USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 967 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 60 ASN : amide:sc= -0.209 K(o=-0.21,f=-5.5!) USER MOD Set 1.2: A 62 THR OG1 : rot -120:sc= 0 USER MOD Set 2.1: A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 51 MET CE :methyl -171:sc= 0 (180deg=-0.0368) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.137 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -88:sc= 0.745 USER MOD Single : A 28 THR OG1 : rot -79:sc= 1.27 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 55:sc= 0.0436 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 42 ASN : amide:sc=-0.00515 X(o=-0.0051,f=-0.041) USER MOD Single : A 44 THR OG1 : rot -75:sc= 0.836 USER MOD Single : A 49 GLN : amide:sc= -0.0372 X(o=-0.037,f=-0.083) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 152:sc= -0.0748 (180deg=-1.3) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0.0962 K(o=0.096,f=-1.1) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0.0053 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 MET CE :methyl 162:sc= 0 (180deg=-0.0157) USER MOD Single : A 110 THR OG1 : rot -0:sc= 0.177 USER MOD Single : A 111 ASN : amide:sc=-0.00379 X(o=-0.0038,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -57:sc= 1.24 USER MOD Single : A 124 MET CE :methyl -175:sc= 0 (180deg=-0.0218) USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= 0.1 K(o=0.1,f=-7.9!) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.053 USER MOD Single : A 143 GLN : amide:sc= -0.0218 K(o=-0.022,f=-1.2) USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 MET CE :methyl 157:sc= -0.254 (180deg=-1.82) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -14.810 18.431 1.401 1.00 0.00 N ATOM 59 CA THR A 5 -15.560 19.290 0.539 1.00 0.00 C ATOM 60 C THR A 5 -16.732 18.552 -0.012 1.00 0.00 C ATOM 61 O THR A 5 -16.789 17.323 -0.004 1.00 0.00 O ATOM 62 CB THR A 5 -14.744 19.885 -0.570 1.00 0.00 C ATOM 63 OG1 THR A 5 -14.641 19.061 -1.722 1.00 0.00 O ATOM 64 CG2 THR A 5 -13.328 20.239 -0.085 1.00 0.00 C ATOM 0 HA THR A 5 -15.899 20.129 1.146 1.00 0.00 H new ATOM 0 HB THR A 5 -15.285 20.785 -0.863 1.00 0.00 H new ATOM 0 HG1 THR A 5 -14.098 19.514 -2.400 1.00 0.00 H new ATOM 0 HG21 THR A 5 -12.758 20.668 -0.909 1.00 0.00 H new ATOM 0 HG22 THR A 5 -13.392 20.962 0.728 1.00 0.00 H new ATOM 0 HG23 THR A 5 -12.829 19.337 0.270 1.00 0.00 H new ATOM 72 N GLU A 6 -17.791 19.288 -0.394 1.00 0.00 N ATOM 73 CA GLU A 6 -18.981 18.771 -0.995 1.00 0.00 C ATOM 74 C GLU A 6 -18.807 18.080 -2.303 1.00 0.00 C ATOM 75 O GLU A 6 -19.441 17.077 -2.628 1.00 0.00 O ATOM 76 CB GLU A 6 -20.021 19.902 -1.074 1.00 0.00 C ATOM 77 CG GLU A 6 -20.074 20.624 0.273 1.00 0.00 C ATOM 78 CD GLU A 6 -20.936 21.876 0.187 1.00 0.00 C ATOM 79 OE1 GLU A 6 -20.531 22.819 -0.543 1.00 0.00 O ATOM 80 OE2 GLU A 6 -22.068 21.938 0.738 1.00 0.00 O ATOM 0 H GLU A 6 -17.818 20.301 -0.277 1.00 0.00 H new ATOM 0 HA GLU A 6 -19.328 17.966 -0.347 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -19.756 20.602 -1.866 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -21.001 19.495 -1.322 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -20.475 19.954 1.033 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -19.065 20.893 0.585 1.00 0.00 H new ATOM 87 N GLU A 7 -17.803 18.495 -3.097 1.00 0.00 N ATOM 88 CA GLU A 7 -17.479 17.976 -4.389 1.00 0.00 C ATOM 89 C GLU A 7 -16.850 16.640 -4.191 1.00 0.00 C ATOM 90 O GLU A 7 -17.287 15.682 -4.827 1.00 0.00 O ATOM 91 CB GLU A 7 -16.522 18.871 -5.195 1.00 0.00 C ATOM 92 CG GLU A 7 -17.241 20.216 -5.317 1.00 0.00 C ATOM 93 CD GLU A 7 -16.534 21.180 -6.259 1.00 0.00 C ATOM 94 OE1 GLU A 7 -15.921 20.829 -7.302 1.00 0.00 O ATOM 95 OE2 GLU A 7 -16.545 22.380 -5.872 1.00 0.00 O ATOM 0 H GLU A 7 -17.174 19.247 -2.814 1.00 0.00 H new ATOM 0 HA GLU A 7 -18.401 17.922 -4.967 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -15.564 18.981 -4.687 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -16.316 18.444 -6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -18.258 20.048 -5.672 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -17.319 20.672 -4.330 1.00 0.00 H new ATOM 102 N GLN A 8 -15.872 16.534 -3.275 1.00 0.00 N ATOM 103 CA GLN A 8 -15.196 15.336 -2.885 1.00 0.00 C ATOM 104 C GLN A 8 -16.124 14.281 -2.388 1.00 0.00 C ATOM 105 O GLN A 8 -15.910 13.090 -2.608 1.00 0.00 O ATOM 106 CB GLN A 8 -14.294 15.590 -1.665 1.00 0.00 C ATOM 107 CG GLN A 8 -12.864 15.948 -2.075 1.00 0.00 C ATOM 108 CD GLN A 8 -12.040 16.538 -0.940 1.00 0.00 C ATOM 109 OE1 GLN A 8 -12.526 16.695 0.179 1.00 0.00 O ATOM 110 NE2 GLN A 8 -10.716 16.707 -1.202 1.00 0.00 N ATOM 0 H GLN A 8 -15.528 17.350 -2.768 1.00 0.00 H new ATOM 0 HA GLN A 8 -14.661 15.026 -3.782 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -14.713 16.399 -1.066 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -14.279 14.701 -1.034 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -12.366 15.053 -2.449 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -12.898 16.661 -2.899 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -10.361 16.565 -2.148 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -10.078 16.976 -0.453 1.00 0.00 H new ATOM 119 N ILE A 9 -17.156 14.667 -1.617 1.00 0.00 N ATOM 120 CA ILE A 9 -18.190 13.778 -1.183 1.00 0.00 C ATOM 121 C ILE A 9 -19.038 13.243 -2.285 1.00 0.00 C ATOM 122 O ILE A 9 -19.543 12.126 -2.191 1.00 0.00 O ATOM 123 CB ILE A 9 -18.921 14.441 -0.054 1.00 0.00 C ATOM 124 CG1 ILE A 9 -18.331 13.989 1.293 1.00 0.00 C ATOM 125 CG2 ILE A 9 -20.423 14.113 -0.079 1.00 0.00 C ATOM 126 CD1 ILE A 9 -18.822 12.646 1.829 1.00 0.00 C ATOM 0 H ILE A 9 -17.275 15.624 -1.286 1.00 0.00 H new ATOM 0 HA ILE A 9 -17.752 12.855 -0.803 1.00 0.00 H new ATOM 0 HB ILE A 9 -18.801 15.518 -0.175 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -17.247 13.942 1.193 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -18.550 14.755 2.037 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -20.918 14.611 0.754 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -20.855 14.459 -1.018 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -20.562 13.035 0.009 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -18.337 12.435 2.782 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -19.902 12.684 1.972 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -18.578 11.859 1.116 1.00 0.00 H new ATOM 138 N ALA A 10 -19.333 14.067 -3.306 1.00 0.00 N ATOM 139 CA ALA A 10 -20.045 13.726 -4.499 1.00 0.00 C ATOM 140 C ALA A 10 -19.371 12.758 -5.409 1.00 0.00 C ATOM 141 O ALA A 10 -20.000 11.846 -5.944 1.00 0.00 O ATOM 142 CB ALA A 10 -20.396 14.956 -5.353 1.00 0.00 C ATOM 0 H ALA A 10 -19.051 15.047 -3.296 1.00 0.00 H new ATOM 0 HA ALA A 10 -20.935 13.247 -4.090 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -20.935 14.638 -6.245 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -21.022 15.635 -4.774 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.480 15.469 -5.646 1.00 0.00 H new ATOM 148 N GLU A 11 -18.027 12.810 -5.367 1.00 0.00 N ATOM 149 CA GLU A 11 -17.120 11.897 -5.990 1.00 0.00 C ATOM 150 C GLU A 11 -17.200 10.522 -5.421 1.00 0.00 C ATOM 151 O GLU A 11 -17.455 9.536 -6.111 1.00 0.00 O ATOM 152 CB GLU A 11 -15.667 12.402 -5.978 1.00 0.00 C ATOM 153 CG GLU A 11 -15.585 13.539 -6.998 1.00 0.00 C ATOM 154 CD GLU A 11 -15.493 13.105 -8.454 1.00 0.00 C ATOM 155 OE1 GLU A 11 -14.439 12.524 -8.826 1.00 0.00 O ATOM 156 OE2 GLU A 11 -16.473 13.303 -9.220 1.00 0.00 O ATOM 0 H GLU A 11 -17.539 13.547 -4.858 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.443 11.841 -7.030 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -15.388 12.753 -4.985 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.977 11.599 -6.238 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -16.463 14.174 -6.881 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.715 14.152 -6.764 1.00 0.00 H new ATOM 163 N PHE A 12 -17.008 10.412 -4.095 1.00 0.00 N ATOM 164 CA PHE A 12 -17.260 9.267 -3.276 1.00 0.00 C ATOM 165 C PHE A 12 -18.647 8.730 -3.365 1.00 0.00 C ATOM 166 O PHE A 12 -18.809 7.511 -3.391 1.00 0.00 O ATOM 167 CB PHE A 12 -16.943 9.637 -1.818 1.00 0.00 C ATOM 168 CG PHE A 12 -15.501 9.647 -1.446 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.641 8.656 -1.857 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.919 10.632 -0.683 1.00 0.00 C ATOM 171 CE1 PHE A 12 -13.305 8.598 -1.537 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.588 10.596 -0.340 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.753 9.587 -0.758 1.00 0.00 C ATOM 0 H PHE A 12 -16.645 11.194 -3.550 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.617 8.469 -3.647 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -17.357 10.625 -1.617 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -17.462 8.935 -1.165 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -15.043 7.867 -2.475 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.525 11.458 -0.343 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.694 7.782 -1.895 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -13.186 11.385 0.277 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.708 9.572 -0.486 1.00 0.00 H new ATOM 183 N LYS A 13 -19.745 9.498 -3.483 1.00 0.00 N ATOM 184 CA LYS A 13 -21.098 9.035 -3.517 1.00 0.00 C ATOM 185 C LYS A 13 -21.401 8.435 -4.846 1.00 0.00 C ATOM 186 O LYS A 13 -22.220 7.520 -4.921 1.00 0.00 O ATOM 187 CB LYS A 13 -21.974 10.275 -3.273 1.00 0.00 C ATOM 188 CG LYS A 13 -23.465 9.967 -3.426 1.00 0.00 C ATOM 189 CD LYS A 13 -24.017 8.858 -2.527 1.00 0.00 C ATOM 190 CE LYS A 13 -23.845 8.982 -1.012 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.581 10.152 -0.483 1.00 0.00 N ATOM 0 H LYS A 13 -19.682 10.513 -3.560 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.281 8.266 -2.766 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.785 10.660 -2.271 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -21.693 11.060 -3.975 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -24.026 10.880 -3.229 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.655 9.694 -4.464 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -25.084 8.768 -2.732 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -23.553 7.921 -2.836 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -24.204 8.074 -0.527 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -22.786 9.075 -0.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -24.446 10.211 0.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -24.221 11.020 -0.929 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.594 10.049 -0.694 1.00 0.00 H new ATOM 205 N GLU A 14 -20.969 9.100 -5.932 1.00 0.00 N ATOM 206 CA GLU A 14 -21.298 8.635 -7.244 1.00 0.00 C ATOM 207 C GLU A 14 -20.582 7.366 -7.556 1.00 0.00 C ATOM 208 O GLU A 14 -21.192 6.427 -8.065 1.00 0.00 O ATOM 209 CB GLU A 14 -21.091 9.700 -8.334 1.00 0.00 C ATOM 210 CG GLU A 14 -22.218 10.727 -8.209 1.00 0.00 C ATOM 211 CD GLU A 14 -23.623 10.241 -8.534 1.00 0.00 C ATOM 212 OE1 GLU A 14 -23.897 9.035 -8.777 1.00 0.00 O ATOM 213 OE2 GLU A 14 -24.586 11.037 -8.370 1.00 0.00 O ATOM 0 H GLU A 14 -20.401 9.947 -5.905 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.368 8.425 -7.243 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -20.121 10.182 -8.217 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -21.101 9.241 -9.323 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -22.218 11.110 -7.189 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -21.988 11.567 -8.865 1.00 0.00 H new ATOM 220 N ALA A 15 -19.349 7.227 -7.038 1.00 0.00 N ATOM 221 CA ALA A 15 -18.636 5.989 -7.106 1.00 0.00 C ATOM 222 C ALA A 15 -19.204 4.899 -6.265 1.00 0.00 C ATOM 223 O ALA A 15 -19.032 3.727 -6.600 1.00 0.00 O ATOM 224 CB ALA A 15 -17.242 6.254 -6.512 1.00 0.00 C ATOM 0 H ALA A 15 -18.842 7.978 -6.569 1.00 0.00 H new ATOM 0 HA ALA A 15 -18.663 5.670 -8.148 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.654 5.337 -6.540 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.739 7.025 -7.095 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.344 6.588 -5.479 1.00 0.00 H new ATOM 230 N PHE A 16 -19.746 5.153 -5.061 1.00 0.00 N ATOM 231 CA PHE A 16 -20.505 4.237 -4.268 1.00 0.00 C ATOM 232 C PHE A 16 -21.638 3.668 -5.051 1.00 0.00 C ATOM 233 O PHE A 16 -21.640 2.442 -5.146 1.00 0.00 O ATOM 234 CB PHE A 16 -21.126 4.820 -2.988 1.00 0.00 C ATOM 235 CG PHE A 16 -21.418 3.720 -2.027 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.619 3.051 -1.997 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.609 3.598 -0.922 1.00 0.00 C ATOM 238 CE1 PHE A 16 -22.923 2.229 -0.937 1.00 0.00 C ATOM 239 CE2 PHE A 16 -20.898 2.799 0.160 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.073 2.085 0.134 1.00 0.00 C ATOM 0 H PHE A 16 -19.646 6.063 -4.611 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.765 3.491 -3.979 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.443 5.539 -2.536 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -22.043 5.358 -3.229 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.324 3.171 -2.806 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.690 4.164 -0.902 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -23.854 1.682 -0.946 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.224 2.735 1.002 1.00 0.00 H new ATOM 0 HZ PHE A 16 -22.325 1.419 0.946 1.00 0.00 H new ATOM 250 N SER A 17 -22.359 4.536 -5.783 1.00 0.00 N ATOM 251 CA SER A 17 -23.456 4.010 -6.534 1.00 0.00 C ATOM 252 C SER A 17 -23.130 3.056 -7.631 1.00 0.00 C ATOM 253 O SER A 17 -23.939 2.184 -7.942 1.00 0.00 O ATOM 254 CB SER A 17 -24.281 5.143 -7.168 1.00 0.00 C ATOM 255 OG SER A 17 -24.932 5.829 -6.108 1.00 0.00 O ATOM 0 H SER A 17 -22.199 5.541 -5.856 1.00 0.00 H new ATOM 0 HA SER A 17 -24.002 3.447 -5.777 1.00 0.00 H new ATOM 0 HB2 SER A 17 -23.637 5.821 -7.728 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.010 4.741 -7.872 1.00 0.00 H new ATOM 0 HG SER A 17 -25.469 6.563 -6.474 1.00 0.00 H new ATOM 261 N LEU A 18 -21.903 3.162 -8.173 1.00 0.00 N ATOM 262 CA LEU A 18 -21.361 2.189 -9.070 1.00 0.00 C ATOM 263 C LEU A 18 -21.219 0.839 -8.456 1.00 0.00 C ATOM 264 O LEU A 18 -21.312 -0.230 -9.057 1.00 0.00 O ATOM 265 CB LEU A 18 -19.950 2.520 -9.585 1.00 0.00 C ATOM 266 CG LEU A 18 -19.808 3.903 -10.243 1.00 0.00 C ATOM 267 CD1 LEU A 18 -18.446 3.997 -10.951 1.00 0.00 C ATOM 268 CD2 LEU A 18 -20.826 4.191 -11.359 1.00 0.00 C ATOM 0 H LEU A 18 -21.273 3.942 -7.983 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.090 2.201 -9.880 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -19.251 2.457 -8.751 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.655 1.758 -10.307 1.00 0.00 H new ATOM 0 HG LEU A 18 -19.950 4.607 -9.423 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -18.345 4.977 -11.417 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -17.647 3.858 -10.223 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -18.379 3.223 -11.715 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.650 5.188 -11.764 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -20.715 3.452 -12.152 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -21.836 4.138 -10.953 1.00 0.00 H new ATOM 280 N PHE A 19 -20.798 0.854 -7.178 1.00 0.00 N ATOM 281 CA PHE A 19 -20.519 -0.384 -6.519 1.00 0.00 C ATOM 282 C PHE A 19 -21.627 -1.220 -5.979 1.00 0.00 C ATOM 283 O PHE A 19 -21.511 -2.434 -5.818 1.00 0.00 O ATOM 284 CB PHE A 19 -19.489 -0.246 -5.385 1.00 0.00 C ATOM 285 CG PHE A 19 -18.195 0.292 -5.891 1.00 0.00 C ATOM 286 CD1 PHE A 19 -17.648 -0.277 -7.016 1.00 0.00 C ATOM 287 CD2 PHE A 19 -17.489 1.311 -5.296 1.00 0.00 C ATOM 288 CE1 PHE A 19 -16.563 0.274 -7.657 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.369 1.872 -5.864 1.00 0.00 C ATOM 290 CZ PHE A 19 -15.970 1.374 -7.081 1.00 0.00 C ATOM 0 H PHE A 19 -20.654 1.693 -6.616 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.151 -0.923 -7.392 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -19.882 0.414 -4.612 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.324 -1.218 -4.920 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.083 -1.184 -7.409 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.828 1.687 -4.342 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.189 -0.142 -8.581 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -15.827 2.668 -5.375 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.162 1.864 -7.604 1.00 0.00 H new ATOM 300 N ASP A 20 -22.668 -0.499 -5.525 1.00 0.00 N ATOM 301 CA ASP A 20 -23.879 -0.879 -4.865 1.00 0.00 C ATOM 302 C ASP A 20 -24.861 -1.361 -5.876 1.00 0.00 C ATOM 303 O ASP A 20 -25.224 -0.635 -6.799 1.00 0.00 O ATOM 304 CB ASP A 20 -24.510 0.190 -3.958 1.00 0.00 C ATOM 305 CG ASP A 20 -25.621 -0.327 -3.056 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.021 -1.510 -3.223 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.126 0.373 -2.138 1.00 0.00 O ATOM 0 H ASP A 20 -22.649 0.514 -5.644 1.00 0.00 H new ATOM 0 HA ASP A 20 -23.600 -1.677 -4.177 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -23.729 0.629 -3.337 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -24.908 0.990 -4.582 1.00 0.00 H new ATOM 312 N LYS A 21 -25.349 -2.614 -5.822 1.00 0.00 N ATOM 313 CA LYS A 21 -26.127 -3.271 -6.826 1.00 0.00 C ATOM 314 C LYS A 21 -27.524 -2.753 -6.788 1.00 0.00 C ATOM 315 O LYS A 21 -28.054 -2.190 -7.744 1.00 0.00 O ATOM 316 CB LYS A 21 -26.081 -4.805 -6.717 1.00 0.00 C ATOM 317 CG LYS A 21 -26.704 -5.598 -7.868 1.00 0.00 C ATOM 318 CD LYS A 21 -26.165 -5.273 -9.262 1.00 0.00 C ATOM 319 CE LYS A 21 -26.821 -6.027 -10.421 1.00 0.00 C ATOM 320 NZ LYS A 21 -26.465 -7.463 -10.370 1.00 0.00 N ATOM 0 H LYS A 21 -25.186 -3.213 -5.012 1.00 0.00 H new ATOM 0 HA LYS A 21 -25.686 -3.040 -7.796 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.038 -5.108 -6.621 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.583 -5.095 -5.794 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -26.552 -6.660 -7.678 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -27.780 -5.424 -7.864 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -26.282 -4.203 -9.436 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -25.095 -5.483 -9.276 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -27.904 -5.912 -10.371 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -26.498 -5.599 -11.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -26.918 -7.961 -11.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -25.433 -7.567 -10.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -26.794 -7.871 -9.472 1.00 0.00 H new ATOM 334 N ASP A 22 -28.202 -3.022 -5.658 1.00 0.00 N ATOM 335 CA ASP A 22 -29.602 -2.810 -5.457 1.00 0.00 C ATOM 336 C ASP A 22 -29.961 -1.387 -5.200 1.00 0.00 C ATOM 337 O ASP A 22 -31.113 -0.958 -5.203 1.00 0.00 O ATOM 338 CB ASP A 22 -30.336 -3.709 -4.447 1.00 0.00 C ATOM 339 CG ASP A 22 -29.717 -3.750 -3.058 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.459 -3.718 -2.992 1.00 0.00 O ATOM 341 OD2 ASP A 22 -30.544 -4.087 -2.168 1.00 0.00 O ATOM 0 H ASP A 22 -27.744 -3.412 -4.834 1.00 0.00 H new ATOM 0 HA ASP A 22 -29.972 -3.125 -6.433 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.367 -3.366 -4.359 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.370 -4.724 -4.844 1.00 0.00 H new ATOM 346 N GLY A 23 -28.943 -0.568 -4.880 1.00 0.00 N ATOM 347 CA GLY A 23 -28.973 0.835 -4.601 1.00 0.00 C ATOM 348 C GLY A 23 -29.691 1.140 -3.332 1.00 0.00 C ATOM 349 O GLY A 23 -30.608 1.955 -3.257 1.00 0.00 O ATOM 0 H GLY A 23 -27.993 -0.933 -4.810 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -27.953 1.214 -4.539 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -29.458 1.358 -5.426 1.00 0.00 H new ATOM 353 N ASP A 24 -29.344 0.359 -2.293 1.00 0.00 N ATOM 354 CA ASP A 24 -29.893 0.490 -0.979 1.00 0.00 C ATOM 355 C ASP A 24 -29.128 1.391 -0.072 1.00 0.00 C ATOM 356 O ASP A 24 -29.663 1.783 0.964 1.00 0.00 O ATOM 357 CB ASP A 24 -30.106 -0.908 -0.374 1.00 0.00 C ATOM 358 CG ASP A 24 -28.925 -1.661 0.221 1.00 0.00 C ATOM 359 OD1 ASP A 24 -27.838 -1.636 -0.415 1.00 0.00 O ATOM 360 OD2 ASP A 24 -28.937 -2.321 1.295 1.00 0.00 O ATOM 0 H ASP A 24 -28.657 -0.390 -2.371 1.00 0.00 H new ATOM 0 HA ASP A 24 -30.855 0.992 -1.085 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -30.859 -0.813 0.409 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -30.534 -1.538 -1.153 1.00 0.00 H new ATOM 365 N GLY A 25 -27.855 1.639 -0.431 1.00 0.00 N ATOM 366 CA GLY A 25 -26.950 2.320 0.442 1.00 0.00 C ATOM 367 C GLY A 25 -25.862 1.463 0.992 1.00 0.00 C ATOM 368 O GLY A 25 -25.003 2.038 1.659 1.00 0.00 O ATOM 0 H GLY A 25 -27.452 1.367 -1.328 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -26.501 3.153 -0.098 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -27.515 2.745 1.271 1.00 0.00 H new ATOM 372 N THR A 26 -25.762 0.146 0.739 1.00 0.00 N ATOM 373 CA THR A 26 -24.792 -0.629 1.448 1.00 0.00 C ATOM 374 C THR A 26 -24.055 -1.579 0.568 1.00 0.00 C ATOM 375 O THR A 26 -24.491 -2.052 -0.481 1.00 0.00 O ATOM 376 CB THR A 26 -25.429 -1.372 2.584 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.280 -2.439 2.191 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.275 -0.556 3.575 1.00 0.00 C ATOM 0 H THR A 26 -26.331 -0.369 0.067 1.00 0.00 H new ATOM 0 HA THR A 26 -24.063 0.079 1.842 1.00 0.00 H new ATOM 0 HB THR A 26 -24.519 -1.718 3.074 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.188 -2.099 2.051 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.674 -1.218 4.343 1.00 0.00 H new ATOM 0 HG22 THR A 26 -25.653 0.208 4.041 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.098 -0.079 3.044 1.00 0.00 H new ATOM 386 N ILE A 27 -22.806 -1.884 0.962 1.00 0.00 N ATOM 387 CA ILE A 27 -21.964 -2.806 0.264 1.00 0.00 C ATOM 388 C ILE A 27 -21.866 -4.039 1.093 1.00 0.00 C ATOM 389 O ILE A 27 -21.393 -4.051 2.229 1.00 0.00 O ATOM 390 CB ILE A 27 -20.607 -2.326 -0.160 1.00 0.00 C ATOM 391 CG1 ILE A 27 -20.514 -0.872 -0.652 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.098 -3.331 -1.206 1.00 0.00 C ATOM 393 CD1 ILE A 27 -21.361 -0.554 -1.884 1.00 0.00 C ATOM 0 H ILE A 27 -22.369 -1.478 1.789 1.00 0.00 H new ATOM 0 HA ILE A 27 -22.446 -2.978 -0.698 1.00 0.00 H new ATOM 0 HB ILE A 27 -19.974 -2.291 0.726 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -20.816 -0.209 0.159 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -19.472 -0.646 -0.877 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.109 -3.028 -1.550 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.039 -4.323 -0.759 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -20.785 -3.355 -2.052 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -21.230 0.494 -2.155 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -21.047 -1.186 -2.715 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -22.411 -0.742 -1.662 1.00 0.00 H new ATOM 405 N THR A 28 -22.430 -5.127 0.539 1.00 0.00 N ATOM 406 CA THR A 28 -22.490 -6.332 1.306 1.00 0.00 C ATOM 407 C THR A 28 -21.460 -7.338 0.922 1.00 0.00 C ATOM 408 O THR A 28 -20.637 -6.988 0.078 1.00 0.00 O ATOM 409 CB THR A 28 -23.843 -6.961 1.149 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.276 -7.215 -0.179 1.00 0.00 O ATOM 411 CG2 THR A 28 -24.879 -6.096 1.888 1.00 0.00 C ATOM 0 H THR A 28 -22.829 -5.176 -0.399 1.00 0.00 H new ATOM 0 HA THR A 28 -22.296 -6.043 2.339 1.00 0.00 H new ATOM 0 HB THR A 28 -23.748 -7.956 1.584 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.601 -6.383 -0.582 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.868 -6.542 1.782 1.00 0.00 H new ATOM 0 HG22 THR A 28 -24.618 -6.039 2.945 1.00 0.00 H new ATOM 0 HG23 THR A 28 -24.886 -5.093 1.462 1.00 0.00 H new ATOM 419 N THR A 29 -21.486 -8.600 1.387 1.00 0.00 N ATOM 420 CA THR A 29 -20.510 -9.613 1.131 1.00 0.00 C ATOM 421 C THR A 29 -20.448 -10.029 -0.298 1.00 0.00 C ATOM 422 O THR A 29 -19.484 -10.490 -0.907 1.00 0.00 O ATOM 423 CB THR A 29 -20.669 -10.815 2.014 1.00 0.00 C ATOM 424 OG1 THR A 29 -21.949 -11.394 1.810 1.00 0.00 O ATOM 425 CG2 THR A 29 -20.546 -10.405 3.492 1.00 0.00 C ATOM 0 H THR A 29 -22.243 -8.935 1.984 1.00 0.00 H new ATOM 0 HA THR A 29 -19.559 -9.139 1.375 1.00 0.00 H new ATOM 0 HB THR A 29 -19.889 -11.534 1.765 1.00 0.00 H new ATOM 0 HG1 THR A 29 -22.048 -12.180 2.387 1.00 0.00 H new ATOM 0 HG21 THR A 29 -20.663 -11.285 4.125 1.00 0.00 H new ATOM 0 HG22 THR A 29 -19.566 -9.961 3.666 1.00 0.00 H new ATOM 0 HG23 THR A 29 -21.322 -9.679 3.734 1.00 0.00 H new ATOM 433 N LYS A 30 -21.608 -9.912 -0.969 1.00 0.00 N ATOM 434 CA LYS A 30 -21.715 -10.313 -2.337 1.00 0.00 C ATOM 435 C LYS A 30 -21.254 -9.235 -3.258 1.00 0.00 C ATOM 436 O LYS A 30 -20.485 -9.455 -4.192 1.00 0.00 O ATOM 437 CB LYS A 30 -23.198 -10.585 -2.642 1.00 0.00 C ATOM 438 CG LYS A 30 -23.905 -11.489 -1.629 1.00 0.00 C ATOM 439 CD LYS A 30 -25.321 -11.886 -2.052 1.00 0.00 C ATOM 440 CE LYS A 30 -25.373 -13.026 -3.071 1.00 0.00 C ATOM 441 NZ LYS A 30 -26.772 -13.191 -3.527 1.00 0.00 N ATOM 0 H LYS A 30 -22.469 -9.541 -0.566 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.095 -11.197 -2.488 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.726 -9.632 -2.689 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.274 -11.040 -3.630 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.311 -12.391 -1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.951 -10.978 -0.667 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.884 -12.179 -1.166 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.821 -11.014 -2.473 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -24.723 -12.806 -3.918 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -25.010 -13.951 -2.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -26.822 -13.964 -4.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -27.378 -13.417 -2.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -27.100 -12.308 -3.968 1.00 0.00 H new ATOM 455 N GLU A 31 -21.585 -7.966 -2.959 1.00 0.00 N ATOM 456 CA GLU A 31 -21.267 -6.786 -3.700 1.00 0.00 C ATOM 457 C GLU A 31 -19.841 -6.423 -3.471 1.00 0.00 C ATOM 458 O GLU A 31 -19.175 -5.985 -4.408 1.00 0.00 O ATOM 459 CB GLU A 31 -22.126 -5.556 -3.358 1.00 0.00 C ATOM 460 CG GLU A 31 -23.609 -5.929 -3.397 1.00 0.00 C ATOM 461 CD GLU A 31 -24.476 -4.924 -2.651 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.551 -4.835 -1.396 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.185 -4.208 -3.407 1.00 0.00 O ATOM 0 H GLU A 31 -22.125 -7.749 -2.121 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.473 -7.039 -4.740 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -21.862 -5.181 -2.369 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -21.925 -4.753 -4.067 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -23.939 -5.991 -4.434 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.744 -6.918 -2.960 1.00 0.00 H new ATOM 470 N LEU A 32 -19.273 -6.735 -2.292 1.00 0.00 N ATOM 471 CA LEU A 32 -17.872 -6.517 -2.103 1.00 0.00 C ATOM 472 C LEU A 32 -17.130 -7.597 -2.811 1.00 0.00 C ATOM 473 O LEU A 32 -16.075 -7.337 -3.388 1.00 0.00 O ATOM 474 CB LEU A 32 -17.239 -6.417 -0.705 1.00 0.00 C ATOM 475 CG LEU A 32 -15.941 -5.610 -0.530 1.00 0.00 C ATOM 476 CD1 LEU A 32 -16.004 -4.115 -0.884 1.00 0.00 C ATOM 477 CD2 LEU A 32 -15.400 -5.839 0.891 1.00 0.00 C ATOM 0 H LEU A 32 -19.767 -7.127 -1.490 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.785 -5.498 -2.481 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.985 -5.989 -0.036 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.045 -7.432 -0.358 1.00 0.00 H new ATOM 0 HG LEU A 32 -15.252 -5.997 -1.281 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.027 -3.660 -0.718 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.284 -4.001 -1.931 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.745 -3.623 -0.254 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.479 -5.271 1.026 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.140 -5.509 1.620 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -15.196 -6.900 1.036 1.00 0.00 H new ATOM 489 N GLY A 33 -17.673 -8.826 -2.885 1.00 0.00 N ATOM 490 CA GLY A 33 -17.270 -9.833 -3.816 1.00 0.00 C ATOM 491 C GLY A 33 -17.204 -9.449 -5.254 1.00 0.00 C ATOM 492 O GLY A 33 -16.277 -9.746 -6.006 1.00 0.00 O ATOM 0 H GLY A 33 -18.426 -9.130 -2.268 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.285 -10.193 -3.518 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.958 -10.673 -3.723 1.00 0.00 H new ATOM 496 N THR A 34 -18.096 -8.599 -5.794 1.00 0.00 N ATOM 497 CA THR A 34 -18.215 -8.114 -7.134 1.00 0.00 C ATOM 498 C THR A 34 -17.121 -7.117 -7.302 1.00 0.00 C ATOM 499 O THR A 34 -16.437 -7.171 -8.323 1.00 0.00 O ATOM 500 CB THR A 34 -19.528 -7.519 -7.546 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.598 -8.416 -7.286 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.572 -7.107 -9.028 1.00 0.00 C ATOM 0 H THR A 34 -18.830 -8.202 -5.207 1.00 0.00 H new ATOM 0 HA THR A 34 -18.146 -8.982 -7.790 1.00 0.00 H new ATOM 0 HB THR A 34 -19.639 -6.616 -6.946 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.579 -8.683 -6.343 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.550 -6.684 -9.259 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.800 -6.363 -9.222 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.398 -7.982 -9.654 1.00 0.00 H new ATOM 510 N VAL A 35 -16.827 -6.212 -6.351 1.00 0.00 N ATOM 511 CA VAL A 35 -15.815 -5.203 -6.303 1.00 0.00 C ATOM 512 C VAL A 35 -14.445 -5.787 -6.348 1.00 0.00 C ATOM 513 O VAL A 35 -13.640 -5.465 -7.220 1.00 0.00 O ATOM 514 CB VAL A 35 -15.974 -4.252 -5.154 1.00 0.00 C ATOM 515 CG1 VAL A 35 -14.686 -3.439 -4.942 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.179 -3.317 -5.349 1.00 0.00 C ATOM 0 H VAL A 35 -17.383 -6.190 -5.496 1.00 0.00 H new ATOM 0 HA VAL A 35 -15.951 -4.607 -7.206 1.00 0.00 H new ATOM 0 HB VAL A 35 -16.163 -4.847 -4.261 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -14.821 -2.755 -4.104 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -13.859 -4.116 -4.728 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.463 -2.869 -5.844 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.259 -2.644 -4.495 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -17.043 -2.733 -6.260 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.090 -3.910 -5.431 1.00 0.00 H new ATOM 526 N MET A 36 -14.098 -6.642 -5.369 1.00 0.00 N ATOM 527 CA MET A 36 -12.871 -7.374 -5.428 1.00 0.00 C ATOM 528 C MET A 36 -12.613 -8.189 -6.648 1.00 0.00 C ATOM 529 O MET A 36 -11.522 -8.152 -7.215 1.00 0.00 O ATOM 530 CB MET A 36 -12.789 -8.353 -4.244 1.00 0.00 C ATOM 531 CG MET A 36 -12.550 -7.748 -2.859 1.00 0.00 C ATOM 532 SD MET A 36 -11.085 -6.671 -2.806 1.00 0.00 S ATOM 533 CE MET A 36 -10.990 -6.505 -1.000 1.00 0.00 C ATOM 0 H MET A 36 -14.664 -6.826 -4.541 1.00 0.00 H new ATOM 0 HA MET A 36 -12.124 -6.580 -5.418 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.718 -8.922 -4.210 1.00 0.00 H new ATOM 0 HB3 MET A 36 -11.988 -9.063 -4.446 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.428 -7.175 -2.561 1.00 0.00 H new ATOM 0 HG3 MET A 36 -12.432 -8.551 -2.132 1.00 0.00 H new ATOM 0 HE1 MET A 36 -10.144 -5.870 -0.737 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.910 -6.056 -0.627 1.00 0.00 H new ATOM 0 HE3 MET A 36 -10.859 -7.489 -0.551 1.00 0.00 H new ATOM 543 N ARG A 37 -13.671 -8.851 -7.152 1.00 0.00 N ATOM 544 CA ARG A 37 -13.580 -9.395 -8.472 1.00 0.00 C ATOM 545 C ARG A 37 -13.298 -8.433 -9.574 1.00 0.00 C ATOM 546 O ARG A 37 -12.578 -8.830 -10.489 1.00 0.00 O ATOM 547 CB ARG A 37 -14.798 -10.213 -8.934 1.00 0.00 C ATOM 548 CG ARG A 37 -14.666 -11.723 -8.730 1.00 0.00 C ATOM 549 CD ARG A 37 -14.321 -12.095 -7.286 1.00 0.00 C ATOM 550 NE ARG A 37 -14.211 -13.580 -7.324 1.00 0.00 N ATOM 551 CZ ARG A 37 -14.737 -14.382 -6.353 1.00 0.00 C ATOM 552 NH1 ARG A 37 -15.610 -13.930 -5.406 1.00 0.00 N ATOM 553 NH2 ARG A 37 -14.337 -15.686 -6.385 1.00 0.00 N ATOM 0 H ARG A 37 -14.556 -9.006 -6.669 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.713 -10.038 -8.319 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.679 -9.863 -8.397 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -14.971 -10.016 -9.992 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -15.601 -12.207 -9.012 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -13.894 -12.109 -9.395 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.388 -11.632 -6.965 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -15.095 -11.768 -6.592 1.00 0.00 H new ATOM 0 HE ARG A 37 -13.723 -14.015 -8.107 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -15.898 -12.951 -5.403 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -15.975 -14.571 -4.701 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -13.686 -16.002 -7.104 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -14.689 -16.345 -5.690 1.00 0.00 H new ATOM 567 N SER A 38 -13.662 -7.139 -9.606 1.00 0.00 N ATOM 568 CA SER A 38 -13.266 -6.123 -10.531 1.00 0.00 C ATOM 569 C SER A 38 -11.866 -5.639 -10.371 1.00 0.00 C ATOM 570 O SER A 38 -11.206 -5.156 -11.289 1.00 0.00 O ATOM 571 CB SER A 38 -14.273 -4.966 -10.644 1.00 0.00 C ATOM 572 OG SER A 38 -15.359 -5.388 -11.456 1.00 0.00 O ATOM 0 H SER A 38 -14.304 -6.767 -8.906 1.00 0.00 H new ATOM 0 HA SER A 38 -13.277 -6.640 -11.491 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.630 -4.677 -9.655 1.00 0.00 H new ATOM 0 HB3 SER A 38 -13.794 -4.089 -11.079 1.00 0.00 H new ATOM 0 HG SER A 38 -16.010 -4.660 -11.535 1.00 0.00 H new ATOM 578 N LEU A 39 -11.307 -5.899 -9.176 1.00 0.00 N ATOM 579 CA LEU A 39 -9.938 -5.557 -8.944 1.00 0.00 C ATOM 580 C LEU A 39 -9.004 -6.572 -9.509 1.00 0.00 C ATOM 581 O LEU A 39 -7.825 -6.351 -9.781 1.00 0.00 O ATOM 582 CB LEU A 39 -9.616 -5.329 -7.457 1.00 0.00 C ATOM 583 CG LEU A 39 -10.330 -4.231 -6.651 1.00 0.00 C ATOM 584 CD1 LEU A 39 -9.796 -4.357 -5.214 1.00 0.00 C ATOM 585 CD2 LEU A 39 -10.069 -2.794 -7.133 1.00 0.00 C ATOM 0 H LEU A 39 -11.787 -6.335 -8.389 1.00 0.00 H new ATOM 0 HA LEU A 39 -9.789 -4.611 -9.465 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -9.799 -6.272 -6.943 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.546 -5.131 -7.389 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.404 -4.383 -6.757 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -10.265 -3.601 -4.584 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.028 -5.349 -4.825 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -8.716 -4.211 -5.213 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.616 -2.094 -6.502 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.002 -2.579 -7.074 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.404 -2.690 -8.165 1.00 0.00 H new ATOM 597 N GLY A 40 -9.552 -7.769 -9.783 1.00 0.00 N ATOM 598 CA GLY A 40 -8.811 -8.911 -10.224 1.00 0.00 C ATOM 599 C GLY A 40 -8.564 -9.945 -9.180 1.00 0.00 C ATOM 600 O GLY A 40 -7.906 -10.961 -9.396 1.00 0.00 O ATOM 0 H GLY A 40 -10.552 -7.949 -9.694 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.346 -9.374 -11.053 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -7.851 -8.573 -10.614 1.00 0.00 H new ATOM 604 N GLN A 41 -9.125 -9.892 -7.959 1.00 0.00 N ATOM 605 CA GLN A 41 -8.844 -10.821 -6.910 1.00 0.00 C ATOM 606 C GLN A 41 -9.726 -12.016 -7.030 1.00 0.00 C ATOM 607 O GLN A 41 -10.609 -12.113 -7.881 1.00 0.00 O ATOM 608 CB GLN A 41 -8.980 -10.118 -5.549 1.00 0.00 C ATOM 609 CG GLN A 41 -7.767 -9.207 -5.351 1.00 0.00 C ATOM 610 CD GLN A 41 -7.944 -8.453 -4.042 1.00 0.00 C ATOM 611 OE1 GLN A 41 -8.656 -8.925 -3.157 1.00 0.00 O ATOM 612 NE2 GLN A 41 -7.539 -7.166 -3.869 1.00 0.00 N ATOM 0 H GLN A 41 -9.800 -9.175 -7.693 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.818 -11.178 -6.992 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.901 -9.536 -5.513 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.037 -10.853 -4.747 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -6.850 -9.796 -5.329 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.677 -8.508 -6.183 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.947 -6.719 -4.569 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.827 -6.648 -3.039 1.00 0.00 H new ATOM 621 N ASN A 42 -9.471 -13.031 -6.185 1.00 0.00 N ATOM 622 CA ASN A 42 -10.238 -14.238 -6.183 1.00 0.00 C ATOM 623 C ASN A 42 -10.468 -14.654 -4.771 1.00 0.00 C ATOM 624 O ASN A 42 -9.839 -15.600 -4.300 1.00 0.00 O ATOM 625 CB ASN A 42 -9.463 -15.395 -6.838 1.00 0.00 C ATOM 626 CG ASN A 42 -9.261 -15.103 -8.318 1.00 0.00 C ATOM 627 OD1 ASN A 42 -10.265 -14.899 -9.000 1.00 0.00 O ATOM 628 ND2 ASN A 42 -7.999 -14.900 -8.781 1.00 0.00 N ATOM 0 H ASN A 42 -8.722 -13.014 -5.493 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.162 -14.043 -6.727 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.498 -15.523 -6.348 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.010 -16.329 -6.713 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -7.853 -14.564 -9.733 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.198 -15.084 -8.176 1.00 0.00 H new ATOM 635 N PRO A 43 -11.200 -13.975 -3.937 1.00 0.00 N ATOM 636 CA PRO A 43 -11.401 -14.308 -2.557 1.00 0.00 C ATOM 637 C PRO A 43 -12.357 -15.443 -2.429 1.00 0.00 C ATOM 638 O PRO A 43 -13.162 -15.651 -3.335 1.00 0.00 O ATOM 639 CB PRO A 43 -11.967 -13.009 -1.987 1.00 0.00 C ATOM 640 CG PRO A 43 -12.593 -12.217 -3.146 1.00 0.00 C ATOM 641 CD PRO A 43 -11.706 -12.666 -4.318 1.00 0.00 C ATOM 0 HA PRO A 43 -10.501 -14.639 -2.038 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -12.715 -13.222 -1.223 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.179 -12.427 -1.509 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.642 -12.471 -3.301 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.547 -11.140 -2.982 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.277 -12.720 -5.245 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -10.890 -11.963 -4.486 1.00 0.00 H new ATOM 649 N THR A 44 -12.375 -16.075 -1.242 1.00 0.00 N ATOM 650 CA THR A 44 -13.451 -16.907 -0.800 1.00 0.00 C ATOM 651 C THR A 44 -14.547 -16.067 -0.242 1.00 0.00 C ATOM 652 O THR A 44 -14.346 -14.909 0.121 1.00 0.00 O ATOM 653 CB THR A 44 -13.090 -17.917 0.249 1.00 0.00 C ATOM 654 OG1 THR A 44 -12.461 -17.231 1.322 1.00 0.00 O ATOM 655 CG2 THR A 44 -12.051 -18.910 -0.299 1.00 0.00 C ATOM 0 H THR A 44 -11.614 -16.004 -0.566 1.00 0.00 H new ATOM 0 HA THR A 44 -13.751 -17.458 -1.692 1.00 0.00 H new ATOM 0 HB THR A 44 -13.994 -18.443 0.558 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.546 -16.992 1.066 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.799 -19.636 0.474 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.464 -19.429 -1.164 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.152 -18.369 -0.596 1.00 0.00 H new ATOM 663 N GLU A 45 -15.696 -16.707 0.038 1.00 0.00 N ATOM 664 CA GLU A 45 -16.686 -16.136 0.898 1.00 0.00 C ATOM 665 C GLU A 45 -16.277 -15.803 2.291 1.00 0.00 C ATOM 666 O GLU A 45 -16.571 -14.726 2.809 1.00 0.00 O ATOM 667 CB GLU A 45 -17.909 -17.067 0.837 1.00 0.00 C ATOM 668 CG GLU A 45 -19.220 -16.486 1.371 1.00 0.00 C ATOM 669 CD GLU A 45 -20.379 -17.466 1.267 1.00 0.00 C ATOM 670 OE1 GLU A 45 -20.829 -17.679 0.109 1.00 0.00 O ATOM 671 OE2 GLU A 45 -20.766 -18.064 2.307 1.00 0.00 O ATOM 0 H GLU A 45 -15.941 -17.625 -0.333 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.906 -15.137 0.522 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -18.062 -17.366 -0.200 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.680 -17.973 1.399 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -19.087 -16.196 2.413 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -19.464 -15.580 0.817 1.00 0.00 H new ATOM 678 N ALA A 46 -15.510 -16.717 2.912 1.00 0.00 N ATOM 679 CA ALA A 46 -14.964 -16.542 4.222 1.00 0.00 C ATOM 680 C ALA A 46 -14.026 -15.387 4.300 1.00 0.00 C ATOM 681 O ALA A 46 -14.012 -14.684 5.309 1.00 0.00 O ATOM 682 CB ALA A 46 -14.310 -17.859 4.671 1.00 0.00 C ATOM 0 H ALA A 46 -15.261 -17.610 2.487 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.774 -16.297 4.910 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.891 -17.735 5.669 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -15.060 -18.650 4.688 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -13.516 -18.127 3.974 1.00 0.00 H new ATOM 688 N GLU A 47 -13.250 -15.071 3.248 1.00 0.00 N ATOM 689 CA GLU A 47 -12.398 -13.923 3.296 1.00 0.00 C ATOM 690 C GLU A 47 -13.242 -12.697 3.357 1.00 0.00 C ATOM 691 O GLU A 47 -13.101 -11.825 4.213 1.00 0.00 O ATOM 692 CB GLU A 47 -11.465 -13.849 2.075 1.00 0.00 C ATOM 693 CG GLU A 47 -10.344 -14.868 2.295 1.00 0.00 C ATOM 694 CD GLU A 47 -9.516 -15.218 1.067 1.00 0.00 C ATOM 695 OE1 GLU A 47 -9.895 -16.167 0.331 1.00 0.00 O ATOM 696 OE2 GLU A 47 -8.422 -14.614 0.903 1.00 0.00 O ATOM 0 H GLU A 47 -13.211 -15.600 2.377 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.770 -14.000 4.184 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -12.012 -14.072 1.159 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -11.055 -12.845 1.965 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.674 -14.483 3.064 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.784 -15.785 2.686 1.00 0.00 H new ATOM 703 N LEU A 48 -14.180 -12.535 2.406 1.00 0.00 N ATOM 704 CA LEU A 48 -15.171 -11.509 2.308 1.00 0.00 C ATOM 705 C LEU A 48 -15.999 -11.223 3.513 1.00 0.00 C ATOM 706 O LEU A 48 -16.159 -10.081 3.943 1.00 0.00 O ATOM 707 CB LEU A 48 -16.047 -11.847 1.089 1.00 0.00 C ATOM 708 CG LEU A 48 -15.443 -11.761 -0.322 1.00 0.00 C ATOM 709 CD1 LEU A 48 -16.573 -12.267 -1.234 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.976 -10.353 -0.729 1.00 0.00 C ATOM 0 H LEU A 48 -14.248 -13.191 1.628 1.00 0.00 H new ATOM 0 HA LEU A 48 -14.627 -10.571 2.201 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -16.418 -12.863 1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.913 -11.185 1.115 1.00 0.00 H new ATOM 0 HG LEU A 48 -14.528 -12.350 -0.389 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -16.240 -12.245 -2.272 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -16.833 -13.289 -0.958 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -17.447 -11.626 -1.120 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -14.564 -10.384 -1.738 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -15.823 -9.667 -0.704 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -14.210 -10.009 -0.034 1.00 0.00 H new ATOM 722 N GLN A 49 -16.583 -12.246 4.162 1.00 0.00 N ATOM 723 CA GLN A 49 -17.315 -12.042 5.374 1.00 0.00 C ATOM 724 C GLN A 49 -16.469 -11.606 6.520 1.00 0.00 C ATOM 725 O GLN A 49 -16.950 -10.821 7.337 1.00 0.00 O ATOM 726 CB GLN A 49 -18.020 -13.321 5.856 1.00 0.00 C ATOM 727 CG GLN A 49 -19.041 -13.882 4.865 1.00 0.00 C ATOM 728 CD GLN A 49 -19.439 -15.289 5.287 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.767 -16.308 5.132 1.00 0.00 O ATOM 730 NE2 GLN A 49 -20.691 -15.279 5.816 1.00 0.00 N ATOM 0 H GLN A 49 -16.548 -13.216 3.847 1.00 0.00 H new ATOM 0 HA GLN A 49 -18.026 -11.261 5.104 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.268 -14.084 6.057 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -18.523 -13.112 6.800 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -19.921 -13.239 4.830 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.618 -13.898 3.861 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -21.195 -14.398 5.917 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -21.127 -16.153 6.112 1.00 0.00 H new ATOM 739 N ASP A 50 -15.192 -12.023 6.592 1.00 0.00 N ATOM 740 CA ASP A 50 -14.300 -11.731 7.670 1.00 0.00 C ATOM 741 C ASP A 50 -13.876 -10.310 7.521 1.00 0.00 C ATOM 742 O ASP A 50 -13.827 -9.518 8.461 1.00 0.00 O ATOM 743 CB ASP A 50 -13.081 -12.665 7.582 1.00 0.00 C ATOM 744 CG ASP A 50 -12.054 -12.351 8.661 1.00 0.00 C ATOM 745 OD1 ASP A 50 -12.300 -12.603 9.870 1.00 0.00 O ATOM 746 OD2 ASP A 50 -10.916 -12.041 8.218 1.00 0.00 O ATOM 0 H ASP A 50 -14.761 -12.591 5.863 1.00 0.00 H new ATOM 0 HA ASP A 50 -14.780 -11.882 8.637 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.408 -13.700 7.680 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -12.618 -12.569 6.600 1.00 0.00 H new ATOM 751 N MET A 51 -13.569 -9.786 6.321 1.00 0.00 N ATOM 752 CA MET A 51 -13.218 -8.429 6.040 1.00 0.00 C ATOM 753 C MET A 51 -14.364 -7.479 6.102 1.00 0.00 C ATOM 754 O MET A 51 -14.196 -6.280 6.320 1.00 0.00 O ATOM 755 CB MET A 51 -12.679 -8.442 4.600 1.00 0.00 C ATOM 756 CG MET A 51 -11.259 -8.999 4.479 1.00 0.00 C ATOM 757 SD MET A 51 -10.411 -8.704 2.898 1.00 0.00 S ATOM 758 CE MET A 51 -11.496 -9.571 1.728 1.00 0.00 C ATOM 0 H MET A 51 -13.567 -10.361 5.479 1.00 0.00 H new ATOM 0 HA MET A 51 -12.505 -8.085 6.790 1.00 0.00 H new ATOM 0 HB2 MET A 51 -13.347 -9.036 3.977 1.00 0.00 H new ATOM 0 HB3 MET A 51 -12.696 -7.426 4.206 1.00 0.00 H new ATOM 0 HG2 MET A 51 -10.654 -8.570 5.277 1.00 0.00 H new ATOM 0 HG3 MET A 51 -11.297 -10.075 4.651 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.018 -9.610 0.749 1.00 0.00 H new ATOM 0 HE2 MET A 51 -11.678 -10.585 2.084 1.00 0.00 H new ATOM 0 HE3 MET A 51 -12.444 -9.039 1.648 1.00 0.00 H new ATOM 768 N ILE A 52 -15.599 -8.000 5.988 1.00 0.00 N ATOM 769 CA ILE A 52 -16.807 -7.244 6.108 1.00 0.00 C ATOM 770 C ILE A 52 -16.997 -6.948 7.556 1.00 0.00 C ATOM 771 O ILE A 52 -17.250 -5.789 7.880 1.00 0.00 O ATOM 772 CB ILE A 52 -17.931 -7.993 5.458 1.00 0.00 C ATOM 773 CG1 ILE A 52 -18.126 -7.596 3.985 1.00 0.00 C ATOM 774 CG2 ILE A 52 -19.254 -7.655 6.166 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.776 -6.251 3.664 1.00 0.00 C ATOM 0 H ILE A 52 -15.762 -8.990 5.804 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.769 -6.288 5.585 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.675 -9.050 5.527 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.147 -7.611 3.507 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -18.725 -8.373 3.510 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -20.070 -8.200 5.692 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -19.188 -7.941 7.216 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -19.443 -6.584 6.093 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.839 -6.126 2.583 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -19.778 -6.220 4.092 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -18.175 -5.446 4.088 1.00 0.00 H new ATOM 787 N ASN A 53 -16.793 -7.921 8.461 1.00 0.00 N ATOM 788 CA ASN A 53 -16.842 -7.838 9.888 1.00 0.00 C ATOM 789 C ASN A 53 -15.765 -6.982 10.462 1.00 0.00 C ATOM 790 O ASN A 53 -15.936 -6.413 11.539 1.00 0.00 O ATOM 791 CB ASN A 53 -16.732 -9.266 10.450 1.00 0.00 C ATOM 792 CG ASN A 53 -17.180 -9.285 11.905 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.186 -8.724 12.335 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.496 -10.188 12.658 1.00 0.00 N ATOM 0 H ASN A 53 -16.569 -8.868 8.157 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.785 -7.369 10.170 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -17.348 -9.946 9.862 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.704 -9.619 10.372 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -16.815 -10.412 13.600 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.664 -10.641 12.280 1.00 0.00 H new ATOM 801 N GLU A 54 -14.580 -6.920 9.829 1.00 0.00 N ATOM 802 CA GLU A 54 -13.450 -6.200 10.330 1.00 0.00 C ATOM 803 C GLU A 54 -13.594 -4.735 10.101 1.00 0.00 C ATOM 804 O GLU A 54 -13.117 -4.007 10.970 1.00 0.00 O ATOM 805 CB GLU A 54 -12.200 -6.793 9.657 1.00 0.00 C ATOM 806 CG GLU A 54 -10.941 -6.253 10.338 1.00 0.00 C ATOM 807 CD GLU A 54 -9.696 -6.883 9.731 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.539 -8.133 9.748 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.863 -6.060 9.266 1.00 0.00 O ATOM 0 H GLU A 54 -14.402 -7.386 8.939 1.00 0.00 H new ATOM 0 HA GLU A 54 -13.365 -6.309 11.411 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -12.222 -7.881 9.722 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -12.190 -6.537 8.597 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.898 -5.169 10.229 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.979 -6.465 11.407 1.00 0.00 H new ATOM 816 N VAL A 55 -14.205 -4.254 9.003 1.00 0.00 N ATOM 817 CA VAL A 55 -14.345 -2.864 8.698 1.00 0.00 C ATOM 818 C VAL A 55 -15.592 -2.271 9.259 1.00 0.00 C ATOM 819 O VAL A 55 -15.750 -1.056 9.371 1.00 0.00 O ATOM 820 CB VAL A 55 -14.301 -2.565 7.229 1.00 0.00 C ATOM 821 CG1 VAL A 55 -12.936 -3.088 6.750 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.431 -3.175 6.383 1.00 0.00 C ATOM 0 H VAL A 55 -14.620 -4.862 8.297 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.478 -2.406 9.174 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.442 -1.493 7.094 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.831 -2.904 5.681 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.140 -2.572 7.287 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.869 -4.159 6.942 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.297 -2.893 5.339 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.406 -4.261 6.471 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.392 -2.804 6.738 1.00 0.00 H new ATOM 832 N ASP A 56 -16.540 -3.164 9.595 1.00 0.00 N ATOM 833 CA ASP A 56 -17.793 -2.848 10.207 1.00 0.00 C ATOM 834 C ASP A 56 -17.710 -2.377 11.618 1.00 0.00 C ATOM 835 O ASP A 56 -17.818 -3.147 12.571 1.00 0.00 O ATOM 836 CB ASP A 56 -18.893 -3.899 9.981 1.00 0.00 C ATOM 837 CG ASP A 56 -20.348 -3.520 10.217 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.612 -2.293 10.328 1.00 0.00 O ATOM 839 OD2 ASP A 56 -21.169 -4.448 10.447 1.00 0.00 O ATOM 0 H ASP A 56 -16.425 -4.164 9.430 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.117 -1.969 9.651 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.808 -4.245 8.951 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.669 -4.751 10.623 1.00 0.00 H new ATOM 844 N ALA A 57 -17.660 -1.035 11.690 1.00 0.00 N ATOM 845 CA ALA A 57 -17.674 -0.286 12.909 1.00 0.00 C ATOM 846 C ALA A 57 -18.992 -0.109 13.580 1.00 0.00 C ATOM 847 O ALA A 57 -19.035 0.084 14.794 1.00 0.00 O ATOM 848 CB ALA A 57 -16.932 1.060 12.882 1.00 0.00 C ATOM 0 H ALA A 57 -17.607 -0.444 10.860 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.098 -0.977 13.524 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -17.010 1.538 13.859 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -15.882 0.892 12.643 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.378 1.706 12.125 1.00 0.00 H new ATOM 854 N ASP A 58 -20.051 -0.058 12.753 1.00 0.00 N ATOM 855 CA ASP A 58 -21.383 -0.025 13.272 1.00 0.00 C ATOM 856 C ASP A 58 -21.978 -1.306 13.749 1.00 0.00 C ATOM 857 O ASP A 58 -22.444 -1.397 14.883 1.00 0.00 O ATOM 858 CB ASP A 58 -22.306 0.906 12.468 1.00 0.00 C ATOM 859 CG ASP A 58 -22.410 0.482 11.010 1.00 0.00 C ATOM 860 OD1 ASP A 58 -22.950 -0.592 10.633 1.00 0.00 O ATOM 861 OD2 ASP A 58 -21.987 1.331 10.181 1.00 0.00 O ATOM 0 H ASP A 58 -19.987 -0.040 11.735 1.00 0.00 H new ATOM 0 HA ASP A 58 -21.266 0.451 14.245 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -23.299 0.909 12.917 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.929 1.927 12.523 1.00 0.00 H new ATOM 866 N GLY A 59 -21.993 -2.361 12.915 1.00 0.00 N ATOM 867 CA GLY A 59 -22.559 -3.630 13.253 1.00 0.00 C ATOM 868 C GLY A 59 -23.775 -4.018 12.486 1.00 0.00 C ATOM 869 O GLY A 59 -24.512 -4.945 12.819 1.00 0.00 O ATOM 0 H GLY A 59 -21.598 -2.330 11.975 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -21.799 -4.397 13.106 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -22.807 -3.626 14.314 1.00 0.00 H new ATOM 873 N ASN A 60 -24.006 -3.406 11.310 1.00 0.00 N ATOM 874 CA ASN A 60 -25.133 -3.722 10.489 1.00 0.00 C ATOM 875 C ASN A 60 -24.905 -4.960 9.692 1.00 0.00 C ATOM 876 O ASN A 60 -25.813 -5.575 9.134 1.00 0.00 O ATOM 877 CB ASN A 60 -25.667 -2.557 9.639 1.00 0.00 C ATOM 878 CG ASN A 60 -24.586 -1.870 8.817 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.467 -2.280 8.514 1.00 0.00 O ATOM 880 ND2 ASN A 60 -24.918 -0.648 8.322 1.00 0.00 N ATOM 0 H ASN A 60 -23.401 -2.681 10.924 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.943 -3.923 11.189 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.442 -2.930 8.969 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.138 -1.824 10.294 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -24.255 -0.136 7.741 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -25.831 -0.244 8.532 1.00 0.00 H new ATOM 887 N GLY A 61 -23.651 -5.431 9.564 1.00 0.00 N ATOM 888 CA GLY A 61 -23.245 -6.419 8.613 1.00 0.00 C ATOM 889 C GLY A 61 -22.667 -5.862 7.357 1.00 0.00 C ATOM 890 O GLY A 61 -22.214 -6.681 6.559 1.00 0.00 O ATOM 0 H GLY A 61 -22.884 -5.107 10.152 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -22.508 -7.073 9.079 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -24.106 -7.038 8.360 1.00 0.00 H new ATOM 894 N THR A 62 -22.634 -4.539 7.120 1.00 0.00 N ATOM 895 CA THR A 62 -22.371 -4.004 5.820 1.00 0.00 C ATOM 896 C THR A 62 -21.323 -2.945 5.818 1.00 0.00 C ATOM 897 O THR A 62 -21.061 -2.442 6.909 1.00 0.00 O ATOM 898 CB THR A 62 -23.587 -3.419 5.164 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.099 -2.209 5.702 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.814 -4.344 5.226 1.00 0.00 C ATOM 0 H THR A 62 -22.792 -3.832 7.838 1.00 0.00 H new ATOM 0 HA THR A 62 -22.024 -4.871 5.258 1.00 0.00 H new ATOM 0 HB THR A 62 -23.181 -3.257 4.165 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.021 -2.349 6.002 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.659 -3.862 4.734 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.588 -5.283 4.721 1.00 0.00 H new ATOM 0 HG23 THR A 62 -25.067 -4.544 6.267 1.00 0.00 H new ATOM 908 N ILE A 63 -20.768 -2.507 4.674 1.00 0.00 N ATOM 909 CA ILE A 63 -20.030 -1.283 4.624 1.00 0.00 C ATOM 910 C ILE A 63 -20.987 -0.284 4.070 1.00 0.00 C ATOM 911 O ILE A 63 -21.443 -0.424 2.937 1.00 0.00 O ATOM 912 CB ILE A 63 -18.838 -1.403 3.721 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.311 -2.846 3.648 1.00 0.00 C ATOM 914 CG2 ILE A 63 -17.763 -0.484 4.327 1.00 0.00 C ATOM 915 CD1 ILE A 63 -16.956 -2.939 2.948 1.00 0.00 C ATOM 0 H ILE A 63 -20.830 -3.000 3.783 1.00 0.00 H new ATOM 0 HA ILE A 63 -19.649 -1.005 5.607 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.103 -1.122 2.702 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.224 -3.249 4.657 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.033 -3.467 3.118 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -16.862 -0.524 3.714 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -18.135 0.540 4.358 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -17.529 -0.816 5.339 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.630 -3.979 2.924 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.046 -2.563 1.929 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.224 -2.342 3.492 1.00 0.00 H new ATOM 927 N ASP A 64 -21.277 0.759 4.868 1.00 0.00 N ATOM 928 CA ASP A 64 -22.039 1.886 4.429 1.00 0.00 C ATOM 929 C ASP A 64 -21.237 3.115 4.168 1.00 0.00 C ATOM 930 O ASP A 64 -20.017 3.026 4.301 1.00 0.00 O ATOM 931 CB ASP A 64 -23.289 2.058 5.308 1.00 0.00 C ATOM 932 CG ASP A 64 -22.946 2.202 6.784 1.00 0.00 C ATOM 933 OD1 ASP A 64 -22.569 1.159 7.383 1.00 0.00 O ATOM 934 OD2 ASP A 64 -23.102 3.298 7.385 1.00 0.00 O ATOM 0 H ASP A 64 -20.975 0.820 5.840 1.00 0.00 H new ATOM 0 HA ASP A 64 -22.407 1.675 3.425 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -23.843 2.937 4.979 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -23.946 1.199 5.173 1.00 0.00 H new ATOM 939 N PHE A 65 -21.829 4.178 3.596 1.00 0.00 N ATOM 940 CA PHE A 65 -21.116 5.273 3.014 1.00 0.00 C ATOM 941 C PHE A 65 -20.098 5.929 3.881 1.00 0.00 C ATOM 942 O PHE A 65 -18.960 5.851 3.421 1.00 0.00 O ATOM 943 CB PHE A 65 -22.121 6.224 2.343 1.00 0.00 C ATOM 944 CG PHE A 65 -21.475 7.364 1.634 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.626 7.067 0.593 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.735 8.672 1.967 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.872 8.066 0.024 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.078 9.692 1.320 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.157 9.370 0.351 1.00 0.00 C ATOM 0 H PHE A 65 -22.842 4.279 3.536 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.463 4.864 2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.725 5.660 1.633 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.801 6.615 3.100 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.552 6.054 0.225 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.456 8.899 2.738 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.074 7.831 -0.664 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -21.281 10.724 1.567 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.643 10.165 -0.168 1.00 0.00 H new ATOM 959 N PRO A 66 -20.190 6.486 5.052 1.00 0.00 N ATOM 960 CA PRO A 66 -19.098 7.226 5.614 1.00 0.00 C ATOM 961 C PRO A 66 -18.091 6.330 6.250 1.00 0.00 C ATOM 962 O PRO A 66 -16.985 6.775 6.553 1.00 0.00 O ATOM 963 CB PRO A 66 -19.769 8.117 6.657 1.00 0.00 C ATOM 964 CG PRO A 66 -20.959 7.267 7.127 1.00 0.00 C ATOM 965 CD PRO A 66 -21.432 6.696 5.781 1.00 0.00 C ATOM 0 HA PRO A 66 -18.546 7.787 4.860 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -19.094 8.354 7.479 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.095 9.065 6.228 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -20.662 6.487 7.829 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -21.727 7.863 7.619 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -21.985 5.766 5.911 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.092 7.389 5.260 1.00 0.00 H new ATOM 973 N GLU A 67 -18.450 5.035 6.324 1.00 0.00 N ATOM 974 CA GLU A 67 -17.680 3.921 6.782 1.00 0.00 C ATOM 975 C GLU A 67 -16.737 3.392 5.757 1.00 0.00 C ATOM 976 O GLU A 67 -15.605 3.010 6.049 1.00 0.00 O ATOM 977 CB GLU A 67 -18.580 2.756 7.225 1.00 0.00 C ATOM 978 CG GLU A 67 -17.887 1.731 8.124 1.00 0.00 C ATOM 979 CD GLU A 67 -18.772 0.546 8.484 1.00 0.00 C ATOM 980 OE1 GLU A 67 -19.248 -0.150 7.548 1.00 0.00 O ATOM 981 OE2 GLU A 67 -19.185 0.307 9.650 1.00 0.00 O ATOM 0 H GLU A 67 -19.381 4.741 6.030 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.106 4.311 7.623 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -19.443 3.160 7.753 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -18.958 2.247 6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -16.991 1.366 7.623 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -17.562 2.224 9.040 1.00 0.00 H new ATOM 988 N PHE A 68 -17.182 3.234 4.498 1.00 0.00 N ATOM 989 CA PHE A 68 -16.487 2.847 3.309 1.00 0.00 C ATOM 990 C PHE A 68 -15.516 3.910 2.925 1.00 0.00 C ATOM 991 O PHE A 68 -14.401 3.717 2.443 1.00 0.00 O ATOM 992 CB PHE A 68 -17.442 2.521 2.148 1.00 0.00 C ATOM 993 CG PHE A 68 -16.898 2.052 0.843 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.373 0.785 0.746 1.00 0.00 C ATOM 995 CD2 PHE A 68 -16.994 2.888 -0.244 1.00 0.00 C ATOM 996 CE1 PHE A 68 -15.976 0.357 -0.499 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.656 2.403 -1.485 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.116 1.145 -1.617 1.00 0.00 C ATOM 0 H PHE A 68 -18.166 3.402 4.291 1.00 0.00 H new ATOM 0 HA PHE A 68 -15.945 1.927 3.525 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.135 1.758 2.503 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.029 3.418 1.950 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.276 0.150 1.614 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.329 3.908 -0.125 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.542 -0.626 -0.602 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.815 3.013 -2.362 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.806 0.781 -2.586 1.00 0.00 H new ATOM 1008 N LEU A 69 -15.842 5.199 3.130 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.166 6.367 2.658 1.00 0.00 C ATOM 1010 C LEU A 69 -13.864 6.425 3.380 1.00 0.00 C ATOM 1011 O LEU A 69 -12.865 6.801 2.769 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.121 7.533 2.964 1.00 0.00 C ATOM 1013 CG LEU A 69 -15.638 8.955 2.634 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -16.940 9.747 2.421 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -14.710 9.655 3.641 1.00 0.00 C ATOM 0 H LEU A 69 -16.663 5.445 3.683 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.935 6.388 1.593 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.049 7.359 2.419 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -16.363 7.499 4.026 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.978 8.902 1.768 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -16.701 10.782 2.179 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -17.505 9.304 1.601 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.538 9.717 3.332 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -14.455 10.648 3.271 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -15.217 9.745 4.602 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -13.799 9.069 3.765 1.00 0.00 H new ATOM 1027 N THR A 70 -13.773 6.110 4.685 1.00 0.00 N ATOM 1028 CA THR A 70 -12.575 6.269 5.449 1.00 0.00 C ATOM 1029 C THR A 70 -11.662 5.140 5.115 1.00 0.00 C ATOM 1030 O THR A 70 -10.456 5.172 5.356 1.00 0.00 O ATOM 1031 CB THR A 70 -12.804 6.245 6.931 1.00 0.00 C ATOM 1032 OG1 THR A 70 -13.598 5.159 7.388 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.545 7.516 7.380 1.00 0.00 C ATOM 0 H THR A 70 -14.554 5.735 5.223 1.00 0.00 H new ATOM 0 HA THR A 70 -12.159 7.244 5.196 1.00 0.00 H new ATOM 0 HB THR A 70 -11.803 6.157 7.353 1.00 0.00 H new ATOM 0 HG1 THR A 70 -13.699 5.214 8.361 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.703 7.483 8.458 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.949 8.393 7.127 1.00 0.00 H new ATOM 0 HG23 THR A 70 -14.508 7.574 6.873 1.00 0.00 H new ATOM 1041 N MET A 71 -12.153 4.016 4.564 1.00 0.00 N ATOM 1042 CA MET A 71 -11.308 2.951 4.120 1.00 0.00 C ATOM 1043 C MET A 71 -10.526 3.209 2.878 1.00 0.00 C ATOM 1044 O MET A 71 -9.319 2.987 2.802 1.00 0.00 O ATOM 1045 CB MET A 71 -11.961 1.577 3.897 1.00 0.00 C ATOM 1046 CG MET A 71 -12.712 1.105 5.144 1.00 0.00 C ATOM 1047 SD MET A 71 -14.181 0.095 4.787 1.00 0.00 S ATOM 1048 CE MET A 71 -13.481 -0.990 3.509 1.00 0.00 C ATOM 0 H MET A 71 -13.149 3.844 4.425 1.00 0.00 H new ATOM 0 HA MET A 71 -10.663 2.919 4.998 1.00 0.00 H new ATOM 0 HB2 MET A 71 -12.651 1.633 3.055 1.00 0.00 H new ATOM 0 HB3 MET A 71 -11.195 0.847 3.634 1.00 0.00 H new ATOM 0 HG2 MET A 71 -12.030 0.528 5.769 1.00 0.00 H new ATOM 0 HG3 MET A 71 -13.016 1.977 5.724 1.00 0.00 H new ATOM 0 HE1 MET A 71 -14.006 -1.945 3.515 1.00 0.00 H new ATOM 0 HE2 MET A 71 -13.594 -0.521 2.532 1.00 0.00 H new ATOM 0 HE3 MET A 71 -12.423 -1.156 3.712 1.00 0.00 H new ATOM 1058 N MET A 72 -11.262 3.700 1.865 1.00 0.00 N ATOM 1059 CA MET A 72 -10.754 4.171 0.614 1.00 0.00 C ATOM 1060 C MET A 72 -9.754 5.256 0.822 1.00 0.00 C ATOM 1061 O MET A 72 -8.679 5.146 0.234 1.00 0.00 O ATOM 1062 CB MET A 72 -11.924 4.783 -0.175 1.00 0.00 C ATOM 1063 CG MET A 72 -12.957 3.753 -0.635 1.00 0.00 C ATOM 1064 SD MET A 72 -12.299 2.262 -1.441 1.00 0.00 S ATOM 1065 CE MET A 72 -12.210 2.951 -3.119 1.00 0.00 C ATOM 0 H MET A 72 -12.278 3.772 1.924 1.00 0.00 H new ATOM 0 HA MET A 72 -10.288 3.337 0.089 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.419 5.530 0.446 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.530 5.305 -1.047 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.542 3.444 0.231 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.644 4.242 -1.326 1.00 0.00 H new ATOM 0 HE1 MET A 72 -11.824 2.195 -3.803 1.00 0.00 H new ATOM 0 HE2 MET A 72 -13.206 3.256 -3.440 1.00 0.00 H new ATOM 0 HE3 MET A 72 -11.547 3.816 -3.122 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.050 6.197 1.736 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.094 7.211 2.055 1.00 0.00 C ATOM 1077 C ALA A 73 -7.913 6.639 2.761 1.00 0.00 C ATOM 1078 O ALA A 73 -6.836 7.126 2.419 1.00 0.00 O ATOM 1079 CB ALA A 73 -9.743 8.262 2.971 1.00 0.00 C ATOM 0 H ALA A 73 -10.932 6.257 2.245 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.765 7.664 1.120 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.013 9.034 3.213 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.593 8.714 2.461 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.083 7.784 3.889 1.00 0.00 H new ATOM 1234 N GLU A 83 -4.985 10.985 -10.835 1.00 0.00 N ATOM 1235 CA GLU A 83 -5.001 12.394 -11.078 1.00 0.00 C ATOM 1236 C GLU A 83 -5.464 13.270 -9.966 1.00 0.00 C ATOM 1237 O GLU A 83 -5.383 14.494 -10.056 1.00 0.00 O ATOM 1238 CB GLU A 83 -5.916 12.586 -12.300 1.00 0.00 C ATOM 1239 CG GLU A 83 -6.012 13.919 -13.043 1.00 0.00 C ATOM 1240 CD GLU A 83 -4.675 14.435 -13.557 1.00 0.00 C ATOM 1241 OE1 GLU A 83 -3.797 13.624 -13.957 1.00 0.00 O ATOM 1242 OE2 GLU A 83 -4.516 15.684 -13.541 1.00 0.00 O ATOM 0 HA GLU A 83 -3.967 12.709 -11.219 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -5.619 11.838 -13.035 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -6.926 12.333 -11.978 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -6.695 13.806 -13.885 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -6.447 14.665 -12.377 1.00 0.00 H new ATOM 1249 N GLU A 84 -5.992 12.756 -8.840 1.00 0.00 N ATOM 1250 CA GLU A 84 -6.580 13.493 -7.765 1.00 0.00 C ATOM 1251 C GLU A 84 -5.614 14.236 -6.908 1.00 0.00 C ATOM 1252 O GLU A 84 -5.787 15.435 -6.696 1.00 0.00 O ATOM 1253 CB GLU A 84 -7.451 12.639 -6.828 1.00 0.00 C ATOM 1254 CG GLU A 84 -8.775 12.258 -7.495 1.00 0.00 C ATOM 1255 CD GLU A 84 -9.563 11.250 -6.671 1.00 0.00 C ATOM 1256 OE1 GLU A 84 -9.072 10.114 -6.439 1.00 0.00 O ATOM 1257 OE2 GLU A 84 -10.738 11.488 -6.282 1.00 0.00 O ATOM 0 H GLU A 84 -6.008 11.750 -8.670 1.00 0.00 H new ATOM 0 HA GLU A 84 -7.198 14.209 -8.307 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -6.909 11.736 -6.547 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -7.649 13.190 -5.909 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -9.377 13.155 -7.642 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -8.576 11.842 -8.483 1.00 0.00 H new ATOM 1264 N ILE A 85 -4.481 13.603 -6.556 1.00 0.00 N ATOM 1265 CA ILE A 85 -3.402 14.230 -5.858 1.00 0.00 C ATOM 1266 C ILE A 85 -2.764 15.254 -6.733 1.00 0.00 C ATOM 1267 O ILE A 85 -2.526 16.373 -6.282 1.00 0.00 O ATOM 1268 CB ILE A 85 -2.419 13.335 -5.163 1.00 0.00 C ATOM 1269 CG1 ILE A 85 -1.520 12.536 -6.122 1.00 0.00 C ATOM 1270 CG2 ILE A 85 -3.302 12.487 -4.231 1.00 0.00 C ATOM 1271 CD1 ILE A 85 -0.534 11.766 -5.245 1.00 0.00 C ATOM 0 H ILE A 85 -4.310 12.619 -6.765 1.00 0.00 H new ATOM 0 HA ILE A 85 -3.863 14.718 -5.000 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.666 13.888 -4.601 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -2.112 11.854 -6.732 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.994 13.201 -6.807 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -2.677 11.792 -3.670 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.831 13.140 -3.537 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -4.025 11.927 -4.825 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.132 11.178 -5.876 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.053 12.469 -4.654 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.083 11.101 -4.578 1.00 0.00 H new ATOM 1283 N ARG A 86 -2.563 14.945 -8.027 1.00 0.00 N ATOM 1284 CA ARG A 86 -2.099 15.803 -9.073 1.00 0.00 C ATOM 1285 C ARG A 86 -2.869 17.072 -9.191 1.00 0.00 C ATOM 1286 O ARG A 86 -2.392 18.175 -8.929 1.00 0.00 O ATOM 1287 CB ARG A 86 -2.082 14.982 -10.374 1.00 0.00 C ATOM 1288 CG ARG A 86 -1.153 13.767 -10.360 1.00 0.00 C ATOM 1289 CD ARG A 86 -0.792 13.265 -11.760 1.00 0.00 C ATOM 1290 NE ARG A 86 0.339 12.306 -11.605 1.00 0.00 N ATOM 1291 CZ ARG A 86 0.346 10.975 -11.906 1.00 0.00 C ATOM 1292 NH1 ARG A 86 -0.734 10.330 -12.435 1.00 0.00 N ATOM 1293 NH2 ARG A 86 1.410 10.250 -11.451 1.00 0.00 N ATOM 0 H ARG A 86 -2.744 14.002 -8.371 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.091 16.144 -8.838 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.096 14.643 -10.585 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.788 15.636 -11.195 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.238 14.024 -9.827 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -1.630 12.960 -9.804 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -1.648 12.778 -12.227 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.507 14.096 -12.405 1.00 0.00 H new ATOM 0 HE ARG A 86 1.207 12.689 -11.231 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.594 10.845 -12.622 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.681 9.333 -12.644 1.00 0.00 H new ATOM 0 HH21 ARG A 86 2.148 10.708 -10.915 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.467 9.251 -11.647 1.00 0.00 H new ATOM 1307 N GLU A 87 -4.152 16.934 -9.572 1.00 0.00 N ATOM 1308 CA GLU A 87 -4.969 18.101 -9.699 1.00 0.00 C ATOM 1309 C GLU A 87 -5.309 18.796 -8.426 1.00 0.00 C ATOM 1310 O GLU A 87 -5.607 19.990 -8.396 1.00 0.00 O ATOM 1311 CB GLU A 87 -6.252 17.671 -10.430 1.00 0.00 C ATOM 1312 CG GLU A 87 -7.250 18.795 -10.714 1.00 0.00 C ATOM 1313 CD GLU A 87 -6.986 19.561 -12.003 1.00 0.00 C ATOM 1314 OE1 GLU A 87 -5.953 19.323 -12.683 1.00 0.00 O ATOM 1315 OE2 GLU A 87 -7.838 20.405 -12.389 1.00 0.00 O ATOM 0 H GLU A 87 -4.611 16.049 -9.785 1.00 0.00 H new ATOM 0 HA GLU A 87 -4.390 18.842 -10.250 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -5.973 17.207 -11.376 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -6.751 16.906 -9.835 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -8.253 18.371 -10.757 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -7.236 19.496 -9.880 1.00 0.00 H new ATOM 1322 N ALA A 88 -5.280 18.145 -7.249 1.00 0.00 N ATOM 1323 CA ALA A 88 -5.444 18.797 -5.987 1.00 0.00 C ATOM 1324 C ALA A 88 -4.422 19.838 -5.686 1.00 0.00 C ATOM 1325 O ALA A 88 -4.847 20.905 -5.247 1.00 0.00 O ATOM 1326 CB ALA A 88 -5.353 17.858 -4.773 1.00 0.00 C ATOM 0 H ALA A 88 -5.139 17.138 -7.173 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.439 19.223 -6.113 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.488 18.433 -3.857 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.131 17.098 -4.842 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.375 17.376 -4.758 1.00 0.00 H new ATOM 1332 N PHE A 89 -3.110 19.648 -5.916 1.00 0.00 N ATOM 1333 CA PHE A 89 -2.097 20.657 -5.932 1.00 0.00 C ATOM 1334 C PHE A 89 -2.454 21.727 -6.906 1.00 0.00 C ATOM 1335 O PHE A 89 -2.459 22.917 -6.595 1.00 0.00 O ATOM 1336 CB PHE A 89 -0.765 20.038 -6.386 1.00 0.00 C ATOM 1337 CG PHE A 89 0.384 20.959 -6.161 1.00 0.00 C ATOM 1338 CD1 PHE A 89 0.915 20.989 -4.893 1.00 0.00 C ATOM 1339 CD2 PHE A 89 0.919 21.837 -7.075 1.00 0.00 C ATOM 1340 CE1 PHE A 89 1.993 21.787 -4.590 1.00 0.00 C ATOM 1341 CE2 PHE A 89 1.987 22.648 -6.772 1.00 0.00 C ATOM 1342 CZ PHE A 89 2.547 22.640 -5.516 1.00 0.00 C ATOM 0 H PHE A 89 -2.731 18.720 -6.105 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.010 21.075 -4.929 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.595 19.107 -5.845 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.825 19.785 -7.445 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.477 20.374 -4.121 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.486 21.891 -8.063 1.00 0.00 H new ATOM 0 HE1 PHE A 89 2.416 21.743 -3.597 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.392 23.301 -7.531 1.00 0.00 H new ATOM 0 HZ PHE A 89 3.384 23.275 -5.268 1.00 0.00 H new ATOM 1352 N ARG A 90 -2.881 21.401 -8.140 1.00 0.00 N ATOM 1353 CA ARG A 90 -3.019 22.325 -9.222 1.00 0.00 C ATOM 1354 C ARG A 90 -4.148 23.285 -9.068 1.00 0.00 C ATOM 1355 O ARG A 90 -4.071 24.487 -9.318 1.00 0.00 O ATOM 1356 CB ARG A 90 -3.000 21.498 -10.519 1.00 0.00 C ATOM 1357 CG ARG A 90 -2.650 22.203 -11.832 1.00 0.00 C ATOM 1358 CD ARG A 90 -2.986 21.342 -13.051 1.00 0.00 C ATOM 1359 NE ARG A 90 -2.104 20.158 -13.257 1.00 0.00 N ATOM 1360 CZ ARG A 90 -2.374 18.828 -13.403 1.00 0.00 C ATOM 1361 NH1 ARG A 90 -3.589 18.255 -13.166 1.00 0.00 N ATOM 1362 NH2 ARG A 90 -1.319 17.987 -13.609 1.00 0.00 N ATOM 0 H ARG A 90 -3.142 20.448 -8.394 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.181 23.022 -9.244 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.290 20.683 -10.381 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -3.985 21.046 -10.638 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.193 23.146 -11.893 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -1.587 22.446 -11.841 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.015 20.996 -12.958 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -2.939 21.968 -13.942 1.00 0.00 H new ATOM 0 HE ARG A 90 -1.110 20.385 -13.296 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -4.373 18.830 -12.857 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -3.714 17.251 -13.298 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.370 18.359 -13.649 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -1.479 16.986 -13.723 1.00 0.00 H new ATOM 1376 N VAL A 91 -5.284 22.813 -8.524 1.00 0.00 N ATOM 1377 CA VAL A 91 -6.302 23.620 -7.926 1.00 0.00 C ATOM 1378 C VAL A 91 -5.902 24.668 -6.945 1.00 0.00 C ATOM 1379 O VAL A 91 -6.447 25.766 -7.038 1.00 0.00 O ATOM 1380 CB VAL A 91 -7.362 22.703 -7.393 1.00 0.00 C ATOM 1381 CG1 VAL A 91 -8.245 23.102 -6.199 1.00 0.00 C ATOM 1382 CG2 VAL A 91 -8.415 22.364 -8.462 1.00 0.00 C ATOM 0 H VAL A 91 -5.503 21.817 -8.500 1.00 0.00 H new ATOM 0 HA VAL A 91 -6.671 24.258 -8.730 1.00 0.00 H new ATOM 0 HB VAL A 91 -6.691 21.912 -7.060 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.944 22.295 -5.978 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -7.617 23.287 -5.328 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.801 24.007 -6.444 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -9.165 21.698 -8.036 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -8.896 23.281 -8.803 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -7.931 21.873 -9.306 1.00 0.00 H new ATOM 1392 N PHE A 92 -4.894 24.370 -6.106 1.00 0.00 N ATOM 1393 CA PHE A 92 -4.331 25.401 -5.291 1.00 0.00 C ATOM 1394 C PHE A 92 -3.415 26.327 -6.014 1.00 0.00 C ATOM 1395 O PHE A 92 -3.514 27.551 -5.927 1.00 0.00 O ATOM 1396 CB PHE A 92 -3.656 24.793 -4.050 1.00 0.00 C ATOM 1397 CG PHE A 92 -4.581 24.303 -2.989 1.00 0.00 C ATOM 1398 CD1 PHE A 92 -5.422 25.085 -2.233 1.00 0.00 C ATOM 1399 CD2 PHE A 92 -4.578 22.942 -2.795 1.00 0.00 C ATOM 1400 CE1 PHE A 92 -6.281 24.565 -1.294 1.00 0.00 C ATOM 1401 CE2 PHE A 92 -5.413 22.377 -1.860 1.00 0.00 C ATOM 1402 CZ PHE A 92 -6.230 23.202 -1.122 1.00 0.00 C ATOM 0 H PHE A 92 -4.479 23.445 -5.993 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.166 26.027 -4.977 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.027 23.962 -4.371 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -2.996 25.543 -3.614 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.407 26.154 -2.383 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.919 22.316 -3.378 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.955 25.189 -0.726 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -5.427 21.308 -1.708 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.863 22.756 -0.369 1.00 0.00 H new ATOM 1412 N ASP A 93 -2.418 25.746 -6.705 1.00 0.00 N ATOM 1413 CA ASP A 93 -1.424 26.456 -7.447 1.00 0.00 C ATOM 1414 C ASP A 93 -2.083 27.064 -8.637 1.00 0.00 C ATOM 1415 O ASP A 93 -2.182 26.421 -9.681 1.00 0.00 O ATOM 1416 CB ASP A 93 -0.177 25.662 -7.872 1.00 0.00 C ATOM 1417 CG ASP A 93 0.917 26.448 -8.582 1.00 0.00 C ATOM 1418 OD1 ASP A 93 1.034 27.674 -8.315 1.00 0.00 O ATOM 1419 OD2 ASP A 93 1.722 25.826 -9.325 1.00 0.00 O ATOM 0 H ASP A 93 -2.300 24.734 -6.748 1.00 0.00 H new ATOM 0 HA ASP A 93 -1.021 27.202 -6.762 1.00 0.00 H new ATOM 0 HB2 ASP A 93 0.255 25.202 -6.983 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -0.495 24.851 -8.527 1.00 0.00 H new ATOM 1424 N LYS A 94 -2.533 28.326 -8.522 1.00 0.00 N ATOM 1425 CA LYS A 94 -3.237 29.075 -9.516 1.00 0.00 C ATOM 1426 C LYS A 94 -2.332 29.559 -10.596 1.00 0.00 C ATOM 1427 O LYS A 94 -2.607 29.465 -11.791 1.00 0.00 O ATOM 1428 CB LYS A 94 -3.946 30.244 -8.811 1.00 0.00 C ATOM 1429 CG LYS A 94 -4.539 31.272 -9.775 1.00 0.00 C ATOM 1430 CD LYS A 94 -5.340 32.238 -8.899 1.00 0.00 C ATOM 1431 CE LYS A 94 -5.937 33.544 -9.427 1.00 0.00 C ATOM 1432 NZ LYS A 94 -4.892 34.509 -9.835 1.00 0.00 N ATOM 0 H LYS A 94 -2.393 28.863 -7.666 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.968 28.433 -10.007 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -4.742 29.848 -8.181 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -3.236 30.744 -8.152 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -3.755 31.796 -10.321 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -5.178 30.792 -10.516 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -6.169 31.664 -8.485 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -4.692 32.509 -8.065 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -6.583 33.329 -10.278 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -6.564 33.993 -8.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.341 35.379 -10.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.290 34.735 -9.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.309 34.092 -10.589 1.00 0.00 H new ATOM 1446 N ASP A 95 -1.200 30.207 -10.267 1.00 0.00 N ATOM 1447 CA ASP A 95 -0.314 30.805 -11.217 1.00 0.00 C ATOM 1448 C ASP A 95 0.529 29.800 -11.922 1.00 0.00 C ATOM 1449 O ASP A 95 0.908 30.009 -13.074 1.00 0.00 O ATOM 1450 CB ASP A 95 0.505 31.853 -10.445 1.00 0.00 C ATOM 1451 CG ASP A 95 1.427 31.363 -9.338 1.00 0.00 C ATOM 1452 OD1 ASP A 95 2.028 30.256 -9.381 1.00 0.00 O ATOM 1453 OD2 ASP A 95 1.491 32.051 -8.284 1.00 0.00 O ATOM 0 H ASP A 95 -0.890 30.319 -9.302 1.00 0.00 H new ATOM 0 HA ASP A 95 -0.871 31.283 -12.023 1.00 0.00 H new ATOM 0 HB2 ASP A 95 1.111 32.401 -11.166 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -0.193 32.567 -10.007 1.00 0.00 H new ATOM 1458 N GLY A 96 0.813 28.613 -11.357 1.00 0.00 N ATOM 1459 CA GLY A 96 1.622 27.650 -12.038 1.00 0.00 C ATOM 1460 C GLY A 96 3.101 27.755 -11.892 1.00 0.00 C ATOM 1461 O GLY A 96 3.789 27.266 -12.787 1.00 0.00 O ATOM 0 H GLY A 96 0.486 28.321 -10.436 1.00 0.00 H new ATOM 0 HA2 GLY A 96 1.322 26.659 -11.697 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.386 27.706 -13.101 1.00 0.00 H new ATOM 1465 N ASN A 97 3.660 28.362 -10.830 1.00 0.00 N ATOM 1466 CA ASN A 97 5.055 28.196 -10.564 1.00 0.00 C ATOM 1467 C ASN A 97 5.534 26.886 -10.040 1.00 0.00 C ATOM 1468 O ASN A 97 6.651 26.495 -10.372 1.00 0.00 O ATOM 1469 CB ASN A 97 5.697 29.418 -9.885 1.00 0.00 C ATOM 1470 CG ASN A 97 5.273 29.652 -8.442 1.00 0.00 C ATOM 1471 OD1 ASN A 97 4.331 29.101 -7.876 1.00 0.00 O ATOM 1472 ND2 ASN A 97 6.086 30.440 -7.688 1.00 0.00 N ATOM 0 H ASN A 97 3.159 28.955 -10.168 1.00 0.00 H new ATOM 0 HA ASN A 97 5.451 28.144 -11.578 1.00 0.00 H new ATOM 0 HB2 ASN A 97 6.781 29.303 -9.915 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.454 30.307 -10.467 1.00 0.00 H new ATOM 0 HD21 ASN A 97 5.903 30.556 -6.691 1.00 0.00 H new ATOM 0 HD22 ASN A 97 6.879 30.915 -8.119 1.00 0.00 H new ATOM 1479 N GLY A 98 4.650 26.068 -9.441 1.00 0.00 N ATOM 1480 CA GLY A 98 4.881 24.815 -8.792 1.00 0.00 C ATOM 1481 C GLY A 98 5.077 24.941 -7.320 1.00 0.00 C ATOM 1482 O GLY A 98 5.384 23.942 -6.672 1.00 0.00 O ATOM 0 H GLY A 98 3.661 26.317 -9.410 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.036 24.153 -8.984 1.00 0.00 H new ATOM 0 HA3 GLY A 98 5.761 24.344 -9.230 1.00 0.00 H new ATOM 1486 N TYR A 99 4.875 26.145 -6.754 1.00 0.00 N ATOM 1487 CA TYR A 99 4.793 26.441 -5.358 1.00 0.00 C ATOM 1488 C TYR A 99 3.427 26.855 -4.930 1.00 0.00 C ATOM 1489 O TYR A 99 2.769 27.730 -5.489 1.00 0.00 O ATOM 1490 CB TYR A 99 5.739 27.577 -4.933 1.00 0.00 C ATOM 1491 CG TYR A 99 7.106 27.054 -5.212 1.00 0.00 C ATOM 1492 CD1 TYR A 99 7.638 26.124 -4.350 1.00 0.00 C ATOM 1493 CD2 TYR A 99 7.805 27.453 -6.327 1.00 0.00 C ATOM 1494 CE1 TYR A 99 8.907 25.663 -4.610 1.00 0.00 C ATOM 1495 CE2 TYR A 99 9.078 27.000 -6.579 1.00 0.00 C ATOM 1496 CZ TYR A 99 9.653 26.162 -5.653 1.00 0.00 C ATOM 1497 OH TYR A 99 10.960 25.636 -5.718 1.00 0.00 O ATOM 0 H TYR A 99 4.759 26.982 -7.325 1.00 0.00 H new ATOM 0 HA TYR A 99 5.076 25.503 -4.879 1.00 0.00 H new ATOM 0 HB2 TYR A 99 5.541 28.489 -5.496 1.00 0.00 H new ATOM 0 HB3 TYR A 99 5.616 27.821 -3.878 1.00 0.00 H new ATOM 0 HD1 TYR A 99 7.078 25.768 -3.498 1.00 0.00 H new ATOM 0 HD2 TYR A 99 7.343 28.139 -7.021 1.00 0.00 H new ATOM 0 HE1 TYR A 99 9.328 24.892 -3.982 1.00 0.00 H new ATOM 0 HE2 TYR A 99 9.608 27.292 -7.473 1.00 0.00 H new ATOM 0 HH TYR A 99 11.434 26.030 -6.480 1.00 0.00 H new ATOM 1507 N ILE A 100 2.958 26.357 -3.772 1.00 0.00 N ATOM 1508 CA ILE A 100 1.827 26.920 -3.102 1.00 0.00 C ATOM 1509 C ILE A 100 2.319 27.822 -2.023 1.00 0.00 C ATOM 1510 O ILE A 100 2.887 27.400 -1.017 1.00 0.00 O ATOM 1511 CB ILE A 100 0.866 25.930 -2.513 1.00 0.00 C ATOM 1512 CG1 ILE A 100 0.299 24.892 -3.497 1.00 0.00 C ATOM 1513 CG2 ILE A 100 -0.250 26.438 -1.585 1.00 0.00 C ATOM 1514 CD1 ILE A 100 -0.218 23.611 -2.845 1.00 0.00 C ATOM 0 H ILE A 100 3.368 25.554 -3.295 1.00 0.00 H new ATOM 0 HA ILE A 100 1.260 27.449 -3.868 1.00 0.00 H new ATOM 0 HB ILE A 100 1.573 25.438 -1.845 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -0.514 25.351 -4.060 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.076 24.630 -4.215 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -0.854 25.596 -1.247 1.00 0.00 H new ATOM 0 HG22 ILE A 100 0.193 26.936 -0.722 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -0.881 27.143 -2.127 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -0.598 22.939 -3.614 1.00 0.00 H new ATOM 0 HD12 ILE A 100 0.595 23.123 -2.306 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -1.020 23.855 -2.148 1.00 0.00 H new ATOM 1526 N SER A 101 2.095 29.142 -2.151 1.00 0.00 N ATOM 1527 CA SER A 101 2.214 30.047 -1.051 1.00 0.00 C ATOM 1528 C SER A 101 0.947 30.060 -0.267 1.00 0.00 C ATOM 1529 O SER A 101 -0.105 29.680 -0.779 1.00 0.00 O ATOM 1530 CB SER A 101 2.421 31.497 -1.522 1.00 0.00 C ATOM 1531 OG SER A 101 1.447 31.843 -2.495 1.00 0.00 O ATOM 0 H SER A 101 1.828 29.587 -3.029 1.00 0.00 H new ATOM 0 HA SER A 101 3.067 29.707 -0.464 1.00 0.00 H new ATOM 0 HB2 SER A 101 2.353 32.176 -0.672 1.00 0.00 H new ATOM 0 HB3 SER A 101 3.421 31.611 -1.942 1.00 0.00 H new ATOM 0 HG SER A 101 1.589 32.768 -2.785 1.00 0.00 H new ATOM 1537 N ALA A 102 0.940 30.649 0.942 1.00 0.00 N ATOM 1538 CA ALA A 102 -0.234 30.766 1.750 1.00 0.00 C ATOM 1539 C ALA A 102 -1.363 31.516 1.132 1.00 0.00 C ATOM 1540 O ALA A 102 -2.560 31.312 1.330 1.00 0.00 O ATOM 1541 CB ALA A 102 0.265 31.491 3.012 1.00 0.00 C ATOM 0 H ALA A 102 1.773 31.055 1.369 1.00 0.00 H new ATOM 0 HA ALA A 102 -0.662 29.779 1.926 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.566 31.632 3.703 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.040 30.894 3.492 1.00 0.00 H new ATOM 0 HB3 ALA A 102 0.675 32.462 2.735 1.00 0.00 H new ATOM 1547 N ALA A 103 -0.999 32.484 0.273 1.00 0.00 N ATOM 1548 CA ALA A 103 -1.924 33.192 -0.557 1.00 0.00 C ATOM 1549 C ALA A 103 -2.834 32.403 -1.434 1.00 0.00 C ATOM 1550 O ALA A 103 -4.050 32.559 -1.542 1.00 0.00 O ATOM 1551 CB ALA A 103 -1.128 34.190 -1.415 1.00 0.00 C ATOM 0 H ALA A 103 -0.032 32.784 0.152 1.00 0.00 H new ATOM 0 HA ALA A 103 -2.612 33.659 0.147 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.812 34.744 -2.058 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -0.597 34.886 -0.765 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -0.410 33.649 -2.030 1.00 0.00 H new ATOM 1557 N GLU A 104 -2.229 31.388 -2.077 1.00 0.00 N ATOM 1558 CA GLU A 104 -2.991 30.454 -2.846 1.00 0.00 C ATOM 1559 C GLU A 104 -3.755 29.362 -2.180 1.00 0.00 C ATOM 1560 O GLU A 104 -4.863 29.076 -2.630 1.00 0.00 O ATOM 1561 CB GLU A 104 -2.001 29.743 -3.784 1.00 0.00 C ATOM 1562 CG GLU A 104 -1.252 30.769 -4.637 1.00 0.00 C ATOM 1563 CD GLU A 104 -0.217 30.209 -5.603 1.00 0.00 C ATOM 1564 OE1 GLU A 104 0.808 29.707 -5.069 1.00 0.00 O ATOM 1565 OE2 GLU A 104 -0.392 30.149 -6.849 1.00 0.00 O ATOM 0 H GLU A 104 -1.224 31.215 -2.065 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.765 31.086 -3.283 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -1.291 29.158 -3.199 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -2.536 29.045 -4.428 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -1.984 31.338 -5.210 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.753 31.472 -3.969 1.00 0.00 H new ATOM 1572 N LEU A 105 -3.239 29.004 -0.990 1.00 0.00 N ATOM 1573 CA LEU A 105 -3.910 28.096 -0.113 1.00 0.00 C ATOM 1574 C LEU A 105 -5.106 28.658 0.575 1.00 0.00 C ATOM 1575 O LEU A 105 -6.130 28.000 0.748 1.00 0.00 O ATOM 1576 CB LEU A 105 -2.998 27.360 0.884 1.00 0.00 C ATOM 1577 CG LEU A 105 -3.699 26.243 1.675 1.00 0.00 C ATOM 1578 CD1 LEU A 105 -2.763 25.024 1.624 1.00 0.00 C ATOM 1579 CD2 LEU A 105 -4.025 26.596 3.136 1.00 0.00 C ATOM 0 H LEU A 105 -2.348 29.348 -0.633 1.00 0.00 H new ATOM 0 HA LEU A 105 -4.275 27.344 -0.812 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.156 26.931 0.340 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -2.588 28.085 1.587 1.00 0.00 H new ATOM 0 HG LEU A 105 -4.670 26.057 1.217 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.213 24.197 2.173 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.606 24.729 0.587 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.805 25.281 2.077 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -4.518 25.749 3.614 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -3.103 26.827 3.669 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.686 27.462 3.162 1.00 0.00 H new ATOM 1591 N ARG A 106 -5.133 29.992 0.744 1.00 0.00 N ATOM 1592 CA ARG A 106 -6.235 30.686 1.335 1.00 0.00 C ATOM 1593 C ARG A 106 -7.335 30.932 0.361 1.00 0.00 C ATOM 1594 O ARG A 106 -8.496 30.641 0.648 1.00 0.00 O ATOM 1595 CB ARG A 106 -5.772 32.027 1.928 1.00 0.00 C ATOM 1596 CG ARG A 106 -6.994 32.568 2.673 1.00 0.00 C ATOM 1597 CD ARG A 106 -6.763 33.612 3.768 1.00 0.00 C ATOM 1598 NE ARG A 106 -8.048 34.209 4.229 1.00 0.00 N ATOM 1599 CZ ARG A 106 -8.833 35.090 3.543 1.00 0.00 C ATOM 1600 NH1 ARG A 106 -8.381 35.879 2.525 1.00 0.00 N ATOM 1601 NH2 ARG A 106 -10.139 35.227 3.917 1.00 0.00 N ATOM 0 H ARG A 106 -4.368 30.605 0.462 1.00 0.00 H new ATOM 0 HA ARG A 106 -6.622 30.045 2.127 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -4.926 31.890 2.602 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -5.449 32.715 1.146 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -7.670 33.001 1.936 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -7.513 31.721 3.123 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -6.251 33.149 4.612 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -6.109 34.398 3.391 1.00 0.00 H new ATOM 0 HE ARG A 106 -8.375 33.930 5.154 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -7.404 35.830 2.237 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -9.021 36.518 2.052 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -10.508 34.678 4.693 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -10.746 35.879 3.420 1.00 0.00 H new ATOM 1615 N HIS A 107 -6.988 31.297 -0.886 1.00 0.00 N ATOM 1616 CA HIS A 107 -7.867 31.710 -1.935 1.00 0.00 C ATOM 1617 C HIS A 107 -8.815 30.596 -2.219 1.00 0.00 C ATOM 1618 O HIS A 107 -9.997 30.794 -2.496 1.00 0.00 O ATOM 1619 CB HIS A 107 -6.962 31.848 -3.172 1.00 0.00 C ATOM 1620 CG HIS A 107 -7.680 32.346 -4.391 1.00 0.00 C ATOM 1621 ND1 HIS A 107 -8.098 33.643 -4.610 1.00 0.00 N ATOM 1622 CD2 HIS A 107 -7.782 31.713 -5.590 1.00 0.00 C ATOM 1623 CE1 HIS A 107 -8.442 33.700 -5.925 1.00 0.00 C ATOM 1624 NE2 HIS A 107 -8.239 32.568 -6.572 1.00 0.00 N ATOM 0 H HIS A 107 -6.012 31.303 -1.183 1.00 0.00 H new ATOM 0 HA HIS A 107 -8.412 32.620 -1.684 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -6.144 32.530 -2.939 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -6.515 30.879 -3.395 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -7.537 30.674 -5.753 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -8.843 34.586 -6.394 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -8.385 32.372 -7.562 1.00 0.00 H new ATOM 1632 N VAL A 108 -8.393 29.319 -2.196 1.00 0.00 N ATOM 1633 CA VAL A 108 -9.223 28.191 -2.484 1.00 0.00 C ATOM 1634 C VAL A 108 -10.279 28.063 -1.440 1.00 0.00 C ATOM 1635 O VAL A 108 -11.446 27.822 -1.747 1.00 0.00 O ATOM 1636 CB VAL A 108 -8.456 26.970 -2.896 1.00 0.00 C ATOM 1637 CG1 VAL A 108 -9.470 25.831 -3.096 1.00 0.00 C ATOM 1638 CG2 VAL A 108 -7.604 27.257 -4.144 1.00 0.00 C ATOM 0 H VAL A 108 -7.433 29.062 -1.967 1.00 0.00 H new ATOM 0 HA VAL A 108 -9.785 28.354 -3.403 1.00 0.00 H new ATOM 0 HB VAL A 108 -7.744 26.670 -2.127 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -8.945 24.925 -3.397 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.002 25.649 -2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -10.184 26.111 -3.871 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -7.056 26.358 -4.425 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -8.253 27.558 -4.966 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -6.898 28.059 -3.926 1.00 0.00 H new ATOM 1648 N MET A 109 -9.959 28.329 -0.161 1.00 0.00 N ATOM 1649 CA MET A 109 -10.884 28.225 0.925 1.00 0.00 C ATOM 1650 C MET A 109 -11.940 29.276 0.930 1.00 0.00 C ATOM 1651 O MET A 109 -13.102 28.919 1.120 1.00 0.00 O ATOM 1652 CB MET A 109 -10.136 28.047 2.257 1.00 0.00 C ATOM 1653 CG MET A 109 -9.166 26.864 2.269 1.00 0.00 C ATOM 1654 SD MET A 109 -9.975 25.236 2.232 1.00 0.00 S ATOM 1655 CE MET A 109 -8.458 24.271 1.976 1.00 0.00 C ATOM 0 H MET A 109 -9.027 28.626 0.127 1.00 0.00 H new ATOM 0 HA MET A 109 -11.466 27.316 0.774 1.00 0.00 H new ATOM 0 HB2 MET A 109 -9.583 28.960 2.477 1.00 0.00 H new ATOM 0 HB3 MET A 109 -10.865 27.915 3.057 1.00 0.00 H new ATOM 0 HG2 MET A 109 -8.500 26.946 1.410 1.00 0.00 H new ATOM 0 HG3 MET A 109 -8.544 26.928 3.162 1.00 0.00 H new ATOM 0 HE1 MET A 109 -8.642 23.228 2.234 1.00 0.00 H new ATOM 0 HE2 MET A 109 -8.156 24.338 0.931 1.00 0.00 H new ATOM 0 HE3 MET A 109 -7.664 24.666 2.609 1.00 0.00 H new ATOM 1665 N THR A 110 -11.600 30.537 0.613 1.00 0.00 N ATOM 1666 CA THR A 110 -12.529 31.588 0.338 1.00 0.00 C ATOM 1667 C THR A 110 -13.504 31.401 -0.773 1.00 0.00 C ATOM 1668 O THR A 110 -14.614 31.927 -0.833 1.00 0.00 O ATOM 1669 CB THR A 110 -11.999 32.989 0.257 1.00 0.00 C ATOM 1670 OG1 THR A 110 -10.998 33.164 -0.734 1.00 0.00 O ATOM 1671 CG2 THR A 110 -11.330 33.300 1.607 1.00 0.00 C ATOM 0 H THR A 110 -10.628 30.839 0.545 1.00 0.00 H new ATOM 0 HA THR A 110 -13.069 31.475 1.278 1.00 0.00 H new ATOM 0 HB THR A 110 -12.838 33.638 0.008 1.00 0.00 H new ATOM 0 HG1 THR A 110 -10.833 32.311 -1.186 1.00 0.00 H new ATOM 0 HG21 THR A 110 -10.930 34.314 1.590 1.00 0.00 H new ATOM 0 HG22 THR A 110 -12.066 33.214 2.406 1.00 0.00 H new ATOM 0 HG23 THR A 110 -10.519 32.593 1.783 1.00 0.00 H new ATOM 1679 N ASN A 111 -13.103 30.516 -1.703 1.00 0.00 N ATOM 1680 CA ASN A 111 -13.837 30.219 -2.893 1.00 0.00 C ATOM 1681 C ASN A 111 -14.866 29.182 -2.600 1.00 0.00 C ATOM 1682 O ASN A 111 -15.942 29.185 -3.196 1.00 0.00 O ATOM 1683 CB ASN A 111 -12.989 29.678 -4.057 1.00 0.00 C ATOM 1684 CG ASN A 111 -13.738 29.711 -5.382 1.00 0.00 C ATOM 1685 OD1 ASN A 111 -14.400 30.631 -5.858 1.00 0.00 O ATOM 1686 ND2 ASN A 111 -13.690 28.522 -6.041 1.00 0.00 N ATOM 0 H ASN A 111 -12.234 29.987 -1.623 1.00 0.00 H new ATOM 0 HA ASN A 111 -14.262 31.174 -3.203 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -12.076 30.268 -4.143 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -12.687 28.654 -3.838 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -14.199 28.404 -6.917 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -13.145 27.749 -5.659 1.00 0.00 H new ATOM 1693 N LEU A 112 -14.484 28.270 -1.688 1.00 0.00 N ATOM 1694 CA LEU A 112 -15.334 27.331 -1.024 1.00 0.00 C ATOM 1695 C LEU A 112 -16.229 27.917 0.013 1.00 0.00 C ATOM 1696 O LEU A 112 -17.177 27.317 0.517 1.00 0.00 O ATOM 1697 CB LEU A 112 -14.509 26.241 -0.319 1.00 0.00 C ATOM 1698 CG LEU A 112 -13.714 25.304 -1.245 1.00 0.00 C ATOM 1699 CD1 LEU A 112 -12.740 24.410 -0.458 1.00 0.00 C ATOM 1700 CD2 LEU A 112 -14.663 24.338 -1.974 1.00 0.00 C ATOM 0 H LEU A 112 -13.511 28.184 -1.395 1.00 0.00 H new ATOM 0 HA LEU A 112 -15.952 26.933 -1.829 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -13.811 26.724 0.365 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -15.183 25.636 0.288 1.00 0.00 H new ATOM 0 HG LEU A 112 -13.174 25.952 -1.935 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -12.199 23.764 -1.150 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -12.031 25.035 0.085 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -13.299 23.797 0.249 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -14.085 23.682 -2.625 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -15.204 23.738 -1.242 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -15.374 24.908 -2.572 1.00 0.00 H new ATOM 1712 N GLY A 113 -15.861 29.131 0.461 1.00 0.00 N ATOM 1713 CA GLY A 113 -16.494 29.854 1.520 1.00 0.00 C ATOM 1714 C GLY A 113 -16.308 29.353 2.911 1.00 0.00 C ATOM 1715 O GLY A 113 -17.110 29.400 3.843 1.00 0.00 O ATOM 0 H GLY A 113 -15.073 29.638 0.058 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -16.136 30.883 1.484 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -17.564 29.881 1.314 1.00 0.00 H new ATOM 1719 N GLU A 114 -15.112 28.768 3.098 1.00 0.00 N ATOM 1720 CA GLU A 114 -14.499 28.192 4.255 1.00 0.00 C ATOM 1721 C GLU A 114 -13.625 29.193 4.930 1.00 0.00 C ATOM 1722 O GLU A 114 -12.677 29.742 4.370 1.00 0.00 O ATOM 1723 CB GLU A 114 -13.723 26.941 3.811 1.00 0.00 C ATOM 1724 CG GLU A 114 -13.175 26.044 4.923 1.00 0.00 C ATOM 1725 CD GLU A 114 -14.277 25.506 5.825 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -14.937 24.557 5.324 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -14.540 26.020 6.945 1.00 0.00 O ATOM 0 H GLU A 114 -14.477 28.690 2.303 1.00 0.00 H new ATOM 0 HA GLU A 114 -15.251 27.896 4.987 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -14.378 26.340 3.180 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -12.887 27.261 3.189 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -12.631 25.210 4.479 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -12.460 26.607 5.523 1.00 0.00 H new ATOM 1734 N LYS A 115 -13.978 29.700 6.125 1.00 0.00 N ATOM 1735 CA LYS A 115 -13.332 30.865 6.645 1.00 0.00 C ATOM 1736 C LYS A 115 -12.060 30.474 7.316 1.00 0.00 C ATOM 1737 O LYS A 115 -12.028 29.673 8.248 1.00 0.00 O ATOM 1738 CB LYS A 115 -14.252 31.534 7.679 1.00 0.00 C ATOM 1739 CG LYS A 115 -15.437 32.331 7.128 1.00 0.00 C ATOM 1740 CD LYS A 115 -16.145 33.173 8.191 1.00 0.00 C ATOM 1741 CE LYS A 115 -17.659 33.165 7.972 1.00 0.00 C ATOM 1742 NZ LYS A 115 -18.247 31.973 8.623 1.00 0.00 N ATOM 0 H LYS A 115 -14.703 29.308 6.726 1.00 0.00 H new ATOM 0 HA LYS A 115 -13.120 31.555 5.828 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -14.640 30.760 8.341 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -13.647 32.203 8.291 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -15.086 32.985 6.330 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -16.154 31.642 6.683 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -15.915 32.783 9.183 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -15.774 34.197 8.157 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -18.101 34.072 8.384 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -17.883 33.157 6.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -19.276 31.968 8.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -17.833 31.113 8.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -18.045 31.999 9.643 1.00 0.00 H new ATOM 1756 N LEU A 116 -10.942 31.078 6.877 1.00 0.00 N ATOM 1757 CA LEU A 116 -9.647 30.873 7.448 1.00 0.00 C ATOM 1758 C LEU A 116 -8.904 32.163 7.388 1.00 0.00 C ATOM 1759 O LEU A 116 -8.845 32.786 6.329 1.00 0.00 O ATOM 1760 CB LEU A 116 -8.673 29.964 6.679 1.00 0.00 C ATOM 1761 CG LEU A 116 -9.053 28.477 6.777 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -8.443 27.672 5.617 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -8.960 27.851 8.178 1.00 0.00 C ATOM 0 H LEU A 116 -10.939 31.733 6.095 1.00 0.00 H new ATOM 0 HA LEU A 116 -9.881 30.440 8.420 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -8.653 30.262 5.631 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -7.665 30.105 7.069 1.00 0.00 H new ATOM 0 HG LEU A 116 -10.132 28.421 6.634 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -8.728 26.624 5.712 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -8.811 28.064 4.669 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -7.357 27.757 5.647 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -9.250 26.802 8.128 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -7.936 27.927 8.543 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -9.628 28.380 8.858 1.00 0.00 H new ATOM 1775 N THR A 117 -8.417 32.620 8.556 1.00 0.00 N ATOM 1776 CA THR A 117 -7.637 33.817 8.610 1.00 0.00 C ATOM 1777 C THR A 117 -6.270 33.445 8.150 1.00 0.00 C ATOM 1778 O THR A 117 -5.825 32.306 8.012 1.00 0.00 O ATOM 1779 CB THR A 117 -7.517 34.566 9.904 1.00 0.00 C ATOM 1780 OG1 THR A 117 -7.111 33.820 11.042 1.00 0.00 O ATOM 1781 CG2 THR A 117 -8.862 35.225 10.256 1.00 0.00 C ATOM 0 H THR A 117 -8.562 32.164 9.457 1.00 0.00 H new ATOM 0 HA THR A 117 -8.183 34.526 7.987 1.00 0.00 H new ATOM 0 HB THR A 117 -6.718 35.279 9.704 1.00 0.00 H new ATOM 0 HG1 THR A 117 -7.732 33.075 11.184 1.00 0.00 H new ATOM 0 HG21 THR A 117 -8.766 35.767 11.197 1.00 0.00 H new ATOM 0 HG22 THR A 117 -9.145 35.919 9.465 1.00 0.00 H new ATOM 0 HG23 THR A 117 -9.629 34.457 10.356 1.00 0.00 H new ATOM 1789 N ASP A 118 -5.427 34.448 7.846 1.00 0.00 N ATOM 1790 CA ASP A 118 -4.097 34.171 7.399 1.00 0.00 C ATOM 1791 C ASP A 118 -3.245 33.505 8.424 1.00 0.00 C ATOM 1792 O ASP A 118 -2.209 32.898 8.155 1.00 0.00 O ATOM 1793 CB ASP A 118 -3.427 35.465 6.905 1.00 0.00 C ATOM 1794 CG ASP A 118 -4.042 35.948 5.599 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -5.261 36.265 5.612 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -3.368 35.935 4.534 1.00 0.00 O ATOM 0 H ASP A 118 -5.662 35.439 7.908 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.190 33.461 6.578 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -3.527 36.241 7.664 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -2.360 35.293 6.764 1.00 0.00 H new ATOM 1801 N GLU A 119 -3.744 33.427 9.670 1.00 0.00 N ATOM 1802 CA GLU A 119 -3.188 32.782 10.819 1.00 0.00 C ATOM 1803 C GLU A 119 -3.482 31.322 10.882 1.00 0.00 C ATOM 1804 O GLU A 119 -2.689 30.399 11.064 1.00 0.00 O ATOM 1805 CB GLU A 119 -3.676 33.481 12.099 1.00 0.00 C ATOM 1806 CG GLU A 119 -2.922 33.024 13.349 1.00 0.00 C ATOM 1807 CD GLU A 119 -1.459 33.420 13.210 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -1.161 34.641 13.297 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -0.624 32.477 13.242 1.00 0.00 O ATOM 0 H GLU A 119 -4.637 33.866 9.894 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.105 32.871 10.734 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -3.561 34.559 11.985 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -4.740 33.286 12.231 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -3.354 33.481 14.239 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.011 31.944 13.470 1.00 0.00 H new ATOM 1816 N GLU A 120 -4.733 31.045 10.474 1.00 0.00 N ATOM 1817 CA GLU A 120 -5.300 29.740 10.332 1.00 0.00 C ATOM 1818 C GLU A 120 -4.764 29.048 9.127 1.00 0.00 C ATOM 1819 O GLU A 120 -4.447 27.862 9.217 1.00 0.00 O ATOM 1820 CB GLU A 120 -6.838 29.775 10.332 1.00 0.00 C ATOM 1821 CG GLU A 120 -7.370 30.222 11.695 1.00 0.00 C ATOM 1822 CD GLU A 120 -8.832 30.601 11.511 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -8.996 31.814 11.211 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -9.728 29.750 11.757 1.00 0.00 O ATOM 0 H GLU A 120 -5.392 31.783 10.227 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.001 29.161 11.205 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -7.191 30.456 9.557 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -7.229 28.787 10.090 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -7.270 29.421 12.427 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.798 31.070 12.071 1.00 0.00 H new ATOM 1831 N VAL A 121 -4.522 29.706 7.979 1.00 0.00 N ATOM 1832 CA VAL A 121 -3.661 29.273 6.924 1.00 0.00 C ATOM 1833 C VAL A 121 -2.244 29.016 7.306 1.00 0.00 C ATOM 1834 O VAL A 121 -1.703 28.030 6.808 1.00 0.00 O ATOM 1835 CB VAL A 121 -3.746 30.302 5.835 1.00 0.00 C ATOM 1836 CG1 VAL A 121 -2.723 30.038 4.717 1.00 0.00 C ATOM 1837 CG2 VAL A 121 -5.166 30.237 5.247 1.00 0.00 C ATOM 0 H VAL A 121 -4.960 30.604 7.775 1.00 0.00 H new ATOM 0 HA VAL A 121 -4.012 28.293 6.601 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.526 31.284 6.254 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.818 30.805 3.949 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.716 30.063 5.132 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.910 29.059 4.277 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -5.264 30.974 4.450 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -5.348 29.241 4.844 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -5.894 30.450 6.030 1.00 0.00 H new ATOM 1847 N ASP A 122 -1.561 29.774 8.183 1.00 0.00 N ATOM 1848 CA ASP A 122 -0.160 29.595 8.410 1.00 0.00 C ATOM 1849 C ASP A 122 0.186 28.369 9.182 1.00 0.00 C ATOM 1850 O ASP A 122 1.246 27.760 9.050 1.00 0.00 O ATOM 1851 CB ASP A 122 0.255 30.784 9.293 1.00 0.00 C ATOM 1852 CG ASP A 122 1.734 30.981 9.593 1.00 0.00 C ATOM 1853 OD1 ASP A 122 2.600 30.733 8.711 1.00 0.00 O ATOM 1854 OD2 ASP A 122 2.087 31.401 10.727 1.00 0.00 O ATOM 0 H ASP A 122 -1.984 30.517 8.739 1.00 0.00 H new ATOM 0 HA ASP A 122 0.335 29.517 7.442 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -0.112 31.694 8.818 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -0.267 30.689 10.245 1.00 0.00 H new ATOM 1859 N GLU A 123 -0.746 27.829 9.988 1.00 0.00 N ATOM 1860 CA GLU A 123 -0.821 26.548 10.619 1.00 0.00 C ATOM 1861 C GLU A 123 -0.778 25.464 9.599 1.00 0.00 C ATOM 1862 O GLU A 123 0.066 24.573 9.683 1.00 0.00 O ATOM 1863 CB GLU A 123 -2.090 26.409 11.478 1.00 0.00 C ATOM 1864 CG GLU A 123 -2.288 25.128 12.291 1.00 0.00 C ATOM 1865 CD GLU A 123 -3.560 25.243 13.118 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -3.481 25.852 14.219 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -4.678 24.769 12.781 1.00 0.00 O ATOM 0 H GLU A 123 -1.569 28.381 10.229 1.00 0.00 H new ATOM 0 HA GLU A 123 0.042 26.458 11.279 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -2.113 27.249 12.173 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.950 26.518 10.818 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -2.351 24.268 11.624 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -1.431 24.963 12.944 1.00 0.00 H new ATOM 1874 N MET A 124 -1.607 25.559 8.544 1.00 0.00 N ATOM 1875 CA MET A 124 -1.596 24.561 7.519 1.00 0.00 C ATOM 1876 C MET A 124 -0.389 24.580 6.646 1.00 0.00 C ATOM 1877 O MET A 124 0.036 23.518 6.195 1.00 0.00 O ATOM 1878 CB MET A 124 -2.905 24.456 6.718 1.00 0.00 C ATOM 1879 CG MET A 124 -4.192 24.571 7.538 1.00 0.00 C ATOM 1880 SD MET A 124 -5.627 24.398 6.435 1.00 0.00 S ATOM 1881 CE MET A 124 -6.715 24.932 7.787 1.00 0.00 C ATOM 0 H MET A 124 -2.276 26.315 8.401 1.00 0.00 H new ATOM 0 HA MET A 124 -1.526 23.632 8.084 1.00 0.00 H new ATOM 0 HB2 MET A 124 -2.909 25.237 5.958 1.00 0.00 H new ATOM 0 HB3 MET A 124 -2.914 23.501 6.193 1.00 0.00 H new ATOM 0 HG2 MET A 124 -4.216 23.800 8.308 1.00 0.00 H new ATOM 0 HG3 MET A 124 -4.226 25.533 8.049 1.00 0.00 H new ATOM 0 HE1 MET A 124 -7.755 24.858 7.468 1.00 0.00 H new ATOM 0 HE2 MET A 124 -6.556 24.293 8.656 1.00 0.00 H new ATOM 0 HE3 MET A 124 -6.488 25.965 8.050 1.00 0.00 H new ATOM 1891 N ILE A 125 0.254 25.725 6.352 1.00 0.00 N ATOM 1892 CA ILE A 125 1.516 25.910 5.705 1.00 0.00 C ATOM 1893 C ILE A 125 2.637 25.358 6.516 1.00 0.00 C ATOM 1894 O ILE A 125 3.479 24.609 6.022 1.00 0.00 O ATOM 1895 CB ILE A 125 1.744 27.342 5.324 1.00 0.00 C ATOM 1896 CG1 ILE A 125 0.697 27.901 4.345 1.00 0.00 C ATOM 1897 CG2 ILE A 125 3.193 27.468 4.824 1.00 0.00 C ATOM 1898 CD1 ILE A 125 0.637 27.205 2.987 1.00 0.00 C ATOM 0 H ILE A 125 -0.163 26.623 6.598 1.00 0.00 H new ATOM 0 HA ILE A 125 1.488 25.341 4.776 1.00 0.00 H new ATOM 0 HB ILE A 125 1.608 27.974 6.201 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -0.285 27.835 4.813 1.00 0.00 H new ATOM 0 HG13 ILE A 125 0.903 28.959 4.184 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.391 28.501 4.538 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.879 27.174 5.618 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.338 26.819 3.961 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.131 27.673 2.372 1.00 0.00 H new ATOM 0 HD12 ILE A 125 1.603 27.293 2.490 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.396 26.151 3.128 1.00 0.00 H new ATOM 1910 N ARG A 126 2.559 25.555 7.844 1.00 0.00 N ATOM 1911 CA ARG A 126 3.536 25.070 8.768 1.00 0.00 C ATOM 1912 C ARG A 126 3.609 23.585 8.874 1.00 0.00 C ATOM 1913 O ARG A 126 4.681 23.005 9.038 1.00 0.00 O ATOM 1914 CB ARG A 126 3.153 25.609 10.157 1.00 0.00 C ATOM 1915 CG ARG A 126 4.283 25.542 11.186 1.00 0.00 C ATOM 1916 CD ARG A 126 3.744 25.758 12.601 1.00 0.00 C ATOM 1917 NE ARG A 126 3.067 27.086 12.626 1.00 0.00 N ATOM 1918 CZ ARG A 126 1.956 27.420 13.344 1.00 0.00 C ATOM 1919 NH1 ARG A 126 1.213 26.500 14.027 1.00 0.00 N ATOM 1920 NH2 ARG A 126 1.507 28.692 13.134 1.00 0.00 N ATOM 0 H ARG A 126 1.795 26.066 8.287 1.00 0.00 H new ATOM 0 HA ARG A 126 4.508 25.407 8.408 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.829 26.645 10.056 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.300 25.043 10.532 1.00 0.00 H new ATOM 0 HG2 ARG A 126 4.779 24.573 11.125 1.00 0.00 H new ATOM 0 HG3 ARG A 126 5.033 26.299 10.958 1.00 0.00 H new ATOM 0 HD2 ARG A 126 3.045 24.966 12.870 1.00 0.00 H new ATOM 0 HD3 ARG A 126 4.555 25.728 13.329 1.00 0.00 H new ATOM 0 HE ARG A 126 3.476 27.820 12.047 1.00 0.00 H new ATOM 0 HH11 ARG A 126 1.482 25.516 14.014 1.00 0.00 H new ATOM 0 HH12 ARG A 126 0.389 26.797 14.551 1.00 0.00 H new ATOM 0 HH21 ARG A 126 1.997 29.305 12.483 1.00 0.00 H new ATOM 0 HH22 ARG A 126 0.681 29.029 13.628 1.00 0.00 H new ATOM 1934 N GLU A 127 2.461 22.889 8.793 1.00 0.00 N ATOM 1935 CA GLU A 127 2.308 21.467 8.767 1.00 0.00 C ATOM 1936 C GLU A 127 2.866 20.992 7.470 1.00 0.00 C ATOM 1937 O GLU A 127 3.564 19.979 7.468 1.00 0.00 O ATOM 1938 CB GLU A 127 0.869 21.069 9.137 1.00 0.00 C ATOM 1939 CG GLU A 127 0.664 19.553 9.115 1.00 0.00 C ATOM 1940 CD GLU A 127 1.378 19.017 10.348 1.00 0.00 C ATOM 1941 OE1 GLU A 127 1.525 19.637 11.435 1.00 0.00 O ATOM 1942 OE2 GLU A 127 1.898 17.885 10.159 1.00 0.00 O ATOM 0 H GLU A 127 1.561 23.366 8.741 1.00 0.00 H new ATOM 0 HA GLU A 127 2.878 20.944 9.535 1.00 0.00 H new ATOM 0 HB2 GLU A 127 0.632 21.451 10.130 1.00 0.00 H new ATOM 0 HB3 GLU A 127 0.174 21.538 8.441 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -0.396 19.302 9.138 1.00 0.00 H new ATOM 0 HG3 GLU A 127 1.075 19.116 8.205 1.00 0.00 H new ATOM 1949 N ALA A 128 2.632 21.654 6.323 1.00 0.00 N ATOM 1950 CA ALA A 128 3.046 21.239 5.019 1.00 0.00 C ATOM 1951 C ALA A 128 4.525 21.323 4.859 1.00 0.00 C ATOM 1952 O ALA A 128 5.144 20.485 4.206 1.00 0.00 O ATOM 1953 CB ALA A 128 2.224 22.110 4.054 1.00 0.00 C ATOM 0 H ALA A 128 2.120 22.536 6.306 1.00 0.00 H new ATOM 0 HA ALA A 128 2.852 20.186 4.815 1.00 0.00 H new ATOM 0 HB1 ALA A 128 2.481 21.856 3.026 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.161 21.931 4.218 1.00 0.00 H new ATOM 0 HB3 ALA A 128 2.447 23.162 4.234 1.00 0.00 H new ATOM 1959 N ASP A 129 5.104 22.451 5.307 1.00 0.00 N ATOM 1960 CA ASP A 129 6.406 22.741 4.791 1.00 0.00 C ATOM 1961 C ASP A 129 7.545 21.992 5.393 1.00 0.00 C ATOM 1962 O ASP A 129 7.736 21.884 6.604 1.00 0.00 O ATOM 1963 CB ASP A 129 6.812 24.219 4.914 1.00 0.00 C ATOM 1964 CG ASP A 129 7.669 24.538 3.697 1.00 0.00 C ATOM 1965 OD1 ASP A 129 7.091 24.542 2.578 1.00 0.00 O ATOM 1966 OD2 ASP A 129 8.924 24.650 3.736 1.00 0.00 O ATOM 0 H ASP A 129 4.711 23.116 5.973 1.00 0.00 H new ATOM 0 HA ASP A 129 6.262 22.428 3.757 1.00 0.00 H new ATOM 0 HB2 ASP A 129 5.932 24.861 4.947 1.00 0.00 H new ATOM 0 HB3 ASP A 129 7.368 24.393 5.835 1.00 0.00 H new ATOM 1971 N ILE A 130 8.461 21.467 4.560 1.00 0.00 N ATOM 1972 CA ILE A 130 9.614 20.705 4.926 1.00 0.00 C ATOM 1973 C ILE A 130 10.860 21.493 5.147 1.00 0.00 C ATOM 1974 O ILE A 130 11.518 21.428 6.184 1.00 0.00 O ATOM 1975 CB ILE A 130 9.841 19.587 3.952 1.00 0.00 C ATOM 1976 CG1 ILE A 130 8.694 18.582 4.152 1.00 0.00 C ATOM 1977 CG2 ILE A 130 11.216 18.919 4.119 1.00 0.00 C ATOM 1978 CD1 ILE A 130 8.695 17.259 3.387 1.00 0.00 C ATOM 0 H ILE A 130 8.388 21.586 3.550 1.00 0.00 H new ATOM 0 HA ILE A 130 9.380 20.295 5.908 1.00 0.00 H new ATOM 0 HB ILE A 130 9.844 19.979 2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 130 8.655 18.342 5.215 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.765 19.097 3.907 1.00 0.00 H new ATOM 0 HG21 ILE A 130 11.323 18.118 3.387 1.00 0.00 H new ATOM 0 HG22 ILE A 130 12.001 19.659 3.964 1.00 0.00 H new ATOM 0 HG23 ILE A 130 11.300 18.506 5.124 1.00 0.00 H new ATOM 0 HD11 ILE A 130 7.810 16.682 3.656 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.686 17.458 2.315 1.00 0.00 H new ATOM 0 HD13 ILE A 130 9.590 16.691 3.643 1.00 0.00 H new ATOM 1990 N ASP A 131 11.249 22.331 4.170 1.00 0.00 N ATOM 1991 CA ASP A 131 12.387 23.185 4.314 1.00 0.00 C ATOM 1992 C ASP A 131 12.169 24.586 4.771 1.00 0.00 C ATOM 1993 O ASP A 131 13.000 25.482 4.632 1.00 0.00 O ATOM 1994 CB ASP A 131 13.171 23.011 3.003 1.00 0.00 C ATOM 1995 CG ASP A 131 12.478 23.244 1.668 1.00 0.00 C ATOM 1996 OD1 ASP A 131 11.346 23.798 1.679 1.00 0.00 O ATOM 1997 OD2 ASP A 131 13.123 22.873 0.651 1.00 0.00 O ATOM 0 H ASP A 131 10.771 22.417 3.273 1.00 0.00 H new ATOM 0 HA ASP A 131 12.968 22.876 5.183 1.00 0.00 H new ATOM 0 HB2 ASP A 131 14.028 23.683 3.046 1.00 0.00 H new ATOM 0 HB3 ASP A 131 13.564 21.994 2.992 1.00 0.00 H new ATOM 2002 N GLY A 132 11.087 24.977 5.468 1.00 0.00 N ATOM 2003 CA GLY A 132 11.060 26.182 6.237 1.00 0.00 C ATOM 2004 C GLY A 132 10.529 27.375 5.518 1.00 0.00 C ATOM 2005 O GLY A 132 10.174 28.347 6.182 1.00 0.00 O ATOM 0 H GLY A 132 10.216 24.447 5.498 1.00 0.00 H new ATOM 0 HA2 GLY A 132 10.454 26.014 7.128 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.072 26.402 6.577 1.00 0.00 H new ATOM 2009 N ASP A 133 10.475 27.360 4.174 1.00 0.00 N ATOM 2010 CA ASP A 133 10.351 28.579 3.437 1.00 0.00 C ATOM 2011 C ASP A 133 8.940 29.055 3.385 1.00 0.00 C ATOM 2012 O ASP A 133 8.684 30.215 3.067 1.00 0.00 O ATOM 2013 CB ASP A 133 10.886 28.427 2.003 1.00 0.00 C ATOM 2014 CG ASP A 133 10.298 27.356 1.095 1.00 0.00 C ATOM 2015 OD1 ASP A 133 9.324 26.669 1.504 1.00 0.00 O ATOM 2016 OD2 ASP A 133 10.839 27.210 -0.033 1.00 0.00 O ATOM 0 H ASP A 133 10.517 26.515 3.604 1.00 0.00 H new ATOM 0 HA ASP A 133 10.951 29.319 3.966 1.00 0.00 H new ATOM 0 HB2 ASP A 133 10.757 29.387 1.503 1.00 0.00 H new ATOM 0 HB3 ASP A 133 11.958 28.245 2.072 1.00 0.00 H new ATOM 2021 N GLY A 134 8.024 28.118 3.688 1.00 0.00 N ATOM 2022 CA GLY A 134 6.613 28.335 3.609 1.00 0.00 C ATOM 2023 C GLY A 134 5.996 28.306 2.253 1.00 0.00 C ATOM 2024 O GLY A 134 4.870 28.707 1.962 1.00 0.00 O ATOM 0 H GLY A 134 8.274 27.179 3.998 1.00 0.00 H new ATOM 0 HA2 GLY A 134 6.120 27.580 4.221 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.394 29.303 4.060 1.00 0.00 H new ATOM 2028 N GLN A 135 6.818 27.897 1.270 1.00 0.00 N ATOM 2029 CA GLN A 135 6.387 27.675 -0.076 1.00 0.00 C ATOM 2030 C GLN A 135 6.237 26.197 -0.186 1.00 0.00 C ATOM 2031 O GLN A 135 7.292 25.567 -0.243 1.00 0.00 O ATOM 2032 CB GLN A 135 7.391 28.190 -1.121 1.00 0.00 C ATOM 2033 CG GLN A 135 7.904 29.631 -1.150 1.00 0.00 C ATOM 2034 CD GLN A 135 6.826 30.687 -0.958 1.00 0.00 C ATOM 2035 OE1 GLN A 135 6.318 31.208 -1.950 1.00 0.00 O ATOM 2036 NE2 GLN A 135 6.608 31.177 0.292 1.00 0.00 N ATOM 0 H GLN A 135 7.811 27.715 1.415 1.00 0.00 H new ATOM 0 HA GLN A 135 5.464 28.218 -0.279 1.00 0.00 H new ATOM 0 HB2 GLN A 135 8.271 27.551 -1.045 1.00 0.00 H new ATOM 0 HB3 GLN A 135 6.944 28.002 -2.097 1.00 0.00 H new ATOM 0 HG2 GLN A 135 8.656 29.752 -0.370 1.00 0.00 H new ATOM 0 HG3 GLN A 135 8.402 29.807 -2.103 1.00 0.00 H new ATOM 0 HE21 GLN A 135 7.041 30.727 1.099 1.00 0.00 H new ATOM 0 HE22 GLN A 135 6.012 31.994 0.423 1.00 0.00 H new ATOM 2045 N VAL A 136 4.979 25.728 -0.267 1.00 0.00 N ATOM 2046 CA VAL A 136 4.757 24.323 -0.124 1.00 0.00 C ATOM 2047 C VAL A 136 4.932 23.735 -1.482 1.00 0.00 C ATOM 2048 O VAL A 136 4.236 24.103 -2.428 1.00 0.00 O ATOM 2049 CB VAL A 136 3.377 24.116 0.427 1.00 0.00 C ATOM 2050 CG1 VAL A 136 3.038 22.630 0.635 1.00 0.00 C ATOM 2051 CG2 VAL A 136 3.248 24.893 1.747 1.00 0.00 C ATOM 0 H VAL A 136 4.146 26.295 -0.425 1.00 0.00 H new ATOM 0 HA VAL A 136 5.450 23.841 0.566 1.00 0.00 H new ATOM 0 HB VAL A 136 2.660 24.492 -0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 136 2.028 22.540 1.035 1.00 0.00 H new ATOM 0 HG12 VAL A 136 3.099 22.106 -0.319 1.00 0.00 H new ATOM 0 HG13 VAL A 136 3.747 22.190 1.336 1.00 0.00 H new ATOM 0 HG21 VAL A 136 2.248 24.750 2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 136 3.988 24.527 2.459 1.00 0.00 H new ATOM 0 HG23 VAL A 136 3.416 25.954 1.563 1.00 0.00 H new ATOM 2061 N ASN A 137 5.797 22.761 -1.817 1.00 0.00 N ATOM 2062 CA ASN A 137 6.072 22.254 -3.125 1.00 0.00 C ATOM 2063 C ASN A 137 5.293 20.990 -3.244 1.00 0.00 C ATOM 2064 O ASN A 137 4.830 20.457 -2.237 1.00 0.00 O ATOM 2065 CB ASN A 137 7.548 22.185 -3.552 1.00 0.00 C ATOM 2066 CG ASN A 137 8.254 20.930 -3.060 1.00 0.00 C ATOM 2067 OD1 ASN A 137 7.875 19.798 -3.358 1.00 0.00 O ATOM 2068 ND2 ASN A 137 9.302 21.042 -2.200 1.00 0.00 N ATOM 0 H ASN A 137 6.353 22.287 -1.106 1.00 0.00 H new ATOM 0 HA ASN A 137 5.744 22.976 -3.873 1.00 0.00 H new ATOM 0 HB2 ASN A 137 7.608 22.225 -4.640 1.00 0.00 H new ATOM 0 HB3 ASN A 137 8.071 23.062 -3.171 1.00 0.00 H new ATOM 0 HD21 ASN A 137 9.746 20.204 -1.825 1.00 0.00 H new ATOM 0 HD22 ASN A 137 9.644 21.964 -1.930 1.00 0.00 H new ATOM 2075 N TYR A 138 5.229 20.337 -4.418 1.00 0.00 N ATOM 2076 CA TYR A 138 4.535 19.113 -4.670 1.00 0.00 C ATOM 2077 C TYR A 138 4.788 18.000 -3.713 1.00 0.00 C ATOM 2078 O TYR A 138 3.855 17.344 -3.252 1.00 0.00 O ATOM 2079 CB TYR A 138 4.623 18.659 -6.137 1.00 0.00 C ATOM 2080 CG TYR A 138 3.555 17.707 -6.552 1.00 0.00 C ATOM 2081 CD1 TYR A 138 2.203 17.957 -6.564 1.00 0.00 C ATOM 2082 CD2 TYR A 138 3.966 16.454 -6.943 1.00 0.00 C ATOM 2083 CE1 TYR A 138 1.280 16.990 -6.886 1.00 0.00 C ATOM 2084 CE2 TYR A 138 3.054 15.532 -7.398 1.00 0.00 C ATOM 2085 CZ TYR A 138 1.700 15.746 -7.297 1.00 0.00 C ATOM 2086 OH TYR A 138 0.866 14.665 -7.654 1.00 0.00 O ATOM 0 H TYR A 138 5.697 20.692 -5.252 1.00 0.00 H new ATOM 0 HA TYR A 138 3.498 19.384 -4.474 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.579 19.538 -6.780 1.00 0.00 H new ATOM 0 HB3 TYR A 138 5.594 18.192 -6.302 1.00 0.00 H new ATOM 0 HD1 TYR A 138 1.854 18.947 -6.312 1.00 0.00 H new ATOM 0 HD2 TYR A 138 5.013 16.193 -6.892 1.00 0.00 H new ATOM 0 HE1 TYR A 138 0.224 17.207 -6.816 1.00 0.00 H new ATOM 0 HE2 TYR A 138 3.410 14.616 -7.846 1.00 0.00 H new ATOM 0 HH TYR A 138 1.418 13.896 -7.909 1.00 0.00 H new ATOM 2096 N GLU A 139 6.044 17.683 -3.351 1.00 0.00 N ATOM 2097 CA GLU A 139 6.402 16.653 -2.425 1.00 0.00 C ATOM 2098 C GLU A 139 5.876 16.930 -1.059 1.00 0.00 C ATOM 2099 O GLU A 139 5.439 16.072 -0.294 1.00 0.00 O ATOM 2100 CB GLU A 139 7.927 16.456 -2.456 1.00 0.00 C ATOM 2101 CG GLU A 139 8.450 15.915 -3.788 1.00 0.00 C ATOM 2102 CD GLU A 139 9.971 15.879 -3.743 1.00 0.00 C ATOM 2103 OE1 GLU A 139 10.535 15.149 -2.885 1.00 0.00 O ATOM 2104 OE2 GLU A 139 10.625 16.622 -4.523 1.00 0.00 O ATOM 0 H GLU A 139 6.856 18.174 -3.726 1.00 0.00 H new ATOM 0 HA GLU A 139 5.934 15.716 -2.726 1.00 0.00 H new ATOM 0 HB2 GLU A 139 8.412 17.409 -2.246 1.00 0.00 H new ATOM 0 HB3 GLU A 139 8.212 15.770 -1.658 1.00 0.00 H new ATOM 0 HG2 GLU A 139 8.055 14.916 -3.970 1.00 0.00 H new ATOM 0 HG3 GLU A 139 8.112 16.546 -4.610 1.00 0.00 H new ATOM 2111 N GLU A 140 6.079 18.167 -0.571 1.00 0.00 N ATOM 2112 CA GLU A 140 5.640 18.675 0.692 1.00 0.00 C ATOM 2113 C GLU A 140 4.161 18.597 0.858 1.00 0.00 C ATOM 2114 O GLU A 140 3.628 18.111 1.854 1.00 0.00 O ATOM 2115 CB GLU A 140 6.043 20.155 0.810 1.00 0.00 C ATOM 2116 CG GLU A 140 7.567 20.209 0.691 1.00 0.00 C ATOM 2117 CD GLU A 140 8.162 21.608 0.769 1.00 0.00 C ATOM 2118 OE1 GLU A 140 7.933 22.486 -0.105 1.00 0.00 O ATOM 2119 OE2 GLU A 140 8.861 21.942 1.763 1.00 0.00 O ATOM 0 H GLU A 140 6.593 18.868 -1.105 1.00 0.00 H new ATOM 0 HA GLU A 140 6.109 18.061 1.461 1.00 0.00 H new ATOM 0 HB2 GLU A 140 5.573 20.747 0.025 1.00 0.00 H new ATOM 0 HB3 GLU A 140 5.715 20.570 1.763 1.00 0.00 H new ATOM 0 HG2 GLU A 140 8.002 19.599 1.483 1.00 0.00 H new ATOM 0 HG3 GLU A 140 7.860 19.757 -0.256 1.00 0.00 H new ATOM 2126 N PHE A 141 3.370 18.785 -0.214 1.00 0.00 N ATOM 2127 CA PHE A 141 1.963 18.535 -0.154 1.00 0.00 C ATOM 2128 C PHE A 141 1.581 17.098 -0.238 1.00 0.00 C ATOM 2129 O PHE A 141 0.793 16.595 0.561 1.00 0.00 O ATOM 2130 CB PHE A 141 1.355 19.316 -1.331 1.00 0.00 C ATOM 2131 CG PHE A 141 -0.116 19.253 -1.562 1.00 0.00 C ATOM 2132 CD1 PHE A 141 -0.916 20.161 -0.910 1.00 0.00 C ATOM 2133 CD2 PHE A 141 -0.709 18.409 -2.472 1.00 0.00 C ATOM 2134 CE1 PHE A 141 -2.241 20.263 -1.263 1.00 0.00 C ATOM 2135 CE2 PHE A 141 -2.040 18.480 -2.809 1.00 0.00 C ATOM 2136 CZ PHE A 141 -2.827 19.406 -2.165 1.00 0.00 C ATOM 0 H PHE A 141 3.704 19.110 -1.121 1.00 0.00 H new ATOM 0 HA PHE A 141 1.589 18.853 0.819 1.00 0.00 H new ATOM 0 HB2 PHE A 141 1.622 20.365 -1.202 1.00 0.00 H new ATOM 0 HB3 PHE A 141 1.845 18.972 -2.242 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -0.509 20.787 -0.130 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -0.099 17.654 -2.945 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -2.842 21.042 -0.817 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -2.457 17.825 -3.560 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.887 19.459 -2.364 1.00 0.00 H new ATOM 2146 N VAL A 142 2.178 16.297 -1.139 1.00 0.00 N ATOM 2147 CA VAL A 142 1.941 14.887 -1.189 1.00 0.00 C ATOM 2148 C VAL A 142 2.360 14.157 0.041 1.00 0.00 C ATOM 2149 O VAL A 142 1.620 13.266 0.455 1.00 0.00 O ATOM 2150 CB VAL A 142 2.535 14.355 -2.459 1.00 0.00 C ATOM 2151 CG1 VAL A 142 2.533 12.819 -2.524 1.00 0.00 C ATOM 2152 CG2 VAL A 142 1.661 14.926 -3.589 1.00 0.00 C ATOM 0 H VAL A 142 2.835 16.633 -1.843 1.00 0.00 H new ATOM 0 HA VAL A 142 0.866 14.707 -1.206 1.00 0.00 H new ATOM 0 HB VAL A 142 3.581 14.651 -2.535 1.00 0.00 H new ATOM 0 HG11 VAL A 142 2.975 12.494 -3.466 1.00 0.00 H new ATOM 0 HG12 VAL A 142 3.114 12.419 -1.693 1.00 0.00 H new ATOM 0 HG13 VAL A 142 1.508 12.453 -2.459 1.00 0.00 H new ATOM 0 HG21 VAL A 142 2.037 14.578 -4.551 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.632 14.590 -3.458 1.00 0.00 H new ATOM 0 HG23 VAL A 142 1.694 16.015 -3.559 1.00 0.00 H new ATOM 2162 N GLN A 143 3.507 14.484 0.662 1.00 0.00 N ATOM 2163 CA GLN A 143 3.909 13.900 1.904 1.00 0.00 C ATOM 2164 C GLN A 143 2.982 14.286 3.004 1.00 0.00 C ATOM 2165 O GLN A 143 2.638 13.418 3.805 1.00 0.00 O ATOM 2166 CB GLN A 143 5.388 14.130 2.261 1.00 0.00 C ATOM 2167 CG GLN A 143 5.950 13.105 3.248 1.00 0.00 C ATOM 2168 CD GLN A 143 7.467 13.232 3.257 1.00 0.00 C ATOM 2169 OE1 GLN A 143 8.105 14.044 2.589 1.00 0.00 O ATOM 2170 NE2 GLN A 143 8.089 12.493 4.214 1.00 0.00 N ATOM 0 H GLN A 143 4.169 15.168 0.294 1.00 0.00 H new ATOM 0 HA GLN A 143 3.833 12.821 1.769 1.00 0.00 H new ATOM 0 HB2 GLN A 143 5.981 14.104 1.347 1.00 0.00 H new ATOM 0 HB3 GLN A 143 5.499 15.128 2.685 1.00 0.00 H new ATOM 0 HG2 GLN A 143 5.548 13.279 4.246 1.00 0.00 H new ATOM 0 HG3 GLN A 143 5.655 12.097 2.957 1.00 0.00 H new ATOM 0 HE21 GLN A 143 7.556 11.821 4.766 1.00 0.00 H new ATOM 0 HE22 GLN A 143 9.088 12.611 4.380 1.00 0.00 H new ATOM 2179 N MET A 144 2.476 15.533 3.016 1.00 0.00 N ATOM 2180 CA MET A 144 1.447 15.956 3.913 1.00 0.00 C ATOM 2181 C MET A 144 0.191 15.166 3.778 1.00 0.00 C ATOM 2182 O MET A 144 -0.366 14.635 4.738 1.00 0.00 O ATOM 2183 CB MET A 144 1.161 17.467 3.963 1.00 0.00 C ATOM 2184 CG MET A 144 0.087 18.019 4.902 1.00 0.00 C ATOM 2185 SD MET A 144 -0.246 19.806 4.961 1.00 0.00 S ATOM 2186 CE MET A 144 -0.984 20.053 3.320 1.00 0.00 C ATOM 0 H MET A 144 2.792 16.268 2.383 1.00 0.00 H new ATOM 0 HA MET A 144 1.885 15.735 4.886 1.00 0.00 H new ATOM 0 HB2 MET A 144 2.097 17.964 4.216 1.00 0.00 H new ATOM 0 HB3 MET A 144 0.897 17.779 2.952 1.00 0.00 H new ATOM 0 HG2 MET A 144 -0.850 17.524 4.648 1.00 0.00 H new ATOM 0 HG3 MET A 144 0.349 17.706 5.913 1.00 0.00 H new ATOM 0 HE1 MET A 144 -1.247 21.103 3.194 1.00 0.00 H new ATOM 0 HE2 MET A 144 -0.267 19.764 2.551 1.00 0.00 H new ATOM 0 HE3 MET A 144 -1.881 19.441 3.229 1.00 0.00 H new ATOM 2196 N MET A 145 -0.279 14.910 2.544 1.00 0.00 N ATOM 2197 CA MET A 145 -1.436 14.116 2.271 1.00 0.00 C ATOM 2198 C MET A 145 -1.567 12.845 3.038 1.00 0.00 C ATOM 2199 O MET A 145 -2.603 12.421 3.547 1.00 0.00 O ATOM 2200 CB MET A 145 -1.656 13.830 0.776 1.00 0.00 C ATOM 2201 CG MET A 145 -2.278 15.098 0.188 1.00 0.00 C ATOM 2202 SD MET A 145 -2.655 14.826 -1.569 1.00 0.00 S ATOM 2203 CE MET A 145 -4.042 15.974 -1.806 1.00 0.00 C ATOM 0 H MET A 145 0.167 15.272 1.701 1.00 0.00 H new ATOM 0 HA MET A 145 -2.225 14.775 2.634 1.00 0.00 H new ATOM 0 HB2 MET A 145 -0.714 13.593 0.282 1.00 0.00 H new ATOM 0 HB3 MET A 145 -2.314 12.972 0.636 1.00 0.00 H new ATOM 0 HG2 MET A 145 -3.187 15.356 0.731 1.00 0.00 H new ATOM 0 HG3 MET A 145 -1.592 15.938 0.298 1.00 0.00 H new ATOM 0 HE1 MET A 145 -4.122 16.235 -2.861 1.00 0.00 H new ATOM 0 HE2 MET A 145 -4.967 15.500 -1.478 1.00 0.00 H new ATOM 0 HE3 MET A 145 -3.871 16.877 -1.221 1.00 0.00 H new