USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 949 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 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= -0.0189 (180deg=-0.0189) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 36:sc= -0.216 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 92:sc= 0.0105 USER MOD Single : A 36 LYS NZ :NH3+ -160:sc= -0.0831 (180deg=-0.7) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 102:sc= 1.38 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 165:sc= -0.0575 (180deg=-0.281) USER MOD Single : A 47 ASN : amide:sc= -1.35 K(o=-1.4,f=-2.3!) USER MOD Single : A 50 ASN : amide:sc= -2.07 K(o=-2.1,f=-0.19) USER MOD Single : A 54 ASN : amide:sc= -5.2 K(o=-5.2,f=-3.4!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -46:sc= 0.18 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -150:sc= -0.0654 (180deg=-0.754) USER MOD Single : A 90 THR OG1 : rot -48:sc= 0.0034 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot -58:sc= 0.123 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 49:sc= 0.214 USER MOD Single : A 108 TYR OH : rot 115:sc= 0.116 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -2.75! C(o=-2.7!,f=-16!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.383 K(o=-0.38,f=-3.2) USER MOD Single : A 121 THR OG1 : rot -66:sc= 1.16 USER MOD Single : A 131 TYR OH : rot 165:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.703 -22.391 2.506 1.00 0.00 N ATOM 49 CA SER A 6 -8.196 -22.618 1.158 1.00 0.00 C ATOM 50 C SER A 6 -7.209 -21.525 0.759 1.00 0.00 C ATOM 51 O SER A 6 -7.351 -20.898 -0.290 1.00 0.00 O ATOM 52 CB SER A 6 -9.351 -22.668 0.157 1.00 0.00 C ATOM 53 OG SER A 6 -9.934 -23.959 0.116 1.00 0.00 O ATOM 0 HA SER A 6 -7.676 -23.576 1.148 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.107 -21.933 0.432 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.989 -22.397 -0.835 1.00 0.00 H new ATOM 0 HG SER A 6 -10.671 -23.965 -0.530 1.00 0.00 H new ATOM 59 N GLY A 7 -6.206 -21.304 1.603 1.00 0.00 N ATOM 60 CA GLY A 7 -5.209 -20.287 1.322 1.00 0.00 C ATOM 61 C GLY A 7 -5.811 -18.901 1.209 1.00 0.00 C ATOM 62 O GLY A 7 -6.904 -18.734 0.669 1.00 0.00 O ATOM 0 H GLY A 7 -6.066 -21.811 2.477 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.458 -20.290 2.112 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.695 -20.533 0.393 1.00 0.00 H new ATOM 66 N MET A 8 -5.097 -17.904 1.722 1.00 0.00 N ATOM 67 CA MET A 8 -5.568 -16.525 1.677 1.00 0.00 C ATOM 68 C MET A 8 -4.423 -15.550 1.930 1.00 0.00 C ATOM 69 O MET A 8 -3.643 -15.723 2.868 1.00 0.00 O ATOM 70 CB MET A 8 -6.676 -16.307 2.710 1.00 0.00 C ATOM 71 CG MET A 8 -6.919 -14.844 3.042 1.00 0.00 C ATOM 72 SD MET A 8 -8.607 -14.527 3.589 1.00 0.00 S ATOM 73 CE MET A 8 -9.451 -14.376 2.017 1.00 0.00 C ATOM 0 H MET A 8 -4.190 -18.026 2.173 1.00 0.00 H new ATOM 0 HA MET A 8 -5.968 -16.337 0.681 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.601 -16.745 2.336 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.418 -16.841 3.625 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.224 -14.532 3.822 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.706 -14.236 2.163 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.509 -14.178 2.190 1.00 0.00 H new ATOM 0 HE2 MET A 8 -9.016 -13.554 1.448 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.342 -15.304 1.455 1.00 0.00 H new ATOM 83 N LEU A 9 -4.325 -14.527 1.089 1.00 0.00 N ATOM 84 CA LEU A 9 -3.274 -13.525 1.221 1.00 0.00 C ATOM 85 C LEU A 9 -3.830 -12.225 1.794 1.00 0.00 C ATOM 86 O LEU A 9 -4.729 -11.614 1.214 1.00 0.00 O ATOM 87 CB LEU A 9 -2.621 -13.259 -0.136 1.00 0.00 C ATOM 88 CG LEU A 9 -1.336 -12.431 -0.112 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.128 -13.325 0.120 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.181 -11.649 -1.409 1.00 0.00 C ATOM 0 H LEU A 9 -4.961 -14.369 0.308 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.522 -13.912 1.909 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.403 -14.218 -0.606 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.346 -12.750 -0.772 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.400 -11.721 0.712 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.777 -12.718 0.134 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.234 -13.840 1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.060 -14.060 -0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.261 -11.065 -1.374 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.139 -12.342 -2.249 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.031 -10.979 -1.534 1.00 0.00 H new ATOM 102 N ARG A 10 -3.288 -11.806 2.933 1.00 0.00 N ATOM 103 CA ARG A 10 -3.730 -10.578 3.583 1.00 0.00 C ATOM 104 C ARG A 10 -2.761 -9.434 3.298 1.00 0.00 C ATOM 105 O ARG A 10 -1.554 -9.564 3.500 1.00 0.00 O ATOM 106 CB ARG A 10 -3.855 -10.791 5.093 1.00 0.00 C ATOM 107 CG ARG A 10 -5.223 -11.292 5.526 1.00 0.00 C ATOM 108 CD ARG A 10 -5.373 -11.264 7.039 1.00 0.00 C ATOM 109 NE ARG A 10 -6.454 -12.131 7.498 1.00 0.00 N ATOM 110 CZ ARG A 10 -6.523 -12.633 8.726 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.578 -12.353 9.613 1.00 0.00 N ATOM 112 NH2 ARG A 10 -7.539 -13.415 9.069 1.00 0.00 N ATOM 0 H ARG A 10 -2.542 -12.299 3.425 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.707 -10.314 3.179 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.097 -11.505 5.415 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.644 -9.851 5.603 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.998 -10.676 5.071 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.371 -12.309 5.163 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.437 -11.576 7.502 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.565 -10.242 7.365 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.197 -12.364 6.840 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.797 -11.751 9.353 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.633 -12.739 10.555 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.268 -13.631 8.389 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.591 -13.800 10.012 1.00 0.00 H new ATOM 126 N VAL A 11 -3.299 -8.313 2.828 1.00 0.00 N ATOM 127 CA VAL A 11 -2.483 -7.146 2.516 1.00 0.00 C ATOM 128 C VAL A 11 -2.922 -5.934 3.330 1.00 0.00 C ATOM 129 O VAL A 11 -3.873 -5.242 2.967 1.00 0.00 O ATOM 130 CB VAL A 11 -2.553 -6.796 1.017 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.747 -5.540 0.724 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.061 -7.963 0.175 1.00 0.00 C ATOM 0 H VAL A 11 -4.296 -8.189 2.655 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.455 -7.401 2.775 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.593 -6.601 0.755 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.808 -5.308 -0.339 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.149 -4.707 1.301 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.705 -5.703 1.000 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.117 -7.699 -0.881 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.028 -8.191 0.438 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.685 -8.837 0.364 1.00 0.00 H new ATOM 142 N ILE A 12 -2.224 -5.684 4.433 1.00 0.00 N ATOM 143 CA ILE A 12 -2.542 -4.555 5.298 1.00 0.00 C ATOM 144 C ILE A 12 -1.897 -3.272 4.786 1.00 0.00 C ATOM 145 O ILE A 12 -0.707 -3.245 4.470 1.00 0.00 O ATOM 146 CB ILE A 12 -2.079 -4.807 6.745 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.661 -6.122 7.268 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.487 -3.647 7.641 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.947 -6.655 8.490 1.00 0.00 C ATOM 0 H ILE A 12 -1.435 -6.248 4.748 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.626 -4.444 5.286 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.992 -4.883 6.755 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.714 -5.974 7.508 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.617 -6.870 6.476 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.153 -3.840 8.660 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.029 -2.727 7.277 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.572 -3.542 7.629 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.413 -7.589 8.805 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.899 -6.835 8.249 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.013 -5.926 9.297 1.00 0.00 H new ATOM 161 N VAL A 13 -2.689 -2.208 4.707 1.00 0.00 N ATOM 162 CA VAL A 13 -2.196 -0.919 4.237 1.00 0.00 C ATOM 163 C VAL A 13 -2.079 0.077 5.384 1.00 0.00 C ATOM 164 O VAL A 13 -3.064 0.698 5.782 1.00 0.00 O ATOM 165 CB VAL A 13 -3.114 -0.329 3.150 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.633 1.054 2.738 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.182 -1.259 1.948 1.00 0.00 C ATOM 0 H VAL A 13 -3.676 -2.213 4.963 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.208 -1.095 3.811 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.119 -0.230 3.561 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.294 1.455 1.969 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.641 1.715 3.605 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.619 0.984 2.344 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.835 -0.827 1.190 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.183 -1.392 1.534 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.577 -2.226 2.258 1.00 0.00 H new ATOM 177 N GLU A 14 -0.868 0.225 5.912 1.00 0.00 N ATOM 178 CA GLU A 14 -0.623 1.146 7.016 1.00 0.00 C ATOM 179 C GLU A 14 -0.923 2.584 6.600 1.00 0.00 C ATOM 180 O GLU A 14 -1.944 3.153 6.985 1.00 0.00 O ATOM 181 CB GLU A 14 0.826 1.033 7.492 1.00 0.00 C ATOM 182 CG GLU A 14 1.069 -0.137 8.430 1.00 0.00 C ATOM 183 CD GLU A 14 0.583 0.135 9.841 1.00 0.00 C ATOM 184 OE1 GLU A 14 0.825 1.252 10.345 1.00 0.00 O ATOM 185 OE2 GLU A 14 -0.038 -0.767 10.439 1.00 0.00 O ATOM 0 H GLU A 14 -0.042 -0.281 5.593 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.289 0.876 7.836 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.478 0.933 6.624 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.107 1.957 7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.565 -1.021 8.040 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.135 -0.363 8.454 1.00 0.00 H new ATOM 192 N SER A 15 -0.024 3.165 5.812 1.00 0.00 N ATOM 193 CA SER A 15 -0.189 4.538 5.348 1.00 0.00 C ATOM 194 C SER A 15 0.915 4.915 4.365 1.00 0.00 C ATOM 195 O SER A 15 1.845 4.143 4.133 1.00 0.00 O ATOM 196 CB SER A 15 -0.183 5.504 6.534 1.00 0.00 C ATOM 197 OG SER A 15 0.936 5.276 7.372 1.00 0.00 O ATOM 0 H SER A 15 0.825 2.707 5.482 1.00 0.00 H new ATOM 0 HA SER A 15 -1.148 4.609 4.836 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.165 6.531 6.170 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.102 5.385 7.108 1.00 0.00 H new ATOM 0 HG SER A 15 0.918 5.907 8.121 1.00 0.00 H new ATOM 203 N ALA A 16 0.805 6.108 3.789 1.00 0.00 N ATOM 204 CA ALA A 16 1.794 6.589 2.833 1.00 0.00 C ATOM 205 C ALA A 16 2.283 7.985 3.205 1.00 0.00 C ATOM 206 O ALA A 16 1.659 8.678 4.008 1.00 0.00 O ATOM 207 CB ALA A 16 1.212 6.589 1.427 1.00 0.00 C ATOM 0 H ALA A 16 0.040 6.759 3.968 1.00 0.00 H new ATOM 0 HA ALA A 16 2.649 5.913 2.861 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.961 6.951 0.723 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.918 5.575 1.155 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.339 7.241 1.395 1.00 0.00 H new ATOM 213 N SER A 17 3.404 8.390 2.616 1.00 0.00 N ATOM 214 CA SER A 17 3.979 9.702 2.889 1.00 0.00 C ATOM 215 C SER A 17 4.867 10.157 1.734 1.00 0.00 C ATOM 216 O SER A 17 5.187 9.377 0.839 1.00 0.00 O ATOM 217 CB SER A 17 4.789 9.667 4.187 1.00 0.00 C ATOM 218 OG SER A 17 3.948 9.827 5.316 1.00 0.00 O ATOM 0 H SER A 17 3.932 7.829 1.947 1.00 0.00 H new ATOM 0 HA SER A 17 3.161 10.414 2.998 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.325 8.721 4.260 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.539 10.458 4.173 1.00 0.00 H new ATOM 0 HG SER A 17 3.093 9.376 5.154 1.00 0.00 H new ATOM 224 N ASN A 18 5.261 11.426 1.764 1.00 0.00 N ATOM 225 CA ASN A 18 6.112 11.986 0.720 1.00 0.00 C ATOM 226 C ASN A 18 5.406 11.955 -0.632 1.00 0.00 C ATOM 227 O ASN A 18 5.994 11.566 -1.642 1.00 0.00 O ATOM 228 CB ASN A 18 7.430 11.214 0.638 1.00 0.00 C ATOM 229 CG ASN A 18 8.284 11.394 1.878 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.732 12.500 2.182 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.514 10.304 2.602 1.00 0.00 N ATOM 0 H ASN A 18 5.005 12.085 2.499 1.00 0.00 H new ATOM 0 HA ASN A 18 6.323 13.024 0.976 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.219 10.154 0.496 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.989 11.547 -0.236 1.00 0.00 H new ATOM 0 HD21 ASN A 18 9.082 10.364 3.447 1.00 0.00 H new ATOM 0 HD22 ASN A 18 8.123 9.408 2.313 1.00 0.00 H new ATOM 238 N ILE A 19 4.143 12.367 -0.644 1.00 0.00 N ATOM 239 CA ILE A 19 3.358 12.387 -1.872 1.00 0.00 C ATOM 240 C ILE A 19 3.483 13.731 -2.582 1.00 0.00 C ATOM 241 O ILE A 19 3.468 14.793 -1.960 1.00 0.00 O ATOM 242 CB ILE A 19 1.870 12.103 -1.593 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.702 10.720 -0.960 1.00 0.00 C ATOM 244 CG2 ILE A 19 1.062 12.204 -2.878 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.268 10.243 -0.922 1.00 0.00 C ATOM 0 H ILE A 19 3.641 12.691 0.183 1.00 0.00 H new ATOM 0 HA ILE A 19 3.756 11.601 -2.514 1.00 0.00 H new ATOM 0 HB ILE A 19 1.498 12.850 -0.892 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.301 9.999 -1.517 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.095 10.744 0.056 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.013 12.001 -2.665 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.160 13.208 -3.292 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.433 11.476 -3.599 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.225 9.256 -0.460 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.333 10.942 -0.340 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.123 10.186 -1.938 1.00 0.00 H new ATOM 257 N PRO A 20 3.606 13.686 -3.916 1.00 0.00 N ATOM 258 CA PRO A 20 3.734 14.891 -4.741 1.00 0.00 C ATOM 259 C PRO A 20 2.441 15.699 -4.790 1.00 0.00 C ATOM 260 O PRO A 20 1.483 15.316 -5.462 1.00 0.00 O ATOM 261 CB PRO A 20 4.072 14.338 -6.128 1.00 0.00 C ATOM 262 CG PRO A 20 3.506 12.960 -6.134 1.00 0.00 C ATOM 263 CD PRO A 20 3.631 12.454 -4.724 1.00 0.00 C ATOM 0 HA PRO A 20 4.484 15.577 -4.347 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.633 14.950 -6.916 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.149 14.325 -6.297 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.464 12.968 -6.455 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.049 12.318 -6.828 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.811 11.785 -4.463 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.556 11.896 -4.578 1.00 0.00 H new ATOM 271 N LYS A 21 2.421 16.818 -4.075 1.00 0.00 N ATOM 272 CA LYS A 21 1.247 17.682 -4.038 1.00 0.00 C ATOM 273 C LYS A 21 0.884 18.167 -5.438 1.00 0.00 C ATOM 274 O LYS A 21 1.552 17.830 -6.416 1.00 0.00 O ATOM 275 CB LYS A 21 1.500 18.882 -3.121 1.00 0.00 C ATOM 276 CG LYS A 21 2.554 19.839 -3.649 1.00 0.00 C ATOM 277 CD LYS A 21 2.365 21.240 -3.092 1.00 0.00 C ATOM 278 CE LYS A 21 2.907 21.355 -1.676 1.00 0.00 C ATOM 279 NZ LYS A 21 3.026 22.774 -1.241 1.00 0.00 N ATOM 0 H LYS A 21 3.205 17.148 -3.513 1.00 0.00 H new ATOM 0 HA LYS A 21 0.412 17.102 -3.645 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.565 19.425 -2.981 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.808 18.520 -2.140 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.545 19.472 -3.384 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.506 19.870 -4.738 1.00 0.00 H new ATOM 0 HD2 LYS A 21 2.871 21.960 -3.736 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.305 21.495 -3.099 1.00 0.00 H new ATOM 0 HE2 LYS A 21 2.250 20.819 -0.991 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.884 20.875 -1.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 3.399 22.810 -0.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.673 23.280 -1.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.089 23.225 -1.269 1.00 0.00 H new ATOM 293 N THR A 22 -0.179 18.960 -5.527 1.00 0.00 N ATOM 294 CA THR A 22 -0.631 19.491 -6.807 1.00 0.00 C ATOM 295 C THR A 22 -0.633 21.015 -6.801 1.00 0.00 C ATOM 296 O THR A 22 -0.526 21.642 -5.746 1.00 0.00 O ATOM 297 CB THR A 22 -2.046 18.989 -7.156 1.00 0.00 C ATOM 298 OG1 THR A 22 -2.978 19.421 -6.158 1.00 0.00 O ATOM 299 CG2 THR A 22 -2.071 17.472 -7.258 1.00 0.00 C ATOM 0 H THR A 22 -0.743 19.249 -4.728 1.00 0.00 H new ATOM 0 HA THR A 22 0.070 19.134 -7.562 1.00 0.00 H new ATOM 0 HB THR A 22 -2.329 19.407 -8.122 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.875 19.100 -6.387 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.080 17.141 -7.505 1.00 0.00 H new ATOM 0 HG22 THR A 22 -1.381 17.148 -8.038 1.00 0.00 H new ATOM 0 HG23 THR A 22 -1.770 17.038 -6.304 1.00 0.00 H new ATOM 356 N LYS A 26 -3.744 19.649 -2.250 1.00 0.00 N ATOM 357 CA LYS A 26 -3.295 18.267 -2.137 1.00 0.00 C ATOM 358 C LYS A 26 -4.303 17.313 -2.771 1.00 0.00 C ATOM 359 O LYS A 26 -5.504 17.378 -2.509 1.00 0.00 O ATOM 360 CB LYS A 26 -3.082 17.897 -0.667 1.00 0.00 C ATOM 361 CG LYS A 26 -2.315 18.946 0.119 1.00 0.00 C ATOM 362 CD LYS A 26 -2.388 18.686 1.614 1.00 0.00 C ATOM 363 CE LYS A 26 -1.150 19.202 2.331 1.00 0.00 C ATOM 364 NZ LYS A 26 -1.180 20.681 2.496 1.00 0.00 N ATOM 0 HA LYS A 26 -2.349 18.174 -2.670 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.052 17.740 -0.196 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.545 16.950 -0.613 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.273 18.951 -0.200 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.720 19.934 -0.100 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.275 19.168 2.025 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.494 17.616 1.793 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.074 18.729 3.310 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.260 18.917 1.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.319 20.993 2.989 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.227 21.134 1.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -2.015 20.951 3.054 1.00 0.00 H new ATOM 378 N PRO A 27 -3.805 16.406 -3.624 1.00 0.00 N ATOM 379 CA PRO A 27 -4.646 15.421 -4.311 1.00 0.00 C ATOM 380 C PRO A 27 -5.199 14.366 -3.359 1.00 0.00 C ATOM 381 O PRO A 27 -4.918 14.390 -2.160 1.00 0.00 O ATOM 382 CB PRO A 27 -3.689 14.781 -5.321 1.00 0.00 C ATOM 383 CG PRO A 27 -2.335 14.967 -4.729 1.00 0.00 C ATOM 384 CD PRO A 27 -2.384 16.272 -3.984 1.00 0.00 C ATOM 0 HA PRO A 27 -5.523 15.881 -4.766 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.916 13.725 -5.467 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.764 15.261 -6.297 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.086 14.144 -4.059 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.570 14.989 -5.505 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.746 16.255 -3.101 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.047 17.102 -4.605 1.00 0.00 H new ATOM 392 N ASP A 28 -5.985 13.442 -3.900 1.00 0.00 N ATOM 393 CA ASP A 28 -6.576 12.377 -3.098 1.00 0.00 C ATOM 394 C ASP A 28 -5.935 11.031 -3.423 1.00 0.00 C ATOM 395 O ASP A 28 -6.334 10.336 -4.358 1.00 0.00 O ATOM 396 CB ASP A 28 -8.085 12.308 -3.336 1.00 0.00 C ATOM 397 CG ASP A 28 -8.750 13.667 -3.236 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.081 14.677 -3.538 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.938 13.720 -2.856 1.00 0.00 O ATOM 0 H ASP A 28 -6.228 13.409 -4.890 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.391 12.602 -2.048 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.275 11.885 -4.323 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.534 11.633 -2.608 1.00 0.00 H new ATOM 404 N PRO A 29 -4.916 10.655 -2.636 1.00 0.00 N ATOM 405 CA PRO A 29 -4.198 9.390 -2.822 1.00 0.00 C ATOM 406 C PRO A 29 -5.052 8.180 -2.462 1.00 0.00 C ATOM 407 O PRO A 29 -5.838 8.223 -1.515 1.00 0.00 O ATOM 408 CB PRO A 29 -3.012 9.512 -1.862 1.00 0.00 C ATOM 409 CG PRO A 29 -3.470 10.464 -0.812 1.00 0.00 C ATOM 410 CD PRO A 29 -4.388 11.434 -1.504 1.00 0.00 C ATOM 0 HA PRO A 29 -3.909 9.234 -3.861 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.750 8.545 -1.432 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.125 9.885 -2.374 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -3.989 9.940 -0.010 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.625 10.982 -0.359 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.186 11.774 -0.843 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.854 12.322 -1.842 1.00 0.00 H new ATOM 418 N ILE A 30 -4.894 7.102 -3.222 1.00 0.00 N ATOM 419 CA ILE A 30 -5.650 5.879 -2.981 1.00 0.00 C ATOM 420 C ILE A 30 -4.847 4.648 -3.386 1.00 0.00 C ATOM 421 O ILE A 30 -4.209 4.628 -4.439 1.00 0.00 O ATOM 422 CB ILE A 30 -6.985 5.883 -3.748 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.753 4.586 -3.484 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.740 6.066 -5.238 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.234 4.691 -3.778 1.00 0.00 C ATOM 0 H ILE A 30 -4.249 7.050 -4.010 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.855 5.840 -1.911 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.588 6.719 -3.394 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.325 3.789 -4.093 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.617 4.298 -2.441 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.694 6.067 -5.766 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.230 7.014 -5.409 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.121 5.249 -5.608 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.715 3.736 -3.569 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.676 5.465 -3.150 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.379 4.948 -4.827 1.00 0.00 H new ATOM 437 N VAL A 31 -4.885 3.620 -2.544 1.00 0.00 N ATOM 438 CA VAL A 31 -4.163 2.382 -2.815 1.00 0.00 C ATOM 439 C VAL A 31 -4.986 1.448 -3.695 1.00 0.00 C ATOM 440 O VAL A 31 -6.199 1.328 -3.526 1.00 0.00 O ATOM 441 CB VAL A 31 -3.796 1.650 -1.511 1.00 0.00 C ATOM 442 CG1 VAL A 31 -3.451 0.196 -1.794 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.643 2.354 -0.812 1.00 0.00 C ATOM 0 H VAL A 31 -5.408 3.620 -1.668 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.247 2.657 -3.339 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.660 1.671 -0.847 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.194 -0.305 -0.861 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.309 -0.300 -2.248 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.602 0.150 -2.476 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.397 1.823 0.108 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.773 2.366 -1.468 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.932 3.378 -0.574 1.00 0.00 H new ATOM 453 N SER A 32 -4.318 0.788 -4.635 1.00 0.00 N ATOM 454 CA SER A 32 -4.987 -0.133 -5.545 1.00 0.00 C ATOM 455 C SER A 32 -4.199 -1.432 -5.680 1.00 0.00 C ATOM 456 O SER A 32 -3.269 -1.527 -6.481 1.00 0.00 O ATOM 457 CB SER A 32 -5.166 0.513 -6.920 1.00 0.00 C ATOM 458 OG SER A 32 -5.754 1.798 -6.807 1.00 0.00 O ATOM 0 H SER A 32 -3.313 0.874 -4.786 1.00 0.00 H new ATOM 0 HA SER A 32 -5.968 -0.365 -5.130 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.199 0.595 -7.416 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.792 -0.123 -7.546 1.00 0.00 H new ATOM 0 HG SER A 32 -5.049 2.477 -6.751 1.00 0.00 H new ATOM 464 N VAL A 33 -4.577 -2.432 -4.890 1.00 0.00 N ATOM 465 CA VAL A 33 -3.908 -3.727 -4.921 1.00 0.00 C ATOM 466 C VAL A 33 -4.584 -4.672 -5.907 1.00 0.00 C ATOM 467 O VAL A 33 -5.812 -4.755 -5.961 1.00 0.00 O ATOM 468 CB VAL A 33 -3.890 -4.383 -3.528 1.00 0.00 C ATOM 469 CG1 VAL A 33 -5.238 -4.219 -2.843 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.513 -5.853 -3.636 1.00 0.00 C ATOM 0 H VAL A 33 -5.344 -2.370 -4.220 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.882 -3.545 -5.242 1.00 0.00 H new ATOM 0 HB VAL A 33 -3.137 -3.882 -2.920 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -5.206 -4.689 -1.860 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -5.463 -3.158 -2.731 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -6.013 -4.692 -3.446 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.505 -6.301 -2.642 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -4.241 -6.370 -4.261 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -2.523 -5.943 -4.082 1.00 0.00 H new ATOM 480 N ILE A 34 -3.776 -5.384 -6.685 1.00 0.00 N ATOM 481 CA ILE A 34 -4.296 -6.325 -7.669 1.00 0.00 C ATOM 482 C ILE A 34 -3.620 -7.686 -7.540 1.00 0.00 C ATOM 483 O ILE A 34 -2.398 -7.796 -7.637 1.00 0.00 O ATOM 484 CB ILE A 34 -4.103 -5.803 -9.105 1.00 0.00 C ATOM 485 CG1 ILE A 34 -4.964 -4.560 -9.339 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.445 -6.889 -10.114 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.262 -3.265 -8.996 1.00 0.00 C ATOM 0 H ILE A 34 -2.758 -5.327 -6.653 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.362 -6.431 -7.470 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.057 -5.527 -9.238 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.270 -4.532 -10.385 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -5.873 -4.640 -8.743 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.304 -6.505 -11.124 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -3.793 -7.749 -9.958 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.484 -7.193 -9.983 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -4.932 -2.426 -9.187 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -3.980 -3.272 -7.943 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.368 -3.162 -9.611 1.00 0.00 H new ATOM 499 N PHE A 35 -4.424 -8.721 -7.321 1.00 0.00 N ATOM 500 CA PHE A 35 -3.904 -10.076 -7.179 1.00 0.00 C ATOM 501 C PHE A 35 -4.994 -11.109 -7.452 1.00 0.00 C ATOM 502 O PHE A 35 -6.083 -11.046 -6.880 1.00 0.00 O ATOM 503 CB PHE A 35 -3.332 -10.281 -5.775 1.00 0.00 C ATOM 504 CG PHE A 35 -2.533 -11.545 -5.631 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.209 -11.592 -6.036 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.106 -12.685 -5.091 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.472 -12.754 -5.906 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.374 -13.850 -4.958 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.054 -13.884 -5.365 1.00 0.00 C ATOM 0 H PHE A 35 -5.438 -8.647 -7.238 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.108 -10.211 -7.912 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.700 -9.430 -5.521 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.151 -10.295 -5.056 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.748 -10.711 -6.458 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.137 -12.663 -4.770 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.559 -12.779 -6.227 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.833 -14.732 -4.537 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.479 -14.792 -5.260 1.00 0.00 H new ATOM 519 N LYS A 36 -4.694 -12.059 -8.331 1.00 0.00 N ATOM 520 CA LYS A 36 -5.646 -13.106 -8.682 1.00 0.00 C ATOM 521 C LYS A 36 -6.897 -12.512 -9.321 1.00 0.00 C ATOM 522 O LYS A 36 -8.019 -12.850 -8.943 1.00 0.00 O ATOM 523 CB LYS A 36 -6.029 -13.912 -7.439 1.00 0.00 C ATOM 524 CG LYS A 36 -4.884 -14.733 -6.869 1.00 0.00 C ATOM 525 CD LYS A 36 -4.757 -16.075 -7.570 1.00 0.00 C ATOM 526 CE LYS A 36 -3.319 -16.568 -7.573 1.00 0.00 C ATOM 527 NZ LYS A 36 -3.039 -17.457 -8.734 1.00 0.00 N ATOM 0 H LYS A 36 -3.798 -12.125 -8.814 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.170 -13.768 -9.405 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.393 -13.229 -6.671 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.854 -14.579 -7.689 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.951 -14.178 -6.971 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -5.045 -14.892 -5.803 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.393 -16.808 -7.073 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.114 -15.986 -8.596 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.642 -15.714 -7.599 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.118 -17.106 -6.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.195 -18.032 -8.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.854 -18.083 -8.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.872 -16.878 -9.582 1.00 0.00 H new ATOM 541 N ASP A 37 -6.697 -11.628 -10.292 1.00 0.00 N ATOM 542 CA ASP A 37 -7.809 -10.990 -10.986 1.00 0.00 C ATOM 543 C ASP A 37 -8.738 -10.291 -9.997 1.00 0.00 C ATOM 544 O ASP A 37 -9.942 -10.191 -10.227 1.00 0.00 O ATOM 545 CB ASP A 37 -8.593 -12.023 -11.797 1.00 0.00 C ATOM 546 CG ASP A 37 -7.691 -12.894 -12.649 1.00 0.00 C ATOM 547 OD1 ASP A 37 -6.959 -13.728 -12.077 1.00 0.00 O ATOM 548 OD2 ASP A 37 -7.717 -12.741 -13.889 1.00 0.00 O ATOM 0 H ASP A 37 -5.775 -11.337 -10.616 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.399 -10.242 -11.664 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -9.167 -12.654 -11.119 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.309 -11.510 -12.438 1.00 0.00 H new ATOM 553 N GLU A 38 -8.168 -9.811 -8.896 1.00 0.00 N ATOM 554 CA GLU A 38 -8.946 -9.125 -7.871 1.00 0.00 C ATOM 555 C GLU A 38 -8.348 -7.755 -7.561 1.00 0.00 C ATOM 556 O GLU A 38 -7.302 -7.652 -6.919 1.00 0.00 O ATOM 557 CB GLU A 38 -9.007 -9.967 -6.595 1.00 0.00 C ATOM 558 CG GLU A 38 -10.260 -9.729 -5.769 1.00 0.00 C ATOM 559 CD GLU A 38 -11.524 -10.156 -6.489 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.542 -11.275 -7.044 1.00 0.00 O ATOM 561 OE2 GLU A 38 -12.495 -9.371 -6.497 1.00 0.00 O ATOM 0 H GLU A 38 -7.171 -9.884 -8.691 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.957 -8.984 -8.253 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -8.953 -11.022 -6.863 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.132 -9.749 -5.983 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.180 -10.275 -4.829 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.329 -8.671 -5.518 1.00 0.00 H new ATOM 568 N LYS A 39 -9.018 -6.705 -8.023 1.00 0.00 N ATOM 569 CA LYS A 39 -8.556 -5.341 -7.796 1.00 0.00 C ATOM 570 C LYS A 39 -9.250 -4.726 -6.585 1.00 0.00 C ATOM 571 O LYS A 39 -10.439 -4.409 -6.632 1.00 0.00 O ATOM 572 CB LYS A 39 -8.811 -4.481 -9.035 1.00 0.00 C ATOM 573 CG LYS A 39 -8.248 -3.074 -8.926 1.00 0.00 C ATOM 574 CD LYS A 39 -7.881 -2.514 -10.290 1.00 0.00 C ATOM 575 CE LYS A 39 -9.098 -2.414 -11.197 1.00 0.00 C ATOM 576 NZ LYS A 39 -9.947 -1.238 -10.859 1.00 0.00 N ATOM 0 H LYS A 39 -9.884 -6.773 -8.558 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.484 -5.375 -7.600 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.373 -4.972 -9.904 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -9.885 -4.421 -9.210 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -8.981 -2.423 -8.450 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.366 -3.082 -8.286 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -7.433 -1.528 -10.171 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.130 -3.152 -10.756 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.772 -2.341 -12.235 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.690 -3.325 -11.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.766 -1.205 -11.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -10.279 -1.320 -9.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.390 -0.366 -10.964 1.00 0.00 H new ATOM 590 N LYS A 40 -8.500 -4.558 -5.501 1.00 0.00 N ATOM 591 CA LYS A 40 -9.042 -3.978 -4.277 1.00 0.00 C ATOM 592 C LYS A 40 -8.350 -2.660 -3.948 1.00 0.00 C ATOM 593 O LYS A 40 -7.124 -2.558 -4.005 1.00 0.00 O ATOM 594 CB LYS A 40 -8.883 -4.956 -3.111 1.00 0.00 C ATOM 595 CG LYS A 40 -9.663 -6.247 -3.288 1.00 0.00 C ATOM 596 CD LYS A 40 -9.291 -7.273 -2.231 1.00 0.00 C ATOM 597 CE LYS A 40 -9.510 -8.693 -2.731 1.00 0.00 C ATOM 598 NZ LYS A 40 -10.892 -9.172 -2.449 1.00 0.00 N ATOM 0 H LYS A 40 -7.515 -4.815 -5.445 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.102 -3.782 -4.435 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.826 -5.194 -2.989 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.208 -4.468 -2.192 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -10.731 -6.038 -3.233 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.469 -6.657 -4.279 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.247 -7.143 -1.948 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.888 -7.106 -1.334 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.323 -8.733 -3.804 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -8.790 -9.360 -2.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.002 -10.143 -2.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.062 -9.158 -1.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.578 -8.550 -2.922 1.00 0.00 H new ATOM 612 N LYS A 41 -9.142 -1.651 -3.600 1.00 0.00 N ATOM 613 CA LYS A 41 -8.606 -0.339 -3.258 1.00 0.00 C ATOM 614 C LYS A 41 -9.045 0.080 -1.859 1.00 0.00 C ATOM 615 O LYS A 41 -10.072 -0.377 -1.355 1.00 0.00 O ATOM 616 CB LYS A 41 -9.063 0.704 -4.281 1.00 0.00 C ATOM 617 CG LYS A 41 -10.468 0.465 -4.806 1.00 0.00 C ATOM 618 CD LYS A 41 -11.521 0.969 -3.833 1.00 0.00 C ATOM 619 CE LYS A 41 -11.885 2.420 -4.107 1.00 0.00 C ATOM 620 NZ LYS A 41 -13.088 2.844 -3.338 1.00 0.00 N ATOM 0 H LYS A 41 -10.158 -1.717 -3.547 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.518 -0.403 -3.275 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -9.018 1.693 -3.824 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.366 0.708 -5.119 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.589 0.967 -5.766 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.615 -0.601 -4.983 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -12.414 0.348 -3.908 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -11.151 0.872 -2.812 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -11.043 3.061 -3.847 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.070 2.553 -5.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.304 3.839 -3.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -13.898 2.249 -3.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.903 2.741 -2.320 1.00 0.00 H new ATOM 634 N THR A 42 -8.261 0.953 -1.234 1.00 0.00 N ATOM 635 CA THR A 42 -8.569 1.434 0.107 1.00 0.00 C ATOM 636 C THR A 42 -9.384 2.721 0.056 1.00 0.00 C ATOM 637 O THR A 42 -9.438 3.394 -0.974 1.00 0.00 O ATOM 638 CB THR A 42 -7.286 1.684 0.922 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.471 2.662 0.266 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.498 0.395 1.099 1.00 0.00 C ATOM 0 H THR A 42 -7.408 1.341 -1.635 1.00 0.00 H new ATOM 0 HA THR A 42 -9.155 0.655 0.595 1.00 0.00 H new ATOM 0 HB THR A 42 -7.573 2.053 1.906 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.580 3.529 0.709 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.596 0.596 1.677 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.111 -0.337 1.625 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.221 0.001 0.121 1.00 0.00 H new ATOM 648 N LYS A 43 -10.017 3.059 1.174 1.00 0.00 N ATOM 649 CA LYS A 43 -10.829 4.268 1.259 1.00 0.00 C ATOM 650 C LYS A 43 -10.003 5.503 0.913 1.00 0.00 C ATOM 651 O LYS A 43 -9.041 5.833 1.606 1.00 0.00 O ATOM 652 CB LYS A 43 -11.420 4.413 2.663 1.00 0.00 C ATOM 653 CG LYS A 43 -10.373 4.598 3.747 1.00 0.00 C ATOM 654 CD LYS A 43 -10.970 4.427 5.134 1.00 0.00 C ATOM 655 CE LYS A 43 -9.913 4.018 6.149 1.00 0.00 C ATOM 656 NZ LYS A 43 -10.520 3.597 7.442 1.00 0.00 N ATOM 0 H LYS A 43 -9.984 2.513 2.035 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.641 4.182 0.537 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.099 5.266 2.676 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -12.015 3.528 2.891 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.569 3.876 3.604 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.930 5.590 3.660 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.436 5.361 5.448 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.757 3.673 5.102 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.318 3.200 5.744 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.233 4.852 6.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -9.768 3.326 8.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.068 4.386 7.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.149 2.785 7.282 1.00 0.00 H new ATOM 670 N LYS A 44 -10.387 6.184 -0.162 1.00 0.00 N ATOM 671 CA LYS A 44 -9.684 7.384 -0.599 1.00 0.00 C ATOM 672 C LYS A 44 -9.657 8.432 0.509 1.00 0.00 C ATOM 673 O LYS A 44 -10.644 8.624 1.221 1.00 0.00 O ATOM 674 CB LYS A 44 -10.352 7.965 -1.848 1.00 0.00 C ATOM 675 CG LYS A 44 -11.451 8.967 -1.540 1.00 0.00 C ATOM 676 CD LYS A 44 -11.982 9.619 -2.806 1.00 0.00 C ATOM 677 CE LYS A 44 -13.199 10.484 -2.519 1.00 0.00 C ATOM 678 NZ LYS A 44 -12.962 11.415 -1.381 1.00 0.00 N ATOM 0 H LYS A 44 -11.182 5.925 -0.747 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.657 7.107 -0.839 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.594 8.448 -2.464 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.770 7.150 -2.439 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.266 8.465 -1.019 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.067 9.734 -0.868 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.200 10.228 -3.258 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.245 8.848 -3.531 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.455 11.057 -3.410 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.053 9.846 -2.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -13.697 12.150 -1.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -12.995 10.885 -0.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -12.028 11.860 -1.486 1.00 0.00 H new ATOM 692 N VAL A 45 -8.522 9.109 0.650 1.00 0.00 N ATOM 693 CA VAL A 45 -8.367 10.139 1.670 1.00 0.00 C ATOM 694 C VAL A 45 -8.409 11.533 1.054 1.00 0.00 C ATOM 695 O VAL A 45 -7.785 11.787 0.023 1.00 0.00 O ATOM 696 CB VAL A 45 -7.045 9.971 2.442 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.856 11.110 3.432 1.00 0.00 C ATOM 698 CG2 VAL A 45 -7.011 8.626 3.152 1.00 0.00 C ATOM 0 H VAL A 45 -7.696 8.962 0.070 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.201 10.025 2.363 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.221 10.001 1.729 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.917 10.974 3.968 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.834 12.059 2.895 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.682 11.115 4.143 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -6.070 8.524 3.693 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.842 8.564 3.855 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -7.097 7.825 2.418 1.00 0.00 H new ATOM 708 N ASP A 46 -9.149 12.434 1.692 1.00 0.00 N ATOM 709 CA ASP A 46 -9.271 13.804 1.207 1.00 0.00 C ATOM 710 C ASP A 46 -7.897 14.430 0.996 1.00 0.00 C ATOM 711 O ASP A 46 -6.880 13.876 1.411 1.00 0.00 O ATOM 712 CB ASP A 46 -10.083 14.645 2.194 1.00 0.00 C ATOM 713 CG ASP A 46 -11.573 14.571 1.928 1.00 0.00 C ATOM 714 OD1 ASP A 46 -12.047 15.267 1.005 1.00 0.00 O ATOM 715 OD2 ASP A 46 -12.266 13.817 2.643 1.00 0.00 O ATOM 0 H ASP A 46 -9.673 12.240 2.545 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.790 13.780 0.249 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.881 14.304 3.209 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.758 15.684 2.136 1.00 0.00 H new ATOM 720 N ASN A 47 -7.874 15.589 0.346 1.00 0.00 N ATOM 721 CA ASN A 47 -6.624 16.291 0.077 1.00 0.00 C ATOM 722 C ASN A 47 -5.639 16.107 1.228 1.00 0.00 C ATOM 723 O ASN A 47 -5.780 16.725 2.282 1.00 0.00 O ATOM 724 CB ASN A 47 -6.889 17.781 -0.149 1.00 0.00 C ATOM 725 CG ASN A 47 -7.347 18.484 1.114 1.00 0.00 C ATOM 726 OD1 ASN A 47 -6.534 19.008 1.875 1.00 0.00 O ATOM 727 ND2 ASN A 47 -8.655 18.499 1.341 1.00 0.00 N ATOM 0 H ASN A 47 -8.707 16.062 -0.004 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.185 15.866 -0.826 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -5.980 18.257 -0.518 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -7.647 17.899 -0.923 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -9.023 18.958 2.174 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -9.292 18.051 0.682 1.00 0.00 H new ATOM 734 N GLU A 48 -4.642 15.253 1.016 1.00 0.00 N ATOM 735 CA GLU A 48 -3.634 14.989 2.035 1.00 0.00 C ATOM 736 C GLU A 48 -2.418 14.293 1.431 1.00 0.00 C ATOM 737 O GLU A 48 -2.551 13.338 0.665 1.00 0.00 O ATOM 738 CB GLU A 48 -4.223 14.127 3.155 1.00 0.00 C ATOM 739 CG GLU A 48 -3.202 13.700 4.195 1.00 0.00 C ATOM 740 CD GLU A 48 -2.562 14.878 4.903 1.00 0.00 C ATOM 741 OE1 GLU A 48 -1.850 15.656 4.234 1.00 0.00 O ATOM 742 OE2 GLU A 48 -2.772 15.023 6.125 1.00 0.00 O ATOM 0 H GLU A 48 -4.511 14.733 0.148 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.315 15.945 2.450 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -5.021 14.682 3.648 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.677 13.238 2.717 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.686 13.058 4.931 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.426 13.105 3.714 1.00 0.00 H new ATOM 749 N LEU A 49 -1.232 14.780 1.779 1.00 0.00 N ATOM 750 CA LEU A 49 0.010 14.207 1.270 1.00 0.00 C ATOM 751 C LEU A 49 0.297 12.861 1.927 1.00 0.00 C ATOM 752 O LEU A 49 0.592 11.879 1.248 1.00 0.00 O ATOM 753 CB LEU A 49 1.176 15.167 1.516 1.00 0.00 C ATOM 754 CG LEU A 49 1.463 16.173 0.401 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.169 16.628 -0.254 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.236 17.366 0.946 1.00 0.00 C ATOM 0 H LEU A 49 -1.104 15.570 2.411 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.103 14.050 0.197 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.978 15.719 2.435 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.077 14.577 1.687 1.00 0.00 H new ATOM 0 HG LEU A 49 2.076 15.683 -0.356 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.394 17.344 -1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.346 15.767 -0.679 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.470 17.101 0.492 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.432 18.072 0.139 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.649 17.856 1.722 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.182 17.025 1.367 1.00 0.00 H new ATOM 768 N ASN A 50 0.207 12.824 3.253 1.00 0.00 N ATOM 769 CA ASN A 50 0.455 11.597 4.002 1.00 0.00 C ATOM 770 C ASN A 50 -0.848 11.018 4.544 1.00 0.00 C ATOM 771 O ASN A 50 -1.212 11.221 5.703 1.00 0.00 O ATOM 772 CB ASN A 50 1.426 11.867 5.154 1.00 0.00 C ATOM 773 CG ASN A 50 2.469 12.908 4.799 1.00 0.00 C ATOM 774 OD1 ASN A 50 2.869 13.714 5.640 1.00 0.00 O ATOM 775 ND2 ASN A 50 2.915 12.897 3.549 1.00 0.00 N ATOM 0 H ASN A 50 -0.036 13.629 3.830 1.00 0.00 H new ATOM 0 HA ASN A 50 0.900 10.869 3.324 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.866 12.201 6.027 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.924 10.938 5.431 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.617 13.575 3.252 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.556 12.211 2.885 1.00 0.00 H new ATOM 782 N PRO A 51 -1.568 10.278 3.689 1.00 0.00 N ATOM 783 CA PRO A 51 -2.840 9.652 4.060 1.00 0.00 C ATOM 784 C PRO A 51 -2.657 8.506 5.049 1.00 0.00 C ATOM 785 O PRO A 51 -1.537 8.057 5.293 1.00 0.00 O ATOM 786 CB PRO A 51 -3.379 9.127 2.727 1.00 0.00 C ATOM 787 CG PRO A 51 -2.169 8.925 1.882 1.00 0.00 C ATOM 788 CD PRO A 51 -1.194 9.994 2.293 1.00 0.00 C ATOM 0 HA PRO A 51 -3.508 10.353 4.560 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.928 8.195 2.862 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.067 9.839 2.270 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.747 7.932 2.036 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.414 9.007 0.823 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.163 9.649 2.215 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.281 10.881 1.665 1.00 0.00 H new ATOM 796 N VAL A 52 -3.763 8.037 5.616 1.00 0.00 N ATOM 797 CA VAL A 52 -3.724 6.942 6.578 1.00 0.00 C ATOM 798 C VAL A 52 -4.907 6.000 6.387 1.00 0.00 C ATOM 799 O VAL A 52 -6.055 6.372 6.631 1.00 0.00 O ATOM 800 CB VAL A 52 -3.728 7.467 8.026 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.835 6.313 9.012 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.482 8.295 8.296 1.00 0.00 C ATOM 0 H VAL A 52 -4.698 8.398 5.426 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.797 6.397 6.400 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.599 8.109 8.159 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.836 6.703 10.030 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.760 5.765 8.832 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.985 5.643 8.881 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.502 8.658 9.324 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.596 7.678 8.146 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.454 9.143 7.612 1.00 0.00 H new ATOM 812 N TRP A 53 -4.620 4.779 5.950 1.00 0.00 N ATOM 813 CA TRP A 53 -5.661 3.783 5.726 1.00 0.00 C ATOM 814 C TRP A 53 -5.713 2.783 6.876 1.00 0.00 C ATOM 815 O TRP A 53 -6.785 2.475 7.395 1.00 0.00 O ATOM 816 CB TRP A 53 -5.419 3.049 4.406 1.00 0.00 C ATOM 817 CG TRP A 53 -5.349 3.965 3.222 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.402 4.491 2.529 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.163 4.461 2.591 1.00 0.00 C ATOM 820 NE1 TRP A 53 -5.942 5.284 1.506 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.572 5.283 1.522 1.00 0.00 C ATOM 822 CE3 TRP A 53 -2.796 4.292 2.825 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.662 5.931 0.692 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -1.894 4.937 2.000 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.330 5.748 0.944 1.00 0.00 C ATOM 0 H TRP A 53 -3.675 4.455 5.744 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.619 4.300 5.675 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.488 2.486 4.477 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.218 2.325 4.249 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.443 4.310 2.752 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.526 5.792 0.842 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.450 3.668 3.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -3.996 6.557 -0.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -0.835 4.814 2.172 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.600 6.238 0.317 1.00 0.00 H new ATOM 836 N ASN A 54 -4.548 2.278 7.269 1.00 0.00 N ATOM 837 CA ASN A 54 -4.462 1.312 8.358 1.00 0.00 C ATOM 838 C ASN A 54 -5.562 0.261 8.241 1.00 0.00 C ATOM 839 O ASN A 54 -6.097 -0.205 9.246 1.00 0.00 O ATOM 840 CB ASN A 54 -4.562 2.024 9.708 1.00 0.00 C ATOM 841 CG ASN A 54 -5.980 2.455 10.030 1.00 0.00 C ATOM 842 OD1 ASN A 54 -6.747 1.706 10.636 1.00 0.00 O ATOM 843 ND2 ASN A 54 -6.335 3.669 9.625 1.00 0.00 N ATOM 0 H ASN A 54 -3.651 2.522 6.850 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.497 0.810 8.290 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -4.199 1.361 10.493 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -3.911 2.898 9.704 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -7.276 4.015 9.813 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -5.667 4.256 9.126 1.00 0.00 H new ATOM 850 N GLU A 55 -5.892 -0.107 7.007 1.00 0.00 N ATOM 851 CA GLU A 55 -6.928 -1.103 6.759 1.00 0.00 C ATOM 852 C GLU A 55 -6.313 -2.472 6.485 1.00 0.00 C ATOM 853 O GLU A 55 -5.091 -2.620 6.453 1.00 0.00 O ATOM 854 CB GLU A 55 -7.803 -0.678 5.578 1.00 0.00 C ATOM 855 CG GLU A 55 -7.233 -1.073 4.226 1.00 0.00 C ATOM 856 CD GLU A 55 -8.219 -0.865 3.093 1.00 0.00 C ATOM 857 OE1 GLU A 55 -8.545 0.304 2.798 1.00 0.00 O ATOM 858 OE2 GLU A 55 -8.665 -1.870 2.502 1.00 0.00 O ATOM 0 H GLU A 55 -5.458 0.269 6.164 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.548 -1.175 7.653 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.792 -1.123 5.690 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.935 0.404 5.605 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.333 -0.490 4.031 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -6.934 -2.121 4.254 1.00 0.00 H new ATOM 865 N ILE A 56 -7.168 -3.469 6.287 1.00 0.00 N ATOM 866 CA ILE A 56 -6.709 -4.826 6.015 1.00 0.00 C ATOM 867 C ILE A 56 -7.409 -5.408 4.792 1.00 0.00 C ATOM 868 O ILE A 56 -8.636 -5.368 4.687 1.00 0.00 O ATOM 869 CB ILE A 56 -6.949 -5.754 7.220 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.387 -5.125 8.496 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.319 -7.117 6.973 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.703 -5.913 9.749 1.00 0.00 C ATOM 0 H ILE A 56 -8.182 -3.363 6.310 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.638 -4.764 5.823 1.00 0.00 H new ATOM 0 HB ILE A 56 -8.023 -5.889 7.347 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.305 -5.031 8.399 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.787 -4.116 8.601 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.497 -7.762 7.834 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.762 -7.567 6.085 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.246 -7.000 6.823 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.274 -5.408 10.614 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.784 -5.985 9.870 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.280 -6.914 9.666 1.00 0.00 H new ATOM 884 N LEU A 57 -6.623 -5.950 3.869 1.00 0.00 N ATOM 885 CA LEU A 57 -7.167 -6.543 2.652 1.00 0.00 C ATOM 886 C LEU A 57 -7.013 -8.061 2.671 1.00 0.00 C ATOM 887 O LEU A 57 -6.080 -8.592 3.272 1.00 0.00 O ATOM 888 CB LEU A 57 -6.467 -5.964 1.422 1.00 0.00 C ATOM 889 CG LEU A 57 -6.477 -4.439 1.300 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.236 -3.954 0.567 1.00 0.00 C ATOM 891 CD2 LEU A 57 -7.737 -3.969 0.588 1.00 0.00 C ATOM 0 H LEU A 57 -5.606 -5.991 3.940 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.229 -6.304 2.604 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.431 -6.301 1.426 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -6.935 -6.383 0.531 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.471 -4.013 2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.261 -2.867 0.490 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.346 -4.259 1.118 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.211 -4.388 -0.432 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.727 -2.882 0.510 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -7.774 -4.404 -0.411 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.614 -4.284 1.154 1.00 0.00 H new ATOM 903 N GLU A 58 -7.934 -8.752 2.006 1.00 0.00 N ATOM 904 CA GLU A 58 -7.899 -10.208 1.945 1.00 0.00 C ATOM 905 C GLU A 58 -8.100 -10.698 0.514 1.00 0.00 C ATOM 906 O GLU A 58 -8.949 -10.186 -0.216 1.00 0.00 O ATOM 907 CB GLU A 58 -8.975 -10.805 2.856 1.00 0.00 C ATOM 908 CG GLU A 58 -9.126 -10.073 4.179 1.00 0.00 C ATOM 909 CD GLU A 58 -10.448 -10.368 4.861 1.00 0.00 C ATOM 910 OE1 GLU A 58 -11.503 -10.154 4.226 1.00 0.00 O ATOM 911 OE2 GLU A 58 -10.429 -10.811 6.028 1.00 0.00 O ATOM 0 H GLU A 58 -8.713 -8.327 1.503 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.918 -10.537 2.289 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.931 -10.792 2.332 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.734 -11.849 3.054 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.308 -10.356 4.842 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.041 -9.000 4.008 1.00 0.00 H new ATOM 918 N PHE A 59 -7.313 -11.694 0.120 1.00 0.00 N ATOM 919 CA PHE A 59 -7.402 -12.252 -1.224 1.00 0.00 C ATOM 920 C PHE A 59 -7.558 -13.770 -1.173 1.00 0.00 C ATOM 921 O PHE A 59 -6.681 -14.478 -0.680 1.00 0.00 O ATOM 922 CB PHE A 59 -6.159 -11.884 -2.036 1.00 0.00 C ATOM 923 CG PHE A 59 -6.057 -10.417 -2.344 1.00 0.00 C ATOM 924 CD1 PHE A 59 -6.669 -9.887 -3.468 1.00 0.00 C ATOM 925 CD2 PHE A 59 -5.350 -9.568 -1.508 1.00 0.00 C ATOM 926 CE1 PHE A 59 -6.576 -8.538 -3.753 1.00 0.00 C ATOM 927 CE2 PHE A 59 -5.253 -8.218 -1.788 1.00 0.00 C ATOM 928 CZ PHE A 59 -5.868 -7.702 -2.912 1.00 0.00 C ATOM 0 H PHE A 59 -6.607 -12.131 0.712 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.282 -11.829 -1.708 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.271 -12.194 -1.486 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.167 -12.444 -2.971 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -7.225 -10.535 -4.129 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.869 -9.966 -0.627 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.057 -8.138 -4.633 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -4.697 -7.568 -1.129 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.795 -6.647 -3.133 1.00 0.00 H new ATOM 938 N ASP A 60 -8.682 -14.260 -1.685 1.00 0.00 N ATOM 939 CA ASP A 60 -8.955 -15.692 -1.698 1.00 0.00 C ATOM 940 C ASP A 60 -8.005 -16.417 -2.646 1.00 0.00 C ATOM 941 O ASP A 60 -7.999 -16.162 -3.852 1.00 0.00 O ATOM 942 CB ASP A 60 -10.404 -15.953 -2.111 1.00 0.00 C ATOM 943 CG ASP A 60 -10.966 -17.214 -1.484 1.00 0.00 C ATOM 944 OD1 ASP A 60 -10.190 -18.170 -1.276 1.00 0.00 O ATOM 945 OD2 ASP A 60 -12.183 -17.246 -1.202 1.00 0.00 O ATOM 0 H ASP A 60 -9.418 -13.686 -2.096 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.798 -16.076 -0.690 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -11.020 -15.101 -1.822 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.461 -16.034 -3.197 1.00 0.00 H new ATOM 950 N LEU A 61 -7.202 -17.321 -2.095 1.00 0.00 N ATOM 951 CA LEU A 61 -6.246 -18.082 -2.891 1.00 0.00 C ATOM 952 C LEU A 61 -6.940 -19.219 -3.634 1.00 0.00 C ATOM 953 O LEU A 61 -6.511 -19.620 -4.716 1.00 0.00 O ATOM 954 CB LEU A 61 -5.139 -18.644 -1.996 1.00 0.00 C ATOM 955 CG LEU A 61 -4.104 -17.635 -1.497 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.015 -18.338 -0.700 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.502 -16.867 -2.664 1.00 0.00 C ATOM 0 H LEU A 61 -7.194 -17.545 -1.100 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.804 -17.408 -3.625 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.604 -19.116 -1.130 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.618 -19.428 -2.545 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.605 -16.924 -0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.287 -17.605 -0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.460 -18.842 0.158 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.517 -19.072 -1.333 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.768 -16.154 -2.290 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.016 -17.564 -3.346 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.291 -16.332 -3.193 1.00 0.00 H new ATOM 969 N ARG A 62 -8.016 -19.733 -3.047 1.00 0.00 N ATOM 970 CA ARG A 62 -8.770 -20.823 -3.654 1.00 0.00 C ATOM 971 C ARG A 62 -7.895 -22.061 -3.825 1.00 0.00 C ATOM 972 O ARG A 62 -7.877 -22.680 -4.888 1.00 0.00 O ATOM 973 CB ARG A 62 -9.330 -20.390 -5.011 1.00 0.00 C ATOM 974 CG ARG A 62 -10.301 -19.224 -4.925 1.00 0.00 C ATOM 975 CD ARG A 62 -11.685 -19.682 -4.492 1.00 0.00 C ATOM 976 NE ARG A 62 -12.404 -20.350 -5.573 1.00 0.00 N ATOM 977 CZ ARG A 62 -12.388 -21.665 -5.764 1.00 0.00 C ATOM 978 NH1 ARG A 62 -11.693 -22.448 -4.950 1.00 0.00 N ATOM 979 NH2 ARG A 62 -13.068 -22.198 -6.771 1.00 0.00 N ATOM 0 H ARG A 62 -8.385 -19.412 -2.152 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.597 -21.073 -2.990 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.502 -20.115 -5.665 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.834 -21.238 -5.474 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.923 -18.486 -4.218 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.367 -18.731 -5.895 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -11.593 -20.361 -3.644 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.261 -18.822 -4.151 1.00 0.00 H new ATOM 0 HE ARG A 62 -12.948 -19.776 -6.217 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -11.169 -22.041 -4.175 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -11.682 -23.457 -5.099 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -13.603 -21.598 -7.399 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -13.055 -23.207 -6.917 1.00 0.00 H new ATOM 993 N GLY A 63 -7.169 -22.417 -2.769 1.00 0.00 N ATOM 994 CA GLY A 63 -6.301 -23.579 -2.823 1.00 0.00 C ATOM 995 C GLY A 63 -5.073 -23.345 -3.680 1.00 0.00 C ATOM 996 O GLY A 63 -4.281 -24.262 -3.904 1.00 0.00 O ATOM 0 H GLY A 63 -7.167 -21.921 -1.877 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.990 -23.844 -1.812 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.859 -24.428 -3.217 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.915 -22.118 -4.163 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.775 -21.768 -5.001 1.00 0.00 C ATOM 1002 C ILE A 64 -2.696 -21.055 -4.193 1.00 0.00 C ATOM 1003 O ILE A 64 -2.827 -19.885 -3.832 1.00 0.00 O ATOM 1004 CB ILE A 64 -4.196 -20.869 -6.179 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -5.314 -21.537 -6.984 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -3.000 -20.569 -7.071 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.870 -22.786 -7.713 1.00 0.00 C ATOM 0 H ILE A 64 -5.562 -21.349 -3.989 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.374 -22.703 -5.393 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.573 -19.927 -5.781 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -6.133 -21.791 -6.311 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.706 -20.823 -7.708 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.314 -19.933 -7.899 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.233 -20.057 -6.491 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.596 -21.502 -7.464 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.713 -23.206 -8.262 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.071 -22.535 -8.411 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.506 -23.518 -6.992 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.602 -21.774 -3.902 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.478 -21.230 -3.135 1.00 0.00 C ATOM 1021 C PRO A 65 0.302 -20.178 -3.917 1.00 0.00 C ATOM 1022 O PRO A 65 -0.152 -19.700 -4.957 1.00 0.00 O ATOM 1023 CB PRO A 65 0.398 -22.457 -2.870 1.00 0.00 C ATOM 1024 CG PRO A 65 0.073 -23.401 -3.976 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.378 -23.174 -4.300 1.00 0.00 C ATOM 0 HA PRO A 65 -0.810 -20.723 -2.229 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.456 -22.196 -2.871 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.179 -22.897 -1.897 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.701 -23.213 -4.847 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.248 -24.433 -3.673 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.582 -23.328 -5.360 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -2.024 -23.857 -3.749 1.00 0.00 H new ATOM 1033 N LEU A 66 1.477 -19.821 -3.410 1.00 0.00 N ATOM 1034 CA LEU A 66 2.321 -18.825 -4.061 1.00 0.00 C ATOM 1035 C LEU A 66 3.577 -19.470 -4.638 1.00 0.00 C ATOM 1036 O LEU A 66 3.939 -20.587 -4.270 1.00 0.00 O ATOM 1037 CB LEU A 66 2.706 -17.727 -3.068 1.00 0.00 C ATOM 1038 CG LEU A 66 1.561 -16.856 -2.553 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.067 -15.869 -1.512 1.00 0.00 C ATOM 1040 CD2 LEU A 66 0.889 -16.121 -3.704 1.00 0.00 C ATOM 0 H LEU A 66 1.867 -20.207 -2.550 1.00 0.00 H new ATOM 0 HA LEU A 66 1.754 -18.382 -4.880 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.194 -18.194 -2.212 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.444 -17.079 -3.541 1.00 0.00 H new ATOM 0 HG LEU A 66 0.822 -17.504 -2.081 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.237 -15.257 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.500 -16.415 -0.674 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.826 -15.227 -1.958 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.076 -15.506 -3.318 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.619 -15.485 -4.205 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.490 -16.845 -4.415 1.00 0.00 H new ATOM 1052 N ASP A 67 4.240 -18.756 -5.542 1.00 0.00 N ATOM 1053 CA ASP A 67 5.458 -19.257 -6.167 1.00 0.00 C ATOM 1054 C ASP A 67 6.480 -18.137 -6.340 1.00 0.00 C ATOM 1055 O ASP A 67 6.178 -16.966 -6.109 1.00 0.00 O ATOM 1056 CB ASP A 67 5.139 -19.887 -7.524 1.00 0.00 C ATOM 1057 CG ASP A 67 6.341 -20.577 -8.139 1.00 0.00 C ATOM 1058 OD1 ASP A 67 6.924 -21.459 -7.474 1.00 0.00 O ATOM 1059 OD2 ASP A 67 6.698 -20.236 -9.286 1.00 0.00 O ATOM 0 H ASP A 67 3.954 -17.829 -5.858 1.00 0.00 H new ATOM 0 HA ASP A 67 5.886 -20.018 -5.514 1.00 0.00 H new ATOM 0 HB2 ASP A 67 4.331 -20.609 -7.405 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.779 -19.115 -8.204 1.00 0.00 H new ATOM 1064 N PHE A 68 7.691 -18.506 -6.745 1.00 0.00 N ATOM 1065 CA PHE A 68 8.758 -17.533 -6.947 1.00 0.00 C ATOM 1066 C PHE A 68 8.359 -16.496 -7.992 1.00 0.00 C ATOM 1067 O PHE A 68 9.020 -15.469 -8.148 1.00 0.00 O ATOM 1068 CB PHE A 68 10.046 -18.238 -7.378 1.00 0.00 C ATOM 1069 CG PHE A 68 10.804 -18.853 -6.236 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.242 -19.871 -5.482 1.00 0.00 C ATOM 1071 CD2 PHE A 68 12.078 -18.413 -5.916 1.00 0.00 C ATOM 1072 CE1 PHE A 68 10.937 -20.437 -4.431 1.00 0.00 C ATOM 1073 CE2 PHE A 68 12.778 -18.976 -4.866 1.00 0.00 C ATOM 1074 CZ PHE A 68 12.207 -19.990 -4.123 1.00 0.00 C ATOM 0 H PHE A 68 7.958 -19.471 -6.940 1.00 0.00 H new ATOM 0 HA PHE A 68 8.931 -17.021 -6.001 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.801 -19.016 -8.101 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.690 -17.521 -7.887 1.00 0.00 H new ATOM 0 HD1 PHE A 68 9.250 -20.226 -5.719 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.530 -17.620 -6.494 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.487 -21.229 -3.850 1.00 0.00 H new ATOM 0 HE2 PHE A 68 13.770 -18.623 -4.627 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.752 -20.433 -3.303 1.00 0.00 H new ATOM 1084 N SER A 69 7.273 -16.773 -8.707 1.00 0.00 N ATOM 1085 CA SER A 69 6.787 -15.867 -9.741 1.00 0.00 C ATOM 1086 C SER A 69 5.722 -14.927 -9.184 1.00 0.00 C ATOM 1087 O SER A 69 5.550 -13.808 -9.668 1.00 0.00 O ATOM 1088 CB SER A 69 6.216 -16.661 -10.918 1.00 0.00 C ATOM 1089 OG SER A 69 7.242 -17.345 -11.617 1.00 0.00 O ATOM 0 H SER A 69 6.713 -17.617 -8.589 1.00 0.00 H new ATOM 0 HA SER A 69 7.629 -15.269 -10.089 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.479 -17.377 -10.554 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.696 -15.986 -11.598 1.00 0.00 H new ATOM 0 HG SER A 69 6.851 -17.846 -12.363 1.00 0.00 H new ATOM 1095 N SER A 70 5.008 -15.391 -8.162 1.00 0.00 N ATOM 1096 CA SER A 70 3.957 -14.594 -7.540 1.00 0.00 C ATOM 1097 C SER A 70 4.459 -13.191 -7.215 1.00 0.00 C ATOM 1098 O SER A 70 5.661 -12.968 -7.069 1.00 0.00 O ATOM 1099 CB SER A 70 3.457 -15.278 -6.266 1.00 0.00 C ATOM 1100 OG SER A 70 4.489 -15.373 -5.300 1.00 0.00 O ATOM 0 H SER A 70 5.139 -16.314 -7.748 1.00 0.00 H new ATOM 0 HA SER A 70 3.132 -14.510 -8.247 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.619 -14.717 -5.853 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.086 -16.275 -6.506 1.00 0.00 H new ATOM 0 HG SER A 70 5.311 -15.688 -5.730 1.00 0.00 H new ATOM 1106 N SER A 71 3.529 -12.248 -7.104 1.00 0.00 N ATOM 1107 CA SER A 71 3.876 -10.864 -6.800 1.00 0.00 C ATOM 1108 C SER A 71 2.621 -10.023 -6.591 1.00 0.00 C ATOM 1109 O SER A 71 1.506 -10.470 -6.864 1.00 0.00 O ATOM 1110 CB SER A 71 4.721 -10.269 -7.927 1.00 0.00 C ATOM 1111 OG SER A 71 4.129 -10.512 -9.191 1.00 0.00 O ATOM 0 H SER A 71 2.530 -12.417 -7.220 1.00 0.00 H new ATOM 0 HA SER A 71 4.456 -10.855 -5.877 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.832 -9.195 -7.774 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.722 -10.700 -7.902 1.00 0.00 H new ATOM 0 HG SER A 71 4.687 -10.120 -9.895 1.00 0.00 H new ATOM 1117 N LEU A 72 2.810 -8.801 -6.104 1.00 0.00 N ATOM 1118 CA LEU A 72 1.693 -7.895 -5.857 1.00 0.00 C ATOM 1119 C LEU A 72 1.886 -6.579 -6.603 1.00 0.00 C ATOM 1120 O LEU A 72 2.999 -6.063 -6.696 1.00 0.00 O ATOM 1121 CB LEU A 72 1.549 -7.628 -4.358 1.00 0.00 C ATOM 1122 CG LEU A 72 0.149 -7.246 -3.876 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -0.701 -8.489 -3.663 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.231 -6.427 -2.596 1.00 0.00 C ATOM 0 H LEU A 72 3.725 -8.415 -5.873 1.00 0.00 H new ATOM 0 HA LEU A 72 0.783 -8.370 -6.224 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.867 -8.520 -3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.237 -6.828 -4.084 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.325 -6.635 -4.645 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.694 -8.197 -3.320 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.788 -9.036 -4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.232 -9.127 -2.914 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.774 -6.164 -2.267 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.725 -7.013 -1.820 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.802 -5.517 -2.782 1.00 0.00 H new ATOM 1136 N GLY A 73 0.792 -6.038 -7.132 1.00 0.00 N ATOM 1137 CA GLY A 73 0.862 -4.785 -7.861 1.00 0.00 C ATOM 1138 C GLY A 73 0.229 -3.637 -7.101 1.00 0.00 C ATOM 1139 O GLY A 73 -0.994 -3.567 -6.975 1.00 0.00 O ATOM 0 H GLY A 73 -0.141 -6.445 -7.069 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.905 -4.547 -8.070 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.362 -4.899 -8.823 1.00 0.00 H new ATOM 1143 N ILE A 74 1.062 -2.735 -6.593 1.00 0.00 N ATOM 1144 CA ILE A 74 0.576 -1.585 -5.841 1.00 0.00 C ATOM 1145 C ILE A 74 0.552 -0.331 -6.709 1.00 0.00 C ATOM 1146 O ILE A 74 1.598 0.232 -7.032 1.00 0.00 O ATOM 1147 CB ILE A 74 1.444 -1.318 -4.597 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.196 -2.391 -3.536 1.00 0.00 C ATOM 1149 CG2 ILE A 74 1.153 0.066 -4.036 1.00 0.00 C ATOM 1150 CD1 ILE A 74 -0.228 -2.421 -3.027 1.00 0.00 C ATOM 0 H ILE A 74 2.077 -2.778 -6.689 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.439 -1.823 -5.522 1.00 0.00 H new ATOM 0 HB ILE A 74 2.494 -1.358 -4.889 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.445 -3.367 -3.953 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.870 -2.222 -2.696 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.774 0.240 -3.157 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.375 0.819 -4.792 1.00 0.00 H new ATOM 0 HG23 ILE A 74 0.102 0.131 -3.756 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.330 -3.206 -2.278 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.475 -1.458 -2.580 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.907 -2.621 -3.856 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.648 0.100 -7.082 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.809 1.289 -7.910 1.00 0.00 C ATOM 1164 C ILE A 75 -1.559 2.385 -7.159 1.00 0.00 C ATOM 1165 O ILE A 75 -2.720 2.214 -6.787 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.561 0.969 -9.215 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -0.953 -0.262 -9.891 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.527 2.166 -10.153 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -1.912 -0.978 -10.816 1.00 0.00 C ATOM 0 H ILE A 75 -1.523 -0.356 -6.824 1.00 0.00 H new ATOM 0 HA ILE A 75 0.193 1.641 -8.155 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.601 0.751 -8.973 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.073 0.042 -10.458 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.613 -0.958 -9.124 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.063 1.924 -11.071 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.002 3.020 -9.670 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.492 2.413 -10.391 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.414 -1.840 -11.260 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.781 -1.313 -10.250 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.233 -0.298 -11.605 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.888 3.511 -6.942 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.492 4.637 -6.239 1.00 0.00 C ATOM 1183 C VAL A 76 -1.777 5.792 -7.192 1.00 0.00 C ATOM 1184 O VAL A 76 -0.867 6.330 -7.824 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.584 5.139 -5.100 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.225 6.320 -4.387 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.287 4.013 -4.121 1.00 0.00 C ATOM 0 H VAL A 76 0.074 3.668 -7.243 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.431 4.279 -5.816 1.00 0.00 H new ATOM 0 HB VAL A 76 0.359 5.474 -5.531 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.569 6.661 -3.586 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.383 7.132 -5.097 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.183 6.015 -3.966 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.356 4.385 -3.323 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.221 3.646 -3.694 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.217 3.200 -4.644 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.047 6.169 -7.293 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.455 7.261 -8.168 1.00 0.00 C ATOM 1199 C LYS A 77 -4.365 8.238 -7.431 1.00 0.00 C ATOM 1200 O LYS A 77 -4.874 7.934 -6.352 1.00 0.00 O ATOM 1201 CB LYS A 77 -4.171 6.712 -9.404 1.00 0.00 C ATOM 1202 CG LYS A 77 -3.380 5.646 -10.142 1.00 0.00 C ATOM 1203 CD LYS A 77 -4.297 4.657 -10.843 1.00 0.00 C ATOM 1204 CE LYS A 77 -4.887 5.249 -12.113 1.00 0.00 C ATOM 1205 NZ LYS A 77 -6.098 6.070 -11.832 1.00 0.00 N ATOM 0 H LYS A 77 -3.813 5.733 -6.779 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.559 7.795 -8.483 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.132 6.295 -9.102 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.381 7.535 -10.087 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.725 6.119 -10.874 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.740 5.114 -9.438 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.740 3.752 -11.087 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -5.102 4.364 -10.169 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.137 5.866 -12.609 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.145 4.445 -12.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.740 6.032 -12.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.584 5.696 -10.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.816 7.056 -11.658 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.568 9.411 -8.021 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.421 10.431 -7.422 1.00 0.00 C ATOM 1221 C ASP A 78 -6.874 10.241 -7.844 1.00 0.00 C ATOM 1222 O ASP A 78 -7.225 10.442 -9.007 1.00 0.00 O ATOM 1223 CB ASP A 78 -4.939 11.827 -7.820 1.00 0.00 C ATOM 1224 CG ASP A 78 -5.176 12.124 -9.288 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -4.352 11.694 -10.121 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -6.186 12.788 -9.603 1.00 0.00 O ATOM 0 H ASP A 78 -4.153 9.679 -8.914 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.361 10.330 -6.338 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.453 12.573 -7.214 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.875 11.917 -7.601 1.00 0.00 H new ATOM 1231 N PHE A 79 -7.716 9.853 -6.891 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.131 9.634 -7.164 1.00 0.00 C ATOM 1233 C PHE A 79 -9.682 10.720 -8.083 1.00 0.00 C ATOM 1234 O PHE A 79 -10.357 10.429 -9.070 1.00 0.00 O ATOM 1235 CB PHE A 79 -9.926 9.604 -5.857 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.285 8.979 -5.996 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.415 7.634 -6.303 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.431 9.736 -5.819 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -12.665 7.057 -6.432 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.683 9.165 -5.947 1.00 0.00 C ATOM 1241 CZ PHE A 79 -13.800 7.823 -6.252 1.00 0.00 C ATOM 0 H PHE A 79 -7.442 9.684 -5.923 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.234 8.672 -7.666 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.357 9.054 -5.107 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.040 10.623 -5.487 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -10.531 7.030 -6.443 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.345 10.785 -5.578 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -12.754 6.008 -6.673 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.569 9.767 -5.809 1.00 0.00 H new ATOM 0 HZ PHE A 79 -14.777 7.374 -6.350 1.00 0.00 H new ATOM 1378 N ILE A 88 0.266 8.811 -9.734 1.00 0.00 N ATOM 1379 CA ILE A 88 1.142 9.235 -8.648 1.00 0.00 C ATOM 1380 C ILE A 88 2.388 8.359 -8.574 1.00 0.00 C ATOM 1381 O ILE A 88 3.509 8.861 -8.504 1.00 0.00 O ATOM 1382 CB ILE A 88 0.417 9.192 -7.290 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.811 10.105 -7.314 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.364 9.599 -6.171 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.608 10.080 -6.029 1.00 0.00 C ATOM 0 HA ILE A 88 1.435 10.263 -8.862 1.00 0.00 H new ATOM 0 HB ILE A 88 0.084 8.171 -7.105 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.490 11.127 -7.513 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.458 9.808 -8.139 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.837 9.564 -5.218 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.211 8.913 -6.143 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.724 10.612 -6.349 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.463 10.750 -6.118 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.960 9.066 -5.839 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -0.976 10.406 -5.203 1.00 0.00 H new ATOM 1397 N GLY A 89 2.184 7.045 -8.592 1.00 0.00 N ATOM 1398 CA GLY A 89 3.300 6.120 -8.528 1.00 0.00 C ATOM 1399 C GLY A 89 2.856 4.694 -8.264 1.00 0.00 C ATOM 1400 O GLY A 89 1.806 4.463 -7.664 1.00 0.00 O ATOM 0 H GLY A 89 1.266 6.605 -8.650 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.853 6.157 -9.466 1.00 0.00 H new ATOM 0 HA3 GLY A 89 3.985 6.436 -7.741 1.00 0.00 H new ATOM 1404 N THR A 90 3.658 3.734 -8.714 1.00 0.00 N ATOM 1405 CA THR A 90 3.342 2.324 -8.525 1.00 0.00 C ATOM 1406 C THR A 90 4.492 1.588 -7.849 1.00 0.00 C ATOM 1407 O THR A 90 5.570 2.149 -7.652 1.00 0.00 O ATOM 1408 CB THR A 90 3.024 1.635 -9.866 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.206 1.564 -10.672 1.00 0.00 O ATOM 1410 CG2 THR A 90 1.937 2.388 -10.617 1.00 0.00 C ATOM 0 H THR A 90 4.531 3.908 -9.212 1.00 0.00 H new ATOM 0 HA THR A 90 2.461 2.281 -7.885 1.00 0.00 H new ATOM 0 HB THR A 90 2.666 0.627 -9.656 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.641 2.442 -10.693 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.730 1.883 -11.560 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.030 2.416 -10.013 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.271 3.406 -10.817 1.00 0.00 H new ATOM 1418 N ALA A 91 4.257 0.329 -7.495 1.00 0.00 N ATOM 1419 CA ALA A 91 5.276 -0.485 -6.843 1.00 0.00 C ATOM 1420 C ALA A 91 4.913 -1.965 -6.896 1.00 0.00 C ATOM 1421 O ALA A 91 3.774 -2.347 -6.622 1.00 0.00 O ATOM 1422 CB ALA A 91 5.465 -0.037 -5.401 1.00 0.00 C ATOM 0 H ALA A 91 3.370 -0.150 -7.649 1.00 0.00 H new ATOM 0 HA ALA A 91 6.214 -0.349 -7.381 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.228 -0.653 -4.926 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.778 1.007 -5.382 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.524 -0.144 -4.861 1.00 0.00 H new ATOM 1428 N THR A 92 5.887 -2.797 -7.251 1.00 0.00 N ATOM 1429 CA THR A 92 5.670 -4.235 -7.341 1.00 0.00 C ATOM 1430 C THR A 92 6.333 -4.965 -6.179 1.00 0.00 C ATOM 1431 O THR A 92 7.536 -4.832 -5.954 1.00 0.00 O ATOM 1432 CB THR A 92 6.213 -4.803 -8.666 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.636 -4.101 -9.773 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.906 -6.288 -8.785 1.00 0.00 C ATOM 0 H THR A 92 6.835 -2.499 -7.481 1.00 0.00 H new ATOM 0 HA THR A 92 4.593 -4.395 -7.300 1.00 0.00 H new ATOM 0 HB THR A 92 7.295 -4.670 -8.676 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.988 -4.467 -10.611 1.00 0.00 H new ATOM 0 HG21 THR A 92 6.299 -6.666 -9.729 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.371 -6.823 -7.957 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.827 -6.440 -8.754 1.00 0.00 H new ATOM 1442 N VAL A 93 5.540 -5.739 -5.444 1.00 0.00 N ATOM 1443 CA VAL A 93 6.051 -6.493 -4.305 1.00 0.00 C ATOM 1444 C VAL A 93 6.260 -7.959 -4.666 1.00 0.00 C ATOM 1445 O VAL A 93 5.327 -8.647 -5.077 1.00 0.00 O ATOM 1446 CB VAL A 93 5.097 -6.403 -3.099 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.694 -7.109 -1.891 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.781 -4.950 -2.776 1.00 0.00 C ATOM 0 H VAL A 93 4.542 -5.860 -5.617 1.00 0.00 H new ATOM 0 HA VAL A 93 7.009 -6.048 -4.035 1.00 0.00 H new ATOM 0 HB VAL A 93 4.164 -6.904 -3.358 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.006 -7.035 -1.049 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.863 -8.159 -2.130 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.642 -6.640 -1.627 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.106 -4.906 -1.921 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.704 -4.421 -2.537 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.307 -4.481 -3.638 1.00 0.00 H new ATOM 1458 N ALA A 94 7.493 -8.431 -4.508 1.00 0.00 N ATOM 1459 CA ALA A 94 7.824 -9.817 -4.815 1.00 0.00 C ATOM 1460 C ALA A 94 7.378 -10.750 -3.694 1.00 0.00 C ATOM 1461 O ALA A 94 7.950 -10.744 -2.603 1.00 0.00 O ATOM 1462 CB ALA A 94 9.319 -9.960 -5.059 1.00 0.00 C ATOM 0 H ALA A 94 8.278 -7.874 -4.170 1.00 0.00 H new ATOM 0 HA ALA A 94 7.289 -10.100 -5.722 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.553 -11.000 -5.287 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.613 -9.330 -5.898 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.864 -9.653 -4.167 1.00 0.00 H new ATOM 1468 N LEU A 95 6.353 -11.549 -3.968 1.00 0.00 N ATOM 1469 CA LEU A 95 5.829 -12.488 -2.982 1.00 0.00 C ATOM 1470 C LEU A 95 6.696 -13.740 -2.907 1.00 0.00 C ATOM 1471 O LEU A 95 6.443 -14.637 -2.103 1.00 0.00 O ATOM 1472 CB LEU A 95 4.389 -12.871 -3.329 1.00 0.00 C ATOM 1473 CG LEU A 95 3.376 -11.726 -3.348 1.00 0.00 C ATOM 1474 CD1 LEU A 95 2.063 -12.185 -3.962 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.150 -11.190 -1.941 1.00 0.00 C ATOM 0 H LEU A 95 5.868 -11.566 -4.865 1.00 0.00 H new ATOM 0 HA LEU A 95 5.844 -12.000 -2.008 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.387 -13.347 -4.309 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.050 -13.618 -2.611 1.00 0.00 H new ATOM 0 HG LEU A 95 3.779 -10.921 -3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.354 -11.357 -3.967 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.237 -12.520 -4.985 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.655 -13.008 -3.375 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.426 -10.376 -1.974 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.769 -11.989 -1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.093 -10.822 -1.536 1.00 0.00 H new ATOM 1487 N LYS A 96 7.723 -13.793 -3.749 1.00 0.00 N ATOM 1488 CA LYS A 96 8.632 -14.933 -3.777 1.00 0.00 C ATOM 1489 C LYS A 96 9.347 -15.092 -2.439 1.00 0.00 C ATOM 1490 O LYS A 96 9.926 -16.140 -2.154 1.00 0.00 O ATOM 1491 CB LYS A 96 9.658 -14.766 -4.900 1.00 0.00 C ATOM 1492 CG LYS A 96 10.725 -13.728 -4.599 1.00 0.00 C ATOM 1493 CD LYS A 96 12.001 -13.997 -5.380 1.00 0.00 C ATOM 1494 CE LYS A 96 11.975 -13.316 -6.740 1.00 0.00 C ATOM 1495 NZ LYS A 96 13.286 -13.420 -7.438 1.00 0.00 N ATOM 0 H LYS A 96 7.947 -13.059 -4.421 1.00 0.00 H new ATOM 0 HA LYS A 96 8.043 -15.831 -3.963 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.139 -15.726 -5.087 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.139 -14.486 -5.817 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.348 -12.735 -4.846 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.944 -13.729 -3.531 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.860 -13.642 -4.810 1.00 0.00 H new ATOM 0 HD3 LYS A 96 12.129 -15.071 -5.512 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.198 -13.767 -7.357 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.713 -12.265 -6.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.227 -12.944 -8.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 14.023 -12.967 -6.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.525 -14.422 -7.580 1.00 0.00 H new ATOM 1509 N ASP A 97 9.303 -14.045 -1.622 1.00 0.00 N ATOM 1510 CA ASP A 97 9.945 -14.069 -0.313 1.00 0.00 C ATOM 1511 C ASP A 97 9.074 -14.798 0.706 1.00 0.00 C ATOM 1512 O ASP A 97 9.580 -15.499 1.583 1.00 0.00 O ATOM 1513 CB ASP A 97 10.228 -12.645 0.166 1.00 0.00 C ATOM 1514 CG ASP A 97 11.590 -12.146 -0.276 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.600 -12.790 0.075 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.646 -11.110 -0.972 1.00 0.00 O ATOM 0 H ASP A 97 8.829 -13.169 -1.843 1.00 0.00 H new ATOM 0 HA ASP A 97 10.889 -14.606 -0.408 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.457 -11.976 -0.217 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.167 -12.612 1.254 1.00 0.00 H new ATOM 1521 N LEU A 98 7.762 -14.627 0.585 1.00 0.00 N ATOM 1522 CA LEU A 98 6.820 -15.268 1.496 1.00 0.00 C ATOM 1523 C LEU A 98 6.661 -16.748 1.163 1.00 0.00 C ATOM 1524 O LEU A 98 6.535 -17.587 2.055 1.00 0.00 O ATOM 1525 CB LEU A 98 5.461 -14.569 1.429 1.00 0.00 C ATOM 1526 CG LEU A 98 5.494 -13.043 1.335 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.158 -12.509 0.843 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.851 -12.433 2.683 1.00 0.00 C ATOM 0 H LEU A 98 7.327 -14.050 -0.135 1.00 0.00 H new ATOM 0 HA LEU A 98 7.216 -15.184 2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.919 -14.954 0.565 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.889 -14.846 2.314 1.00 0.00 H new ATOM 0 HG LEU A 98 6.262 -12.759 0.616 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.201 -11.422 0.783 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.943 -12.919 -0.144 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.371 -12.803 1.537 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.870 -11.347 2.597 1.00 0.00 H new ATOM 0 HD22 LEU A 98 5.107 -12.726 3.423 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.833 -12.789 2.995 1.00 0.00 H new ATOM 1540 N THR A 99 6.668 -17.062 -0.129 1.00 0.00 N ATOM 1541 CA THR A 99 6.526 -18.441 -0.581 1.00 0.00 C ATOM 1542 C THR A 99 7.328 -19.393 0.298 1.00 0.00 C ATOM 1543 O THR A 99 8.432 -19.069 0.735 1.00 0.00 O ATOM 1544 CB THR A 99 6.982 -18.603 -2.043 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.329 -18.140 -2.190 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.069 -17.830 -2.983 1.00 0.00 C ATOM 0 H THR A 99 6.770 -16.380 -0.881 1.00 0.00 H new ATOM 0 HA THR A 99 5.467 -18.689 -0.509 1.00 0.00 H new ATOM 0 HB THR A 99 6.932 -19.661 -2.301 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.384 -17.201 -1.916 1.00 0.00 H new ATOM 0 HG21 THR A 99 6.411 -17.959 -4.010 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.050 -18.205 -2.890 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.092 -16.772 -2.724 1.00 0.00 H new ATOM 1554 N GLY A 100 6.766 -20.571 0.554 1.00 0.00 N ATOM 1555 CA GLY A 100 7.445 -21.553 1.380 1.00 0.00 C ATOM 1556 C GLY A 100 6.478 -22.474 2.097 1.00 0.00 C ATOM 1557 O GLY A 100 6.737 -22.903 3.221 1.00 0.00 O ATOM 0 H GLY A 100 5.853 -20.863 0.204 1.00 0.00 H new ATOM 0 HA2 GLY A 100 8.114 -22.147 0.757 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.065 -21.039 2.114 1.00 0.00 H new ATOM 1561 N ASP A 101 5.360 -22.778 1.447 1.00 0.00 N ATOM 1562 CA ASP A 101 4.350 -23.654 2.030 1.00 0.00 C ATOM 1563 C ASP A 101 4.208 -23.398 3.527 1.00 0.00 C ATOM 1564 O ASP A 101 3.833 -24.292 4.285 1.00 0.00 O ATOM 1565 CB ASP A 101 4.711 -25.119 1.782 1.00 0.00 C ATOM 1566 CG ASP A 101 5.636 -25.676 2.846 1.00 0.00 C ATOM 1567 OD1 ASP A 101 6.826 -25.299 2.855 1.00 0.00 O ATOM 1568 OD2 ASP A 101 5.169 -26.490 3.671 1.00 0.00 O ATOM 0 H ASP A 101 5.130 -22.431 0.516 1.00 0.00 H new ATOM 0 HA ASP A 101 3.395 -23.437 1.551 1.00 0.00 H new ATOM 0 HB2 ASP A 101 3.799 -25.714 1.750 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.187 -25.213 0.806 1.00 0.00 H new ATOM 1573 N GLN A 102 4.512 -22.174 3.945 1.00 0.00 N ATOM 1574 CA GLN A 102 4.420 -21.802 5.352 1.00 0.00 C ATOM 1575 C GLN A 102 3.963 -20.355 5.504 1.00 0.00 C ATOM 1576 O GLN A 102 4.308 -19.496 4.692 1.00 0.00 O ATOM 1577 CB GLN A 102 5.771 -21.998 6.042 1.00 0.00 C ATOM 1578 CG GLN A 102 5.999 -23.415 6.543 1.00 0.00 C ATOM 1579 CD GLN A 102 7.305 -23.565 7.298 1.00 0.00 C ATOM 1580 OE1 GLN A 102 8.063 -22.606 7.445 1.00 0.00 O ATOM 1581 NE2 GLN A 102 7.574 -24.772 7.782 1.00 0.00 N ATOM 0 H GLN A 102 4.824 -21.423 3.330 1.00 0.00 H new ATOM 0 HA GLN A 102 3.681 -22.448 5.825 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.567 -21.736 5.345 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.843 -21.308 6.883 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.173 -23.704 7.193 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.993 -24.101 5.696 1.00 0.00 H new ATOM 0 HE21 GLN A 102 6.917 -25.538 7.636 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.438 -24.933 8.300 1.00 0.00 H new ATOM 1590 N SER A 103 3.185 -20.092 6.549 1.00 0.00 N ATOM 1591 CA SER A 103 2.677 -18.749 6.805 1.00 0.00 C ATOM 1592 C SER A 103 3.818 -17.791 7.135 1.00 0.00 C ATOM 1593 O SER A 103 4.520 -17.964 8.131 1.00 0.00 O ATOM 1594 CB SER A 103 1.668 -18.774 7.955 1.00 0.00 C ATOM 1595 OG SER A 103 1.464 -17.475 8.482 1.00 0.00 O ATOM 0 H SER A 103 2.893 -20.791 7.232 1.00 0.00 H new ATOM 0 HA SER A 103 2.179 -18.396 5.902 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.720 -19.180 7.602 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.026 -19.437 8.742 1.00 0.00 H new ATOM 0 HG SER A 103 0.814 -17.517 9.214 1.00 0.00 H new ATOM 1601 N ARG A 104 3.995 -16.780 6.291 1.00 0.00 N ATOM 1602 CA ARG A 104 5.050 -15.794 6.491 1.00 0.00 C ATOM 1603 C ARG A 104 4.571 -14.398 6.103 1.00 0.00 C ATOM 1604 O ARG A 104 4.225 -14.149 4.948 1.00 0.00 O ATOM 1605 CB ARG A 104 6.288 -16.166 5.673 1.00 0.00 C ATOM 1606 CG ARG A 104 7.400 -15.133 5.745 1.00 0.00 C ATOM 1607 CD ARG A 104 8.664 -15.626 5.058 1.00 0.00 C ATOM 1608 NE ARG A 104 9.169 -16.856 5.660 1.00 0.00 N ATOM 1609 CZ ARG A 104 8.750 -18.069 5.317 1.00 0.00 C ATOM 1610 NH1 ARG A 104 7.823 -18.213 4.380 1.00 0.00 N ATOM 1611 NH2 ARG A 104 9.258 -19.141 5.911 1.00 0.00 N ATOM 0 H ARG A 104 3.422 -16.622 5.462 1.00 0.00 H new ATOM 0 HA ARG A 104 5.311 -15.789 7.549 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.671 -17.124 6.025 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.997 -16.302 4.631 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.068 -14.206 5.277 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.618 -14.903 6.788 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.459 -15.797 4.001 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.431 -14.854 5.113 1.00 0.00 H new ATOM 0 HE ARG A 104 9.883 -16.780 6.384 1.00 0.00 H new ATOM 0 HH11 ARG A 104 7.430 -17.391 3.921 1.00 0.00 H new ATOM 0 HH12 ARG A 104 7.503 -19.145 4.118 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.971 -19.034 6.632 1.00 0.00 H new ATOM 0 HH22 ARG A 104 8.935 -20.072 5.646 1.00 0.00 H new ATOM 1625 N SER A 105 4.554 -13.492 7.075 1.00 0.00 N ATOM 1626 CA SER A 105 4.113 -12.123 6.836 1.00 0.00 C ATOM 1627 C SER A 105 5.267 -11.141 7.017 1.00 0.00 C ATOM 1628 O SER A 105 5.690 -10.862 8.140 1.00 0.00 O ATOM 1629 CB SER A 105 2.967 -11.761 7.782 1.00 0.00 C ATOM 1630 OG SER A 105 3.278 -12.117 9.118 1.00 0.00 O ATOM 0 H SER A 105 4.841 -13.681 8.035 1.00 0.00 H new ATOM 0 HA SER A 105 3.760 -12.056 5.807 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.768 -10.691 7.724 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.057 -12.272 7.468 1.00 0.00 H new ATOM 0 HG SER A 105 4.173 -11.789 9.344 1.00 0.00 H new ATOM 1636 N LEU A 106 5.773 -10.621 5.904 1.00 0.00 N ATOM 1637 CA LEU A 106 6.878 -9.670 5.938 1.00 0.00 C ATOM 1638 C LEU A 106 6.386 -8.252 5.665 1.00 0.00 C ATOM 1639 O LEU A 106 5.795 -7.964 4.624 1.00 0.00 O ATOM 1640 CB LEU A 106 7.943 -10.059 4.911 1.00 0.00 C ATOM 1641 CG LEU A 106 8.708 -11.353 5.194 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.322 -11.900 3.915 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.782 -11.118 6.246 1.00 0.00 C ATOM 0 H LEU A 106 5.436 -10.842 4.967 1.00 0.00 H new ATOM 0 HA LEU A 106 7.317 -9.696 6.936 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.463 -10.150 3.936 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.663 -9.244 4.837 1.00 0.00 H new ATOM 0 HG LEU A 106 8.005 -12.092 5.580 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.862 -12.821 4.136 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.533 -12.107 3.192 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.012 -11.165 3.499 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.316 -12.049 6.435 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.483 -10.364 5.888 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.317 -10.773 7.170 1.00 0.00 H new ATOM 1655 N PRO A 107 6.636 -7.344 6.620 1.00 0.00 N ATOM 1656 CA PRO A 107 6.229 -5.941 6.503 1.00 0.00 C ATOM 1657 C PRO A 107 7.029 -5.191 5.444 1.00 0.00 C ATOM 1658 O PRO A 107 8.199 -4.869 5.649 1.00 0.00 O ATOM 1659 CB PRO A 107 6.518 -5.371 7.894 1.00 0.00 C ATOM 1660 CG PRO A 107 7.590 -6.245 8.446 1.00 0.00 C ATOM 1661 CD PRO A 107 7.335 -7.617 7.886 1.00 0.00 C ATOM 0 HA PRO A 107 5.188 -5.843 6.194 1.00 0.00 H new ATOM 0 HB2 PRO A 107 6.844 -4.333 7.836 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.628 -5.391 8.523 1.00 0.00 H new ATOM 0 HG2 PRO A 107 8.576 -5.883 8.157 1.00 0.00 H new ATOM 0 HG3 PRO A 107 7.562 -6.257 9.536 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.264 -8.163 7.722 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.726 -8.219 8.560 1.00 0.00 H new ATOM 1669 N TYR A 108 6.390 -4.915 4.312 1.00 0.00 N ATOM 1670 CA TYR A 108 7.044 -4.205 3.219 1.00 0.00 C ATOM 1671 C TYR A 108 6.870 -2.696 3.369 1.00 0.00 C ATOM 1672 O TYR A 108 5.813 -2.147 3.057 1.00 0.00 O ATOM 1673 CB TYR A 108 6.478 -4.663 1.874 1.00 0.00 C ATOM 1674 CG TYR A 108 6.873 -6.074 1.501 1.00 0.00 C ATOM 1675 CD1 TYR A 108 6.095 -7.159 1.886 1.00 0.00 C ATOM 1676 CD2 TYR A 108 8.023 -6.322 0.762 1.00 0.00 C ATOM 1677 CE1 TYR A 108 6.453 -8.450 1.548 1.00 0.00 C ATOM 1678 CE2 TYR A 108 8.387 -7.610 0.417 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.599 -8.670 0.813 1.00 0.00 C ATOM 1680 OH TYR A 108 7.958 -9.954 0.473 1.00 0.00 O ATOM 0 H TYR A 108 5.420 -5.172 4.128 1.00 0.00 H new ATOM 0 HA TYR A 108 8.109 -4.436 3.255 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.391 -4.595 1.905 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.818 -3.981 1.095 1.00 0.00 H new ATOM 0 HD1 TYR A 108 5.195 -6.990 2.459 1.00 0.00 H new ATOM 0 HD2 TYR A 108 8.643 -5.494 0.452 1.00 0.00 H new ATOM 0 HE1 TYR A 108 5.839 -9.282 1.858 1.00 0.00 H new ATOM 0 HE2 TYR A 108 9.283 -7.785 -0.159 1.00 0.00 H new ATOM 0 HH TYR A 108 7.911 -10.060 -0.500 1.00 0.00 H new ATOM 1690 N LYS A 109 7.916 -2.032 3.849 1.00 0.00 N ATOM 1691 CA LYS A 109 7.883 -0.587 4.040 1.00 0.00 C ATOM 1692 C LYS A 109 9.018 0.089 3.278 1.00 0.00 C ATOM 1693 O LYS A 109 9.909 -0.578 2.750 1.00 0.00 O ATOM 1694 CB LYS A 109 7.980 -0.246 5.529 1.00 0.00 C ATOM 1695 CG LYS A 109 7.112 -1.125 6.412 1.00 0.00 C ATOM 1696 CD LYS A 109 6.671 -0.393 7.668 1.00 0.00 C ATOM 1697 CE LYS A 109 5.959 -1.324 8.636 1.00 0.00 C ATOM 1698 NZ LYS A 109 6.135 -0.895 10.051 1.00 0.00 N ATOM 0 H LYS A 109 8.798 -2.472 4.113 1.00 0.00 H new ATOM 0 HA LYS A 109 6.935 -0.216 3.649 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.018 -0.338 5.847 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.694 0.796 5.674 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.235 -1.450 5.853 1.00 0.00 H new ATOM 0 HG3 LYS A 109 7.665 -2.023 6.688 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.540 0.047 8.158 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.008 0.428 7.397 1.00 0.00 H new ATOM 0 HE2 LYS A 109 4.896 -1.354 8.395 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.342 -2.337 8.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 5.634 -1.556 10.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 7.147 -0.891 10.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 5.746 0.062 10.175 1.00 0.00 H new ATOM 1712 N LEU A 110 8.981 1.416 3.225 1.00 0.00 N ATOM 1713 CA LEU A 110 10.009 2.182 2.528 1.00 0.00 C ATOM 1714 C LEU A 110 10.012 1.860 1.037 1.00 0.00 C ATOM 1715 O LEU A 110 11.058 1.891 0.388 1.00 0.00 O ATOM 1716 CB LEU A 110 11.385 1.890 3.128 1.00 0.00 C ATOM 1717 CG LEU A 110 11.514 2.083 4.639 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.715 1.319 5.174 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.625 3.562 4.980 1.00 0.00 C ATOM 0 H LEU A 110 8.251 1.984 3.656 1.00 0.00 H new ATOM 0 HA LEU A 110 9.784 3.241 2.651 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.652 0.860 2.890 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.117 2.531 2.636 1.00 0.00 H new ATOM 0 HG LEU A 110 10.617 1.687 5.115 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.791 1.468 6.251 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.594 0.257 4.962 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.622 1.684 4.692 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.716 3.681 6.060 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.505 3.983 4.493 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.734 4.084 4.632 1.00 0.00 H new ATOM 1731 N ILE A 111 8.836 1.552 0.501 1.00 0.00 N ATOM 1732 CA ILE A 111 8.703 1.228 -0.913 1.00 0.00 C ATOM 1733 C ILE A 111 8.704 2.490 -1.770 1.00 0.00 C ATOM 1734 O ILE A 111 7.878 3.382 -1.580 1.00 0.00 O ATOM 1735 CB ILE A 111 7.412 0.435 -1.190 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.423 -0.885 -0.416 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.257 0.179 -2.682 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.089 -1.599 -0.421 1.00 0.00 C ATOM 0 H ILE A 111 7.962 1.520 1.025 1.00 0.00 H new ATOM 0 HA ILE A 111 9.563 0.612 -1.177 1.00 0.00 H new ATOM 0 HB ILE A 111 6.561 1.026 -0.852 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.179 -1.542 -0.845 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.718 -0.690 0.615 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.340 -0.382 -2.862 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.209 1.131 -3.211 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.110 -0.395 -3.043 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.171 -2.526 0.146 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.333 -0.960 0.035 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.801 -1.826 -1.448 1.00 0.00 H new ATOM 1750 N SER A 112 9.637 2.556 -2.714 1.00 0.00 N ATOM 1751 CA SER A 112 9.748 3.710 -3.599 1.00 0.00 C ATOM 1752 C SER A 112 8.792 3.581 -4.782 1.00 0.00 C ATOM 1753 O SER A 112 8.901 2.653 -5.584 1.00 0.00 O ATOM 1754 CB SER A 112 11.185 3.857 -4.103 1.00 0.00 C ATOM 1755 OG SER A 112 11.950 4.670 -3.231 1.00 0.00 O ATOM 0 H SER A 112 10.327 1.825 -2.886 1.00 0.00 H new ATOM 0 HA SER A 112 9.478 4.600 -3.031 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.647 2.873 -4.187 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.181 4.293 -5.102 1.00 0.00 H new ATOM 0 HG SER A 112 12.865 4.747 -3.574 1.00 0.00 H new ATOM 1761 N LEU A 113 7.857 4.518 -4.883 1.00 0.00 N ATOM 1762 CA LEU A 113 6.881 4.511 -5.967 1.00 0.00 C ATOM 1763 C LEU A 113 7.468 5.129 -7.232 1.00 0.00 C ATOM 1764 O LEU A 113 8.242 6.085 -7.168 1.00 0.00 O ATOM 1765 CB LEU A 113 5.621 5.273 -5.551 1.00 0.00 C ATOM 1766 CG LEU A 113 4.861 4.707 -4.351 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.811 5.697 -3.870 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.216 3.375 -4.708 1.00 0.00 C ATOM 0 H LEU A 113 7.754 5.293 -4.228 1.00 0.00 H new ATOM 0 HA LEU A 113 6.618 3.475 -6.179 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.900 6.302 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.942 5.306 -6.403 1.00 0.00 H new ATOM 0 HG LEU A 113 5.571 4.539 -3.541 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.280 5.278 -3.016 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.296 6.627 -3.575 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.103 5.897 -4.675 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.679 2.987 -3.842 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.518 3.518 -5.533 1.00 0.00 H new ATOM 0 HD23 LEU A 113 4.988 2.665 -5.005 1.00 0.00 H new ATOM 1780 N LEU A 114 7.093 4.579 -8.382 1.00 0.00 N ATOM 1781 CA LEU A 114 7.581 5.077 -9.663 1.00 0.00 C ATOM 1782 C LEU A 114 6.422 5.359 -10.614 1.00 0.00 C ATOM 1783 O LEU A 114 5.392 4.689 -10.569 1.00 0.00 O ATOM 1784 CB LEU A 114 8.540 4.067 -10.295 1.00 0.00 C ATOM 1785 CG LEU A 114 9.491 3.353 -9.334 1.00 0.00 C ATOM 1786 CD1 LEU A 114 10.133 2.153 -10.012 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.555 4.314 -8.825 1.00 0.00 C ATOM 0 H LEU A 114 6.453 3.788 -8.453 1.00 0.00 H new ATOM 0 HA LEU A 114 8.115 6.010 -9.482 1.00 0.00 H new ATOM 0 HB2 LEU A 114 7.950 3.314 -10.817 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.136 4.584 -11.047 1.00 0.00 H new ATOM 0 HG LEU A 114 8.915 2.996 -8.480 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.807 1.657 -9.313 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.357 1.454 -10.326 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.696 2.486 -10.884 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.223 3.789 -8.142 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.128 4.701 -9.667 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.077 5.141 -8.300 1.00 0.00 H new ATOM 1799 N ASN A 115 6.600 6.354 -11.477 1.00 0.00 N ATOM 1800 CA ASN A 115 5.570 6.724 -12.441 1.00 0.00 C ATOM 1801 C ASN A 115 5.551 5.751 -13.617 1.00 0.00 C ATOM 1802 O ASN A 115 6.282 4.762 -13.627 1.00 0.00 O ATOM 1803 CB ASN A 115 5.802 8.149 -12.947 1.00 0.00 C ATOM 1804 CG ASN A 115 7.276 8.495 -13.041 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.130 7.611 -13.101 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.580 9.788 -13.055 1.00 0.00 N ATOM 0 H ASN A 115 7.448 6.919 -11.528 1.00 0.00 H new ATOM 0 HA ASN A 115 4.604 6.678 -11.938 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.341 8.263 -13.928 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.308 8.854 -12.279 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.555 10.082 -13.118 1.00 0.00 H new ATOM 0 HD22 ASN A 115 6.839 10.487 -13.003 1.00 0.00 H new ATOM 1813 N GLU A 116 4.710 6.042 -14.605 1.00 0.00 N ATOM 1814 CA GLU A 116 4.596 5.193 -15.785 1.00 0.00 C ATOM 1815 C GLU A 116 5.893 5.204 -16.590 1.00 0.00 C ATOM 1816 O GLU A 116 6.045 4.453 -17.554 1.00 0.00 O ATOM 1817 CB GLU A 116 3.433 5.656 -16.664 1.00 0.00 C ATOM 1818 CG GLU A 116 3.699 6.968 -17.384 1.00 0.00 C ATOM 1819 CD GLU A 116 2.868 7.120 -18.643 1.00 0.00 C ATOM 1820 OE1 GLU A 116 2.963 6.242 -19.526 1.00 0.00 O ATOM 1821 OE2 GLU A 116 2.124 8.118 -18.746 1.00 0.00 O ATOM 0 H GLU A 116 4.098 6.858 -14.612 1.00 0.00 H new ATOM 0 HA GLU A 116 4.405 4.173 -15.450 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.216 4.884 -17.402 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.542 5.765 -16.046 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.486 7.798 -16.710 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.756 7.029 -17.641 1.00 0.00 H new ATOM 1828 N LYS A 117 6.824 6.062 -16.188 1.00 0.00 N ATOM 1829 CA LYS A 117 8.108 6.173 -16.870 1.00 0.00 C ATOM 1830 C LYS A 117 9.168 5.325 -16.175 1.00 0.00 C ATOM 1831 O LYS A 117 10.081 4.807 -16.817 1.00 0.00 O ATOM 1832 CB LYS A 117 8.559 7.635 -16.918 1.00 0.00 C ATOM 1833 CG LYS A 117 7.479 8.590 -17.396 1.00 0.00 C ATOM 1834 CD LYS A 117 6.553 8.997 -16.262 1.00 0.00 C ATOM 1835 CE LYS A 117 5.997 10.397 -16.473 1.00 0.00 C ATOM 1836 NZ LYS A 117 5.099 10.464 -17.660 1.00 0.00 N ATOM 0 H LYS A 117 6.713 6.691 -15.393 1.00 0.00 H new ATOM 0 HA LYS A 117 7.983 5.804 -17.888 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.886 7.938 -15.923 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.423 7.718 -17.577 1.00 0.00 H new ATOM 0 HG2 LYS A 117 7.942 9.478 -17.826 1.00 0.00 H new ATOM 0 HG3 LYS A 117 6.899 8.118 -18.189 1.00 0.00 H new ATOM 0 HD2 LYS A 117 5.731 8.285 -16.188 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.094 8.958 -15.317 1.00 0.00 H new ATOM 0 HE2 LYS A 117 5.448 10.708 -15.584 1.00 0.00 H new ATOM 0 HE3 LYS A 117 6.821 11.100 -16.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 4.741 11.434 -17.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.629 10.192 -18.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 4.299 9.812 -17.528 1.00 0.00 H new ATOM 1850 N GLY A 118 9.039 5.186 -14.859 1.00 0.00 N ATOM 1851 CA GLY A 118 9.993 4.398 -14.100 1.00 0.00 C ATOM 1852 C GLY A 118 10.905 5.257 -13.246 1.00 0.00 C ATOM 1853 O GLY A 118 11.923 4.782 -12.745 1.00 0.00 O ATOM 0 H GLY A 118 8.292 5.605 -14.305 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.455 3.698 -13.461 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.596 3.804 -14.786 1.00 0.00 H new ATOM 1857 N GLN A 119 10.540 6.524 -13.083 1.00 0.00 N ATOM 1858 CA GLN A 119 11.335 7.451 -12.286 1.00 0.00 C ATOM 1859 C GLN A 119 10.935 7.387 -10.816 1.00 0.00 C ATOM 1860 O GLN A 119 9.915 6.792 -10.466 1.00 0.00 O ATOM 1861 CB GLN A 119 11.169 8.879 -12.810 1.00 0.00 C ATOM 1862 CG GLN A 119 12.031 9.184 -14.025 1.00 0.00 C ATOM 1863 CD GLN A 119 13.505 9.284 -13.686 1.00 0.00 C ATOM 1864 OE1 GLN A 119 13.921 8.957 -12.574 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.304 9.736 -14.644 1.00 0.00 N ATOM 0 H GLN A 119 9.699 6.932 -13.492 1.00 0.00 H new ATOM 0 HA GLN A 119 12.382 7.159 -12.372 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.123 9.044 -13.066 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.417 9.581 -12.014 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.886 8.404 -14.773 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.701 10.121 -14.474 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.916 9.996 -15.551 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.306 9.824 -14.473 1.00 0.00 H new ATOM 1874 N ASP A 120 11.744 8.001 -9.961 1.00 0.00 N ATOM 1875 CA ASP A 120 11.474 8.015 -8.528 1.00 0.00 C ATOM 1876 C ASP A 120 10.551 9.172 -8.159 1.00 0.00 C ATOM 1877 O ASP A 120 11.007 10.280 -7.877 1.00 0.00 O ATOM 1878 CB ASP A 120 12.782 8.120 -7.742 1.00 0.00 C ATOM 1879 CG ASP A 120 13.797 7.076 -8.165 1.00 0.00 C ATOM 1880 OD1 ASP A 120 14.254 7.130 -9.325 1.00 0.00 O ATOM 1881 OD2 ASP A 120 14.133 6.205 -7.336 1.00 0.00 O ATOM 0 H ASP A 120 12.593 8.496 -10.235 1.00 0.00 H new ATOM 0 HA ASP A 120 10.977 7.080 -8.269 1.00 0.00 H new ATOM 0 HB2 ASP A 120 13.208 9.114 -7.882 1.00 0.00 H new ATOM 0 HB3 ASP A 120 12.573 8.009 -6.678 1.00 0.00 H new ATOM 1886 N THR A 121 9.248 8.908 -8.166 1.00 0.00 N ATOM 1887 CA THR A 121 8.260 9.927 -7.835 1.00 0.00 C ATOM 1888 C THR A 121 8.592 10.606 -6.511 1.00 0.00 C ATOM 1889 O THR A 121 8.329 11.794 -6.328 1.00 0.00 O ATOM 1890 CB THR A 121 6.843 9.329 -7.750 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.770 8.391 -6.670 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.467 8.639 -9.053 1.00 0.00 C ATOM 0 H THR A 121 8.853 7.997 -8.397 1.00 0.00 H new ATOM 0 HA THR A 121 8.288 10.666 -8.636 1.00 0.00 H new ATOM 0 HB THR A 121 6.140 10.143 -7.572 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.339 7.618 -6.869 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.462 8.225 -8.969 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.494 9.362 -9.868 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.175 7.836 -9.257 1.00 0.00 H new ATOM 1900 N GLY A 122 9.174 9.844 -5.590 1.00 0.00 N ATOM 1901 CA GLY A 122 9.533 10.390 -4.294 1.00 0.00 C ATOM 1902 C GLY A 122 8.474 10.132 -3.241 1.00 0.00 C ATOM 1903 O GLY A 122 8.340 10.895 -2.286 1.00 0.00 O ATOM 0 H GLY A 122 9.403 8.858 -5.718 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.478 9.954 -3.969 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.693 11.464 -4.388 1.00 0.00 H new ATOM 1907 N ALA A 123 7.717 9.053 -3.418 1.00 0.00 N ATOM 1908 CA ALA A 123 6.664 8.696 -2.475 1.00 0.00 C ATOM 1909 C ALA A 123 6.922 7.326 -1.857 1.00 0.00 C ATOM 1910 O ALA A 123 7.348 6.395 -2.541 1.00 0.00 O ATOM 1911 CB ALA A 123 5.308 8.721 -3.164 1.00 0.00 C ATOM 0 H ALA A 123 7.814 8.412 -4.205 1.00 0.00 H new ATOM 0 HA ALA A 123 6.664 9.433 -1.672 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.531 8.452 -2.448 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.115 9.722 -3.551 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.305 8.007 -3.987 1.00 0.00 H new ATOM 1917 N THR A 124 6.661 7.209 -0.559 1.00 0.00 N ATOM 1918 CA THR A 124 6.866 5.953 0.151 1.00 0.00 C ATOM 1919 C THR A 124 5.582 5.489 0.830 1.00 0.00 C ATOM 1920 O THR A 124 4.853 6.291 1.414 1.00 0.00 O ATOM 1921 CB THR A 124 7.976 6.082 1.211 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.539 6.932 2.277 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.249 6.644 0.596 1.00 0.00 C ATOM 0 H THR A 124 6.307 7.969 0.022 1.00 0.00 H new ATOM 0 HA THR A 124 7.168 5.215 -0.593 1.00 0.00 H new ATOM 0 HB THR A 124 8.190 5.088 1.604 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.250 7.008 2.947 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.018 6.726 1.364 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.595 5.979 -0.195 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.047 7.630 0.178 1.00 0.00 H new ATOM 1931 N ILE A 125 5.312 4.190 0.750 1.00 0.00 N ATOM 1932 CA ILE A 125 4.117 3.620 1.359 1.00 0.00 C ATOM 1933 C ILE A 125 4.440 2.326 2.097 1.00 0.00 C ATOM 1934 O ILE A 125 5.180 1.480 1.594 1.00 0.00 O ATOM 1935 CB ILE A 125 3.028 3.340 0.306 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.823 2.657 0.956 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.587 2.482 -0.819 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.604 2.604 0.063 1.00 0.00 C ATOM 0 H ILE A 125 5.905 3.513 0.270 1.00 0.00 H new ATOM 0 HA ILE A 125 3.743 4.357 2.070 1.00 0.00 H new ATOM 0 HB ILE A 125 2.699 4.289 -0.117 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.100 1.642 1.239 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.568 3.186 1.874 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.806 2.293 -1.555 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.417 3.003 -1.296 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.940 1.534 -0.413 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.211 2.107 0.589 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.301 3.618 -0.200 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.842 2.050 -0.845 1.00 0.00 H new ATOM 1950 N ASP A 126 3.878 2.176 3.292 1.00 0.00 N ATOM 1951 CA ASP A 126 4.103 0.983 4.099 1.00 0.00 C ATOM 1952 C ASP A 126 3.014 -0.055 3.850 1.00 0.00 C ATOM 1953 O ASP A 126 1.841 0.286 3.689 1.00 0.00 O ATOM 1954 CB ASP A 126 4.149 1.347 5.584 1.00 0.00 C ATOM 1955 CG ASP A 126 5.177 2.420 5.885 1.00 0.00 C ATOM 1956 OD1 ASP A 126 6.190 2.492 5.159 1.00 0.00 O ATOM 1957 OD2 ASP A 126 4.968 3.188 6.848 1.00 0.00 O ATOM 0 H ASP A 126 3.263 2.866 3.723 1.00 0.00 H new ATOM 0 HA ASP A 126 5.062 0.553 3.809 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.165 1.691 5.901 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.378 0.455 6.167 1.00 0.00 H new ATOM 1962 N LEU A 127 3.408 -1.323 3.819 1.00 0.00 N ATOM 1963 CA LEU A 127 2.465 -2.412 3.589 1.00 0.00 C ATOM 1964 C LEU A 127 2.921 -3.686 4.294 1.00 0.00 C ATOM 1965 O LEU A 127 4.115 -3.977 4.362 1.00 0.00 O ATOM 1966 CB LEU A 127 2.313 -2.673 2.089 1.00 0.00 C ATOM 1967 CG LEU A 127 1.837 -1.488 1.247 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.251 -1.666 -0.206 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.328 -1.328 1.357 1.00 0.00 C ATOM 0 H LEU A 127 4.374 -1.623 3.950 1.00 0.00 H new ATOM 0 HA LEU A 127 1.500 -2.116 4.000 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.275 -3.007 1.699 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.611 -3.495 1.953 1.00 0.00 H new ATOM 0 HG LEU A 127 2.307 -0.582 1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.904 -0.814 -0.790 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.337 -1.731 -0.269 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.809 -2.581 -0.601 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.007 -0.480 0.752 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.161 -2.235 1.000 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.055 -1.154 2.398 1.00 0.00 H new ATOM 1981 N VAL A 128 1.961 -4.443 4.816 1.00 0.00 N ATOM 1982 CA VAL A 128 2.263 -5.687 5.513 1.00 0.00 C ATOM 1983 C VAL A 128 1.484 -6.854 4.917 1.00 0.00 C ATOM 1984 O VAL A 128 0.332 -7.095 5.281 1.00 0.00 O ATOM 1985 CB VAL A 128 1.939 -5.582 7.015 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.352 -6.853 7.741 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.621 -4.366 7.623 1.00 0.00 C ATOM 0 H VAL A 128 0.968 -4.216 4.769 1.00 0.00 H new ATOM 0 HA VAL A 128 3.331 -5.867 5.391 1.00 0.00 H new ATOM 0 HB VAL A 128 0.862 -5.461 7.129 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.115 -6.760 8.801 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.813 -7.703 7.322 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.424 -7.008 7.621 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.381 -4.307 8.685 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.700 -4.454 7.499 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.271 -3.464 7.122 1.00 0.00 H new ATOM 1997 N ILE A 129 2.119 -7.576 4.000 1.00 0.00 N ATOM 1998 CA ILE A 129 1.486 -8.719 3.354 1.00 0.00 C ATOM 1999 C ILE A 129 1.725 -10.000 4.146 1.00 0.00 C ATOM 2000 O ILE A 129 2.773 -10.171 4.768 1.00 0.00 O ATOM 2001 CB ILE A 129 2.005 -8.913 1.917 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.078 -7.568 1.192 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.112 -9.883 1.158 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.120 -7.528 0.096 1.00 0.00 C ATOM 0 H ILE A 129 3.072 -7.390 3.688 1.00 0.00 H new ATOM 0 HA ILE A 129 0.417 -8.510 3.320 1.00 0.00 H new ATOM 0 HB ILE A 129 3.009 -9.334 1.963 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.102 -7.342 0.763 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.296 -6.784 1.918 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.492 -10.010 0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.107 -10.847 1.667 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.097 -9.488 1.119 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.116 -6.545 -0.374 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.104 -7.722 0.522 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.892 -8.288 -0.651 1.00 0.00 H new ATOM 2016 N GLY A 130 0.746 -10.899 4.118 1.00 0.00 N ATOM 2017 CA GLY A 130 0.870 -12.154 4.836 1.00 0.00 C ATOM 2018 C GLY A 130 0.403 -13.340 4.015 1.00 0.00 C ATOM 2019 O GLY A 130 -0.754 -13.398 3.598 1.00 0.00 O ATOM 0 H GLY A 130 -0.131 -10.781 3.611 1.00 0.00 H new ATOM 0 HA2 GLY A 130 1.911 -12.303 5.124 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.288 -12.102 5.756 1.00 0.00 H new ATOM 2023 N TYR A 131 1.305 -14.287 3.781 1.00 0.00 N ATOM 2024 CA TYR A 131 0.980 -15.475 3.001 1.00 0.00 C ATOM 2025 C TYR A 131 0.537 -16.619 3.909 1.00 0.00 C ATOM 2026 O TYR A 131 1.008 -16.747 5.040 1.00 0.00 O ATOM 2027 CB TYR A 131 2.187 -15.910 2.168 1.00 0.00 C ATOM 2028 CG TYR A 131 2.089 -17.328 1.653 1.00 0.00 C ATOM 2029 CD1 TYR A 131 0.991 -17.744 0.910 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.094 -18.252 1.910 1.00 0.00 C ATOM 2031 CE1 TYR A 131 0.896 -19.039 0.439 1.00 0.00 C ATOM 2032 CE2 TYR A 131 3.009 -19.549 1.442 1.00 0.00 C ATOM 2033 CZ TYR A 131 1.908 -19.937 0.707 1.00 0.00 C ATOM 2034 OH TYR A 131 1.819 -21.229 0.239 1.00 0.00 O ATOM 0 H TYR A 131 2.266 -14.255 4.120 1.00 0.00 H new ATOM 0 HA TYR A 131 0.156 -15.225 2.333 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.297 -15.232 1.322 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.089 -15.814 2.773 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.198 -17.042 0.697 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.957 -17.951 2.486 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.035 -19.346 -0.136 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.800 -20.255 1.650 1.00 0.00 H new ATOM 0 HH TYR A 131 2.697 -21.660 0.300 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.370 -17.448 3.405 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.877 -18.582 4.169 1.00 0.00 C ATOM 2046 C ASP A 132 -1.204 -19.754 3.248 1.00 0.00 C ATOM 2047 O ASP A 132 -2.099 -19.683 2.407 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.121 -18.177 4.960 1.00 0.00 C ATOM 2049 CG ASP A 132 -1.784 -17.351 6.186 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.180 -16.270 6.025 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -2.123 -17.786 7.307 1.00 0.00 O ATOM 0 H ASP A 132 -0.769 -17.356 2.471 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.100 -18.896 4.866 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.789 -17.607 4.314 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.661 -19.073 5.266 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.460 -20.859 3.410 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.652 -22.067 2.602 1.00 0.00 C ATOM 2058 C PRO A 133 -1.959 -22.781 2.928 1.00 0.00 C ATOM 2059 O PRO A 133 -2.355 -22.902 4.087 1.00 0.00 O ATOM 2060 CB PRO A 133 0.545 -22.942 2.983 1.00 0.00 C ATOM 2061 CG PRO A 133 0.929 -22.486 4.348 1.00 0.00 C ATOM 2062 CD PRO A 133 0.625 -21.014 4.393 1.00 0.00 C ATOM 0 HA PRO A 133 -0.710 -21.840 1.537 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.280 -23.999 2.979 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.367 -22.817 2.278 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.367 -23.024 5.112 1.00 0.00 H new ATOM 0 HG3 PRO A 133 1.986 -22.672 4.539 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.313 -20.698 5.389 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.496 -20.416 4.127 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.646 -23.266 1.883 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.919 -23.977 2.034 1.00 0.00 C ATOM 2072 C PRO A 134 -3.744 -25.347 2.680 1.00 0.00 C ATOM 2073 O PRO A 134 -2.650 -25.911 2.676 1.00 0.00 O ATOM 2074 CB PRO A 134 -4.416 -24.124 0.593 1.00 0.00 C ATOM 2075 CG PRO A 134 -3.181 -24.081 -0.240 1.00 0.00 C ATOM 2076 CD PRO A 134 -2.233 -23.157 0.474 1.00 0.00 C ATOM 0 HA PRO A 134 -4.610 -23.442 2.685 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.955 -25.061 0.454 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -5.101 -23.319 0.327 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.749 -25.076 -0.349 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -3.400 -23.717 -1.244 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -1.195 -23.460 0.335 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -2.318 -22.134 0.109 1.00 0.00 H new