HB2 TYR A 40 13.490 -11.439 -1.448 1.00 0.00 H new ATOM 0 HB3 TYR A 40 14.232 -10.180 -2.415 1.00 0.00 H new ATOM 0 HD1 TYR A 40 10.720 -11.517 -2.346 1.00 0.00 H new ATOM 0 HD2 TYR A 40 13.263 -8.139 -1.825 1.00 0.00 H new ATOM 0 HE1 TYR A 40 8.752 -10.091 -2.002 1.00 0.00 H new ATOM 0 HE2 TYR A 40 11.297 -6.710 -1.478 1.00 0.00 H new ATOM 0 HH TYR A 40 9.093 -6.592 -1.362 1.00 0.00 H new ATOM 610 N LEU A 41 14.005 -10.041 -5.158 1.00 0.00 N ATOM 611 CA LEU A 41 13.907 -9.170 -6.324 1.00 0.00 C ATOM 612 C LEU A 41 13.918 -9.983 -7.615 1.00 0.00 C ATOM 613 O LEU A 41 13.152 -9.711 -8.539 1.00 0.00 O ATOM 614 CB LEU A 41 15.058 -8.164 -6.333 1.00 0.00 C ATOM 615 CG LEU A 41 15.271 -7.376 -5.039 1.00 0.00 C ATOM 616 CD1 LEU A 41 16.590 -6.620 -5.086 1.00 0.00 C ATOM 617 CD2 LEU A 41 14.113 -6.419 -4.802 1.00 0.00 C ATOM 0 H LEU A 41 14.889 -9.973 -4.654 1.00 0.00 H new ATOM 0 HA LEU A 41 12.962 -8.631 -6.264 1.00 0.00 H new ATOM 0 HB2 LEU A 41 15.979 -8.698 -6.565 1.00 0.00 H new ATOM 0 HB3 LEU A 41 14.888 -7.455 -7.143 1.00 0.00 H new ATOM 0 HG LEU A 41 15.310 -8.081 -4.208 1.00 0.00 H new ATOM 0 HD11 LEU A 41 16.725 -6.065 -4.157 1.00 0.00 H new ATOM 0 HD12 LEU A 41 17.410 -7.327 -5.209 1.00 0.00 H new ATOM 0 HD13 LEU A 41 16.581 -5.925 -5.926 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.281 -5.867 -3.877 1.00 0.00 H new ATOM 0 HD22 LEU A 41 14.043 -5.719 -5.635 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.184 -6.984 -4.724 1.00 0.00 H new ATOM 629 N ASP A 42 14.789 -10.984 -7.669 1.00 0.00 N ATOM 630 CA ASP A 42 14.898 -11.841 -8.844 1.00 0.00 C ATOM 631 C ASP A 42 13.535 -12.042 -9.498 1.00 0.00 C ATOM 632 O ASP A 42 13.417 -12.050 -10.725 1.00 0.00 O ATOM 633 CB ASP A 42 15.499 -13.195 -8.462 1.00 0.00 C ATOM 634 CG ASP A 42 17.013 -13.161 -8.407 1.00 0.00 C ATOM 635 OD1 ASP A 42 17.647 -13.237 -9.480 1.00 0.00 O ATOM 636 OD2 ASP A 42 17.565 -13.060 -7.291 1.00 0.00 O ATOM 0 H ASP A 42 15.430 -11.222 -6.913 1.00 0.00 H new ATOM 0 HA ASP A 42 15.556 -11.350 -9.561 1.00 0.00 H new ATOM 0 HB2 ASP A 42 15.110 -13.501 -7.491 1.00 0.00 H new ATOM 0 HB3 ASP A 42 15.181 -13.947 -9.184 1.00 0.00 H new ATOM 641 N HIS A 43 12.506 -12.204 -8.673 1.00 0.00 N ATOM 642 CA HIS A 43 11.150 -12.407 -9.170 1.00 0.00 C ATOM 643 C HIS A 43 10.354 -11.105 -9.121 1.00 0.00 C ATOM 644 O HIS A 43 9.489 -10.865 -9.963 1.00 0.00 O ATOM 645 CB HIS A 43 10.439 -13.485 -8.352 1.00 0.00 C ATOM 646 CG HIS A 43 11.029 -14.850 -8.519 1.00 0.00 C ATOM 647 ND1 HIS A 43 10.455 -15.828 -9.304 1.00 0.00 N ATOM 648 CD2 HIS A 43 12.151 -15.399 -7.999 1.00 0.00 C ATOM 649 CE1 HIS A 43 11.197 -16.919 -9.258 1.00 0.00 C ATOM 650 NE2 HIS A 43 12.233 -16.686 -8.472 1.00 0.00 N ATOM 0 H HIS A 43 12.585 -12.199 -7.656 1.00 0.00 H new ATOM 0 HA HIS A 43 11.215 -12.735 -10.208 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.472 -13.210 -7.298 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.388 -13.515 -8.641 1.00 0.00 H new ATOM 0 HD2 HIS A 43 12.852 -14.915 -7.335 1.00 0.00 H new ATOM 0 HE1 HIS A 43 10.992 -17.845 -9.775 1.00 0.00 H new ATOM 0 HE2 HIS A 43 12.973 -17.353 -8.252 1.00 0.00 H new ATOM 659 N ILE A 44 10.652 -10.273 -8.129 1.00 0.00 N ATOM 660 CA ILE A 44 9.964 -8.997 -7.972 1.00 0.00 C ATOM 661 C ILE A 44 10.840 -7.839 -8.436 1.00 0.00 C ATOM 662 O ILE A 44 11.950 -7.646 -7.938 1.00 0.00 O ATOM 663 CB ILE A 44 9.551 -8.758 -6.508 1.00 0.00 C ATOM 664 CG1 ILE A 44 8.526 -9.805 -6.067 1.00 0.00 C ATOM 665 CG2 ILE A 44 8.989 -7.354 -6.338 1.00 0.00 C ATOM 666 CD1 ILE A 44 7.417 -10.026 -7.072 1.00 0.00 C ATOM 0 H ILE A 44 11.364 -10.459 -7.423 1.00 0.00 H new ATOM 0 HA ILE A 44 9.069 -9.043 -8.592 1.00 0.00 H new ATOM 0 HB ILE A 44 10.434 -8.853 -5.877 1.00 0.00 H new ATOM 0 HG12 ILE A 44 9.038 -10.751 -5.889 1.00 0.00 H new ATOM 0 HG13 ILE A 44 8.089 -9.496 -5.118 1.00 0.00 H new ATOM 0 HG21 ILE A 44 8.702 -7.201 -5.298 1.00 0.00 H new ATOM 0 HG22 ILE A 44 9.747 -6.622 -6.617 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.115 -7.232 -6.978 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.728 -10.781 -6.693 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.879 -9.091 -7.232 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.844 -10.365 -8.016 1.00 0.00 H new ATOM 678 N LYS A 45 10.335 -7.068 -9.393 1.00 0.00 N ATOM 679 CA LYS A 45 11.069 -5.926 -9.924 1.00 0.00 C ATOM 680 C LYS A 45 10.904 -4.706 -9.023 1.00 0.00 C ATOM 681 O LYS A 45 11.882 -4.056 -8.657 1.00 0.00 O ATOM 682 CB LYS A 45 10.586 -5.596 -11.339 1.00 0.00 C ATOM 683 CG LYS A 45 11.092 -6.564 -12.395 1.00 0.00 C ATOM 684 CD LYS A 45 10.235 -7.817 -12.460 1.00 0.00 C ATOM 685 CE LYS A 45 8.923 -7.558 -13.187 1.00 0.00 C ATOM 686 NZ LYS A 45 9.107 -7.520 -14.664 1.00 0.00 N ATOM 0 H LYS A 45 9.419 -7.214 -9.817 1.00 0.00 H new ATOM 0 HA LYS A 45 12.126 -6.190 -9.959 1.00 0.00 H new ATOM 0 HB2 LYS A 45 9.496 -5.595 -11.351 1.00 0.00 H new ATOM 0 HB3 LYS A 45 10.908 -4.587 -11.598 1.00 0.00 H new ATOM 0 HG2 LYS A 45 11.095 -6.073 -13.368 1.00 0.00 H new ATOM 0 HG3 LYS A 45 12.123 -6.839 -12.174 1.00 0.00 H new ATOM 0 HD2 LYS A 45 10.784 -8.609 -12.969 1.00 0.00 H new ATOM 0 HD3 LYS A 45 10.029 -8.171 -11.450 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.205 -8.337 -12.930 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.501 -6.612 -12.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 8.182 -7.409 -15.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.719 -6.718 -14.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.549 -8.406 -14.982 1.00 0.00 H new ATOM 700 N LYS A 46 9.660 -4.403 -8.667 1.00 0.00 N ATOM 701 CA LYS A 46 9.366 -3.263 -7.806 1.00 0.00 C ATOM 702 C LYS A 46 8.778 -3.725 -6.477 1.00 0.00 C ATOM 703 O LYS A 46 7.562 -3.801 -6.301 1.00 0.00 O ATOM 704 CB LYS A 46 8.395 -2.309 -8.503 1.00 0.00 C ATOM 705 CG LYS A 46 8.556 -0.859 -8.078 1.00 0.00 C ATOM 706 CD LYS A 46 8.301 -0.683 -6.590 1.00 0.00 C ATOM 707 CE LYS A 46 7.729 0.692 -6.282 1.00 0.00 C ATOM 708 NZ LYS A 46 8.634 1.784 -6.736 1.00 0.00 N ATOM 0 H LYS A 46 8.839 -4.931 -8.962 1.00 0.00 H new ATOM 0 HA LYS A 46 10.300 -2.738 -7.607 1.00 0.00 H new ATOM 0 HB2 LYS A 46 8.539 -2.381 -9.581 1.00 0.00 H new ATOM 0 HB3 LYS A 46 7.374 -2.628 -8.296 1.00 0.00 H new ATOM 0 HG2 LYS A 46 9.563 -0.518 -8.318 1.00 0.00 H new ATOM 0 HG3 LYS A 46 7.864 -0.234 -8.643 1.00 0.00 H new ATOM 0 HD2 LYS A 46 7.610 -1.452 -6.245 1.00 0.00 H new ATOM 0 HD3 LYS A 46 9.232 -0.822 -6.041 1.00 0.00 H new ATOM 0 HE2 LYS A 46 6.759 0.799 -6.768 1.00 0.00 H new ATOM 0 HE3 LYS A 46 7.560 0.783 -5.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 8.277 2.697 -6.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 9.590 1.621 -6.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.668 1.797 -7.775 1.00 0.00 H new ATOM 722 N PRO A 47 9.659 -4.037 -5.514 1.00 0.00 N ATOM 723 CA PRO A 47 9.250 -4.493 -4.183 1.00 0.00 C ATOM 724 C PRO A 47 8.601 -3.382 -3.364 1.00 0.00 C ATOM 725 O PRO A 47 9.002 -2.221 -3.448 1.00 0.00 O ATOM 726 CB PRO A 47 10.566 -4.935 -3.539 1.00 0.00 C ATOM 727 CG PRO A 47 11.616 -4.146 -4.243 1.00 0.00 C ATOM 728 CD PRO A 47 11.124 -3.969 -5.653 1.00 0.00 C ATOM 0 HA PRO A 47 8.500 -5.282 -4.235 1.00 0.00 H new ATOM 0 HB2 PRO A 47 10.570 -4.733 -2.468 1.00 0.00 H new ATOM 0 HB3 PRO A 47 10.727 -6.006 -3.662 1.00 0.00 H new ATOM 0 HG2 PRO A 47 11.770 -3.181 -3.759 1.00 0.00 H new ATOM 0 HG3 PRO A 47 12.573 -4.667 -4.226 1.00 0.00 H new ATOM 0 HD2 PRO A 47 11.444 -3.016 -6.074 1.00 0.00 H new ATOM 0 HD3 PRO A 47 11.502 -4.751 -6.312 1.00 0.00 H new ATOM 736 N MET A 48 7.598 -3.746 -2.572 1.00 0.00 N ATOM 737 CA MET A 48 6.896 -2.779 -1.737 1.00 0.00 C ATOM 738 C MET A 48 6.404 -3.430 -0.447 1.00 0.00 C ATOM 739 O MET A 48 6.352 -4.656 -0.341 1.00 0.00 O ATOM 740 CB MET A 48 5.714 -2.176 -2.500 1.00 0.00 C ATOM 741 CG MET A 48 5.032 -1.036 -1.761 1.00 0.00 C ATOM 742 SD MET A 48 6.185 0.257 -1.262 1.00 0.00 S ATOM 743 CE MET A 48 6.953 0.650 -2.831 1.00 0.00 C ATOM 0 H MET A 48 7.253 -4.703 -2.491 1.00 0.00 H new ATOM 0 HA MET A 48 7.596 -1.984 -1.479 1.00 0.00 H new ATOM 0 HB2 MET A 48 6.063 -1.814 -3.467 1.00 0.00 H new ATOM 0 HB3 MET A 48 4.982 -2.959 -2.698 1.00 0.00 H new ATOM 0 HG2 MET A 48 4.262 -0.604 -2.400 1.00 0.00 H new ATOM 0 HG3 MET A 48 4.530 -1.430 -0.878 1.00 0.00 H new ATOM 0 HE1 MET A 48 7.502 1.588 -2.743 1.00 0.00 H new ATOM 0 HE2 MET A 48 7.641 -0.148 -3.109 1.00 0.00 H new ATOM 0 HE3 MET A 48 6.184 0.750 -3.597 1.00 0.00 H new ATOM 753 N ASP A 49 6.045 -2.604 0.528 1.00 0.00 N ATOM 754 CA ASP A 49 5.556 -3.099 1.810 1.00 0.00 C ATOM 755 C ASP A 49 4.862 -1.990 2.593 1.00 0.00 C ATOM 756 O ASP A 49 4.893 -0.824 2.198 1.00 0.00 O ATOM 757 CB ASP A 49 6.711 -3.674 2.632 1.00 0.00 C ATOM 758 CG ASP A 49 7.047 -5.099 2.239 1.00 0.00 C ATOM 759 OD1 ASP A 49 6.209 -5.994 2.478 1.00 0.00 O ATOM 760 OD2 ASP A 49 8.149 -5.321 1.694 1.00 0.00 O ATOM 0 H ASP A 49 6.083 -1.587 0.456 1.00 0.00 H new ATOM 0 HA ASP A 49 4.830 -3.888 1.614 1.00 0.00 H new ATOM 0 HB2 ASP A 49 7.593 -3.047 2.503 1.00 0.00 H new ATOM 0 HB3 ASP A 49 6.451 -3.644 3.690 1.00 0.00 H new ATOM 765 N PHE A 50 4.234 -2.360 3.704 1.00 0.00 N ATOM 766 CA PHE A 50 3.530 -1.397 4.541 1.00 0.00 C ATOM 767 C PHE A 50 4.510 -0.438 5.211 1.00 0.00 C ATOM 768 O PHE A 50 4.153 0.685 5.566 1.00 0.00 O ATOM 769 CB PHE A 50 2.703 -2.122 5.605 1.00 0.00 C ATOM 770 CG PHE A 50 1.303 -2.441 5.162 1.00 0.00 C ATOM 771 CD1 PHE A 50 0.525 -1.480 4.536 1.00 0.00 C ATOM 772 CD2 PHE A 50 0.766 -3.701 5.371 1.00 0.00 C ATOM 773 CE1 PHE A 50 -0.763 -1.771 4.126 1.00 0.00 C ATOM 774 CE2 PHE A 50 -0.521 -3.997 4.963 1.00 0.00 C ATOM 775 CZ PHE A 50 -1.287 -3.031 4.341 1.00 0.00 C ATOM 0 H PHE A 50 4.199 -3.321 4.045 1.00 0.00 H new ATOM 0 HA PHE A 50 2.862 -0.819 3.902 1.00 0.00 H new ATOM 0 HB2 PHE A 50 3.209 -3.048 5.878 1.00 0.00 H new ATOM 0 HB3 PHE A 50 2.660 -1.505 6.503 1.00 0.00 H new ATOM 0 HD1 PHE A 50 0.929 -0.493 4.367 1.00 0.00 H new ATOM 0 HD2 PHE A 50 1.360 -4.460 5.858 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -1.359 -1.014 3.638 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -0.927 -4.983 5.131 1.00 0.00 H new ATOM 0 HZ PHE A 50 -2.293 -3.260 4.023 1.00 0.00 H new ATOM 785 N PHE A 51 5.749 -0.890 5.380 1.00 0.00 N ATOM 786 CA PHE A 51 6.781 -0.074 6.008 1.00 0.00 C ATOM 787 C PHE A 51 7.544 0.736 4.963 1.00 0.00 C ATOM 788 O PHE A 51 7.950 1.872 5.215 1.00 0.00 O ATOM 789 CB PHE A 51 7.753 -0.958 6.793 1.00 0.00 C ATOM 790 CG PHE A 51 9.078 -0.303 7.060 1.00 0.00 C ATOM 791 CD1 PHE A 51 10.028 -0.198 6.059 1.00 0.00 C ATOM 792 CD2 PHE A 51 9.372 0.209 8.314 1.00 0.00 C ATOM 793 CE1 PHE A 51 11.248 0.404 6.303 1.00 0.00 C ATOM 794 CE2 PHE A 51 10.589 0.813 8.564 1.00 0.00 C ATOM 795 CZ PHE A 51 11.528 0.911 7.556 1.00 0.00 C ATOM 0 H PHE A 51 6.062 -1.817 5.091 1.00 0.00 H new ATOM 0 HA PHE A 51 6.294 0.618 6.695 1.00 0.00 H new ATOM 0 HB2 PHE A 51 7.295 -1.233 7.743 1.00 0.00 H new ATOM 0 HB3 PHE A 51 7.919 -1.882 6.240 1.00 0.00 H new ATOM 0 HD1 PHE A 51 9.814 -0.591 5.076 1.00 0.00 H new ATOM 0 HD2 PHE A 51 8.641 0.135 9.105 1.00 0.00 H new ATOM 0 HE1 PHE A 51 11.982 0.478 5.514 1.00 0.00 H new ATOM 0 HE2 PHE A 51 10.806 1.208 9.546 1.00 0.00 H new ATOM 0 HZ PHE A 51 12.480 1.384 7.748 1.00 0.00 H new ATOM 805 N THR A 52 7.736 0.144 3.788 1.00 0.00 N ATOM 806 CA THR A 52 8.450 0.808 2.706 1.00 0.00 C ATOM 807 C THR A 52 7.729 2.077 2.268 1.00 0.00 C ATOM 808 O THR A 52 8.318 3.157 2.231 1.00 0.00 O ATOM 809 CB THR A 52 8.616 -0.121 1.489 1.00 0.00 C ATOM 810 OG1 THR A 52 9.484 -1.211 1.819 1.00 0.00 O ATOM 811 CG2 THR A 52 9.181 0.641 0.299 1.00 0.00 C ATOM 0 H THR A 52 7.406 -0.795 3.562 1.00 0.00 H new ATOM 0 HA THR A 52 9.436 1.069 3.092 1.00 0.00 H new ATOM 0 HB THR A 52 7.633 -0.508 1.219 1.00 0.00 H new ATOM 0 HG1 THR A 52 9.583 -1.798 1.040 1.00 0.00 H new ATOM 0 HG21 THR A 52 9.289 -0.036 -0.548 1.00 0.00 H new ATOM 0 HG22 THR A 52 8.504 1.452 0.031 1.00 0.00 H new ATOM 0 HG23 THR A 52 10.155 1.054 0.561 1.00 0.00 H new ATOM 819 N MET A 53 6.449 1.940 1.936 1.00 0.00 N ATOM 820 CA MET A 53 5.646 3.078 1.503 1.00 0.00 C ATOM 821 C MET A 53 5.676 4.192 2.543 1.00 0.00 C ATOM 822 O MET A 53 5.799 5.370 2.204 1.00 0.00 O ATOM 823 CB MET A 53 4.202 2.642 1.246 1.00 0.00 C ATOM 824 CG MET A 53 3.561 1.937 2.430 1.00 0.00 C ATOM 825 SD MET A 53 2.014 1.118 1.996 1.00 0.00 S ATOM 826 CE MET A 53 1.262 2.353 0.938 1.00 0.00 C ATOM 0 H MET A 53 5.946 1.053 1.959 1.00 0.00 H new ATOM 0 HA MET A 53 6.073 3.460 0.576 1.00 0.00 H new ATOM 0 HB2 MET A 53 3.607 3.518 0.989 1.00 0.00 H new ATOM 0 HB3 MET A 53 4.180 1.977 0.382 1.00 0.00 H new ATOM 0 HG2 MET A 53 4.258 1.200 2.830 1.00 0.00 H new ATOM 0 HG3 MET A 53 3.374 2.662 3.222 1.00 0.00 H new ATOM 0 HE1 MET A 53 0.205 2.123 0.805 1.00 0.00 H new ATOM 0 HE2 MET A 53 1.364 3.336 1.397 1.00 0.00 H new ATOM 0 HE3 MET A 53 1.759 2.352 -0.032 1.00 0.00 H new ATOM 836 N LYS A 54 5.561 3.815 3.812 1.00 0.00 N ATOM 837 CA LYS A 54 5.576 4.782 4.904 1.00 0.00 C ATOM 838 C LYS A 54 6.780 5.712 4.790 1.00 0.00 C ATOM 839 O LYS A 54 6.640 6.933 4.856 1.00 0.00 O ATOM 840 CB LYS A 54 5.601 4.059 6.252 1.00 0.00 C ATOM 841 CG LYS A 54 5.034 4.884 7.395 1.00 0.00 C ATOM 842 CD LYS A 54 5.838 6.154 7.617 1.00 0.00 C ATOM 843 CE LYS A 54 5.782 6.603 9.070 1.00 0.00 C ATOM 844 NZ LYS A 54 6.880 6.003 9.877 1.00 0.00 N ATOM 0 H LYS A 54 5.456 2.845 4.110 1.00 0.00 H new ATOM 0 HA LYS A 54 4.669 5.382 4.838 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.034 3.132 6.168 1.00 0.00 H new ATOM 0 HB3 LYS A 54 6.629 3.784 6.488 1.00 0.00 H new ATOM 0 HG2 LYS A 54 3.997 5.142 7.180 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.032 4.289 8.308 1.00 0.00 H new ATOM 0 HD2 LYS A 54 6.875 5.985 7.327 1.00 0.00 H new ATOM 0 HD3 LYS A 54 5.453 6.946 6.975 1.00 0.00 H new ATOM 0 HE2 LYS A 54 5.848 7.690 9.117 1.00 0.00 H new ATOM 0 HE3 LYS A 54 4.820 6.323 9.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 6.808 6.333 10.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 6.802 4.966 9.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.798 6.290 9.482 1.00 0.00 H new ATOM 858 N GLN A 55 7.961 5.126 4.620 1.00 0.00 N ATOM 859 CA GLN A 55 9.188 5.903 4.496 1.00 0.00 C ATOM 860 C GLN A 55 9.059 6.956 3.400 1.00 0.00 C ATOM 861 O GLN A 55 9.275 8.143 3.639 1.00 0.00 O ATOM 862 CB GLN A 55 10.372 4.982 4.198 1.00 0.00 C ATOM 863 CG GLN A 55 10.551 3.870 5.219 1.00 0.00 C ATOM 864 CD GLN A 55 11.154 4.364 6.520 1.00 0.00 C ATOM 865 OE1 GLN A 55 12.304 4.802 6.558 1.00 0.00 O ATOM 866 NE2 GLN A 55 10.378 4.295 7.595 1.00 0.00 N ATOM 0 H GLN A 55 8.094 4.116 4.565 1.00 0.00 H new ATOM 0 HA GLN A 55 9.362 6.412 5.444 1.00 0.00 H new ATOM 0 HB2 GLN A 55 10.238 4.539 3.211 1.00 0.00 H new ATOM 0 HB3 GLN A 55 11.284 5.578 4.159 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.584 3.410 5.423 1.00 0.00 H new ATOM 0 HG3 GLN A 55 11.191 3.095 4.798 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.431 3.925 7.517 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.729 4.612 8.499 1.00 0.00 H new ATOM 875 N ASN A 56 8.705 6.511 2.199 1.00 0.00 N ATOM 876 CA ASN A 56 8.547 7.415 1.065 1.00 0.00 C ATOM 877 C ASN A 56 7.531 8.509 1.379 1.00 0.00 C ATOM 878 O ASN A 56 7.765 9.686 1.102 1.00 0.00 O ATOM 879 CB ASN A 56 8.109 6.637 -0.177 1.00 0.00 C ATOM 880 CG ASN A 56 9.082 5.532 -0.540 1.00 0.00 C ATOM 881 OD1 ASN A 56 10.275 5.621 -0.252 1.00 0.00 O ATOM 882 ND2 ASN A 56 8.574 4.483 -1.176 1.00 0.00 N ATOM 0 H ASN A 56 8.522 5.530 1.986 1.00 0.00 H new ATOM 0 HA ASN A 56 9.511 7.885 0.869 1.00 0.00 H new ATOM 0 HB2 ASN A 56 7.123 6.206 -0.004 1.00 0.00 H new ATOM 0 HB3 ASN A 56 8.014 7.324 -1.018 1.00 0.00 H new ATOM 0 HD21 ASN A 56 9.180 3.708 -1.446 1.00 0.00 H new ATOM 0 HD22 ASN A 56 7.578 4.452 -1.394 1.00 0.00 H new ATOM 889 N LEU A 57 6.403 8.112 1.959 1.00 0.00 N ATOM 890 CA LEU A 57 5.351 9.058 2.311 1.00 0.00 C ATOM 891 C LEU A 57 5.884 10.145 3.240 1.00 0.00 C ATOM 892 O LEU A 57 5.595 11.327 3.058 1.00 0.00 O ATOM 893 CB LEU A 57 4.184 8.328 2.979 1.00 0.00 C ATOM 894 CG LEU A 57 3.155 9.211 3.684 1.00 0.00 C ATOM 895 CD1 LEU A 57 1.784 8.554 3.663 1.00 0.00 C ATOM 896 CD2 LEU A 57 3.589 9.498 5.114 1.00 0.00 C ATOM 0 H LEU A 57 6.194 7.142 2.195 1.00 0.00 H new ATOM 0 HA LEU A 57 4.999 9.530 1.394 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.669 7.739 2.221 1.00 0.00 H new ATOM 0 HB3 LEU A 57 4.590 7.626 3.707 1.00 0.00 H new ATOM 0 HG LEU A 57 3.089 10.158 3.148 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.064 9.197 4.170 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.470 8.401 2.631 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.833 7.592 4.174 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.844 10.128 5.601 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.684 8.560 5.661 1.00 0.00 H new ATOM 0 HD23 LEU A 57 4.550 10.012 5.106 1.00 0.00 H new ATOM 908 N GLU A 58 6.665 9.735 4.235 1.00 0.00 N ATOM 909 CA GLU A 58 7.238 10.674 5.191 1.00 0.00 C ATOM 910 C GLU A 58 8.275 11.569 4.520 1.00 0.00 C ATOM 911 O GLU A 58 8.634 12.623 5.043 1.00 0.00 O ATOM 912 CB GLU A 58 7.879 9.920 6.359 1.00 0.00 C ATOM 913 CG GLU A 58 6.879 9.442 7.398 1.00 0.00 C ATOM 914 CD GLU A 58 6.612 10.480 8.470 1.00 0.00 C ATOM 915 OE1 GLU A 58 7.588 10.989 9.061 1.00 0.00 O ATOM 916 OE2 GLU A 58 5.426 10.783 8.721 1.00 0.00 O ATOM 0 H GLU A 58 6.915 8.760 4.399 1.00 0.00 H new ATOM 0 HA GLU A 58 6.432 11.302 5.571 1.00 0.00 H new ATOM 0 HB2 GLU A 58 8.424 9.060 5.970 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.610 10.569 6.842 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.942 9.186 6.904 1.00 0.00 H new ATOM 0 HG3 GLU A 58 7.253 8.531 7.865 1.00 0.00 H new ATOM 923 N ALA A 59 8.752 11.141 3.356 1.00 0.00 N ATOM 924 CA ALA A 59 9.746 11.904 2.611 1.00 0.00 C ATOM 925 C ALA A 59 9.090 12.748 1.523 1.00 0.00 C ATOM 926 O ALA A 59 9.760 13.238 0.615 1.00 0.00 O ATOM 927 CB ALA A 59 10.782 10.969 2.001 1.00 0.00 C ATOM 0 H ALA A 59 8.466 10.270 2.908 1.00 0.00 H new ATOM 0 HA ALA A 59 10.245 12.578 3.307 1.00 0.00 H new ATOM 0 HB1 ALA A 59 11.518 11.553 1.448 1.00 0.00 H new ATOM 0 HB2 ALA A 59 11.282 10.413 2.794 1.00 0.00 H new ATOM 0 HB3 ALA A 59 10.289 10.271 1.324 1.00 0.00 H new ATOM 933 N TYR A 60 7.775 12.913 1.623 1.00 0.00 N ATOM 934 CA TYR A 60 7.027 13.696 0.647 1.00 0.00 C ATOM 935 C TYR A 60 7.241 13.155 -0.763 1.00 0.00 C ATOM 936 O TYR A 60 7.450 13.918 -1.708 1.00 0.00 O ATOM 937 CB TYR A 60 7.446 15.166 0.711 1.00 0.00 C ATOM 938 CG TYR A 60 6.993 15.870 1.969 1.00 0.00 C ATOM 939 CD1 TYR A 60 7.322 15.372 3.225 1.00 0.00 C ATOM 940 CD2 TYR A 60 6.237 17.033 1.904 1.00 0.00 C ATOM 941 CE1 TYR A 60 6.910 16.012 4.378 1.00 0.00 C ATOM 942 CE2 TYR A 60 5.822 17.681 3.052 1.00 0.00 C ATOM 943 CZ TYR A 60 6.160 17.166 4.286 1.00 0.00 C ATOM 944 OH TYR A 60 5.748 17.808 5.432 1.00 0.00 O ATOM 0 H TYR A 60 7.206 12.515 2.370 1.00 0.00 H new ATOM 0 HA TYR A 60 5.967 13.617 0.890 1.00 0.00 H new ATOM 0 HB2 TYR A 60 8.532 15.229 0.640 1.00 0.00 H new ATOM 0 HB3 TYR A 60 7.039 15.689 -0.155 1.00 0.00 H new ATOM 0 HD1 TYR A 60 7.910 14.469 3.300 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.969 17.438 0.940 1.00 0.00 H new ATOM 0 HE1 TYR A 60 7.174 15.611 5.346 1.00 0.00 H new ATOM 0 HE2 TYR A 60 5.236 18.586 2.983 1.00 0.00 H new ATOM 0 HH TYR A 60 5.231 18.605 5.192 1.00 0.00 H new ATOM 954 N ARG A 61 7.186 11.834 -0.898 1.00 0.00 N ATOM 955 CA ARG A 61 7.374 11.190 -2.193 1.00 0.00 C ATOM 956 C ARG A 61 6.037 10.993 -2.901 1.00 0.00 C ATOM 957 O ARG A 61 5.974 10.954 -4.130 1.00 0.00 O ATOM 958 CB ARG A 61 8.075 9.841 -2.018 1.00 0.00 C ATOM 959 CG ARG A 61 9.569 9.959 -1.768 1.00 0.00 C ATOM 960 CD ARG A 61 10.313 8.723 -2.249 1.00 0.00 C ATOM 961 NE ARG A 61 11.762 8.881 -2.146 1.00 0.00 N ATOM 962 CZ ARG A 61 12.629 7.929 -2.470 1.00 0.00 C ATOM 963 NH1 ARG A 61 12.198 6.758 -2.917 1.00 0.00 N ATOM 964 NH2 ARG A 61 13.933 8.149 -2.349 1.00 0.00 N ATOM 0 H ARG A 61 7.013 11.189 -0.127 1.00 0.00 H new ATOM 0 HA ARG A 61 7.998 11.839 -2.807 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.617 9.308 -1.185 1.00 0.00 H new ATOM 0 HB3 ARG A 61 7.911 9.237 -2.911 1.00 0.00 H new ATOM 0 HG2 ARG A 61 9.956 10.840 -2.279 1.00 0.00 H new ATOM 0 HG3 ARG A 61 9.751 10.103 -0.703 1.00 0.00 H new ATOM 0 HD2 ARG A 61 10.000 7.860 -1.661 1.00 0.00 H new ATOM 0 HD3 ARG A 61 10.043 8.518 -3.285 1.00 0.00 H new ATOM 0 HE ARG A 61 12.127 9.771 -1.807 1.00 0.00 H new ATOM 0 HH11 ARG A 61 11.197 6.586 -3.013 1.00 0.00 H new ATOM 0 HH12 ARG A 61 12.867 6.029 -3.165 1.00 0.00 H new ATOM 0 HH21 ARG A 61 14.269 9.049 -2.007 1.00 0.00 H new ATOM 0 HH22 ARG A 61 14.599 7.418 -2.598 1.00 0.00 H new ATOM 978 N TYR A 62 4.972 10.867 -2.118 1.00 0.00 N ATOM 979 CA TYR A 62 3.637 10.672 -2.670 1.00 0.00 C ATOM 980 C TYR A 62 2.839 11.972 -2.643 1.00 0.00 C ATOM 981 O TYR A 62 2.263 12.340 -1.619 1.00 0.00 O ATOM 982 CB TYR A 62 2.893 9.588 -1.888 1.00 0.00 C ATOM 983 CG TYR A 62 3.593 8.248 -1.893 1.00 0.00 C ATOM 984 CD1 TYR A 62 4.043 7.682 -3.080 1.00 0.00 C ATOM 985 CD2 TYR A 62 3.806 7.549 -0.712 1.00 0.00 C ATOM 986 CE1 TYR A 62 4.682 6.458 -3.089 1.00 0.00 C ATOM 987 CE2 TYR A 62 4.447 6.325 -0.711 1.00 0.00 C ATOM 988 CZ TYR A 62 4.882 5.783 -1.903 1.00 0.00 C ATOM 989 OH TYR A 62 5.520 4.564 -1.908 1.00 0.00 O ATOM 0 H TYR A 62 5.007 10.896 -1.099 1.00 0.00 H new ATOM 0 HA TYR A 62 3.744 10.355 -3.707 1.00 0.00 H new ATOM 0 HB2 TYR A 62 2.766 9.918 -0.857 1.00 0.00 H new ATOM 0 HB3 TYR A 62 1.895 9.468 -2.309 1.00 0.00 H new ATOM 0 HD1 TYR A 62 3.890 8.208 -4.011 1.00 0.00 H new ATOM 0 HD2 TYR A 62 3.465 7.970 0.222 1.00 0.00 H new ATOM 0 HE1 TYR A 62 5.024 6.031 -4.020 1.00 0.00 H new ATOM 0 HE2 TYR A 62 4.607 5.796 0.217 1.00 0.00 H new ATOM 0 HH TYR A 62 5.635 4.259 -2.832 1.00 0.00 H new ATOM 999 N LEU A 63 2.810 12.663 -3.777 1.00 0.00 N ATOM 1000 CA LEU A 63 2.083 13.924 -3.886 1.00 0.00 C ATOM 1001 C LEU A 63 0.701 13.705 -4.492 1.00 0.00 C ATOM 1002 O LEU A 63 -0.231 14.462 -4.228 1.00 0.00 O ATOM 1003 CB LEU A 63 2.875 14.920 -4.735 1.00 0.00 C ATOM 1004 CG LEU A 63 4.310 15.194 -4.287 1.00 0.00 C ATOM 1005 CD1 LEU A 63 5.173 15.598 -5.472 1.00 0.00 C ATOM 1006 CD2 LEU A 63 4.337 16.272 -3.213 1.00 0.00 C ATOM 0 H LEU A 63 3.281 12.372 -4.634 1.00 0.00 H new ATOM 0 HA LEU A 63 1.958 14.331 -2.883 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.900 14.552 -5.761 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.333 15.866 -4.749 1.00 0.00 H new ATOM 0 HG LEU A 63 4.719 14.276 -3.863 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.191 15.789 -5.132 1.00 0.00 H new ATOM 0 HD12 LEU A 63 5.181 14.794 -6.208 1.00 0.00 H new ATOM 0 HD13 LEU A 63 4.767 16.502 -5.927 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.367 16.454 -2.906 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.909 17.192 -3.610 1.00 0.00 H new ATOM 0 HD23 LEU A 63 3.755 15.943 -2.352 1.00 0.00 H new ATOM 1018 N ASN A 64 0.578 12.662 -5.308 1.00 0.00 N ATOM 1019 CA ASN A 64 -0.691 12.342 -5.952 1.00 0.00 C ATOM 1020 C ASN A 64 -1.226 11.000 -5.461 1.00 0.00 C ATOM 1021 O ASN A 64 -0.517 9.994 -5.475 1.00 0.00 O ATOM 1022 CB ASN A 64 -0.522 12.311 -7.472 1.00 0.00 C ATOM 1023 CG ASN A 64 0.702 11.527 -7.902 1.00 0.00 C ATOM 1024 OD1 ASN A 64 0.595 10.399 -8.384 1.00 0.00 O ATOM 1025 ND2 ASN A 64 1.877 12.123 -7.728 1.00 0.00 N ATOM 0 H ASN A 64 1.341 12.025 -5.538 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.410 13.118 -5.689 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.410 11.870 -7.925 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -0.447 13.332 -7.847 1.00 0.00 H new ATOM 0 HD21 ASN A 64 2.736 11.645 -7.998 1.00 0.00 H new ATOM 0 HD22 ASN A 64 1.919 13.059 -7.325 1.00 0.00 H new ATOM 1032 N PHE A 65 -2.483 10.993 -5.030 1.00 0.00 N ATOM 1033 CA PHE A 65 -3.114 9.774 -4.535 1.00 0.00 C ATOM 1034 C PHE A 65 -2.697 8.567 -5.370 1.00 0.00 C ATOM 1035 O PHE A 65 -2.219 7.566 -4.837 1.00 0.00 O ATOM 1036 CB PHE A 65 -4.637 9.920 -4.554 1.00 0.00 C ATOM 1037 CG PHE A 65 -5.357 8.788 -3.877 1.00 0.00 C ATOM 1038 CD1 PHE A 65 -5.444 8.731 -2.496 1.00 0.00 C ATOM 1039 CD2 PHE A 65 -5.945 7.780 -4.624 1.00 0.00 C ATOM 1040 CE1 PHE A 65 -6.104 7.690 -1.872 1.00 0.00 C ATOM 1041 CE2 PHE A 65 -6.607 6.736 -4.006 1.00 0.00 C ATOM 1042 CZ PHE A 65 -6.688 6.692 -2.628 1.00 0.00 C ATOM 0 H PHE A 65 -3.085 11.817 -5.013 1.00 0.00 H new ATOM 0 HA PHE A 65 -2.783 9.614 -3.509 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -4.910 10.856 -4.067 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -4.975 9.988 -5.588 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -4.991 9.509 -1.900 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -5.885 7.810 -5.702 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -6.163 7.656 -0.794 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -7.060 5.956 -4.600 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.207 5.879 -2.142 1.00 0.00 H new ATOM 1052 N ASP A 66 -2.884 8.670 -6.682 1.00 0.00 N ATOM 1053 CA ASP A 66 -2.527 7.589 -7.592 1.00 0.00 C ATOM 1054 C ASP A 66 -1.237 6.908 -7.147 1.00 0.00 C ATOM 1055 O ASP A 66 -1.165 5.680 -7.071 1.00 0.00 O ATOM 1056 CB ASP A 66 -2.372 8.123 -9.017 1.00 0.00 C ATOM 1057 CG ASP A 66 -2.425 7.022 -10.057 1.00 0.00 C ATOM 1058 OD1 ASP A 66 -3.542 6.567 -10.382 1.00 0.00 O ATOM 1059 OD2 ASP A 66 -1.351 6.614 -10.546 1.00 0.00 O ATOM 0 H ASP A 66 -3.281 9.491 -7.138 1.00 0.00 H new ATOM 0 HA ASP A 66 -3.330 6.852 -7.574 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -3.161 8.847 -9.218 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -1.424 8.654 -9.102 1.00 0.00 H new ATOM 1064 N ASP A 67 -0.220 7.711 -6.855 1.00 0.00 N ATOM 1065 CA ASP A 67 1.069 7.186 -6.418 1.00 0.00 C ATOM 1066 C ASP A 67 0.916 6.370 -5.138 1.00 0.00 C ATOM 1067 O ASP A 67 1.307 5.203 -5.083 1.00 0.00 O ATOM 1068 CB ASP A 67 2.060 8.328 -6.193 1.00 0.00 C ATOM 1069 CG ASP A 67 3.500 7.885 -6.356 1.00 0.00 C ATOM 1070 OD1 ASP A 67 3.724 6.697 -6.666 1.00 0.00 O ATOM 1071 OD2 ASP A 67 4.404 8.728 -6.173 1.00 0.00 O ATOM 0 H ASP A 67 -0.263 8.728 -6.913 1.00 0.00 H new ATOM 0 HA ASP A 67 1.452 6.533 -7.202 1.00 0.00 H new ATOM 0 HB2 ASP A 67 1.849 9.133 -6.897 1.00 0.00 H new ATOM 0 HB3 ASP A 67 1.919 8.735 -5.192 1.00 0.00 H new ATOM 1076 N PHE A 68 0.346 6.990 -4.111 1.00 0.00 N ATOM 1077 CA PHE A 68 0.144 6.322 -2.830 1.00 0.00 C ATOM 1078 C PHE A 68 -0.646 5.028 -3.011 1.00 0.00 C ATOM 1079 O PHE A 68 -0.552 4.113 -2.194 1.00 0.00 O ATOM 1080 CB PHE A 68 -0.589 7.248 -1.857 1.00 0.00 C ATOM 1081 CG PHE A 68 -0.938 6.591 -0.553 1.00 0.00 C ATOM 1082 CD1 PHE A 68 -2.033 5.747 -0.458 1.00 0.00 C ATOM 1083 CD2 PHE A 68 -0.171 6.818 0.579 1.00 0.00 C ATOM 1084 CE1 PHE A 68 -2.357 5.141 0.741 1.00 0.00 C ATOM 1085 CE2 PHE A 68 -0.491 6.214 1.781 1.00 0.00 C ATOM 1086 CZ PHE A 68 -1.586 5.376 1.863 1.00 0.00 C ATOM 0 H PHE A 68 0.015 7.954 -4.140 1.00 0.00 H new ATOM 0 HA PHE A 68 1.123 6.076 -2.418 1.00 0.00 H new ATOM 0 HB2 PHE A 68 0.033 8.121 -1.660 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -1.503 7.608 -2.329 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -2.640 5.561 -1.331 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.685 7.473 0.522 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -3.212 4.484 0.801 1.00 0.00 H new ATOM 0 HE2 PHE A 68 0.115 6.397 2.656 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.839 4.906 2.802 1.00 0.00 H new ATOM 1096 N GLU A 69 -1.424 4.962 -4.087 1.00 0.00 N ATOM 1097 CA GLU A 69 -2.231 3.781 -4.373 1.00 0.00 C ATOM 1098 C GLU A 69 -1.403 2.715 -5.084 1.00 0.00 C ATOM 1099 O GLU A 69 -1.471 1.534 -4.747 1.00 0.00 O ATOM 1100 CB GLU A 69 -3.441 4.160 -5.231 1.00 0.00 C ATOM 1101 CG GLU A 69 -4.125 2.967 -5.877 1.00 0.00 C ATOM 1102 CD GLU A 69 -5.179 3.376 -6.888 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -6.036 4.216 -6.545 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -5.144 2.856 -8.023 1.00 0.00 O ATOM 0 H GLU A 69 -1.513 5.711 -4.774 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.580 3.372 -3.425 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.164 4.691 -4.611 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.121 4.851 -6.011 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.376 2.346 -6.369 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.588 2.355 -5.103 1.00 0.00 H new ATOM 1111 N GLU A 70 -0.621 3.142 -6.072 1.00 0.00 N ATOM 1112 CA GLU A 70 0.219 2.225 -6.831 1.00 0.00 C ATOM 1113 C GLU A 70 0.985 1.291 -5.899 1.00 0.00 C ATOM 1114 O GLU A 70 0.940 0.070 -6.052 1.00 0.00 O ATOM 1115 CB GLU A 70 1.200 3.004 -7.709 1.00 0.00 C ATOM 1116 CG GLU A 70 1.979 2.129 -8.677 1.00 0.00 C ATOM 1117 CD GLU A 70 1.095 1.503 -9.738 1.00 0.00 C ATOM 1118 OE1 GLU A 70 0.268 0.635 -9.387 1.00 0.00 O ATOM 1119 OE2 GLU A 70 1.230 1.882 -10.921 1.00 0.00 O ATOM 0 H GLU A 70 -0.553 4.117 -6.364 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.429 1.623 -7.469 1.00 0.00 H new ATOM 0 HB2 GLU A 70 0.650 3.756 -8.275 1.00 0.00 H new ATOM 0 HB3 GLU A 70 1.903 3.537 -7.069 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.752 2.727 -9.160 1.00 0.00 H new ATOM 0 HG3 GLU A 70 2.486 1.341 -8.121 1.00 0.00 H new ATOM 1126 N ASP A 71 1.688 1.873 -4.935 1.00 0.00 N ATOM 1127 CA ASP A 71 2.465 1.094 -3.977 1.00 0.00 C ATOM 1128 C ASP A 71 1.625 -0.035 -3.387 1.00 0.00 C ATOM 1129 O ASP A 71 1.932 -1.213 -3.570 1.00 0.00 O ATOM 1130 CB ASP A 71 2.987 1.996 -2.857 1.00 0.00 C ATOM 1131 CG ASP A 71 3.750 3.193 -3.388 1.00 0.00 C ATOM 1132 OD1 ASP A 71 4.911 3.016 -3.814 1.00 0.00 O ATOM 1133 OD2 ASP A 71 3.187 4.309 -3.377 1.00 0.00 O ATOM 0 H ASP A 71 1.736 2.882 -4.795 1.00 0.00 H new ATOM 0 HA ASP A 71 3.312 0.656 -4.505 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.149 2.342 -2.252 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.636 1.417 -2.200 1.00 0.00 H new ATOM 1138 N PHE A 72 0.563 0.332 -2.677 1.00 0.00 N ATOM 1139 CA PHE A 72 -0.321 -0.649 -2.059 1.00 0.00 C ATOM 1140 C PHE A 72 -0.597 -1.808 -3.011 1.00 0.00 C ATOM 1141 O PHE A 72 -0.522 -2.974 -2.625 1.00 0.00 O ATOM 1142 CB PHE A 72 -1.638 0.010 -1.644 1.00 0.00 C ATOM 1143 CG PHE A 72 -2.684 -0.971 -1.197 1.00 0.00 C ATOM 1144 CD1 PHE A 72 -2.743 -1.390 0.123 1.00 0.00 C ATOM 1145 CD2 PHE A 72 -3.608 -1.476 -2.097 1.00 0.00 C ATOM 1146 CE1 PHE A 72 -3.704 -2.292 0.537 1.00 0.00 C ATOM 1147 CE2 PHE A 72 -4.571 -2.379 -1.689 1.00 0.00 C ATOM 1148 CZ PHE A 72 -4.619 -2.789 -0.371 1.00 0.00 C ATOM 0 H PHE A 72 0.294 1.302 -2.515 1.00 0.00 H new ATOM 0 HA PHE A 72 0.176 -1.041 -1.172 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -1.443 0.715 -0.836 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -2.027 0.587 -2.483 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -2.029 -1.007 0.837 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -3.575 -1.160 -3.129 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -3.740 -2.608 1.569 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -5.286 -2.764 -2.401 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.370 -3.496 -0.051 1.00 0.00 H new ATOM 1158 N ASN A 73 -0.918 -1.478 -4.258 1.00 0.00 N ATOM 1159 CA ASN A 73 -1.207 -2.493 -5.267 1.00 0.00 C ATOM 1160 C ASN A 73 -0.064 -3.498 -5.369 1.00 0.00 C ATOM 1161 O ASN A 73 -0.291 -4.706 -5.460 1.00 0.00 O ATOM 1162 CB ASN A 73 -1.447 -1.834 -6.627 1.00 0.00 C ATOM 1163 CG ASN A 73 -2.474 -0.721 -6.557 1.00 0.00 C ATOM 1164 OD1 ASN A 73 -3.191 -0.584 -5.565 1.00 0.00 O ATOM 1165 ND2 ASN A 73 -2.552 0.079 -7.614 1.00 0.00 N ATOM 0 H ASN A 73 -0.985 -0.517 -4.594 1.00 0.00 H new ATOM 0 HA ASN A 73 -2.109 -3.026 -4.965 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -0.506 -1.433 -7.005 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -1.781 -2.588 -7.339 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -3.226 0.844 -7.626 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -1.938 -0.072 -8.414 1.00 0.00 H new ATOM 1172 N LEU A 74 1.165 -2.993 -5.355 1.00 0.00 N ATOM 1173 CA LEU A 74 2.344 -3.846 -5.447 1.00 0.00 C ATOM 1174 C LEU A 74 2.433 -4.784 -4.247 1.00 0.00 C ATOM 1175 O LEU A 74 2.699 -5.976 -4.397 1.00 0.00 O ATOM 1176 CB LEU A 74 3.610 -2.992 -5.535 1.00 0.00 C ATOM 1177 CG LEU A 74 3.884 -2.335 -6.888 1.00 0.00 C ATOM 1178 CD1 LEU A 74 4.980 -1.289 -6.762 1.00 0.00 C ATOM 1179 CD2 LEU A 74 4.262 -3.384 -7.924 1.00 0.00 C ATOM 0 H LEU A 74 1.370 -1.997 -5.281 1.00 0.00 H new ATOM 0 HA LEU A 74 2.256 -4.449 -6.351 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.549 -2.209 -4.779 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.465 -3.618 -5.278 1.00 0.00 H new ATOM 0 HG LEU A 74 2.972 -1.838 -7.219 1.00 0.00 H new ATOM 0 HD11 LEU A 74 5.161 -0.832 -7.735 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.670 -0.521 -6.053 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.896 -1.762 -6.407 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.453 -2.898 -8.881 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.159 -3.910 -7.598 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.444 -4.096 -8.036 1.00 0.00 H new ATOM 1191 N ILE A 75 2.204 -4.237 -3.057 1.00 0.00 N ATOM 1192 CA ILE A 75 2.254 -5.026 -1.833 1.00 0.00 C ATOM 1193 C ILE A 75 1.444 -6.311 -1.973 1.00 0.00 C ATOM 1194 O ILE A 75 1.798 -7.344 -1.408 1.00 0.00 O ATOM 1195 CB ILE A 75 1.725 -4.227 -0.627 1.00 0.00 C ATOM 1196 CG1 ILE A 75 2.618 -3.013 -0.361 1.00 0.00 C ATOM 1197 CG2 ILE A 75 1.651 -5.116 0.606 1.00 0.00 C ATOM 1198 CD1 ILE A 75 2.067 -2.078 0.693 1.00 0.00 C ATOM 0 H ILE A 75 1.982 -3.252 -2.915 1.00 0.00 H new ATOM 0 HA ILE A 75 3.301 -5.277 -1.662 1.00 0.00 H new ATOM 0 HB ILE A 75 0.720 -3.873 -0.857 1.00 0.00 H new ATOM 0 HG12 ILE A 75 3.604 -3.358 -0.049 1.00 0.00 H new ATOM 0 HG13 ILE A 75 2.753 -2.460 -1.291 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.275 -4.537 1.450 1.00 0.00 H new ATOM 0 HG22 ILE A 75 0.979 -5.952 0.412 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.645 -5.496 0.841 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.751 -1.241 0.830 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.094 -1.704 0.375 1.00 0.00 H new ATOM 0 HD13 ILE A 75 1.958 -2.615 1.635 1.00 0.00 H new ATOM 1210 N VAL A 76 0.354 -6.236 -2.730 1.00 0.00 N ATOM 1211 CA VAL A 76 -0.506 -7.394 -2.947 1.00 0.00 C ATOM 1212 C VAL A 76 -0.056 -8.192 -4.165 1.00 0.00 C ATOM 1213 O VAL A 76 -0.013 -9.423 -4.133 1.00 0.00 O ATOM 1214 CB VAL A 76 -1.975 -6.973 -3.137 1.00 0.00 C ATOM 1215 CG1 VAL A 76 -2.839 -8.181 -3.467 1.00 0.00 C ATOM 1216 CG2 VAL A 76 -2.491 -6.263 -1.894 1.00 0.00 C ATOM 0 H VAL A 76 0.046 -5.387 -3.203 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.427 -8.019 -2.058 1.00 0.00 H new ATOM 0 HB VAL A 76 -2.029 -6.277 -3.974 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.874 -7.864 -3.598 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -2.482 -8.643 -4.388 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.781 -8.903 -2.653 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.531 -5.973 -2.046 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.423 -6.934 -1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.889 -5.373 -1.707 1.00 0.00 H new ATOM 1226 N SER A 77 0.279 -7.484 -5.239 1.00 0.00 N ATOM 1227 CA SER A 77 0.723 -8.127 -6.471 1.00 0.00 C ATOM 1228 C SER A 77 2.011 -8.911 -6.239 1.00 0.00 C ATOM 1229 O SER A 77 2.013 -10.142 -6.255 1.00 0.00 O ATOM 1230 CB SER A 77 0.938 -7.083 -7.567 1.00 0.00 C ATOM 1231 OG SER A 77 0.713 -7.637 -8.851 1.00 0.00 O ATOM 0 H SER A 77 0.252 -6.465 -5.281 1.00 0.00 H new ATOM 0 HA SER A 77 -0.053 -8.822 -6.790 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.265 -6.241 -7.408 1.00 0.00 H new ATOM 0 HB3 SER A 77 1.955 -6.694 -7.509 1.00 0.00 H new ATOM 0 HG SER A 77 0.855 -6.949 -9.534 1.00 0.00 H new ATOM 1237 N ASN A 78 3.107 -8.189 -6.025 1.00 0.00 N ATOM 1238 CA ASN A 78 4.402 -8.816 -5.792 1.00 0.00 C ATOM 1239 C ASN A 78 4.247 -10.100 -4.982 1.00 0.00 C ATOM 1240 O ASN A 78 5.002 -11.055 -5.163 1.00 0.00 O ATOM 1241 CB ASN A 78 5.336 -7.850 -5.062 1.00 0.00 C ATOM 1242 CG ASN A 78 5.721 -6.660 -5.919 1.00 0.00 C ATOM 1243 OD1 ASN A 78 5.976 -6.799 -7.115 1.00 0.00 O ATOM 1244 ND2 ASN A 78 5.767 -5.480 -5.309 1.00 0.00 N ATOM 0 H ASN A 78 3.123 -7.169 -6.008 1.00 0.00 H new ATOM 0 HA ASN A 78 4.835 -9.068 -6.760 1.00 0.00 H new ATOM 0 HB2 ASN A 78 4.850 -7.497 -4.152 1.00 0.00 H new ATOM 0 HB3 ASN A 78 6.237 -8.381 -4.757 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.021 -4.644 -5.835 1.00 0.00 H new ATOM 0 HD22 ASN A 78 5.548 -5.411 -4.315 1.00 0.00 H new ATOM 1251 N CYS A 79 3.263 -10.115 -4.090 1.00 0.00 N ATOM 1252 CA CYS A 79 3.008 -11.281 -3.253 1.00 0.00 C ATOM 1253 C CYS A 79 2.215 -12.337 -4.016 1.00 0.00 C ATOM 1254 O CYS A 79 2.560 -13.519 -4.001 1.00 0.00 O ATOM 1255 CB CYS A 79 2.249 -10.871 -1.988 1.00 0.00 C ATOM 1256 SG CYS A 79 2.500 -11.983 -0.584 1.00 0.00 S ATOM 0 H CYS A 79 2.629 -9.333 -3.928 1.00 0.00 H new ATOM 0 HA CYS A 79 3.969 -11.710 -2.969 1.00 0.00 H new ATOM 0 HB2 CYS A 79 2.558 -9.866 -1.701 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.184 -10.824 -2.215 1.00 0.00 H new ATOM 0 HG CYS A 79 1.349 -12.293 -0.065 1.00 0.00 H new ATOM 1262 N LEU A 80 1.151 -11.903 -4.681 1.00 0.00 N ATOM 1263 CA LEU A 80 0.307 -12.811 -5.450 1.00 0.00 C ATOM 1264 C LEU A 80 1.087 -13.435 -6.602 1.00 0.00 C ATOM 1265 O LEU A 80 0.703 -14.478 -7.135 1.00 0.00 O ATOM 1266 CB LEU A 80 -0.916 -12.067 -5.992 1.00 0.00 C ATOM 1267 CG LEU A 80 -1.973 -11.674 -4.959 1.00 0.00 C ATOM 1268 CD1 LEU A 80 -2.875 -10.580 -5.509 1.00 0.00 C ATOM 1269 CD2 LEU A 80 -2.795 -12.887 -4.547 1.00 0.00 C ATOM 0 H LEU A 80 0.852 -10.928 -4.704 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.025 -13.609 -4.786 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.573 -11.162 -6.494 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.391 -12.691 -6.749 1.00 0.00 H new ATOM 0 HG LEU A 80 -1.464 -11.288 -4.076 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -3.621 -10.313 -4.760 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -2.276 -9.703 -5.753 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.376 -10.939 -6.408 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -3.542 -12.588 -3.812 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.294 -13.303 -5.422 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -2.139 -13.640 -4.112 1.00 0.00 H new ATOM 1281 N LYS A 81 2.186 -12.793 -6.983 1.00 0.00 N ATOM 1282 CA LYS A 81 3.024 -13.286 -8.069 1.00 0.00 C ATOM 1283 C LYS A 81 4.122 -14.201 -7.537 1.00 0.00 C ATOM 1284 O LYS A 81 4.384 -15.264 -8.102 1.00 0.00 O ATOM 1285 CB LYS A 81 3.647 -12.114 -8.831 1.00 0.00 C ATOM 1286 CG LYS A 81 4.978 -12.451 -9.481 1.00 0.00 C ATOM 1287 CD LYS A 81 5.368 -11.415 -10.523 1.00 0.00 C ATOM 1288 CE LYS A 81 6.628 -11.824 -11.272 1.00 0.00 C ATOM 1289 NZ LYS A 81 6.648 -11.284 -12.659 1.00 0.00 N ATOM 0 H LYS A 81 2.517 -11.929 -6.555 1.00 0.00 H new ATOM 0 HA LYS A 81 2.395 -13.861 -8.748 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.951 -11.780 -9.600 1.00 0.00 H new ATOM 0 HB3 LYS A 81 3.788 -11.279 -8.145 1.00 0.00 H new ATOM 0 HG2 LYS A 81 5.753 -12.509 -8.717 1.00 0.00 H new ATOM 0 HG3 LYS A 81 4.917 -13.434 -9.949 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.549 -11.283 -11.231 1.00 0.00 H new ATOM 0 HD3 LYS A 81 5.528 -10.452 -10.038 1.00 0.00 H new ATOM 0 HE2 LYS A 81 7.504 -11.467 -10.731 1.00 0.00 H new ATOM 0 HE3 LYS A 81 6.694 -12.911 -11.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 7.522 -11.585 -13.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 5.826 -11.644 -13.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 6.610 -10.245 -12.628 1.00 0.00 H new ATOM 1303 N TYR A 82 4.758 -13.783 -6.448 1.00 0.00 N ATOM 1304 CA TYR A 82 5.828 -14.566 -5.842 1.00 0.00 C ATOM 1305 C TYR A 82 5.325 -15.945 -5.425 1.00 0.00 C ATOM 1306 O TYR A 82 5.782 -16.966 -5.938 1.00 0.00 O ATOM 1307 CB TYR A 82 6.400 -13.832 -4.628 1.00 0.00 C ATOM 1308 CG TYR A 82 7.826 -14.216 -4.305 1.00 0.00 C ATOM 1309 CD1 TYR A 82 8.827 -14.124 -5.265 1.00 0.00 C ATOM 1310 CD2 TYR A 82 8.175 -14.670 -3.038 1.00 0.00 C ATOM 1311 CE1 TYR A 82 10.131 -14.475 -4.975 1.00 0.00 C ATOM 1312 CE2 TYR A 82 9.476 -15.021 -2.738 1.00 0.00 C ATOM 1313 CZ TYR A 82 10.450 -14.923 -3.709 1.00 0.00 C ATOM 1314 OH TYR A 82 11.749 -15.272 -3.415 1.00 0.00 O ATOM 0 H TYR A 82 4.551 -12.907 -5.967 1.00 0.00 H new ATOM 0 HA TYR A 82 6.615 -14.695 -6.585 1.00 0.00 H new ATOM 0 HB2 TYR A 82 6.354 -12.758 -4.808 1.00 0.00 H new ATOM 0 HB3 TYR A 82 5.772 -14.037 -3.761 1.00 0.00 H new ATOM 0 HD1 TYR A 82 8.581 -13.772 -6.256 1.00 0.00 H new ATOM 0 HD2 TYR A 82 7.415 -14.749 -2.275 1.00 0.00 H new ATOM 0 HE1 TYR A 82 10.896 -14.399 -5.734 1.00 0.00 H new ATOM 0 HE2 TYR A 82 9.730 -15.370 -1.748 1.00 0.00 H new ATOM 0 HH TYR A 82 12.363 -14.738 -3.962 1.00 0.00 H new ATOM 1324 N ASN A 83 4.381 -15.966 -4.491 1.00 0.00 N ATOM 1325 CA ASN A 83 3.814 -17.219 -4.004 1.00 0.00 C ATOM 1326 C ASN A 83 2.464 -17.496 -4.657 1.00 0.00 C ATOM 1327 O ASN A 83 1.997 -16.723 -5.493 1.00 0.00 O ATOM 1328 CB ASN A 83 3.657 -17.174 -2.482 1.00 0.00 C ATOM 1329 CG ASN A 83 4.771 -16.395 -1.808 1.00 0.00 C ATOM 1330 OD1 ASN A 83 5.808 -16.956 -1.453 1.00 0.00 O ATOM 1331 ND2 ASN A 83 4.561 -15.097 -1.630 1.00 0.00 N ATOM 0 H ASN A 83 3.992 -15.130 -4.056 1.00 0.00 H new ATOM 0 HA ASN A 83 4.498 -18.025 -4.269 1.00 0.00 H new ATOM 0 HB2 ASN A 83 2.698 -16.721 -2.232 1.00 0.00 H new ATOM 0 HB3 ASN A 83 3.641 -18.191 -2.091 1.00 0.00 H new ATOM 0 HD21 ASN A 83 5.275 -14.522 -1.183 1.00 0.00 H new ATOM 0 HD22 ASN A 83 3.686 -14.675 -1.940 1.00 0.00 H new ATOM 1338 N ALA A 84 1.841 -18.604 -4.269 1.00 0.00 N ATOM 1339 CA ALA A 84 0.544 -18.982 -4.816 1.00 0.00 C ATOM 1340 C ALA A 84 -0.493 -19.141 -3.708 1.00 0.00 C ATOM 1341 O ALA A 84 -0.147 -19.283 -2.535 1.00 0.00 O ATOM 1342 CB ALA A 84 0.664 -20.269 -5.618 1.00 0.00 C ATOM 0 H ALA A 84 2.214 -19.255 -3.578 1.00 0.00 H new ATOM 0 HA ALA A 84 0.210 -18.184 -5.479 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.312 -20.539 -6.020 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.367 -20.122 -6.438 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.024 -21.069 -4.971 1.00 0.00 H new ATOM 1348 N LYS A 85 -1.765 -19.117 -4.088 1.00 0.00 N ATOM 1349 CA LYS A 85 -2.853 -19.258 -3.127 1.00 0.00 C ATOM 1350 C LYS A 85 -2.490 -20.262 -2.038 1.00 0.00 C ATOM 1351 O LYS A 85 -2.826 -20.073 -0.869 1.00 0.00 O ATOM 1352 CB LYS A 85 -4.134 -19.703 -3.838 1.00 0.00 C ATOM 1353 CG LYS A 85 -4.712 -18.648 -4.766 1.00 0.00 C ATOM 1354 CD LYS A 85 -5.615 -19.266 -5.819 1.00 0.00 C ATOM 1355 CE LYS A 85 -5.933 -18.278 -6.931 1.00 0.00 C ATOM 1356 NZ LYS A 85 -6.857 -18.860 -7.943 1.00 0.00 N ATOM 0 H LYS A 85 -2.069 -19.001 -5.055 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.021 -18.287 -2.661 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -3.926 -20.606 -4.412 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.882 -19.966 -3.090 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -5.276 -17.920 -4.184 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -3.901 -18.107 -5.253 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.133 -20.148 -6.241 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.542 -19.602 -5.353 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.382 -17.382 -6.503 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -5.008 -17.970 -7.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.049 -18.156 -8.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.419 -19.701 -8.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -7.750 -19.131 -7.483 1.00 0.00 H new ATOM 1370 N ASP A 86 -1.800 -21.328 -2.428 1.00 0.00 N ATOM 1371 CA ASP A 86 -1.389 -22.361 -1.484 1.00 0.00 C ATOM 1372 C ASP A 86 -0.697 -21.744 -0.272 1.00 0.00 C ATOM 1373 O ASP A 86 -1.016 -22.071 0.871 1.00 0.00 O ATOM 1374 CB ASP A 86 -0.455 -23.361 -2.165 1.00 0.00 C ATOM 1375 CG ASP A 86 -1.121 -24.083 -3.320 1.00 0.00 C ATOM 1376 OD1 ASP A 86 -2.047 -23.504 -3.925 1.00 0.00 O ATOM 1377 OD2 ASP A 86 -0.718 -25.227 -3.618 1.00 0.00 O ATOM 0 H ASP A 86 -1.513 -21.500 -3.392 1.00 0.00 H new ATOM 0 HA ASP A 86 -2.282 -22.884 -1.143 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.429 -22.838 -2.529 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -0.114 -24.092 -1.432 1.00 0.00 H new ATOM 1382 N THR A 87 0.252 -20.849 -0.529 1.00 0.00 N ATOM 1383 CA THR A 87 0.990 -20.189 0.540 1.00 0.00 C ATOM 1384 C THR A 87 0.081 -19.271 1.349 1.00 0.00 C ATOM 1385 O THR A 87 -1.030 -18.951 0.925 1.00 0.00 O ATOM 1386 CB THR A 87 2.167 -19.366 -0.017 1.00 0.00 C ATOM 1387 OG1 THR A 87 1.675 -18.262 -0.784 1.00 0.00 O ATOM 1388 CG2 THR A 87 3.070 -20.230 -0.883 1.00 0.00 C ATOM 0 H THR A 87 0.527 -20.565 -1.469 1.00 0.00 H new ATOM 0 HA THR A 87 1.379 -20.974 1.188 1.00 0.00 H new ATOM 0 HB THR A 87 2.749 -18.991 0.825 1.00 0.00 H new ATOM 0 HG1 THR A 87 1.113 -18.596 -1.514 1.00 0.00 H new ATOM 0 HG21 THR A 87 3.894 -19.627 -1.265 1.00 0.00 H new ATOM 0 HG22 THR A 87 3.468 -21.052 -0.287 1.00 0.00 H new ATOM 0 HG23 THR A 87 2.497 -20.632 -1.719 1.00 0.00 H new ATOM 1396 N ILE A 88 0.560 -18.852 2.516 1.00 0.00 N ATOM 1397 CA ILE A 88 -0.211 -17.969 3.383 1.00 0.00 C ATOM 1398 C ILE A 88 -0.179 -16.533 2.873 1.00 0.00 C ATOM 1399 O ILE A 88 -1.215 -15.964 2.526 1.00 0.00 O ATOM 1400 CB ILE A 88 0.320 -18.000 4.829 1.00 0.00 C ATOM 1401 CG1 ILE A 88 -0.339 -19.136 5.614 1.00 0.00 C ATOM 1402 CG2 ILE A 88 0.070 -16.663 5.512 1.00 0.00 C ATOM 1403 CD1 ILE A 88 -0.126 -19.042 7.108 1.00 0.00 C ATOM 0 H ILE A 88 1.477 -19.109 2.882 1.00 0.00 H new ATOM 0 HA ILE A 88 -1.239 -18.332 3.372 1.00 0.00 H new ATOM 0 HB ILE A 88 1.395 -18.179 4.802 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -1.409 -19.136 5.407 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.055 -20.088 5.258 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.450 -16.699 6.533 1.00 0.00 H new ATOM 0 HG22 ILE A 88 0.581 -15.872 4.962 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -1.000 -16.458 5.531 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.621 -19.880 7.599 1.00 0.00 H new ATOM 0 HD12 ILE A 88 0.942 -19.073 7.326 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.545 -18.106 7.477 1.00 0.00 H new ATOM 1415 N PHE A 89 1.014 -15.952 2.827 1.00 0.00 N ATOM 1416 CA PHE A 89 1.180 -14.581 2.357 1.00 0.00 C ATOM 1417 C PHE A 89 0.256 -14.296 1.177 1.00 0.00 C ATOM 1418 O PHE A 89 -0.124 -13.149 0.936 1.00 0.00 O ATOM 1419 CB PHE A 89 2.635 -14.330 1.954 1.00 0.00 C ATOM 1420 CG PHE A 89 3.626 -15.105 2.773 1.00 0.00 C ATOM 1421 CD1 PHE A 89 3.493 -15.187 4.151 1.00 0.00 C ATOM 1422 CD2 PHE A 89 4.690 -15.753 2.167 1.00 0.00 C ATOM 1423 CE1 PHE A 89 4.405 -15.898 4.907 1.00 0.00 C ATOM 1424 CE2 PHE A 89 5.604 -16.467 2.918 1.00 0.00 C ATOM 1425 CZ PHE A 89 5.461 -16.541 4.290 1.00 0.00 C ATOM 0 H PHE A 89 1.881 -16.409 3.109 1.00 0.00 H new ATOM 0 HA PHE A 89 0.916 -13.908 3.173 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.762 -14.589 0.903 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.851 -13.266 2.048 1.00 0.00 H new ATOM 0 HD1 PHE A 89 2.668 -14.690 4.638 1.00 0.00 H new ATOM 0 HD2 PHE A 89 4.806 -15.699 1.095 1.00 0.00 H new ATOM 0 HE1 PHE A 89 4.293 -15.951 5.980 1.00 0.00 H new ATOM 0 HE2 PHE A 89 6.429 -16.967 2.433 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.173 -17.100 4.879 1.00 0.00 H new ATOM 1435 N TYR A 90 -0.100 -15.345 0.445 1.00 0.00 N ATOM 1436 CA TYR A 90 -0.976 -15.207 -0.713 1.00 0.00 C ATOM 1437 C TYR A 90 -2.407 -14.904 -0.280 1.00 0.00 C ATOM 1438 O TYR A 90 -2.980 -13.883 -0.660 1.00 0.00 O ATOM 1439 CB TYR A 90 -0.946 -16.483 -1.555 1.00 0.00 C ATOM 1440 CG TYR A 90 -1.530 -16.309 -2.940 1.00 0.00 C ATOM 1441 CD1 TYR A 90 -2.870 -15.992 -3.114 1.00 0.00 C ATOM 1442 CD2 TYR A 90 -0.739 -16.459 -4.073 1.00 0.00 C ATOM 1443 CE1 TYR A 90 -3.409 -15.832 -4.377 1.00 0.00 C ATOM 1444 CE2 TYR A 90 -1.268 -16.300 -5.339 1.00 0.00 C ATOM 1445 CZ TYR A 90 -2.603 -15.987 -5.485 1.00 0.00 C ATOM 1446 OH TYR A 90 -3.134 -15.828 -6.745 1.00 0.00 O ATOM 0 H TYR A 90 0.204 -16.300 0.632 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.613 -14.373 -1.314 1.00 0.00 H new ATOM 0 HB2 TYR A 90 0.085 -16.825 -1.645 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.497 -17.266 -1.033 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -3.503 -15.868 -2.248 1.00 0.00 H new ATOM 0 HD2 TYR A 90 0.307 -16.704 -3.962 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -4.454 -15.587 -4.495 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -0.640 -16.420 -6.209 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.433 -15.970 -7.415 1.00 0.00 H new ATOM 1456 N ARG A 91 -2.978 -15.800 0.520 1.00 0.00 N ATOM 1457 CA ARG A 91 -4.343 -15.629 1.005 1.00 0.00 C ATOM 1458 C ARG A 91 -4.483 -14.326 1.787 1.00 0.00 C ATOM 1459 O ARG A 91 -5.504 -13.646 1.699 1.00 0.00 O ATOM 1460 CB ARG A 91 -4.743 -16.812 1.889 1.00 0.00 C ATOM 1461 CG ARG A 91 -5.318 -17.985 1.113 1.00 0.00 C ATOM 1462 CD ARG A 91 -5.353 -19.249 1.959 1.00 0.00 C ATOM 1463 NE ARG A 91 -6.265 -20.248 1.411 1.00 0.00 N ATOM 1464 CZ ARG A 91 -7.587 -20.172 1.512 1.00 0.00 C ATOM 1465 NH1 ARG A 91 -8.149 -19.146 2.137 1.00 0.00 N ATOM 1466 NH2 ARG A 91 -8.351 -21.121 0.987 1.00 0.00 N ATOM 0 H ARG A 91 -2.517 -16.650 0.845 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.007 -15.587 0.142 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.869 -17.150 2.447 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -5.478 -16.476 2.620 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.326 -17.742 0.778 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.719 -18.160 0.219 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -4.350 -19.670 2.023 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.659 -18.997 2.975 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.865 -21.049 0.923 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -7.566 -18.413 2.541 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -9.165 -19.090 2.213 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.923 -21.911 0.504 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -9.366 -21.060 1.066 1.00 0.00 H new ATOM 1480 N ALA A 92 -3.451 -13.986 2.551 1.00 0.00 N ATOM 1481 CA ALA A 92 -3.458 -12.764 3.346 1.00 0.00 C ATOM 1482 C ALA A 92 -3.498 -11.528 2.453 1.00 0.00 C ATOM 1483 O ALA A 92 -4.145 -10.534 2.781 1.00 0.00 O ATOM 1484 CB ALA A 92 -2.241 -12.720 4.258 1.00 0.00 C ATOM 0 H ALA A 92 -2.599 -14.540 2.637 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.358 -12.765 3.960 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.260 -11.802 4.845 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.257 -13.580 4.928 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.333 -12.747 3.655 1.00 0.00 H new ATOM 1490 N ALA A 93 -2.801 -11.597 1.323 1.00 0.00 N ATOM 1491 CA ALA A 93 -2.758 -10.485 0.383 1.00 0.00 C ATOM 1492 C ALA A 93 -4.103 -10.302 -0.313 1.00 0.00 C ATOM 1493 O ALA A 93 -4.552 -9.177 -0.532 1.00 0.00 O ATOM 1494 CB ALA A 93 -1.655 -10.703 -0.642 1.00 0.00 C ATOM 0 H ALA A 93 -2.258 -12.412 1.037 1.00 0.00 H new ATOM 0 HA ALA A 93 -2.543 -9.575 0.943 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -1.634 -9.864 -1.338 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -0.694 -10.776 -0.133 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -1.845 -11.625 -1.191 1.00 0.00 H new ATOM 1500 N VAL A 94 -4.740 -11.416 -0.661 1.00 0.00 N ATOM 1501 CA VAL A 94 -6.033 -11.379 -1.332 1.00 0.00 C ATOM 1502 C VAL A 94 -7.046 -10.570 -0.530 1.00 0.00 C ATOM 1503 O VAL A 94 -7.890 -9.875 -1.096 1.00 0.00 O ATOM 1504 CB VAL A 94 -6.589 -12.796 -1.558 1.00 0.00 C ATOM 1505 CG1 VAL A 94 -8.072 -12.742 -1.896 1.00 0.00 C ATOM 1506 CG2 VAL A 94 -5.810 -13.506 -2.655 1.00 0.00 C ATOM 0 H VAL A 94 -4.381 -12.355 -0.489 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.874 -10.901 -2.298 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.472 -13.364 -0.635 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.447 -13.754 -2.052 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -8.616 -12.277 -1.074 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.217 -12.157 -2.804 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.217 -14.507 -2.801 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.893 -12.941 -3.584 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -4.761 -13.579 -2.367 1.00 0.00 H new ATOM 1516 N ARG A 95 -6.956 -10.663 0.793 1.00 0.00 N ATOM 1517 CA ARG A 95 -7.865 -9.940 1.674 1.00 0.00 C ATOM 1518 C ARG A 95 -7.634 -8.435 1.578 1.00 0.00 C ATOM 1519 O ARG A 95 -8.561 -7.669 1.315 1.00 0.00 O ATOM 1520 CB ARG A 95 -7.684 -10.403 3.121 1.00 0.00 C ATOM 1521 CG ARG A 95 -8.540 -9.640 4.117 1.00 0.00 C ATOM 1522 CD ARG A 95 -8.734 -10.426 5.403 1.00 0.00 C ATOM 1523 NE ARG A 95 -7.692 -10.137 6.385 1.00 0.00 N ATOM 1524 CZ ARG A 95 -6.501 -10.725 6.388 1.00 0.00 C ATOM 1525 NH1 ARG A 95 -6.202 -11.630 5.466 1.00 0.00 N ATOM 1526 NH2 ARG A 95 -5.605 -10.409 7.315 1.00 0.00 N ATOM 0 H ARG A 95 -6.262 -11.232 1.278 1.00 0.00 H new ATOM 0 HA ARG A 95 -8.885 -10.155 1.356 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.924 -11.464 3.187 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -6.636 -10.296 3.399 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.071 -8.682 4.342 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.511 -9.423 3.672 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -9.709 -10.189 5.829 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -8.735 -11.493 5.179 1.00 0.00 H new ATOM 0 HE ARG A 95 -7.890 -9.446 7.108 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -6.887 -11.876 4.752 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -5.287 -12.080 5.471 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -5.831 -9.714 8.026 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.691 -10.861 7.316 1.00 0.00 H new ATOM 1540 N LEU A 96 -6.390 -8.019 1.792 1.00 0.00 N ATOM 1541 CA LEU A 96 -6.037 -6.604 1.730 1.00 0.00 C ATOM 1542 C LEU A 96 -6.574 -5.964 0.455 1.00 0.00 C ATOM 1543 O LEU A 96 -7.176 -4.891 0.493 1.00 0.00 O ATOM 1544 CB LEU A 96 -4.518 -6.436 1.798 1.00 0.00 C ATOM 1545 CG LEU A 96 -3.852 -6.860 3.108 1.00 0.00 C ATOM 1546 CD1 LEU A 96 -2.339 -6.783 2.988 1.00 0.00 C ATOM 1547 CD2 LEU A 96 -4.343 -5.994 4.259 1.00 0.00 C ATOM 0 H LEU A 96 -5.610 -8.640 2.010 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.492 -6.103 2.584 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -4.073 -7.010 0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.280 -5.388 1.616 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.126 -7.895 3.315 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.883 -7.088 3.930 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.003 -7.446 2.191 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.044 -5.759 2.757 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -3.859 -6.309 5.184 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -4.099 -4.951 4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.423 -6.101 4.360 1.00 0.00 H new ATOM 1559 N ARG A 97 -6.354 -6.630 -0.674 1.00 0.00 N ATOM 1560 CA ARG A 97 -6.818 -6.126 -1.961 1.00 0.00 C ATOM 1561 C ARG A 97 -8.340 -6.032 -1.992 1.00 0.00 C ATOM 1562 O ARG A 97 -8.903 -5.128 -2.610 1.00 0.00 O ATOM 1563 CB ARG A 97 -6.330 -7.033 -3.094 1.00 0.00 C ATOM 1564 CG ARG A 97 -6.730 -6.547 -4.478 1.00 0.00 C ATOM 1565 CD ARG A 97 -5.765 -7.045 -5.542 1.00 0.00 C ATOM 1566 NE ARG A 97 -6.317 -6.909 -6.887 1.00 0.00 N ATOM 1567 CZ ARG A 97 -5.640 -7.201 -7.993 1.00 0.00 C ATOM 1568 NH1 ARG A 97 -4.393 -7.642 -7.913 1.00 0.00 N ATOM 1569 NH2 ARG A 97 -6.212 -7.051 -9.181 1.00 0.00 N ATOM 0 H ARG A 97 -5.857 -7.520 -0.723 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.406 -5.126 -2.101 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -5.244 -7.109 -3.045 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.727 -8.036 -2.942 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.738 -6.892 -4.709 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.755 -5.457 -4.489 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -4.831 -6.486 -5.475 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -5.525 -8.091 -5.353 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.275 -6.571 -6.983 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -3.951 -7.758 -7.001 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -3.876 -7.865 -8.763 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -7.172 -6.711 -9.246 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -5.692 -7.275 -10.029 1.00 0.00 H new ATOM 1583 N GLU A 98 -9.000 -6.970 -1.321 1.00 0.00 N ATOM 1584 CA GLU A 98 -10.458 -6.992 -1.273 1.00 0.00 C ATOM 1585 C GLU A 98 -10.987 -5.925 -0.319 1.00 0.00 C ATOM 1586 O GLU A 98 -11.616 -4.957 -0.743 1.00 0.00 O ATOM 1587 CB GLU A 98 -10.955 -8.373 -0.839 1.00 0.00 C ATOM 1588 CG GLU A 98 -10.833 -9.432 -1.921 1.00 0.00 C ATOM 1589 CD GLU A 98 -11.798 -9.207 -3.069 1.00 0.00 C ATOM 1590 OE1 GLU A 98 -13.008 -9.454 -2.885 1.00 0.00 O ATOM 1591 OE2 GLU A 98 -11.342 -8.783 -4.152 1.00 0.00 O ATOM 0 H GLU A 98 -8.549 -7.724 -0.803 1.00 0.00 H new ATOM 0 HA GLU A 98 -10.833 -6.777 -2.274 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -10.391 -8.694 0.037 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -11.999 -8.295 -0.535 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -9.813 -9.438 -2.305 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -11.015 -10.414 -1.485 1.00 0.00 H new ATOM 1598 N GLN A 99 -10.727 -6.112 0.972 1.00 0.00 N ATOM 1599 CA GLN A 99 -11.178 -5.167 1.986 1.00 0.00 C ATOM 1600 C GLN A 99 -10.528 -3.801 1.785 1.00 0.00 C ATOM 1601 O GLN A 99 -11.209 -2.776 1.759 1.00 0.00 O ATOM 1602 CB GLN A 99 -10.857 -5.696 3.384 1.00 0.00 C ATOM 1603 CG GLN A 99 -11.547 -7.010 3.710 1.00 0.00 C ATOM 1604 CD GLN A 99 -11.542 -7.320 5.194 1.00 0.00 C ATOM 1605 OE1 GLN A 99 -11.404 -6.423 6.027 1.00 0.00 O ATOM 1606 NE2 GLN A 99 -11.691 -8.595 5.534 1.00 0.00 N ATOM 0 H GLN A 99 -10.207 -6.909 1.339 1.00 0.00 H new ATOM 0 HA GLN A 99 -12.258 -5.054 1.887 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -9.779 -5.829 3.474 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -11.149 -4.949 4.122 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -12.577 -6.973 3.354 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -11.052 -7.819 3.172 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -11.802 -9.306 4.811 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -11.694 -8.863 6.518 1.00 0.00 H new ATOM 1615 N GLY A 100 -9.207 -3.795 1.641 1.00 0.00 N ATOM 1616 CA GLY A 100 -8.488 -2.550 1.445 1.00 0.00 C ATOM 1617 C GLY A 100 -9.198 -1.614 0.488 1.00 0.00 C ATOM 1618 O GLY A 100 -9.327 -0.420 0.755 1.00 0.00 O ATOM 0 H GLY A 100 -8.622 -4.630 1.657 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.360 -2.053 2.407 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -7.490 -2.767 1.063 1.00 0.00 H new ATOM 1622 N GLY A 101 -9.663 -2.158 -0.635 1.00 0.00 N ATOM 1623 CA GLY A 101 -10.357 -1.349 -1.619 1.00 0.00 C ATOM 1624 C GLY A 101 -11.238 -0.292 -0.982 1.00 0.00 C ATOM 1625 O GLY A 101 -11.196 0.876 -1.368 1.00 0.00 O ATOM 0 H GLY A 101 -9.571 -3.144 -0.879 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.627 -0.866 -2.268 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -10.968 -1.994 -2.250 1.00 0.00 H new ATOM 1629 N ALA A 102 -12.041 -0.703 -0.007 1.00 0.00 N ATOM 1630 CA ALA A 102 -12.937 0.217 0.684 1.00 0.00 C ATOM 1631 C ALA A 102 -12.164 1.381 1.295 1.00 0.00 C ATOM 1632 O ALA A 102 -12.593 2.532 1.217 1.00 0.00 O ATOM 1633 CB ALA A 102 -13.723 -0.520 1.759 1.00 0.00 C ATOM 0 H ALA A 102 -12.090 -1.667 0.323 1.00 0.00 H new ATOM 0 HA ALA A 102 -13.636 0.623 -0.047 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -14.388 0.179 2.267 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -14.313 -1.313 1.299 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -13.032 -0.954 2.482 1.00 0.00 H new ATOM 1639 N VAL A 103 -11.023 1.074 1.902 1.00 0.00 N ATOM 1640 CA VAL A 103 -10.189 2.094 2.526 1.00 0.00 C ATOM 1641 C VAL A 103 -9.672 3.089 1.492 1.00 0.00 C ATOM 1642 O VAL A 103 -9.618 4.293 1.746 1.00 0.00 O ATOM 1643 CB VAL A 103 -8.992 1.468 3.263 1.00 0.00 C ATOM 1644 CG1 VAL A 103 -8.036 2.550 3.746 1.00 0.00 C ATOM 1645 CG2 VAL A 103 -9.469 0.611 4.425 1.00 0.00 C ATOM 0 H VAL A 103 -10.654 0.126 1.975 1.00 0.00 H new ATOM 0 HA VAL A 103 -10.816 2.617 3.248 1.00 0.00 H new ATOM 0 HB VAL A 103 -8.455 0.826 2.565 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -7.196 2.088 4.265 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.667 3.118 2.892 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.559 3.220 4.428 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -8.609 0.177 4.934 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.032 1.228 5.125 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -10.109 -0.187 4.050 1.00 0.00 H new ATOM 1655 N LEU A 104 -9.295 2.578 0.325 1.00 0.00 N ATOM 1656 CA LEU A 104 -8.783 3.421 -0.750 1.00 0.00 C ATOM 1657 C LEU A 104 -9.919 4.150 -1.459 1.00 0.00 C ATOM 1658 O LEU A 104 -9.723 5.224 -2.027 1.00 0.00 O ATOM 1659 CB LEU A 104 -7.995 2.578 -1.754 1.00 0.00 C ATOM 1660 CG LEU A 104 -6.635 2.066 -1.280 1.00 0.00 C ATOM 1661 CD1 LEU A 104 -6.063 1.069 -2.277 1.00 0.00 C ATOM 1662 CD2 LEU A 104 -5.672 3.225 -1.070 1.00 0.00 C ATOM 0 H LEU A 104 -9.334 1.584 0.099 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.119 4.165 -0.310 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.606 1.720 -2.036 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.843 3.171 -2.656 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.772 1.557 -0.326 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.095 0.715 -1.923 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.744 0.224 -2.377 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.940 1.553 -3.246 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.709 2.841 -0.733 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.540 3.763 -2.009 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.076 3.902 -0.318 1.00 0.00 H new ATOM 1674 N ARG A 105 -11.109 3.559 -1.421 1.00 0.00 N ATOM 1675 CA ARG A 105 -12.278 4.151 -2.060 1.00 0.00 C ATOM 1676 C ARG A 105 -12.822 5.309 -1.230 1.00 0.00 C ATOM 1677 O ARG A 105 -13.175 6.359 -1.768 1.00 0.00 O ATOM 1678 CB ARG A 105 -13.367 3.096 -2.259 1.00 0.00 C ATOM 1679 CG ARG A 105 -13.267 2.358 -3.584 1.00 0.00 C ATOM 1680 CD ARG A 105 -14.563 1.636 -3.920 1.00 0.00 C ATOM 1681 NE ARG A 105 -14.702 1.399 -5.354 1.00 0.00 N ATOM 1682 CZ ARG A 105 -13.977 0.512 -6.025 1.00 0.00 C ATOM 1683 NH1 ARG A 105 -13.066 -0.219 -5.395 1.00 0.00 N ATOM 1684 NH2 ARG A 105 -14.160 0.352 -7.329 1.00 0.00 N ATOM 0 H ARG A 105 -11.289 2.670 -0.954 1.00 0.00 H new ATOM 0 HA ARG A 105 -11.973 4.535 -3.033 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.313 2.373 -1.445 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -14.343 3.577 -2.194 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -13.027 3.065 -4.378 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -12.449 1.638 -3.540 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -14.595 0.684 -3.391 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -15.409 2.226 -3.567 1.00 0.00 H new ATOM 0 HE ARG A 105 -15.394 1.945 -5.868 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -12.921 -0.100 -4.392 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -12.511 -0.900 -5.913 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -14.859 0.911 -7.818 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.602 -0.330 -7.842 1.00 0.00 H new ATOM 1698 N GLN A 106 -12.886 5.112 0.083 1.00 0.00 N ATOM 1699 CA GLN A 106 -13.389 6.139 0.986 1.00 0.00 C ATOM 1700 C GLN A 106 -12.415 7.309 1.074 1.00 0.00 C ATOM 1701 O GLN A 106 -12.812 8.440 1.352 1.00 0.00 O ATOM 1702 CB GLN A 106 -13.627 5.552 2.378 1.00 0.00 C ATOM 1703 CG GLN A 106 -12.352 5.357 3.182 1.00 0.00 C ATOM 1704 CD GLN A 106 -12.595 4.645 4.499 1.00 0.00 C ATOM 1705 OE1 GLN A 106 -12.983 3.477 4.523 1.00 0.00 O ATOM 1706 NE2 GLN A 106 -12.370 5.348 5.602 1.00 0.00 N ATOM 0 H GLN A 106 -12.596 4.250 0.545 1.00 0.00 H new ATOM 0 HA GLN A 106 -14.335 6.506 0.588 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -14.298 6.210 2.931 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -14.133 4.592 2.277 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -11.638 4.784 2.590 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -11.898 6.329 3.377 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -12.049 6.314 5.535 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -12.518 4.923 6.517 1.00 0.00 H new ATOM 1715 N ALA A 107 -11.138 7.029 0.837 1.00 0.00 N ATOM 1716 CA ALA A 107 -10.107 8.059 0.889 1.00 0.00 C ATOM 1717 C ALA A 107 -9.903 8.701 -0.480 1.00 0.00 C ATOM 1718 O ALA A 107 -9.473 9.850 -0.579 1.00 0.00 O ATOM 1719 CB ALA A 107 -8.799 7.471 1.398 1.00 0.00 C ATOM 0 H ALA A 107 -10.792 6.097 0.607 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.437 8.835 1.580 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -8.038 8.251 1.432 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -8.947 7.065 2.399 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -8.473 6.675 0.729 1.00 0.00 H new ATOM 1725 N ARG A 108 -10.214 7.951 -1.532 1.00 0.00 N ATOM 1726 CA ARG A 108 -10.063 8.447 -2.894 1.00 0.00 C ATOM 1727 C ARG A 108 -10.905 9.700 -3.114 1.00 0.00 C ATOM 1728 O ARG A 108 -10.417 10.706 -3.629 1.00 0.00 O ATOM 1729 CB ARG A 108 -10.466 7.367 -3.901 1.00 0.00 C ATOM 1730 CG ARG A 108 -10.426 7.835 -5.346 1.00 0.00 C ATOM 1731 CD ARG A 108 -9.018 7.763 -5.915 1.00 0.00 C ATOM 1732 NE ARG A 108 -9.012 7.834 -7.374 1.00 0.00 N ATOM 1733 CZ ARG A 108 -9.378 6.828 -8.159 1.00 0.00 C ATOM 1734 NH1 ARG A 108 -9.778 5.680 -7.630 1.00 0.00 N ATOM 1735 NH2 ARG A 108 -9.347 6.969 -9.479 1.00 0.00 N ATOM 0 H ARG A 108 -10.572 6.998 -1.467 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.014 8.703 -3.045 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -9.802 6.510 -3.787 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -11.473 7.022 -3.667 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -11.095 7.220 -5.948 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -10.793 8.859 -5.408 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -8.421 8.580 -5.510 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -8.545 6.834 -5.595 1.00 0.00 H new ATOM 0 HE ARG A 108 -8.710 8.704 -7.813 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -9.805 5.568 -6.617 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -10.058 4.909 -8.236 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -9.042 7.851 -9.891 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -9.628 6.195 -10.081 1.00 0.00 H new ATOM 1749 N ARG A 109 -12.172 9.632 -2.717 1.00 0.00 N ATOM 1750 CA ARG A 109 -13.081 10.761 -2.873 1.00 0.00 C ATOM 1751 C ARG A 109 -12.527 12.005 -2.182 1.00 0.00 C ATOM 1752 O ARG A 109 -12.731 13.126 -2.648 1.00 0.00 O ATOM 1753 CB ARG A 109 -14.458 10.417 -2.297 1.00 0.00 C ATOM 1754 CG ARG A 109 -14.526 10.515 -0.782 1.00 0.00 C ATOM 1755 CD ARG A 109 -15.742 9.785 -0.232 1.00 0.00 C ATOM 1756 NE ARG A 109 -16.954 10.593 -0.325 1.00 0.00 N ATOM 1757 CZ ARG A 109 -18.110 10.253 0.234 1.00 0.00 C ATOM 1758 NH1 ARG A 109 -18.208 9.126 0.925 1.00 0.00 N ATOM 1759 NH2 ARG A 109 -19.169 11.041 0.104 1.00 0.00 N ATOM 0 H ARG A 109 -12.591 8.808 -2.286 1.00 0.00 H new ATOM 0 HA ARG A 109 -13.180 10.971 -3.938 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -15.201 11.087 -2.730 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -14.727 9.405 -2.600 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -13.620 10.093 -0.348 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -14.564 11.563 -0.485 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -15.884 8.854 -0.780 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -15.564 9.518 0.810 1.00 0.00 H new ATOM 0 HE ARG A 109 -16.911 11.467 -0.848 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -17.395 8.519 1.028 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -19.096 8.866 1.354 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -19.096 11.910 -0.426 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -20.056 10.778 0.534 1.00 0.00 H new ATOM 1773 N GLN A 110 -11.827 11.797 -1.072 1.00 0.00 N ATOM 1774 CA GLN A 110 -11.245 12.901 -0.319 1.00 0.00 C ATOM 1775 C GLN A 110 -10.149 13.592 -1.125 1.00 0.00 C ATOM 1776 O GLN A 110 -10.194 14.802 -1.341 1.00 0.00 O ATOM 1777 CB GLN A 110 -10.678 12.398 1.009 1.00 0.00 C ATOM 1778 CG GLN A 110 -11.688 11.632 1.850 1.00 0.00 C ATOM 1779 CD GLN A 110 -11.389 11.710 3.334 1.00 0.00 C ATOM 1780 OE1 GLN A 110 -10.915 10.745 3.935 1.00 0.00 O ATOM 1781 NE2 GLN A 110 -11.665 12.862 3.935 1.00 0.00 N ATOM 0 H GLN A 110 -11.649 10.875 -0.674 1.00 0.00 H new ATOM 0 HA GLN A 110 -12.034 13.626 -0.117 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -9.822 11.754 0.808 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -10.310 13.248 1.583 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -12.686 12.028 1.663 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -11.696 10.587 1.539 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -12.057 13.636 3.399 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -11.485 12.973 4.933 1.00 0.00 H new ATOM 1790 N ALA A 111 -9.166 12.813 -1.565 1.00 0.00 N ATOM 1791 CA ALA A 111 -8.059 13.349 -2.347 1.00 0.00 C ATOM 1792 C ALA A 111 -8.567 14.086 -3.583 1.00 0.00 C ATOM 1793 O ALA A 111 -7.820 14.822 -4.227 1.00 0.00 O ATOM 1794 CB ALA A 111 -7.109 12.231 -2.751 1.00 0.00 C ATOM 0 H ALA A 111 -9.114 11.809 -1.393 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.519 14.063 -1.726 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.287 12.645 -3.335 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.713 11.749 -1.857 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -7.646 11.496 -3.351 1.00 0.00 H new ATOM 1800 N GLU A 112 -9.840 13.884 -3.906 1.00 0.00 N ATOM 1801 CA GLU A 112 -10.445 14.529 -5.065 1.00 0.00 C ATOM 1802 C GLU A 112 -11.337 15.691 -4.636 1.00 0.00 C ATOM 1803 O GLU A 112 -11.429 16.706 -5.328 1.00 0.00 O ATOM 1804 CB GLU A 112 -11.261 13.517 -5.872 1.00 0.00 C ATOM 1805 CG GLU A 112 -10.433 12.364 -6.415 1.00 0.00 C ATOM 1806 CD GLU A 112 -10.987 11.809 -7.714 1.00 0.00 C ATOM 1807 OE1 GLU A 112 -12.211 11.920 -7.933 1.00 0.00 O ATOM 1808 OE2 GLU A 112 -10.195 11.264 -8.511 1.00 0.00 O ATOM 0 H GLU A 112 -10.472 13.279 -3.382 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.643 14.920 -5.691 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -12.055 13.118 -5.241 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.742 14.031 -6.704 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.409 12.701 -6.576 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.394 11.568 -5.671 1.00 0.00 H new ATOM 1815 N LYS A 113 -11.993 15.535 -3.491 1.00 0.00 N ATOM 1816 CA LYS A 113 -12.878 16.569 -2.969 1.00 0.00 C ATOM 1817 C LYS A 113 -12.088 17.816 -2.584 1.00 0.00 C ATOM 1818 O LYS A 113 -12.646 18.908 -2.484 1.00 0.00 O ATOM 1819 CB LYS A 113 -13.647 16.045 -1.754 1.00 0.00 C ATOM 1820 CG LYS A 113 -12.945 16.302 -0.431 1.00 0.00 C ATOM 1821 CD LYS A 113 -13.794 15.856 0.747 1.00 0.00 C ATOM 1822 CE LYS A 113 -14.778 16.938 1.167 1.00 0.00 C ATOM 1823 NZ LYS A 113 -15.242 16.750 2.569 1.00 0.00 N ATOM 0 H LYS A 113 -11.928 14.702 -2.907 1.00 0.00 H new ATOM 0 HA LYS A 113 -13.587 16.836 -3.753 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -14.632 16.511 -1.729 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -13.805 14.973 -1.869 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -11.992 15.773 -0.415 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -12.721 17.365 -0.337 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -14.339 14.950 0.482 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -13.148 15.604 1.588 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -14.307 17.916 1.068 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -15.637 16.929 0.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -15.911 17.507 2.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -15.714 15.828 2.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -14.426 16.784 3.212 1.00 0.00 H new ATOM 1837 N MET A 114 -10.788 17.645 -2.371 1.00 0.00 N ATOM 1838 CA MET A 114 -9.922 18.759 -2.000 1.00 0.00 C ATOM 1839 C MET A 114 -10.196 19.976 -2.877 1.00 0.00 C ATOM 1840 O MET A 114 -10.437 21.074 -2.376 1.00 0.00 O ATOM 1841 CB MET A 114 -8.452 18.351 -2.116 1.00 0.00 C ATOM 1842 CG MET A 114 -8.048 17.249 -1.150 1.00 0.00 C ATOM 1843 SD MET A 114 -7.494 17.889 0.441 1.00 0.00 S ATOM 1844 CE MET A 114 -7.073 16.369 1.289 1.00 0.00 C ATOM 0 H MET A 114 -10.311 16.747 -2.449 1.00 0.00 H new ATOM 0 HA MET A 114 -10.136 19.024 -0.965 1.00 0.00 H new ATOM 0 HB2 MET A 114 -8.255 18.019 -3.135 1.00 0.00 H new ATOM 0 HB3 MET A 114 -7.826 19.225 -1.939 1.00 0.00 H new ATOM 0 HG2 MET A 114 -8.894 16.580 -0.993 1.00 0.00 H new ATOM 0 HG3 MET A 114 -7.250 16.655 -1.596 1.00 0.00 H new ATOM 0 HE1 MET A 114 -6.387 16.587 2.107 1.00 0.00 H new ATOM 0 HE2 MET A 114 -7.979 15.912 1.687 1.00 0.00 H new ATOM 0 HE3 MET A 114 -6.597 15.682 0.589 1.00 0.00 H new