USER MOD reduce.3.24.130724 H: found=0, std=0, add=792, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 790 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 33:sc= 0.516 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -140:sc= -0.845 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -139:sc= -0.537 (180deg=-2.44!) USER MOD Single : A 10 GLN : amide:sc= -0.374 K(o=-0.37,f=-2.8!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.0993 K(o=-0.099,f=-1.5) USER MOD Single : A 19 LYS NZ :NH3+ -144:sc= 0.297 (180deg=-0.03) USER MOD Single : A 20 CYS SG : rot -176:sc= -2.18 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.236 K(o=-0.24,f=-1.7!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot -20:sc= -2.42! USER MOD Single : A 59 SER OG : rot -60:sc= 0.0152 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 165:sc= -0.0139 (180deg=-0.299) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.710 -19.196 13.930 1.00 0.00 N ATOM 2 CA GLY A 1 2.818 -18.390 15.134 1.00 0.00 C ATOM 3 C GLY A 1 2.139 -17.031 14.948 1.00 0.00 C ATOM 4 O GLY A 1 0.952 -16.882 15.235 1.00 0.00 O ATOM 0 H1 GLY A 1 3.178 -20.112 14.082 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.707 -19.353 13.706 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.168 -18.701 13.138 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.360 -18.917 15.971 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.869 -18.244 15.385 1.00 0.00 H new ATOM 8 N SER A 2 2.921 -16.075 14.468 1.00 0.00 N ATOM 9 CA SER A 2 2.411 -14.734 14.241 1.00 0.00 C ATOM 10 C SER A 2 2.249 -14.484 12.740 1.00 0.00 C ATOM 11 O SER A 2 3.230 -14.477 11.999 1.00 0.00 O ATOM 12 CB SER A 2 3.333 -13.681 14.858 1.00 0.00 C ATOM 13 OG SER A 2 4.612 -13.659 14.231 1.00 0.00 O ATOM 0 H SER A 2 3.905 -16.203 14.230 1.00 0.00 H new ATOM 0 HA SER A 2 1.438 -14.652 14.725 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.870 -12.698 14.772 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.454 -13.884 15.922 1.00 0.00 H new ATOM 0 HG SER A 2 4.515 -13.884 13.282 1.00 0.00 H new ATOM 19 N SER A 3 1.002 -14.285 12.337 1.00 0.00 N ATOM 20 CA SER A 3 0.699 -14.035 10.938 1.00 0.00 C ATOM 21 C SER A 3 -0.428 -13.007 10.822 1.00 0.00 C ATOM 22 O SER A 3 -1.349 -12.997 11.637 1.00 0.00 O ATOM 23 CB SER A 3 0.313 -15.329 10.218 1.00 0.00 C ATOM 24 OG SER A 3 1.113 -15.555 9.060 1.00 0.00 O ATOM 0 H SER A 3 0.190 -14.292 12.955 1.00 0.00 H new ATOM 0 HA SER A 3 1.595 -13.638 10.460 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.420 -16.170 10.902 1.00 0.00 H new ATOM 0 HB3 SER A 3 -0.737 -15.284 9.930 1.00 0.00 H new ATOM 0 HG SER A 3 0.837 -16.391 8.630 1.00 0.00 H new ATOM 30 N GLY A 4 -0.317 -12.167 9.803 1.00 0.00 N ATOM 31 CA GLY A 4 -1.316 -11.137 9.571 1.00 0.00 C ATOM 32 C GLY A 4 -1.512 -10.893 8.073 1.00 0.00 C ATOM 33 O GLY A 4 -1.279 -9.788 7.585 1.00 0.00 O ATOM 0 H GLY A 4 0.449 -12.179 9.129 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -2.263 -11.435 10.022 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.009 -10.211 10.057 1.00 0.00 H new ATOM 37 N SER A 5 -1.939 -11.942 7.386 1.00 0.00 N ATOM 38 CA SER A 5 -2.170 -11.854 5.954 1.00 0.00 C ATOM 39 C SER A 5 -1.064 -11.026 5.295 1.00 0.00 C ATOM 40 O SER A 5 -1.252 -9.843 5.016 1.00 0.00 O ATOM 41 CB SER A 5 -3.540 -11.245 5.652 1.00 0.00 C ATOM 42 OG SER A 5 -3.869 -11.327 4.268 1.00 0.00 O ATOM 0 H SER A 5 -2.131 -12.857 7.794 1.00 0.00 H new ATOM 0 HA SER A 5 -2.154 -12.864 5.543 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.302 -11.760 6.237 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.549 -10.201 5.965 1.00 0.00 H new ATOM 0 HG SER A 5 -4.309 -10.498 3.987 1.00 0.00 H new ATOM 48 N SER A 6 0.064 -11.681 5.066 1.00 0.00 N ATOM 49 CA SER A 6 1.200 -11.021 4.445 1.00 0.00 C ATOM 50 C SER A 6 0.961 -10.871 2.941 1.00 0.00 C ATOM 51 O SER A 6 -0.095 -11.250 2.436 1.00 0.00 O ATOM 52 CB SER A 6 2.495 -11.794 4.702 1.00 0.00 C ATOM 53 OG SER A 6 2.402 -13.149 4.272 1.00 0.00 O ATOM 0 H SER A 6 0.216 -12.662 5.299 1.00 0.00 H new ATOM 0 HA SER A 6 1.305 -10.032 4.890 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.319 -11.304 4.182 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.728 -11.767 5.766 1.00 0.00 H new ATOM 0 HG SER A 6 3.249 -13.608 4.452 1.00 0.00 H new ATOM 59 N GLY A 7 1.959 -10.317 2.268 1.00 0.00 N ATOM 60 CA GLY A 7 1.870 -10.113 0.832 1.00 0.00 C ATOM 61 C GLY A 7 0.812 -9.062 0.493 1.00 0.00 C ATOM 62 O GLY A 7 1.144 -7.915 0.194 1.00 0.00 O ATOM 0 H GLY A 7 2.833 -10.003 2.690 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.839 -9.797 0.445 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.623 -11.055 0.342 1.00 0.00 H new ATOM 66 N LEU A 8 -0.441 -9.489 0.550 1.00 0.00 N ATOM 67 CA LEU A 8 -1.550 -8.599 0.252 1.00 0.00 C ATOM 68 C LEU A 8 -1.275 -7.225 0.867 1.00 0.00 C ATOM 69 O LEU A 8 -1.116 -6.240 0.147 1.00 0.00 O ATOM 70 CB LEU A 8 -2.873 -9.221 0.704 1.00 0.00 C ATOM 71 CG LEU A 8 -3.404 -10.368 -0.159 1.00 0.00 C ATOM 72 CD1 LEU A 8 -4.619 -11.029 0.496 1.00 0.00 C ATOM 73 CD2 LEU A 8 -3.708 -9.890 -1.580 1.00 0.00 C ATOM 0 H LEU A 8 -0.713 -10.440 0.798 1.00 0.00 H new ATOM 0 HA LEU A 8 -1.644 -8.454 -0.824 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.750 -9.586 1.724 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.629 -8.436 0.735 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.626 -11.127 -0.235 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.977 -11.841 -0.137 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -4.336 -11.427 1.470 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.411 -10.291 0.622 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -4.084 -10.725 -2.172 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -4.460 -9.102 -1.546 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.797 -9.503 -2.036 1.00 0.00 H new ATOM 85 N LYS A 9 -1.227 -7.203 2.190 1.00 0.00 N ATOM 86 CA LYS A 9 -0.974 -5.967 2.910 1.00 0.00 C ATOM 87 C LYS A 9 0.105 -5.167 2.177 1.00 0.00 C ATOM 88 O LYS A 9 -0.145 -4.052 1.722 1.00 0.00 O ATOM 89 CB LYS A 9 -0.636 -6.258 4.373 1.00 0.00 C ATOM 90 CG LYS A 9 -1.157 -5.147 5.288 1.00 0.00 C ATOM 91 CD LYS A 9 -0.102 -4.747 6.321 1.00 0.00 C ATOM 92 CE LYS A 9 0.744 -3.577 5.815 1.00 0.00 C ATOM 93 NZ LYS A 9 1.832 -4.066 4.938 1.00 0.00 N ATOM 0 H LYS A 9 -1.359 -8.022 2.783 1.00 0.00 H new ATOM 0 HA LYS A 9 -1.871 -5.349 2.932 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -1.073 -7.212 4.668 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.444 -6.353 4.489 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.433 -4.278 4.690 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -2.060 -5.484 5.797 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -0.590 -4.470 7.256 1.00 0.00 H new ATOM 0 HD3 LYS A 9 0.542 -5.599 6.537 1.00 0.00 H new ATOM 0 HE2 LYS A 9 0.115 -2.875 5.267 1.00 0.00 H new ATOM 0 HE3 LYS A 9 1.166 -3.034 6.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.707 -3.544 5.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 1.986 -5.080 5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 1.569 -3.918 3.943 1.00 0.00 H new ATOM 107 N GLN A 10 1.282 -5.768 2.085 1.00 0.00 N ATOM 108 CA GLN A 10 2.400 -5.126 1.416 1.00 0.00 C ATOM 109 C GLN A 10 1.990 -4.674 0.012 1.00 0.00 C ATOM 110 O GLN A 10 2.149 -3.506 -0.339 1.00 0.00 O ATOM 111 CB GLN A 10 3.614 -6.056 1.359 1.00 0.00 C ATOM 112 CG GLN A 10 4.902 -5.297 1.682 1.00 0.00 C ATOM 113 CD GLN A 10 5.771 -5.136 0.432 1.00 0.00 C ATOM 114 OE1 GLN A 10 5.571 -5.783 -0.582 1.00 0.00 O ATOM 115 NE2 GLN A 10 6.745 -4.240 0.562 1.00 0.00 N ATOM 0 H GLN A 10 1.486 -6.693 2.463 1.00 0.00 H new ATOM 0 HA GLN A 10 2.685 -4.246 1.992 1.00 0.00 H new ATOM 0 HB2 GLN A 10 3.483 -6.875 2.067 1.00 0.00 H new ATOM 0 HB3 GLN A 10 3.689 -6.501 0.367 1.00 0.00 H new ATOM 0 HG2 GLN A 10 4.658 -4.316 2.089 1.00 0.00 H new ATOM 0 HG3 GLN A 10 5.460 -5.831 2.451 1.00 0.00 H new ATOM 0 HE21 GLN A 10 6.857 -3.732 1.440 1.00 0.00 H new ATOM 0 HE22 GLN A 10 7.380 -4.060 -0.216 1.00 0.00 H new ATOM 124 N LYS A 11 1.470 -5.624 -0.752 1.00 0.00 N ATOM 125 CA LYS A 11 1.036 -5.338 -2.109 1.00 0.00 C ATOM 126 C LYS A 11 0.209 -4.051 -2.115 1.00 0.00 C ATOM 127 O LYS A 11 0.552 -3.092 -2.804 1.00 0.00 O ATOM 128 CB LYS A 11 0.303 -6.543 -2.701 1.00 0.00 C ATOM 129 CG LYS A 11 1.279 -7.679 -3.017 1.00 0.00 C ATOM 130 CD LYS A 11 0.657 -9.040 -2.702 1.00 0.00 C ATOM 131 CE LYS A 11 0.693 -9.956 -3.927 1.00 0.00 C ATOM 132 NZ LYS A 11 0.853 -11.368 -3.514 1.00 0.00 N ATOM 0 H LYS A 11 1.340 -6.592 -0.457 1.00 0.00 H new ATOM 0 HA LYS A 11 1.896 -5.167 -2.756 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -0.453 -6.894 -1.999 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.220 -6.245 -3.610 1.00 0.00 H new ATOM 0 HG2 LYS A 11 1.561 -7.639 -4.069 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.193 -7.550 -2.437 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.195 -9.508 -1.878 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.374 -8.906 -2.374 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.226 -9.841 -4.502 1.00 0.00 H new ATOM 0 HE3 LYS A 11 1.516 -9.667 -4.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 0.876 -11.976 -4.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 1.742 -11.476 -2.985 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 0.054 -11.645 -2.909 1.00 0.00 H new ATOM 146 N VAL A 12 -0.865 -4.073 -1.339 1.00 0.00 N ATOM 147 CA VAL A 12 -1.744 -2.919 -1.247 1.00 0.00 C ATOM 148 C VAL A 12 -0.934 -1.701 -0.800 1.00 0.00 C ATOM 149 O VAL A 12 -1.019 -0.637 -1.411 1.00 0.00 O ATOM 150 CB VAL A 12 -2.919 -3.230 -0.317 1.00 0.00 C ATOM 151 CG1 VAL A 12 -3.918 -2.071 -0.289 1.00 0.00 C ATOM 152 CG2 VAL A 12 -3.606 -4.536 -0.719 1.00 0.00 C ATOM 0 H VAL A 12 -1.146 -4.871 -0.769 1.00 0.00 H new ATOM 0 HA VAL A 12 -2.171 -2.685 -2.222 1.00 0.00 H new ATOM 0 HB VAL A 12 -2.524 -3.356 0.691 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -4.743 -2.318 0.379 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -3.420 -1.170 0.067 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -4.304 -1.899 -1.294 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -4.437 -4.733 -0.042 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -3.981 -4.451 -1.739 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -2.890 -5.356 -0.663 1.00 0.00 H new ATOM 162 N GLU A 13 -0.168 -1.897 0.263 1.00 0.00 N ATOM 163 CA GLU A 13 0.657 -0.827 0.799 1.00 0.00 C ATOM 164 C GLU A 13 1.343 -0.066 -0.337 1.00 0.00 C ATOM 165 O GLU A 13 1.283 1.162 -0.391 1.00 0.00 O ATOM 166 CB GLU A 13 1.685 -1.373 1.792 1.00 0.00 C ATOM 167 CG GLU A 13 1.164 -1.279 3.228 1.00 0.00 C ATOM 168 CD GLU A 13 0.984 0.181 3.652 1.00 0.00 C ATOM 169 OE1 GLU A 13 1.582 1.045 2.975 1.00 0.00 O ATOM 170 OE2 GLU A 13 0.254 0.398 4.642 1.00 0.00 O ATOM 0 H GLU A 13 -0.101 -2.781 0.768 1.00 0.00 H new ATOM 0 HA GLU A 13 0.013 -0.133 1.338 1.00 0.00 H new ATOM 0 HB2 GLU A 13 1.913 -2.411 1.551 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.616 -0.813 1.702 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.213 -1.805 3.309 1.00 0.00 H new ATOM 0 HG3 GLU A 13 1.860 -1.775 3.904 1.00 0.00 H new ATOM 177 N ASN A 14 1.978 -0.826 -1.217 1.00 0.00 N ATOM 178 CA ASN A 14 2.675 -0.238 -2.348 1.00 0.00 C ATOM 179 C ASN A 14 1.660 0.444 -3.268 1.00 0.00 C ATOM 180 O ASN A 14 1.848 1.594 -3.662 1.00 0.00 O ATOM 181 CB ASN A 14 3.406 -1.308 -3.161 1.00 0.00 C ATOM 182 CG ASN A 14 4.920 -1.089 -3.120 1.00 0.00 C ATOM 183 OD1 ASN A 14 5.462 -0.196 -3.751 1.00 0.00 O ATOM 184 ND2 ASN A 14 5.570 -1.951 -2.343 1.00 0.00 N ATOM 0 H ASN A 14 2.024 -1.844 -1.170 1.00 0.00 H new ATOM 0 HA ASN A 14 3.399 0.479 -1.962 1.00 0.00 H new ATOM 0 HB2 ASN A 14 3.167 -2.296 -2.767 1.00 0.00 H new ATOM 0 HB3 ASN A 14 3.059 -1.285 -4.194 1.00 0.00 H new ATOM 0 HD21 ASN A 14 6.584 -1.888 -2.248 1.00 0.00 H new ATOM 0 HD22 ASN A 14 5.055 -2.675 -1.842 1.00 0.00 H new ATOM 191 N LEU A 15 0.606 -0.295 -3.584 1.00 0.00 N ATOM 192 CA LEU A 15 -0.439 0.223 -4.451 1.00 0.00 C ATOM 193 C LEU A 15 -0.723 1.681 -4.083 1.00 0.00 C ATOM 194 O LEU A 15 -0.408 2.591 -4.848 1.00 0.00 O ATOM 195 CB LEU A 15 -1.674 -0.677 -4.397 1.00 0.00 C ATOM 196 CG LEU A 15 -3.020 0.018 -4.617 1.00 0.00 C ATOM 197 CD1 LEU A 15 -3.092 0.645 -6.010 1.00 0.00 C ATOM 198 CD2 LEU A 15 -4.182 -0.945 -4.360 1.00 0.00 C ATOM 0 H LEU A 15 0.453 -1.248 -3.255 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.112 0.214 -5.491 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.563 -1.458 -5.149 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.697 -1.171 -3.426 1.00 0.00 H new ATOM 0 HG LEU A 15 -3.108 0.829 -3.895 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.058 1.132 -6.140 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.296 1.382 -6.119 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -2.973 -0.132 -6.765 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -5.127 -0.427 -4.523 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.110 -1.792 -5.042 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.137 -1.303 -3.331 1.00 0.00 H new ATOM 210 N PHE A 16 -1.317 1.857 -2.911 1.00 0.00 N ATOM 211 CA PHE A 16 -1.647 3.189 -2.433 1.00 0.00 C ATOM 212 C PHE A 16 -0.495 4.163 -2.684 1.00 0.00 C ATOM 213 O PHE A 16 -0.675 5.188 -3.340 1.00 0.00 O ATOM 214 CB PHE A 16 -1.886 3.076 -0.926 1.00 0.00 C ATOM 215 CG PHE A 16 -3.108 2.235 -0.551 1.00 0.00 C ATOM 216 CD1 PHE A 16 -4.222 2.269 -1.330 1.00 0.00 C ATOM 217 CD2 PHE A 16 -3.080 1.455 0.563 1.00 0.00 C ATOM 218 CE1 PHE A 16 -5.356 1.489 -0.982 1.00 0.00 C ATOM 219 CE2 PHE A 16 -4.214 0.674 0.911 1.00 0.00 C ATOM 220 CZ PHE A 16 -5.328 0.708 0.132 1.00 0.00 C ATOM 0 H PHE A 16 -1.578 1.100 -2.279 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.525 3.566 -2.957 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.002 2.641 -0.460 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -2.006 4.077 -0.511 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -4.244 2.890 -2.214 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -2.196 1.430 1.183 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.241 1.515 -1.601 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -4.192 0.053 1.794 1.00 0.00 H new ATOM 0 HZ PHE A 16 -6.191 0.115 0.397 1.00 0.00 H new ATOM 230 N ASN A 17 0.664 3.810 -2.148 1.00 0.00 N ATOM 231 CA ASN A 17 1.846 4.640 -2.305 1.00 0.00 C ATOM 232 C ASN A 17 2.044 4.962 -3.787 1.00 0.00 C ATOM 233 O ASN A 17 2.205 6.124 -4.158 1.00 0.00 O ATOM 234 CB ASN A 17 3.098 3.916 -1.806 1.00 0.00 C ATOM 235 CG ASN A 17 3.544 4.464 -0.449 1.00 0.00 C ATOM 236 OD1 ASN A 17 4.560 5.128 -0.322 1.00 0.00 O ATOM 237 ND2 ASN A 17 2.731 4.149 0.555 1.00 0.00 N ATOM 0 H ASN A 17 0.810 2.960 -1.604 1.00 0.00 H new ATOM 0 HA ASN A 17 1.700 5.549 -1.722 1.00 0.00 H new ATOM 0 HB2 ASN A 17 2.896 2.848 -1.722 1.00 0.00 H new ATOM 0 HB3 ASN A 17 3.903 4.032 -2.532 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.942 4.467 1.501 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.896 3.590 0.379 1.00 0.00 H new ATOM 244 N GLU A 18 2.026 3.912 -4.595 1.00 0.00 N ATOM 245 CA GLU A 18 2.203 4.068 -6.029 1.00 0.00 C ATOM 246 C GLU A 18 1.257 5.145 -6.566 1.00 0.00 C ATOM 247 O GLU A 18 1.692 6.076 -7.242 1.00 0.00 O ATOM 248 CB GLU A 18 1.989 2.739 -6.756 1.00 0.00 C ATOM 249 CG GLU A 18 3.065 1.723 -6.368 1.00 0.00 C ATOM 250 CD GLU A 18 2.610 0.296 -6.683 1.00 0.00 C ATOM 251 OE1 GLU A 18 1.438 0.151 -7.092 1.00 0.00 O ATOM 252 OE2 GLU A 18 3.445 -0.617 -6.507 1.00 0.00 O ATOM 0 H GLU A 18 1.892 2.950 -4.284 1.00 0.00 H new ATOM 0 HA GLU A 18 3.229 4.386 -6.216 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.004 2.342 -6.512 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.009 2.902 -7.834 1.00 0.00 H new ATOM 0 HG2 GLU A 18 3.988 1.942 -6.906 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.287 1.811 -5.305 1.00 0.00 H new ATOM 259 N LYS A 19 -0.018 4.981 -6.245 1.00 0.00 N ATOM 260 CA LYS A 19 -1.028 5.928 -6.686 1.00 0.00 C ATOM 261 C LYS A 19 -0.632 7.336 -6.237 1.00 0.00 C ATOM 262 O LYS A 19 -0.724 8.287 -7.012 1.00 0.00 O ATOM 263 CB LYS A 19 -2.414 5.495 -6.204 1.00 0.00 C ATOM 264 CG LYS A 19 -2.786 4.121 -6.766 1.00 0.00 C ATOM 265 CD LYS A 19 -2.799 4.139 -8.296 1.00 0.00 C ATOM 266 CE LYS A 19 -4.085 3.515 -8.840 1.00 0.00 C ATOM 267 NZ LYS A 19 -4.010 3.374 -10.312 1.00 0.00 N ATOM 0 H LYS A 19 -0.375 4.207 -5.685 1.00 0.00 H new ATOM 0 HA LYS A 19 -1.085 5.945 -7.774 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.430 5.463 -5.115 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -3.156 6.231 -6.512 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.074 3.375 -6.414 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -3.767 3.826 -6.394 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -2.710 5.165 -8.652 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -1.936 3.593 -8.677 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -4.244 2.538 -8.383 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.940 4.136 -8.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -4.948 3.549 -10.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -3.330 4.063 -10.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -3.700 2.411 -10.553 1.00 0.00 H new ATOM 281 N CYS A 20 -0.201 7.425 -4.988 1.00 0.00 N ATOM 282 CA CYS A 20 0.209 8.701 -4.426 1.00 0.00 C ATOM 283 C CYS A 20 1.020 9.452 -5.484 1.00 0.00 C ATOM 284 O CYS A 20 0.564 10.462 -6.019 1.00 0.00 O ATOM 285 CB CYS A 20 0.995 8.520 -3.126 1.00 0.00 C ATOM 286 SG CYS A 20 1.109 10.116 -2.237 1.00 0.00 S ATOM 0 H CYS A 20 -0.127 6.634 -4.348 1.00 0.00 H new ATOM 0 HA CYS A 20 -0.672 9.286 -4.162 1.00 0.00 H new ATOM 0 HB2 CYS A 20 0.506 7.777 -2.496 1.00 0.00 H new ATOM 0 HB3 CYS A 20 1.994 8.144 -3.345 1.00 0.00 H new ATOM 0 HG CYS A 20 1.849 9.971 -1.178 1.00 0.00 H new ATOM 292 N GLY A 21 2.208 8.931 -5.753 1.00 0.00 N ATOM 293 CA GLY A 21 3.086 9.541 -6.737 1.00 0.00 C ATOM 294 C GLY A 21 2.381 9.685 -8.087 1.00 0.00 C ATOM 295 O GLY A 21 2.334 10.775 -8.654 1.00 0.00 O ATOM 0 H GLY A 21 2.583 8.094 -5.307 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.408 10.521 -6.384 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.984 8.934 -6.854 1.00 0.00 H new ATOM 299 N GLU A 22 1.850 8.568 -8.564 1.00 0.00 N ATOM 300 CA GLU A 22 1.150 8.556 -9.837 1.00 0.00 C ATOM 301 C GLU A 22 0.220 9.766 -9.942 1.00 0.00 C ATOM 302 O GLU A 22 0.116 10.384 -11.001 1.00 0.00 O ATOM 303 CB GLU A 22 0.374 7.251 -10.023 1.00 0.00 C ATOM 304 CG GLU A 22 0.861 6.496 -11.262 1.00 0.00 C ATOM 305 CD GLU A 22 0.369 7.171 -12.544 1.00 0.00 C ATOM 306 OE1 GLU A 22 -0.762 6.842 -12.961 1.00 0.00 O ATOM 307 OE2 GLU A 22 1.136 8.002 -13.078 1.00 0.00 O ATOM 0 H GLU A 22 1.891 7.665 -8.091 1.00 0.00 H new ATOM 0 HA GLU A 22 1.888 8.619 -10.636 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.494 6.623 -9.140 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.690 7.467 -10.119 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.950 6.456 -11.263 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.504 5.467 -11.229 1.00 0.00 H new ATOM 314 N ALA A 23 -0.434 10.069 -8.830 1.00 0.00 N ATOM 315 CA ALA A 23 -1.351 11.195 -8.784 1.00 0.00 C ATOM 316 C ALA A 23 -0.633 12.454 -9.274 1.00 0.00 C ATOM 317 O ALA A 23 -1.076 13.095 -10.226 1.00 0.00 O ATOM 318 CB ALA A 23 -1.897 11.351 -7.363 1.00 0.00 C ATOM 0 H ALA A 23 -0.347 9.554 -7.954 1.00 0.00 H new ATOM 0 HA ALA A 23 -2.202 11.024 -9.444 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -2.585 12.196 -7.328 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -2.424 10.442 -7.074 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -1.071 11.527 -6.673 1.00 0.00 H new ATOM 324 N LEU A 24 0.464 12.770 -8.602 1.00 0.00 N ATOM 325 CA LEU A 24 1.248 13.941 -8.958 1.00 0.00 C ATOM 326 C LEU A 24 1.968 13.684 -10.283 1.00 0.00 C ATOM 327 O LEU A 24 2.468 14.615 -10.912 1.00 0.00 O ATOM 328 CB LEU A 24 2.187 14.325 -7.812 1.00 0.00 C ATOM 329 CG LEU A 24 1.515 14.675 -6.483 1.00 0.00 C ATOM 330 CD1 LEU A 24 1.792 13.600 -5.429 1.00 0.00 C ATOM 331 CD2 LEU A 24 1.934 16.067 -6.006 1.00 0.00 C ATOM 0 H LEU A 24 0.829 12.236 -7.813 1.00 0.00 H new ATOM 0 HA LEU A 24 0.598 14.803 -9.110 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.876 13.498 -7.641 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.786 15.179 -8.130 1.00 0.00 H new ATOM 0 HG LEU A 24 0.437 14.701 -6.642 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.303 13.873 -4.494 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.404 12.642 -5.775 1.00 0.00 H new ATOM 0 HD13 LEU A 24 2.867 13.518 -5.266 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.442 16.291 -5.059 1.00 0.00 H new ATOM 0 HD22 LEU A 24 3.015 16.094 -5.868 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.644 16.809 -6.750 1.00 0.00 H new ATOM 343 N GLY A 25 1.997 12.416 -10.668 1.00 0.00 N ATOM 344 CA GLY A 25 2.647 12.025 -11.907 1.00 0.00 C ATOM 345 C GLY A 25 4.150 11.830 -11.700 1.00 0.00 C ATOM 346 O GLY A 25 4.955 12.630 -12.175 1.00 0.00 O ATOM 0 H GLY A 25 1.581 11.647 -10.143 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.204 11.101 -12.278 1.00 0.00 H new ATOM 0 HA3 GLY A 25 2.477 12.787 -12.667 1.00 0.00 H new ATOM 350 N LEU A 26 4.484 10.762 -10.989 1.00 0.00 N ATOM 351 CA LEU A 26 5.876 10.452 -10.713 1.00 0.00 C ATOM 352 C LEU A 26 6.172 9.018 -11.156 1.00 0.00 C ATOM 353 O LEU A 26 5.253 8.247 -11.429 1.00 0.00 O ATOM 354 CB LEU A 26 6.204 10.722 -9.243 1.00 0.00 C ATOM 355 CG LEU A 26 5.980 12.156 -8.758 1.00 0.00 C ATOM 356 CD1 LEU A 26 6.289 12.284 -7.265 1.00 0.00 C ATOM 357 CD2 LEU A 26 6.785 13.150 -9.598 1.00 0.00 C ATOM 0 H LEU A 26 3.814 10.101 -10.596 1.00 0.00 H new ATOM 0 HA LEU A 26 6.533 11.105 -11.287 1.00 0.00 H new ATOM 0 HB2 LEU A 26 5.602 10.053 -8.628 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.248 10.460 -9.070 1.00 0.00 H new ATOM 0 HG LEU A 26 4.926 12.402 -8.890 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.122 13.313 -6.946 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.637 11.618 -6.700 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.329 12.012 -7.084 1.00 0.00 H new ATOM 0 HD21 LEU A 26 6.608 14.162 -9.233 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.847 12.916 -9.520 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.474 13.081 -10.640 1.00 0.00 H new ATOM 369 N LYS A 27 7.458 8.703 -11.213 1.00 0.00 N ATOM 370 CA LYS A 27 7.886 7.375 -11.618 1.00 0.00 C ATOM 371 C LYS A 27 8.198 6.543 -10.373 1.00 0.00 C ATOM 372 O LYS A 27 8.789 5.469 -10.472 1.00 0.00 O ATOM 373 CB LYS A 27 9.052 7.466 -12.605 1.00 0.00 C ATOM 374 CG LYS A 27 8.570 7.262 -14.043 1.00 0.00 C ATOM 375 CD LYS A 27 9.729 6.863 -14.958 1.00 0.00 C ATOM 376 CE LYS A 27 10.277 8.078 -15.709 1.00 0.00 C ATOM 377 NZ LYS A 27 10.885 7.663 -16.993 1.00 0.00 N ATOM 0 H LYS A 27 8.217 9.345 -10.985 1.00 0.00 H new ATOM 0 HA LYS A 27 7.086 6.863 -12.152 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.535 8.439 -12.514 1.00 0.00 H new ATOM 0 HB3 LYS A 27 9.801 6.714 -12.359 1.00 0.00 H new ATOM 0 HG2 LYS A 27 7.801 6.490 -14.067 1.00 0.00 H new ATOM 0 HG3 LYS A 27 8.111 8.180 -14.410 1.00 0.00 H new ATOM 0 HD2 LYS A 27 10.524 6.407 -14.367 1.00 0.00 H new ATOM 0 HD3 LYS A 27 9.392 6.111 -15.672 1.00 0.00 H new ATOM 0 HE2 LYS A 27 9.474 8.791 -15.894 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.020 8.587 -15.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 11.252 8.500 -17.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 11.665 7.000 -16.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 10.166 7.198 -17.583 1.00 0.00 H new ATOM 391 N GLN A 28 7.788 7.071 -9.229 1.00 0.00 N ATOM 392 CA GLN A 28 8.016 6.390 -7.966 1.00 0.00 C ATOM 393 C GLN A 28 6.775 6.490 -7.077 1.00 0.00 C ATOM 394 O GLN A 28 5.787 7.119 -7.453 1.00 0.00 O ATOM 395 CB GLN A 28 9.247 6.954 -7.254 1.00 0.00 C ATOM 396 CG GLN A 28 9.063 8.439 -6.935 1.00 0.00 C ATOM 397 CD GLN A 28 9.494 8.749 -5.500 1.00 0.00 C ATOM 398 OE1 GLN A 28 10.187 7.982 -4.853 1.00 0.00 O ATOM 399 NE2 GLN A 28 9.044 9.914 -5.040 1.00 0.00 N ATOM 0 H GLN A 28 7.299 7.963 -9.150 1.00 0.00 H new ATOM 0 HA GLN A 28 8.207 5.337 -8.173 1.00 0.00 H new ATOM 0 HB2 GLN A 28 9.424 6.400 -6.332 1.00 0.00 H new ATOM 0 HB3 GLN A 28 10.128 6.820 -7.882 1.00 0.00 H new ATOM 0 HG2 GLN A 28 9.648 9.039 -7.632 1.00 0.00 H new ATOM 0 HG3 GLN A 28 8.018 8.718 -7.073 1.00 0.00 H new ATOM 0 HE21 GLN A 28 8.468 10.509 -5.635 1.00 0.00 H new ATOM 0 HE22 GLN A 28 9.276 10.212 -4.092 1.00 0.00 H new ATOM 408 N ALA A 29 6.866 5.860 -5.915 1.00 0.00 N ATOM 409 CA ALA A 29 5.762 5.870 -4.970 1.00 0.00 C ATOM 410 C ALA A 29 5.948 7.028 -3.988 1.00 0.00 C ATOM 411 O ALA A 29 7.022 7.624 -3.921 1.00 0.00 O ATOM 412 CB ALA A 29 5.682 4.514 -4.264 1.00 0.00 C ATOM 0 H ALA A 29 7.687 5.339 -5.606 1.00 0.00 H new ATOM 0 HA ALA A 29 4.815 6.025 -5.487 1.00 0.00 H new ATOM 0 HB1 ALA A 29 4.854 4.521 -3.555 1.00 0.00 H new ATOM 0 HB2 ALA A 29 5.521 3.728 -5.002 1.00 0.00 H new ATOM 0 HB3 ALA A 29 6.614 4.326 -3.731 1.00 0.00 H new ATOM 418 N VAL A 30 4.885 7.312 -3.249 1.00 0.00 N ATOM 419 CA VAL A 30 4.918 8.389 -2.274 1.00 0.00 C ATOM 420 C VAL A 30 3.978 8.050 -1.115 1.00 0.00 C ATOM 421 O VAL A 30 2.791 7.804 -1.326 1.00 0.00 O ATOM 422 CB VAL A 30 4.578 9.718 -2.950 1.00 0.00 C ATOM 423 CG1 VAL A 30 4.722 10.885 -1.970 1.00 0.00 C ATOM 424 CG2 VAL A 30 5.441 9.937 -4.194 1.00 0.00 C ATOM 0 H VAL A 30 3.996 6.815 -3.306 1.00 0.00 H new ATOM 0 HA VAL A 30 5.920 8.498 -1.859 1.00 0.00 H new ATOM 0 HB VAL A 30 3.536 9.675 -3.268 1.00 0.00 H new ATOM 0 HG11 VAL A 30 4.474 11.818 -2.476 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.046 10.739 -1.128 1.00 0.00 H new ATOM 0 HG13 VAL A 30 5.749 10.931 -1.607 1.00 0.00 H new ATOM 0 HG21 VAL A 30 5.179 10.889 -4.656 1.00 0.00 H new ATOM 0 HG22 VAL A 30 6.493 9.949 -3.909 1.00 0.00 H new ATOM 0 HG23 VAL A 30 5.267 9.129 -4.905 1.00 0.00 H new ATOM 434 N LYS A 31 4.543 8.048 0.083 1.00 0.00 N ATOM 435 CA LYS A 31 3.771 7.744 1.275 1.00 0.00 C ATOM 436 C LYS A 31 2.416 8.450 1.194 1.00 0.00 C ATOM 437 O LYS A 31 2.356 9.666 1.018 1.00 0.00 O ATOM 438 CB LYS A 31 4.569 8.087 2.534 1.00 0.00 C ATOM 439 CG LYS A 31 4.434 6.986 3.587 1.00 0.00 C ATOM 440 CD LYS A 31 4.503 7.568 5.001 1.00 0.00 C ATOM 441 CE LYS A 31 4.822 6.479 6.027 1.00 0.00 C ATOM 442 NZ LYS A 31 4.080 6.719 7.285 1.00 0.00 N ATOM 0 H LYS A 31 5.528 8.252 0.254 1.00 0.00 H new ATOM 0 HA LYS A 31 3.571 6.674 1.335 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.620 8.222 2.277 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.217 9.033 2.945 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.488 6.462 3.451 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.228 6.251 3.453 1.00 0.00 H new ATOM 0 HD2 LYS A 31 5.266 8.345 5.041 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.553 8.041 5.250 1.00 0.00 H new ATOM 0 HE2 LYS A 31 4.558 5.502 5.623 1.00 0.00 H new ATOM 0 HE3 LYS A 31 5.893 6.462 6.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 4.308 5.971 7.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.352 7.643 7.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 3.058 6.712 7.092 1.00 0.00 H new ATOM 456 N VAL A 32 1.362 7.658 1.326 1.00 0.00 N ATOM 457 CA VAL A 32 0.012 8.193 1.270 1.00 0.00 C ATOM 458 C VAL A 32 -0.227 9.089 2.487 1.00 0.00 C ATOM 459 O VAL A 32 -0.266 8.609 3.618 1.00 0.00 O ATOM 460 CB VAL A 32 -0.999 7.051 1.161 1.00 0.00 C ATOM 461 CG1 VAL A 32 -2.431 7.571 1.297 1.00 0.00 C ATOM 462 CG2 VAL A 32 -0.818 6.281 -0.149 1.00 0.00 C ATOM 0 H VAL A 32 1.416 6.650 1.472 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.118 8.810 0.381 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.814 6.361 1.984 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -3.130 6.738 1.216 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.552 8.053 2.267 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -2.633 8.293 0.505 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -1.549 5.474 -0.201 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.963 6.957 -0.992 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.187 5.862 -0.189 1.00 0.00 H new ATOM 472 N PRO A 33 -0.386 10.410 2.206 1.00 0.00 N ATOM 473 CA PRO A 33 -0.621 11.378 3.264 1.00 0.00 C ATOM 474 C PRO A 33 -2.056 11.281 3.786 1.00 0.00 C ATOM 475 O PRO A 33 -2.782 12.274 3.806 1.00 0.00 O ATOM 476 CB PRO A 33 -0.306 12.728 2.640 1.00 0.00 C ATOM 477 CG PRO A 33 -0.357 12.513 1.136 1.00 0.00 C ATOM 478 CD PRO A 33 -0.347 11.016 0.877 1.00 0.00 C ATOM 0 HA PRO A 33 0.004 11.204 4.140 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -1.030 13.481 2.952 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.677 13.082 2.951 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -1.255 12.967 0.716 1.00 0.00 H new ATOM 0 HG3 PRO A 33 0.496 12.989 0.653 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -1.205 10.712 0.278 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.546 10.715 0.330 1.00 0.00 H new ATOM 486 N PHE A 34 -2.422 10.076 4.198 1.00 0.00 N ATOM 487 CA PHE A 34 -3.757 9.837 4.719 1.00 0.00 C ATOM 488 C PHE A 34 -4.274 11.057 5.483 1.00 0.00 C ATOM 489 O PHE A 34 -5.465 11.362 5.440 1.00 0.00 O ATOM 490 CB PHE A 34 -3.655 8.652 5.683 1.00 0.00 C ATOM 491 CG PHE A 34 -3.552 7.293 4.989 1.00 0.00 C ATOM 492 CD1 PHE A 34 -4.680 6.637 4.606 1.00 0.00 C ATOM 493 CD2 PHE A 34 -2.332 6.740 4.754 1.00 0.00 C ATOM 494 CE1 PHE A 34 -4.584 5.375 3.963 1.00 0.00 C ATOM 495 CE2 PHE A 34 -2.236 5.478 4.111 1.00 0.00 C ATOM 496 CZ PHE A 34 -3.364 4.822 3.728 1.00 0.00 C ATOM 0 H PHE A 34 -1.817 9.255 4.182 1.00 0.00 H new ATOM 0 HA PHE A 34 -4.446 9.637 3.899 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -2.782 8.790 6.321 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -4.529 8.651 6.335 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -5.649 7.076 4.791 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -1.436 7.261 5.057 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -5.480 4.854 3.660 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -1.267 5.039 3.926 1.00 0.00 H new ATOM 0 HZ PHE A 34 -3.291 3.863 3.238 1.00 0.00 H new ATOM 506 N ALA A 35 -3.353 11.723 6.164 1.00 0.00 N ATOM 507 CA ALA A 35 -3.701 12.904 6.936 1.00 0.00 C ATOM 508 C ALA A 35 -4.369 13.930 6.018 1.00 0.00 C ATOM 509 O ALA A 35 -5.498 14.350 6.268 1.00 0.00 O ATOM 510 CB ALA A 35 -2.447 13.458 7.615 1.00 0.00 C ATOM 0 H ALA A 35 -2.366 11.467 6.197 1.00 0.00 H new ATOM 0 HA ALA A 35 -4.413 12.652 7.722 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -2.708 14.344 8.194 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -2.028 12.701 8.278 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -1.710 13.724 6.857 1.00 0.00 H new ATOM 516 N LEU A 36 -3.643 14.303 4.974 1.00 0.00 N ATOM 517 CA LEU A 36 -4.151 15.272 4.018 1.00 0.00 C ATOM 518 C LEU A 36 -5.576 14.886 3.615 1.00 0.00 C ATOM 519 O LEU A 36 -6.423 15.753 3.408 1.00 0.00 O ATOM 520 CB LEU A 36 -3.193 15.408 2.833 1.00 0.00 C ATOM 521 CG LEU A 36 -1.952 16.272 3.070 1.00 0.00 C ATOM 522 CD1 LEU A 36 -1.182 16.494 1.767 1.00 0.00 C ATOM 523 CD2 LEU A 36 -2.325 17.592 3.748 1.00 0.00 C ATOM 0 H LEU A 36 -2.708 13.952 4.769 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.204 16.262 4.471 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -2.866 14.411 2.539 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.745 15.824 1.990 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.288 15.738 3.749 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.305 17.111 1.963 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.866 15.532 1.363 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.825 16.997 1.045 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.425 18.187 3.905 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.019 18.144 3.114 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.797 17.387 4.709 1.00 0.00 H new ATOM 535 N PHE A 37 -5.796 13.583 3.516 1.00 0.00 N ATOM 536 CA PHE A 37 -7.103 13.071 3.141 1.00 0.00 C ATOM 537 C PHE A 37 -8.049 13.050 4.344 1.00 0.00 C ATOM 538 O PHE A 37 -9.266 13.111 4.182 1.00 0.00 O ATOM 539 CB PHE A 37 -6.897 11.639 2.643 1.00 0.00 C ATOM 540 CG PHE A 37 -6.116 11.543 1.332 1.00 0.00 C ATOM 541 CD1 PHE A 37 -4.760 11.652 1.339 1.00 0.00 C ATOM 542 CD2 PHE A 37 -6.776 11.348 0.159 1.00 0.00 C ATOM 543 CE1 PHE A 37 -4.034 11.562 0.122 1.00 0.00 C ATOM 544 CE2 PHE A 37 -6.050 11.258 -1.058 1.00 0.00 C ATOM 545 CZ PHE A 37 -4.695 11.367 -1.051 1.00 0.00 C ATOM 0 H PHE A 37 -5.091 12.867 3.689 1.00 0.00 H new ATOM 0 HA PHE A 37 -7.546 13.707 2.375 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -6.371 11.071 3.410 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -7.871 11.168 2.509 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -4.236 11.807 2.270 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -7.853 11.262 0.153 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.957 11.648 0.128 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -6.574 11.103 -1.989 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.143 11.299 -1.977 1.00 0.00 H new ATOM 555 N GLU A 38 -7.452 12.962 5.524 1.00 0.00 N ATOM 556 CA GLU A 38 -8.225 12.931 6.753 1.00 0.00 C ATOM 557 C GLU A 38 -8.793 14.319 7.058 1.00 0.00 C ATOM 558 O GLU A 38 -9.975 14.455 7.371 1.00 0.00 O ATOM 559 CB GLU A 38 -7.380 12.416 7.920 1.00 0.00 C ATOM 560 CG GLU A 38 -6.948 13.566 8.833 1.00 0.00 C ATOM 561 CD GLU A 38 -6.133 13.047 10.020 1.00 0.00 C ATOM 562 OE1 GLU A 38 -5.182 12.278 9.762 1.00 0.00 O ATOM 563 OE2 GLU A 38 -6.481 13.430 11.157 1.00 0.00 O ATOM 0 H GLU A 38 -6.442 12.911 5.654 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.058 12.241 6.618 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -7.952 11.686 8.494 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -6.499 11.901 7.537 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.354 14.283 8.265 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -7.828 14.097 9.196 1.00 0.00 H new ATOM 570 N SER A 39 -7.925 15.314 6.956 1.00 0.00 N ATOM 571 CA SER A 39 -8.325 16.687 7.216 1.00 0.00 C ATOM 572 C SER A 39 -8.978 17.287 5.970 1.00 0.00 C ATOM 573 O SER A 39 -9.985 17.987 6.069 1.00 0.00 O ATOM 574 CB SER A 39 -7.128 17.536 7.650 1.00 0.00 C ATOM 575 OG SER A 39 -6.770 17.300 9.008 1.00 0.00 O ATOM 0 H SER A 39 -6.945 15.197 6.697 1.00 0.00 H new ATOM 0 HA SER A 39 -9.049 16.684 8.031 1.00 0.00 H new ATOM 0 HB2 SER A 39 -6.276 17.316 7.007 1.00 0.00 H new ATOM 0 HB3 SER A 39 -7.365 18.592 7.516 1.00 0.00 H new ATOM 0 HG SER A 39 -6.001 17.859 9.246 1.00 0.00 H new ATOM 581 N PHE A 40 -8.379 16.991 4.826 1.00 0.00 N ATOM 582 CA PHE A 40 -8.891 17.492 3.562 1.00 0.00 C ATOM 583 C PHE A 40 -9.201 16.343 2.601 1.00 0.00 C ATOM 584 O PHE A 40 -8.457 16.106 1.650 1.00 0.00 O ATOM 585 CB PHE A 40 -7.795 18.369 2.953 1.00 0.00 C ATOM 586 CG PHE A 40 -7.266 19.450 3.898 1.00 0.00 C ATOM 587 CD1 PHE A 40 -8.075 20.475 4.279 1.00 0.00 C ATOM 588 CD2 PHE A 40 -5.988 19.386 4.356 1.00 0.00 C ATOM 589 CE1 PHE A 40 -7.584 21.479 5.155 1.00 0.00 C ATOM 590 CE2 PHE A 40 -5.497 20.389 5.233 1.00 0.00 C ATOM 591 CZ PHE A 40 -6.305 21.414 5.614 1.00 0.00 C ATOM 0 H PHE A 40 -7.544 16.411 4.748 1.00 0.00 H new ATOM 0 HA PHE A 40 -9.813 18.049 3.728 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -6.965 17.733 2.644 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -8.184 18.846 2.053 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -9.091 20.525 3.915 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -5.346 18.572 4.053 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -8.226 22.294 5.457 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -4.482 20.338 5.597 1.00 0.00 H new ATOM 0 HZ PHE A 40 -5.931 22.177 6.281 1.00 0.00 H new ATOM 601 N PRO A 41 -10.329 15.641 2.889 1.00 0.00 N ATOM 602 CA PRO A 41 -10.747 14.522 2.061 1.00 0.00 C ATOM 603 C PRO A 41 -11.346 15.010 0.741 1.00 0.00 C ATOM 604 O PRO A 41 -10.928 14.577 -0.332 1.00 0.00 O ATOM 605 CB PRO A 41 -11.740 13.750 2.915 1.00 0.00 C ATOM 606 CG PRO A 41 -12.192 14.713 4.001 1.00 0.00 C ATOM 607 CD PRO A 41 -11.235 15.893 4.006 1.00 0.00 C ATOM 0 HA PRO A 41 -9.915 13.883 1.766 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -12.586 13.409 2.318 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -11.277 12.863 3.347 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -13.212 15.049 3.813 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -12.194 14.219 4.973 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -11.768 16.835 3.879 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -10.692 15.959 4.949 1.00 0.00 H new ATOM 615 N GLU A 42 -12.315 15.905 0.863 1.00 0.00 N ATOM 616 CA GLU A 42 -12.976 16.457 -0.308 1.00 0.00 C ATOM 617 C GLU A 42 -11.942 16.852 -1.364 1.00 0.00 C ATOM 618 O GLU A 42 -12.164 16.659 -2.558 1.00 0.00 O ATOM 619 CB GLU A 42 -13.856 17.650 0.071 1.00 0.00 C ATOM 620 CG GLU A 42 -13.026 18.761 0.716 1.00 0.00 C ATOM 621 CD GLU A 42 -13.914 19.712 1.521 1.00 0.00 C ATOM 622 OE1 GLU A 42 -14.207 19.367 2.686 1.00 0.00 O ATOM 623 OE2 GLU A 42 -14.281 20.763 0.952 1.00 0.00 O ATOM 0 H GLU A 42 -12.659 16.262 1.755 1.00 0.00 H new ATOM 0 HA GLU A 42 -13.624 15.689 -0.731 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -14.356 18.034 -0.818 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -14.636 17.327 0.761 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -12.271 18.323 1.369 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -12.496 19.319 -0.056 1.00 0.00 H new ATOM 630 N ASP A 43 -10.833 17.399 -0.886 1.00 0.00 N ATOM 631 CA ASP A 43 -9.765 17.823 -1.774 1.00 0.00 C ATOM 632 C ASP A 43 -8.969 16.597 -2.228 1.00 0.00 C ATOM 633 O ASP A 43 -8.696 16.436 -3.417 1.00 0.00 O ATOM 634 CB ASP A 43 -8.802 18.775 -1.062 1.00 0.00 C ATOM 635 CG ASP A 43 -9.463 19.980 -0.390 1.00 0.00 C ATOM 636 OD1 ASP A 43 -10.548 20.373 -0.871 1.00 0.00 O ATOM 637 OD2 ASP A 43 -8.869 20.480 0.590 1.00 0.00 O ATOM 0 H ASP A 43 -10.652 17.558 0.105 1.00 0.00 H new ATOM 0 HA ASP A 43 -10.216 18.336 -2.624 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -8.252 18.214 -0.307 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -8.071 19.137 -1.785 1.00 0.00 H new ATOM 642 N PHE A 44 -8.618 15.766 -1.258 1.00 0.00 N ATOM 643 CA PHE A 44 -7.859 14.561 -1.543 1.00 0.00 C ATOM 644 C PHE A 44 -8.668 13.309 -1.198 1.00 0.00 C ATOM 645 O PHE A 44 -9.050 13.110 -0.046 1.00 0.00 O ATOM 646 CB PHE A 44 -6.607 14.603 -0.665 1.00 0.00 C ATOM 647 CG PHE A 44 -5.821 15.912 -0.763 1.00 0.00 C ATOM 648 CD1 PHE A 44 -5.172 16.230 -1.915 1.00 0.00 C ATOM 649 CD2 PHE A 44 -5.772 16.757 0.302 1.00 0.00 C ATOM 650 CE1 PHE A 44 -4.443 17.445 -2.006 1.00 0.00 C ATOM 651 CE2 PHE A 44 -5.043 17.972 0.210 1.00 0.00 C ATOM 652 CZ PHE A 44 -4.393 18.291 -0.942 1.00 0.00 C ATOM 0 H PHE A 44 -8.845 15.904 -0.273 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.611 14.520 -2.604 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -6.898 14.443 0.373 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -5.953 13.777 -0.943 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -5.211 15.559 -2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -6.287 16.504 1.217 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.928 17.698 -2.921 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -5.004 18.643 1.055 1.00 0.00 H new ATOM 0 HZ PHE A 44 -3.838 19.215 -1.012 1.00 0.00 H new ATOM 662 N TYR A 45 -8.905 12.497 -2.218 1.00 0.00 N ATOM 663 CA TYR A 45 -9.662 11.270 -2.037 1.00 0.00 C ATOM 664 C TYR A 45 -9.333 10.256 -3.134 1.00 0.00 C ATOM 665 O TYR A 45 -8.973 10.636 -4.248 1.00 0.00 O ATOM 666 CB TYR A 45 -11.136 11.663 -2.148 1.00 0.00 C ATOM 667 CG TYR A 45 -11.520 12.262 -3.502 1.00 0.00 C ATOM 668 CD1 TYR A 45 -11.347 13.611 -3.734 1.00 0.00 C ATOM 669 CD2 TYR A 45 -12.039 11.452 -4.492 1.00 0.00 C ATOM 670 CE1 TYR A 45 -11.709 14.174 -5.009 1.00 0.00 C ATOM 671 CE2 TYR A 45 -12.401 12.015 -5.767 1.00 0.00 C ATOM 672 CZ TYR A 45 -12.218 13.349 -5.963 1.00 0.00 C ATOM 673 OH TYR A 45 -12.559 13.881 -7.167 1.00 0.00 O ATOM 0 H TYR A 45 -8.586 12.665 -3.172 1.00 0.00 H new ATOM 0 HA TYR A 45 -9.423 10.810 -1.078 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -11.751 10.782 -1.964 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -11.369 12.384 -1.364 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -10.940 14.244 -2.960 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -12.174 10.396 -4.310 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -11.579 15.228 -5.203 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -12.808 11.393 -6.550 1.00 0.00 H new ATOM 0 HH TYR A 45 -12.683 14.849 -7.074 1.00 0.00 H new ATOM 683 N VAL A 46 -9.468 8.986 -2.782 1.00 0.00 N ATOM 684 CA VAL A 46 -9.189 7.914 -3.724 1.00 0.00 C ATOM 685 C VAL A 46 -10.509 7.358 -4.262 1.00 0.00 C ATOM 686 O VAL A 46 -11.468 7.190 -3.510 1.00 0.00 O ATOM 687 CB VAL A 46 -8.317 6.847 -3.059 1.00 0.00 C ATOM 688 CG1 VAL A 46 -8.143 5.633 -3.974 1.00 0.00 C ATOM 689 CG2 VAL A 46 -6.961 7.424 -2.650 1.00 0.00 C ATOM 0 H VAL A 46 -9.767 8.675 -1.858 1.00 0.00 H new ATOM 0 HA VAL A 46 -8.624 8.291 -4.576 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.826 6.514 -2.154 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -7.519 4.890 -3.478 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -9.119 5.200 -4.193 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -7.667 5.944 -4.904 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.361 6.645 -2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.443 7.797 -3.533 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.111 8.241 -1.945 1.00 0.00 H new ATOM 699 N GLU A 47 -10.515 7.088 -5.559 1.00 0.00 N ATOM 700 CA GLU A 47 -11.702 6.555 -6.206 1.00 0.00 C ATOM 701 C GLU A 47 -11.398 5.190 -6.829 1.00 0.00 C ATOM 702 O GLU A 47 -10.257 4.732 -6.803 1.00 0.00 O ATOM 703 CB GLU A 47 -12.239 7.529 -7.256 1.00 0.00 C ATOM 704 CG GLU A 47 -12.591 8.877 -6.623 1.00 0.00 C ATOM 705 CD GLU A 47 -14.002 9.317 -7.020 1.00 0.00 C ATOM 706 OE1 GLU A 47 -14.284 9.290 -8.237 1.00 0.00 O ATOM 707 OE2 GLU A 47 -14.767 9.671 -6.096 1.00 0.00 O ATOM 0 H GLU A 47 -9.717 7.228 -6.179 1.00 0.00 H new ATOM 0 HA GLU A 47 -12.477 6.424 -5.450 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.494 7.674 -8.038 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.123 7.105 -7.733 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.521 8.803 -5.538 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.869 9.630 -6.938 1.00 0.00 H new ATOM 714 N GLY A 48 -12.440 4.580 -7.375 1.00 0.00 N ATOM 715 CA GLY A 48 -12.299 3.278 -8.004 1.00 0.00 C ATOM 716 C GLY A 48 -12.520 2.153 -6.990 1.00 0.00 C ATOM 717 O GLY A 48 -12.967 1.065 -7.352 1.00 0.00 O ATOM 0 H GLY A 48 -13.385 4.963 -7.395 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -13.017 3.184 -8.819 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.305 3.187 -8.442 1.00 0.00 H new ATOM 721 N LEU A 49 -12.198 2.453 -5.741 1.00 0.00 N ATOM 722 CA LEU A 49 -12.356 1.481 -4.673 1.00 0.00 C ATOM 723 C LEU A 49 -13.660 0.708 -4.881 1.00 0.00 C ATOM 724 O LEU A 49 -14.616 1.238 -5.446 1.00 0.00 O ATOM 725 CB LEU A 49 -12.258 2.165 -3.307 1.00 0.00 C ATOM 726 CG LEU A 49 -10.846 2.504 -2.827 1.00 0.00 C ATOM 727 CD1 LEU A 49 -10.888 3.466 -1.638 1.00 0.00 C ATOM 728 CD2 LEU A 49 -10.055 1.233 -2.508 1.00 0.00 C ATOM 0 H LEU A 49 -11.828 3.356 -5.444 1.00 0.00 H new ATOM 0 HA LEU A 49 -11.546 0.753 -4.698 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -12.840 3.086 -3.341 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -12.727 1.519 -2.565 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.323 3.014 -3.636 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -9.871 3.691 -1.316 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -11.387 4.389 -1.934 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -11.435 3.005 -0.816 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -9.055 1.502 -2.169 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.566 0.674 -1.724 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -9.981 0.616 -3.404 1.00 0.00 H new ATOM 740 N PRO A 50 -13.657 -0.565 -4.402 1.00 0.00 N ATOM 741 CA PRO A 50 -14.827 -1.416 -4.531 1.00 0.00 C ATOM 742 C PRO A 50 -15.915 -1.007 -3.535 1.00 0.00 C ATOM 743 O PRO A 50 -15.643 -0.846 -2.346 1.00 0.00 O ATOM 744 CB PRO A 50 -14.314 -2.828 -4.303 1.00 0.00 C ATOM 745 CG PRO A 50 -12.975 -2.676 -3.599 1.00 0.00 C ATOM 746 CD PRO A 50 -12.543 -1.225 -3.728 1.00 0.00 C ATOM 0 HA PRO A 50 -15.302 -1.332 -5.508 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.012 -3.404 -3.695 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.201 -3.360 -5.248 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -13.062 -2.957 -2.549 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -12.232 -3.337 -4.045 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.352 -0.780 -2.751 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -11.622 -1.136 -4.305 1.00 0.00 H new ATOM 754 N GLU A 51 -17.122 -0.850 -4.057 1.00 0.00 N ATOM 755 CA GLU A 51 -18.251 -0.463 -3.228 1.00 0.00 C ATOM 756 C GLU A 51 -18.231 -1.236 -1.908 1.00 0.00 C ATOM 757 O GLU A 51 -18.097 -2.459 -1.903 1.00 0.00 O ATOM 758 CB GLU A 51 -19.573 -0.677 -3.968 1.00 0.00 C ATOM 759 CG GLU A 51 -20.030 -2.133 -3.865 1.00 0.00 C ATOM 760 CD GLU A 51 -20.879 -2.529 -5.075 1.00 0.00 C ATOM 761 OE1 GLU A 51 -20.505 -2.111 -6.192 1.00 0.00 O ATOM 762 OE2 GLU A 51 -21.883 -3.240 -4.855 1.00 0.00 O ATOM 0 H GLU A 51 -17.343 -0.984 -5.044 1.00 0.00 H new ATOM 0 HA GLU A 51 -18.165 0.600 -3.005 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -20.338 -0.022 -3.551 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.456 -0.402 -5.016 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -19.160 -2.787 -3.797 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -20.606 -2.273 -2.951 1.00 0.00 H new ATOM 769 N GLY A 52 -18.366 -0.491 -0.821 1.00 0.00 N ATOM 770 CA GLY A 52 -18.364 -1.091 0.502 1.00 0.00 C ATOM 771 C GLY A 52 -16.957 -1.093 1.102 1.00 0.00 C ATOM 772 O GLY A 52 -16.795 -1.219 2.315 1.00 0.00 O ATOM 0 H GLY A 52 -18.477 0.523 -0.829 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -19.041 -0.541 1.156 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -18.739 -2.113 0.442 1.00 0.00 H new ATOM 776 N VAL A 53 -15.974 -0.951 0.225 1.00 0.00 N ATOM 777 CA VAL A 53 -14.585 -0.935 0.653 1.00 0.00 C ATOM 778 C VAL A 53 -14.077 0.508 0.665 1.00 0.00 C ATOM 779 O VAL A 53 -13.902 1.117 -0.390 1.00 0.00 O ATOM 780 CB VAL A 53 -13.752 -1.855 -0.241 1.00 0.00 C ATOM 781 CG1 VAL A 53 -12.272 -1.803 0.147 1.00 0.00 C ATOM 782 CG2 VAL A 53 -14.280 -3.290 -0.195 1.00 0.00 C ATOM 0 H VAL A 53 -16.112 -0.846 -0.780 1.00 0.00 H new ATOM 0 HA VAL A 53 -14.493 -1.321 1.668 1.00 0.00 H new ATOM 0 HB VAL A 53 -13.843 -1.497 -1.267 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.702 -2.466 -0.504 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -11.903 -0.783 0.039 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -12.156 -2.123 1.182 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -13.670 -3.923 -0.839 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -14.234 -3.662 0.828 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -15.313 -3.309 -0.541 1.00 0.00 H new ATOM 792 N PRO A 54 -13.849 1.027 1.901 1.00 0.00 N ATOM 793 CA PRO A 54 -13.364 2.387 2.064 1.00 0.00 C ATOM 794 C PRO A 54 -11.878 2.486 1.710 1.00 0.00 C ATOM 795 O PRO A 54 -11.258 1.492 1.336 1.00 0.00 O ATOM 796 CB PRO A 54 -13.653 2.737 3.514 1.00 0.00 C ATOM 797 CG PRO A 54 -13.861 1.412 4.229 1.00 0.00 C ATOM 798 CD PRO A 54 -14.045 0.335 3.171 1.00 0.00 C ATOM 0 HA PRO A 54 -13.855 3.091 1.393 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -12.825 3.293 3.954 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.538 3.368 3.595 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -13.005 1.182 4.863 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -14.735 1.462 4.879 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -13.324 -0.472 3.298 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -15.037 -0.112 3.229 1.00 0.00 H new ATOM 806 N PHE A 55 -11.351 3.694 1.841 1.00 0.00 N ATOM 807 CA PHE A 55 -9.950 3.936 1.540 1.00 0.00 C ATOM 808 C PHE A 55 -9.107 3.938 2.817 1.00 0.00 C ATOM 809 O PHE A 55 -8.164 4.718 2.941 1.00 0.00 O ATOM 810 CB PHE A 55 -9.865 5.315 0.884 1.00 0.00 C ATOM 811 CG PHE A 55 -8.438 5.767 0.568 1.00 0.00 C ATOM 812 CD1 PHE A 55 -7.636 4.993 -0.211 1.00 0.00 C ATOM 813 CD2 PHE A 55 -7.971 6.944 1.066 1.00 0.00 C ATOM 814 CE1 PHE A 55 -6.311 5.412 -0.504 1.00 0.00 C ATOM 815 CE2 PHE A 55 -6.646 7.363 0.774 1.00 0.00 C ATOM 816 CZ PHE A 55 -5.845 6.589 -0.005 1.00 0.00 C ATOM 0 H PHE A 55 -11.869 4.516 2.152 1.00 0.00 H new ATOM 0 HA PHE A 55 -9.569 3.151 0.887 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -10.444 5.303 -0.039 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -10.330 6.049 1.543 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -8.007 4.059 -0.607 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -8.608 7.560 1.683 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -5.674 4.797 -1.122 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.275 8.296 1.171 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.838 6.909 -0.228 1.00 0.00 H new ATOM 826 N ARG A 56 -9.477 3.056 3.733 1.00 0.00 N ATOM 827 CA ARG A 56 -8.767 2.947 4.996 1.00 0.00 C ATOM 828 C ARG A 56 -7.388 2.321 4.777 1.00 0.00 C ATOM 829 O ARG A 56 -7.016 2.009 3.647 1.00 0.00 O ATOM 830 CB ARG A 56 -9.552 2.097 5.998 1.00 0.00 C ATOM 831 CG ARG A 56 -10.629 2.929 6.697 1.00 0.00 C ATOM 832 CD ARG A 56 -10.217 3.266 8.131 1.00 0.00 C ATOM 833 NE ARG A 56 -11.375 3.810 8.876 1.00 0.00 N ATOM 834 CZ ARG A 56 -11.837 5.060 8.736 1.00 0.00 C ATOM 835 NH1 ARG A 56 -11.244 5.902 7.880 1.00 0.00 N ATOM 836 NH2 ARG A 56 -12.893 5.467 9.453 1.00 0.00 N ATOM 0 H ARG A 56 -10.259 2.410 3.626 1.00 0.00 H new ATOM 0 HA ARG A 56 -8.654 3.953 5.401 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.015 1.256 5.483 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.870 1.681 6.740 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -10.802 3.849 6.139 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -11.570 2.379 6.705 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -9.841 2.373 8.629 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.405 3.993 8.123 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.850 3.195 9.537 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.440 5.592 7.334 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.596 6.853 7.774 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.345 4.826 10.105 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -13.245 6.418 9.347 1.00 0.00 H new ATOM 850 N ARG A 57 -6.667 2.156 5.876 1.00 0.00 N ATOM 851 CA ARG A 57 -5.337 1.573 5.819 1.00 0.00 C ATOM 852 C ARG A 57 -5.427 0.076 5.517 1.00 0.00 C ATOM 853 O ARG A 57 -6.414 -0.573 5.861 1.00 0.00 O ATOM 854 CB ARG A 57 -4.589 1.776 7.138 1.00 0.00 C ATOM 855 CG ARG A 57 -4.221 3.248 7.338 1.00 0.00 C ATOM 856 CD ARG A 57 -4.228 3.617 8.823 1.00 0.00 C ATOM 857 NE ARG A 57 -4.445 5.073 8.981 1.00 0.00 N ATOM 858 CZ ARG A 57 -5.632 5.676 8.831 1.00 0.00 C ATOM 859 NH1 ARG A 57 -6.716 4.953 8.519 1.00 0.00 N ATOM 860 NH2 ARG A 57 -5.735 7.002 8.994 1.00 0.00 N ATOM 0 H ARG A 57 -6.979 2.416 6.812 1.00 0.00 H new ATOM 0 HA ARG A 57 -4.788 2.076 5.023 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -5.209 1.436 7.968 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.685 1.167 7.145 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -3.235 3.441 6.916 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -4.927 3.880 6.799 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.014 3.066 9.340 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -3.282 3.330 9.282 1.00 0.00 H new ATOM 0 HE ARG A 57 -3.641 5.653 9.219 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -6.638 3.944 8.396 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -7.620 5.412 8.405 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.910 7.552 9.232 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -6.639 7.461 8.880 1.00 0.00 H new ATOM 874 N PRO A 58 -4.355 -0.443 4.859 1.00 0.00 N ATOM 875 CA PRO A 58 -4.304 -1.852 4.507 1.00 0.00 C ATOM 876 C PRO A 58 -4.010 -2.714 5.736 1.00 0.00 C ATOM 877 O PRO A 58 -4.499 -3.838 5.842 1.00 0.00 O ATOM 878 CB PRO A 58 -3.225 -1.951 3.441 1.00 0.00 C ATOM 879 CG PRO A 58 -2.395 -0.684 3.568 1.00 0.00 C ATOM 880 CD PRO A 58 -3.169 0.295 4.436 1.00 0.00 C ATOM 0 HA PRO A 58 -5.255 -2.226 4.129 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -2.609 -2.838 3.590 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -3.665 -2.032 2.447 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -1.426 -0.906 4.014 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -2.203 -0.253 2.585 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -2.577 0.618 5.292 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -3.439 1.192 3.878 1.00 0.00 H new ATOM 888 N SER A 59 -3.214 -2.155 6.635 1.00 0.00 N ATOM 889 CA SER A 59 -2.850 -2.859 7.853 1.00 0.00 C ATOM 890 C SER A 59 -4.035 -2.879 8.820 1.00 0.00 C ATOM 891 O SER A 59 -3.928 -2.406 9.950 1.00 0.00 O ATOM 892 CB SER A 59 -1.633 -2.213 8.519 1.00 0.00 C ATOM 893 OG SER A 59 -1.078 -3.044 9.536 1.00 0.00 O ATOM 0 H SER A 59 -2.811 -1.222 6.545 1.00 0.00 H new ATOM 0 HA SER A 59 -2.586 -3.883 7.590 1.00 0.00 H new ATOM 0 HB2 SER A 59 -0.874 -2.007 7.765 1.00 0.00 H new ATOM 0 HB3 SER A 59 -1.922 -1.255 8.951 1.00 0.00 H new ATOM 0 HG SER A 59 -1.754 -3.212 10.226 1.00 0.00 H new ATOM 899 N THR A 60 -5.140 -3.432 8.340 1.00 0.00 N ATOM 900 CA THR A 60 -6.344 -3.521 9.148 1.00 0.00 C ATOM 901 C THR A 60 -7.393 -4.387 8.449 1.00 0.00 C ATOM 902 O THR A 60 -8.031 -5.228 9.081 1.00 0.00 O ATOM 903 CB THR A 60 -6.826 -2.097 9.436 1.00 0.00 C ATOM 904 OG1 THR A 60 -7.010 -2.072 10.849 1.00 0.00 O ATOM 905 CG2 THR A 60 -8.223 -1.827 8.874 1.00 0.00 C ATOM 0 H THR A 60 -5.226 -3.823 7.402 1.00 0.00 H new ATOM 0 HA THR A 60 -6.145 -4.012 10.101 1.00 0.00 H new ATOM 0 HB THR A 60 -6.120 -1.382 9.013 1.00 0.00 H new ATOM 0 HG1 THR A 60 -7.321 -1.184 11.123 1.00 0.00 H new ATOM 0 HG21 THR A 60 -8.517 -0.803 9.106 1.00 0.00 H new ATOM 0 HG22 THR A 60 -8.213 -1.966 7.793 1.00 0.00 H new ATOM 0 HG23 THR A 60 -8.936 -2.519 9.322 1.00 0.00 H new ATOM 913 N PHE A 61 -7.539 -4.153 7.153 1.00 0.00 N ATOM 914 CA PHE A 61 -8.500 -4.901 6.360 1.00 0.00 C ATOM 915 C PHE A 61 -8.328 -6.407 6.570 1.00 0.00 C ATOM 916 O PHE A 61 -7.429 -6.839 7.289 1.00 0.00 O ATOM 917 CB PHE A 61 -8.226 -4.568 4.893 1.00 0.00 C ATOM 918 CG PHE A 61 -8.652 -3.156 4.485 1.00 0.00 C ATOM 919 CD1 PHE A 61 -9.832 -2.646 4.932 1.00 0.00 C ATOM 920 CD2 PHE A 61 -7.852 -2.411 3.676 1.00 0.00 C ATOM 921 CE1 PHE A 61 -10.227 -1.336 4.553 1.00 0.00 C ATOM 922 CE2 PHE A 61 -8.248 -1.101 3.298 1.00 0.00 C ATOM 923 CZ PHE A 61 -9.427 -0.591 3.744 1.00 0.00 C ATOM 0 H PHE A 61 -7.008 -3.456 6.632 1.00 0.00 H new ATOM 0 HA PHE A 61 -9.515 -4.633 6.654 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -7.160 -4.686 4.697 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -8.747 -5.290 4.264 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -10.467 -3.237 5.575 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -6.916 -2.816 3.321 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -11.163 -0.931 4.907 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -7.612 -0.509 2.656 1.00 0.00 H new ATOM 0 HZ PHE A 61 -9.728 0.405 3.456 1.00 0.00 H new ATOM 933 N GLY A 62 -9.205 -7.165 5.927 1.00 0.00 N ATOM 934 CA GLY A 62 -9.161 -8.614 6.034 1.00 0.00 C ATOM 935 C GLY A 62 -8.332 -9.222 4.902 1.00 0.00 C ATOM 936 O GLY A 62 -7.761 -8.498 4.087 1.00 0.00 O ATOM 0 H GLY A 62 -9.949 -6.803 5.331 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -8.734 -8.898 6.996 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -10.174 -9.015 6.004 1.00 0.00 H new ATOM 940 N ILE A 63 -8.291 -10.547 4.887 1.00 0.00 N ATOM 941 CA ILE A 63 -7.541 -11.261 3.868 1.00 0.00 C ATOM 942 C ILE A 63 -8.235 -11.090 2.515 1.00 0.00 C ATOM 943 O ILE A 63 -7.583 -10.821 1.508 1.00 0.00 O ATOM 944 CB ILE A 63 -7.339 -12.721 4.276 1.00 0.00 C ATOM 945 CG1 ILE A 63 -6.290 -12.842 5.383 1.00 0.00 C ATOM 946 CG2 ILE A 63 -6.994 -13.587 3.062 1.00 0.00 C ATOM 947 CD1 ILE A 63 -6.556 -14.068 6.259 1.00 0.00 C ATOM 0 H ILE A 63 -8.765 -11.144 5.564 1.00 0.00 H new ATOM 0 HA ILE A 63 -6.540 -10.841 3.768 1.00 0.00 H new ATOM 0 HB ILE A 63 -8.279 -13.095 4.682 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.296 -12.915 4.941 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -6.300 -11.942 5.998 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -6.855 -14.620 3.380 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -7.806 -13.536 2.336 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -6.075 -13.222 2.604 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.796 -14.131 7.038 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -7.540 -13.980 6.719 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.521 -14.968 5.645 1.00 0.00 H new ATOM 959 N PRO A 64 -9.585 -11.257 2.537 1.00 0.00 N ATOM 960 CA PRO A 64 -10.375 -11.125 1.325 1.00 0.00 C ATOM 961 C PRO A 64 -10.529 -9.655 0.929 1.00 0.00 C ATOM 962 O PRO A 64 -10.297 -9.291 -0.223 1.00 0.00 O ATOM 963 CB PRO A 64 -11.701 -11.796 1.645 1.00 0.00 C ATOM 964 CG PRO A 64 -11.778 -11.867 3.161 1.00 0.00 C ATOM 965 CD PRO A 64 -10.391 -11.576 3.712 1.00 0.00 C ATOM 0 HA PRO A 64 -9.904 -11.595 0.462 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -12.536 -11.225 1.238 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -11.751 -12.792 1.204 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -12.499 -11.143 3.541 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -12.117 -12.853 3.480 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -10.411 -10.744 4.416 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -9.989 -12.437 4.247 1.00 0.00 H new ATOM 973 N ARG A 65 -10.919 -8.850 1.906 1.00 0.00 N ATOM 974 CA ARG A 65 -11.107 -7.428 1.674 1.00 0.00 C ATOM 975 C ARG A 65 -9.877 -6.836 0.982 1.00 0.00 C ATOM 976 O ARG A 65 -10.004 -5.973 0.114 1.00 0.00 O ATOM 977 CB ARG A 65 -11.352 -6.683 2.988 1.00 0.00 C ATOM 978 CG ARG A 65 -12.664 -5.898 2.937 1.00 0.00 C ATOM 979 CD ARG A 65 -12.621 -4.695 3.882 1.00 0.00 C ATOM 980 NE ARG A 65 -12.847 -5.139 5.276 1.00 0.00 N ATOM 981 CZ ARG A 65 -13.258 -4.332 6.264 1.00 0.00 C ATOM 982 NH1 ARG A 65 -13.490 -3.035 6.017 1.00 0.00 N ATOM 983 NH2 ARG A 65 -13.436 -4.821 7.498 1.00 0.00 N ATOM 0 H ARG A 65 -11.110 -9.155 2.860 1.00 0.00 H new ATOM 0 HA ARG A 65 -11.981 -7.309 1.034 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -11.382 -7.394 3.813 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.524 -6.002 3.184 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -12.849 -5.558 1.918 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -13.493 -6.550 3.211 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -11.656 -4.194 3.803 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -13.382 -3.969 3.595 1.00 0.00 H new ATOM 0 HE ARG A 65 -12.679 -6.120 5.498 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -13.354 -2.662 5.077 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -13.803 -2.421 6.769 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -13.259 -5.808 7.686 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -13.749 -4.207 8.250 1.00 0.00 H new ATOM 997 N LEU A 66 -8.715 -7.323 1.392 1.00 0.00 N ATOM 998 CA LEU A 66 -7.464 -6.853 0.822 1.00 0.00 C ATOM 999 C LEU A 66 -7.482 -7.079 -0.692 1.00 0.00 C ATOM 1000 O LEU A 66 -7.182 -6.169 -1.462 1.00 0.00 O ATOM 1001 CB LEU A 66 -6.275 -7.508 1.527 1.00 0.00 C ATOM 1002 CG LEU A 66 -5.810 -6.835 2.821 1.00 0.00 C ATOM 1003 CD1 LEU A 66 -5.094 -7.835 3.731 1.00 0.00 C ATOM 1004 CD2 LEU A 66 -4.943 -5.610 2.521 1.00 0.00 C ATOM 0 H LEU A 66 -8.614 -8.038 2.112 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.350 -5.781 0.984 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.536 -8.542 1.752 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -5.435 -7.535 0.832 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.690 -6.482 3.359 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.774 -7.332 4.643 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -5.774 -8.648 3.985 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.223 -8.238 3.214 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.626 -5.151 3.457 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.065 -5.916 1.952 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.519 -4.890 1.940 1.00 0.00 H new ATOM 1016 N GLU A 67 -7.835 -8.298 -1.072 1.00 0.00 N ATOM 1017 CA GLU A 67 -7.896 -8.655 -2.479 1.00 0.00 C ATOM 1018 C GLU A 67 -8.952 -7.812 -3.196 1.00 0.00 C ATOM 1019 O GLU A 67 -8.719 -7.328 -4.303 1.00 0.00 O ATOM 1020 CB GLU A 67 -8.176 -10.149 -2.654 1.00 0.00 C ATOM 1021 CG GLU A 67 -6.878 -10.958 -2.617 1.00 0.00 C ATOM 1022 CD GLU A 67 -6.483 -11.425 -4.020 1.00 0.00 C ATOM 1023 OE1 GLU A 67 -6.949 -12.518 -4.407 1.00 0.00 O ATOM 1024 OE2 GLU A 67 -5.723 -10.678 -4.674 1.00 0.00 O ATOM 0 H GLU A 67 -8.082 -9.051 -0.430 1.00 0.00 H new ATOM 0 HA GLU A 67 -6.926 -8.445 -2.929 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.845 -10.492 -1.865 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.687 -10.318 -3.602 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -6.078 -10.350 -2.194 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -7.002 -11.822 -1.964 1.00 0.00 H new ATOM 1031 N LYS A 68 -10.091 -7.661 -2.536 1.00 0.00 N ATOM 1032 CA LYS A 68 -11.183 -6.884 -3.096 1.00 0.00 C ATOM 1033 C LYS A 68 -10.635 -5.569 -3.653 1.00 0.00 C ATOM 1034 O LYS A 68 -11.060 -5.115 -4.714 1.00 0.00 O ATOM 1035 CB LYS A 68 -12.294 -6.698 -2.060 1.00 0.00 C ATOM 1036 CG LYS A 68 -12.798 -8.048 -1.548 1.00 0.00 C ATOM 1037 CD LYS A 68 -14.287 -7.982 -1.200 1.00 0.00 C ATOM 1038 CE LYS A 68 -14.582 -6.798 -0.276 1.00 0.00 C ATOM 1039 NZ LYS A 68 -15.837 -7.026 0.473 1.00 0.00 N ATOM 0 H LYS A 68 -10.281 -8.064 -1.618 1.00 0.00 H new ATOM 0 HA LYS A 68 -11.641 -7.417 -3.929 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.922 -6.104 -1.225 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -13.120 -6.142 -2.503 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -12.632 -8.813 -2.306 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -12.228 -8.343 -0.667 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -14.874 -7.890 -2.114 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -14.593 -8.910 -0.717 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -13.756 -6.658 0.421 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -14.663 -5.883 -0.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -16.022 -6.213 1.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -16.625 -7.137 -0.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -15.747 -7.888 1.047 1.00 0.00 H new ATOM 1053 N ILE A 69 -9.699 -4.994 -2.912 1.00 0.00 N ATOM 1054 CA ILE A 69 -9.088 -3.740 -3.319 1.00 0.00 C ATOM 1055 C ILE A 69 -8.127 -3.999 -4.481 1.00 0.00 C ATOM 1056 O ILE A 69 -8.246 -3.383 -5.539 1.00 0.00 O ATOM 1057 CB ILE A 69 -8.433 -3.049 -2.122 1.00 0.00 C ATOM 1058 CG1 ILE A 69 -9.489 -2.515 -1.152 1.00 0.00 C ATOM 1059 CG2 ILE A 69 -7.469 -1.954 -2.580 1.00 0.00 C ATOM 1060 CD1 ILE A 69 -9.126 -2.853 0.295 1.00 0.00 C ATOM 0 H ILE A 69 -9.349 -5.373 -2.032 1.00 0.00 H new ATOM 0 HA ILE A 69 -9.847 -3.047 -3.681 1.00 0.00 H new ATOM 0 HB ILE A 69 -7.844 -3.789 -1.581 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -9.579 -1.435 -1.265 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -10.461 -2.943 -1.396 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -7.017 -1.479 -1.709 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.687 -2.393 -3.200 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.014 -1.208 -3.158 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -9.893 -2.462 0.963 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -9.061 -3.935 0.411 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.165 -2.403 0.544 1.00 0.00 H new ATOM 1072 N LEU A 70 -7.196 -4.912 -4.245 1.00 0.00 N ATOM 1073 CA LEU A 70 -6.215 -5.260 -5.258 1.00 0.00 C ATOM 1074 C LEU A 70 -6.921 -5.445 -6.603 1.00 0.00 C ATOM 1075 O LEU A 70 -6.502 -4.879 -7.611 1.00 0.00 O ATOM 1076 CB LEU A 70 -5.400 -6.478 -4.819 1.00 0.00 C ATOM 1077 CG LEU A 70 -4.091 -6.180 -4.086 1.00 0.00 C ATOM 1078 CD1 LEU A 70 -3.885 -7.145 -2.917 1.00 0.00 C ATOM 1079 CD2 LEU A 70 -2.906 -6.192 -5.054 1.00 0.00 C ATOM 0 H LEU A 70 -7.101 -5.421 -3.366 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.494 -4.452 -5.384 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.024 -7.094 -4.171 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.171 -7.075 -5.702 1.00 0.00 H new ATOM 0 HG LEU A 70 -4.155 -5.176 -3.667 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.947 -6.911 -2.413 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.710 -7.044 -2.212 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.850 -8.168 -3.292 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.988 -5.977 -4.508 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.829 -7.173 -5.522 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -3.056 -5.434 -5.823 1.00 0.00 H new ATOM 1091 N ARG A 71 -7.981 -6.240 -6.574 1.00 0.00 N ATOM 1092 CA ARG A 71 -8.749 -6.506 -7.779 1.00 0.00 C ATOM 1093 C ARG A 71 -8.867 -5.237 -8.625 1.00 0.00 C ATOM 1094 O ARG A 71 -8.719 -5.284 -9.845 1.00 0.00 O ATOM 1095 CB ARG A 71 -10.151 -7.015 -7.437 1.00 0.00 C ATOM 1096 CG ARG A 71 -10.229 -8.537 -7.568 1.00 0.00 C ATOM 1097 CD ARG A 71 -11.294 -9.114 -6.633 1.00 0.00 C ATOM 1098 NE ARG A 71 -11.349 -10.586 -6.776 1.00 0.00 N ATOM 1099 CZ ARG A 71 -11.836 -11.219 -7.853 1.00 0.00 C ATOM 1100 NH1 ARG A 71 -12.313 -10.512 -8.887 1.00 0.00 N ATOM 1101 NH2 ARG A 71 -11.846 -12.558 -7.895 1.00 0.00 N ATOM 0 H ARG A 71 -8.326 -6.708 -5.736 1.00 0.00 H new ATOM 0 HA ARG A 71 -8.223 -7.275 -8.344 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -10.411 -6.720 -6.420 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -10.882 -6.551 -8.100 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -10.461 -8.805 -8.599 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -9.259 -8.976 -7.335 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -11.066 -8.849 -5.601 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -12.267 -8.681 -6.865 1.00 0.00 H new ATOM 0 HE ARG A 71 -10.994 -11.155 -6.007 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -12.305 -9.493 -8.855 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -12.683 -10.993 -9.706 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -11.483 -13.096 -7.108 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -12.216 -13.040 -8.714 1.00 0.00 H new ATOM 1115 N ASN A 72 -9.132 -4.132 -7.943 1.00 0.00 N ATOM 1116 CA ASN A 72 -9.271 -2.853 -8.617 1.00 0.00 C ATOM 1117 C ASN A 72 -8.064 -1.973 -8.287 1.00 0.00 C ATOM 1118 O ASN A 72 -8.222 -0.837 -7.842 1.00 0.00 O ATOM 1119 CB ASN A 72 -10.532 -2.120 -8.153 1.00 0.00 C ATOM 1120 CG ASN A 72 -11.793 -2.867 -8.591 1.00 0.00 C ATOM 1121 OD1 ASN A 72 -11.764 -3.743 -9.440 1.00 0.00 O ATOM 1122 ND2 ASN A 72 -12.899 -2.474 -7.965 1.00 0.00 N ATOM 0 H ASN A 72 -9.254 -4.097 -6.931 1.00 0.00 H new ATOM 0 HA ASN A 72 -9.337 -3.042 -9.688 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -10.521 -2.022 -7.067 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -10.542 -1.110 -8.564 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -13.793 -2.912 -8.186 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -12.853 -1.734 -7.264 1.00 0.00 H new ATOM 1129 N LYS A 73 -6.885 -2.531 -8.516 1.00 0.00 N ATOM 1130 CA LYS A 73 -5.651 -1.812 -8.248 1.00 0.00 C ATOM 1131 C LYS A 73 -5.300 -0.942 -9.457 1.00 0.00 C ATOM 1132 O LYS A 73 -4.423 -0.084 -9.375 1.00 0.00 O ATOM 1133 CB LYS A 73 -4.540 -2.784 -7.847 1.00 0.00 C ATOM 1134 CG LYS A 73 -4.202 -3.735 -8.997 1.00 0.00 C ATOM 1135 CD LYS A 73 -2.688 -3.888 -9.155 1.00 0.00 C ATOM 1136 CE LYS A 73 -2.275 -5.359 -9.072 1.00 0.00 C ATOM 1137 NZ LYS A 73 -0.902 -5.482 -8.531 1.00 0.00 N ATOM 0 H LYS A 73 -6.758 -3.474 -8.884 1.00 0.00 H new ATOM 0 HA LYS A 73 -5.778 -1.142 -7.398 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -3.650 -2.225 -7.559 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -4.852 -3.359 -6.975 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -4.652 -4.710 -8.811 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -4.632 -3.357 -9.925 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -2.375 -3.472 -10.112 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -2.178 -3.319 -8.378 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -2.973 -5.904 -8.436 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -2.324 -5.813 -10.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -0.637 -6.486 -8.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -0.237 -4.979 -9.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -0.866 -5.067 -7.578 1.00 0.00 H new ATOM 1151 N ALA A 74 -6.004 -1.193 -10.551 1.00 0.00 N ATOM 1152 CA ALA A 74 -5.778 -0.443 -11.775 1.00 0.00 C ATOM 1153 C ALA A 74 -6.897 0.586 -11.951 1.00 0.00 C ATOM 1154 O ALA A 74 -6.682 1.648 -12.534 1.00 0.00 O ATOM 1155 CB ALA A 74 -5.685 -1.411 -12.956 1.00 0.00 C ATOM 0 H ALA A 74 -6.731 -1.905 -10.615 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.835 0.101 -11.724 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -5.516 -0.849 -13.875 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -4.858 -2.102 -12.796 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -6.616 -1.972 -13.041 1.00 0.00 H new ATOM 1161 N LYS A 75 -8.066 0.236 -11.437 1.00 0.00 N ATOM 1162 CA LYS A 75 -9.219 1.116 -11.530 1.00 0.00 C ATOM 1163 C LYS A 75 -9.077 2.245 -10.507 1.00 0.00 C ATOM 1164 O LYS A 75 -9.494 3.374 -10.761 1.00 0.00 O ATOM 1165 CB LYS A 75 -10.516 0.317 -11.389 1.00 0.00 C ATOM 1166 CG LYS A 75 -10.580 -0.812 -12.419 1.00 0.00 C ATOM 1167 CD LYS A 75 -10.925 -0.269 -13.807 1.00 0.00 C ATOM 1168 CE LYS A 75 -11.730 -1.292 -14.612 1.00 0.00 C ATOM 1169 NZ LYS A 75 -12.159 -0.713 -15.904 1.00 0.00 N ATOM 0 H LYS A 75 -8.240 -0.645 -10.954 1.00 0.00 H new ATOM 0 HA LYS A 75 -9.265 1.581 -12.515 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -10.583 -0.099 -10.384 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -11.371 0.980 -11.518 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.622 -1.331 -12.455 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -11.328 -1.545 -12.115 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.497 0.653 -13.709 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.009 -0.020 -14.342 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -11.126 -2.182 -14.788 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -12.603 -1.608 -14.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -12.704 -1.420 -16.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.753 0.123 -15.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.322 -0.434 -16.454 1.00 0.00 H new ATOM 1183 N ILE A 76 -8.487 1.901 -9.372 1.00 0.00 N ATOM 1184 CA ILE A 76 -8.285 2.871 -8.309 1.00 0.00 C ATOM 1185 C ILE A 76 -7.597 4.112 -8.882 1.00 0.00 C ATOM 1186 O ILE A 76 -6.773 4.006 -9.788 1.00 0.00 O ATOM 1187 CB ILE A 76 -7.532 2.235 -7.139 1.00 0.00 C ATOM 1188 CG1 ILE A 76 -8.477 1.407 -6.265 1.00 0.00 C ATOM 1189 CG2 ILE A 76 -6.783 3.295 -6.329 1.00 0.00 C ATOM 1190 CD1 ILE A 76 -7.699 0.387 -5.431 1.00 0.00 C ATOM 0 H ILE A 76 -8.142 0.964 -9.165 1.00 0.00 H new ATOM 0 HA ILE A 76 -9.243 3.196 -7.902 1.00 0.00 H new ATOM 0 HB ILE A 76 -6.785 1.552 -7.543 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -9.041 2.067 -5.606 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -9.202 0.891 -6.894 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -6.256 2.817 -5.503 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.065 3.804 -6.972 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.494 4.021 -5.934 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -8.394 -0.188 -4.819 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -7.156 -0.287 -6.094 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -6.992 0.908 -4.785 1.00 0.00 H new ATOM 1202 N LYS A 77 -7.961 5.259 -8.328 1.00 0.00 N ATOM 1203 CA LYS A 77 -7.389 6.519 -8.773 1.00 0.00 C ATOM 1204 C LYS A 77 -7.364 7.504 -7.602 1.00 0.00 C ATOM 1205 O LYS A 77 -8.259 7.494 -6.759 1.00 0.00 O ATOM 1206 CB LYS A 77 -8.135 7.043 -10.001 1.00 0.00 C ATOM 1207 CG LYS A 77 -7.191 7.809 -10.931 1.00 0.00 C ATOM 1208 CD LYS A 77 -7.651 9.257 -11.107 1.00 0.00 C ATOM 1209 CE LYS A 77 -7.624 9.666 -12.581 1.00 0.00 C ATOM 1210 NZ LYS A 77 -6.326 10.291 -12.921 1.00 0.00 N ATOM 0 H LYS A 77 -8.644 5.343 -7.575 1.00 0.00 H new ATOM 0 HA LYS A 77 -6.357 6.377 -9.093 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -8.585 6.210 -10.540 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -8.949 7.696 -9.685 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -6.180 7.792 -10.524 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -7.152 7.316 -11.902 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -8.661 9.372 -10.713 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -7.006 9.920 -10.530 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -7.789 8.792 -13.210 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -8.436 10.364 -12.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.324 10.563 -13.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.183 11.137 -12.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.557 9.613 -12.744 1.00 0.00 H new ATOM 1224 N PHE A 78 -6.329 8.331 -7.588 1.00 0.00 N ATOM 1225 CA PHE A 78 -6.175 9.320 -6.535 1.00 0.00 C ATOM 1226 C PHE A 78 -6.449 10.730 -7.062 1.00 0.00 C ATOM 1227 O PHE A 78 -5.823 11.168 -8.026 1.00 0.00 O ATOM 1228 CB PHE A 78 -4.725 9.241 -6.054 1.00 0.00 C ATOM 1229 CG PHE A 78 -4.465 8.126 -5.039 1.00 0.00 C ATOM 1230 CD1 PHE A 78 -5.061 6.913 -5.194 1.00 0.00 C ATOM 1231 CD2 PHE A 78 -3.638 8.347 -3.983 1.00 0.00 C ATOM 1232 CE1 PHE A 78 -4.820 5.878 -4.252 1.00 0.00 C ATOM 1233 CE2 PHE A 78 -3.397 7.312 -3.041 1.00 0.00 C ATOM 1234 CZ PHE A 78 -3.993 6.100 -3.195 1.00 0.00 C ATOM 0 H PHE A 78 -5.589 8.336 -8.290 1.00 0.00 H new ATOM 0 HA PHE A 78 -6.882 9.118 -5.730 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.075 9.092 -6.916 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.449 10.196 -5.608 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -5.717 6.737 -6.033 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -3.164 9.310 -3.860 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -5.293 4.915 -4.375 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -2.740 7.488 -2.202 1.00 0.00 H new ATOM 0 HZ PHE A 78 -3.810 5.313 -2.478 1.00 0.00 H new ATOM 1244 N ILE A 79 -7.385 11.401 -6.407 1.00 0.00 N ATOM 1245 CA ILE A 79 -7.750 12.752 -6.798 1.00 0.00 C ATOM 1246 C ILE A 79 -6.936 13.753 -5.976 1.00 0.00 C ATOM 1247 O ILE A 79 -6.844 13.630 -4.756 1.00 0.00 O ATOM 1248 CB ILE A 79 -9.263 12.951 -6.689 1.00 0.00 C ATOM 1249 CG1 ILE A 79 -10.018 11.805 -7.364 1.00 0.00 C ATOM 1250 CG2 ILE A 79 -9.677 14.316 -7.243 1.00 0.00 C ATOM 1251 CD1 ILE A 79 -9.272 11.314 -8.607 1.00 0.00 C ATOM 0 H ILE A 79 -7.902 11.034 -5.608 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.505 12.926 -7.846 1.00 0.00 H new ATOM 0 HB ILE A 79 -9.534 12.936 -5.633 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -10.141 10.982 -6.660 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -11.018 12.138 -7.643 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -10.757 14.432 -7.154 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -9.179 15.104 -6.678 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -9.390 14.385 -8.292 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.830 10.499 -9.068 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -9.172 12.134 -9.319 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -8.282 10.959 -8.321 1.00 0.00 H new ATOM 1263 N ILE A 80 -6.367 14.722 -6.678 1.00 0.00 N ATOM 1264 CA ILE A 80 -5.564 15.744 -6.028 1.00 0.00 C ATOM 1265 C ILE A 80 -6.001 17.123 -6.526 1.00 0.00 C ATOM 1266 O ILE A 80 -5.783 17.466 -7.687 1.00 0.00 O ATOM 1267 CB ILE A 80 -4.074 15.462 -6.227 1.00 0.00 C ATOM 1268 CG1 ILE A 80 -3.742 14.006 -5.893 1.00 0.00 C ATOM 1269 CG2 ILE A 80 -3.218 16.444 -5.426 1.00 0.00 C ATOM 1270 CD1 ILE A 80 -3.466 13.837 -4.398 1.00 0.00 C ATOM 0 H ILE A 80 -6.446 14.821 -7.690 1.00 0.00 H new ATOM 0 HA ILE A 80 -5.726 15.728 -4.950 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.836 15.613 -7.280 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -4.571 13.363 -6.189 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -2.871 13.687 -6.466 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -2.163 16.221 -5.585 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.428 17.462 -5.755 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -3.452 16.350 -4.366 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -3.233 12.793 -4.187 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -2.621 14.463 -4.111 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -4.347 14.134 -3.829 1.00 0.00 H new ATOM 1282 N LYS A 81 -6.611 17.877 -5.623 1.00 0.00 N ATOM 1283 CA LYS A 81 -7.081 19.211 -5.956 1.00 0.00 C ATOM 1284 C LYS A 81 -6.024 20.237 -5.542 1.00 0.00 C ATOM 1285 O LYS A 81 -5.919 21.303 -6.147 1.00 0.00 O ATOM 1286 CB LYS A 81 -8.458 19.464 -5.340 1.00 0.00 C ATOM 1287 CG LYS A 81 -9.463 18.400 -5.789 1.00 0.00 C ATOM 1288 CD LYS A 81 -10.885 18.780 -5.372 1.00 0.00 C ATOM 1289 CE LYS A 81 -11.859 17.628 -5.634 1.00 0.00 C ATOM 1290 NZ LYS A 81 -13.121 18.139 -6.214 1.00 0.00 N ATOM 0 H LYS A 81 -6.791 17.589 -4.661 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.217 19.309 -7.033 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.380 19.460 -4.253 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.815 20.452 -5.631 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -9.416 18.284 -6.872 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.197 17.437 -5.354 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -10.900 19.041 -4.314 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.205 19.664 -5.923 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.405 16.907 -6.314 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.067 17.101 -4.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.771 17.345 -6.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.561 18.809 -5.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.919 18.622 -7.113 1.00 0.00 H new ATOM 1304 N LYS A 82 -5.269 19.880 -4.514 1.00 0.00 N ATOM 1305 CA LYS A 82 -4.225 20.756 -4.012 1.00 0.00 C ATOM 1306 C LYS A 82 -2.922 19.966 -3.878 1.00 0.00 C ATOM 1307 O LYS A 82 -2.581 19.504 -2.790 1.00 0.00 O ATOM 1308 CB LYS A 82 -4.671 21.432 -2.713 1.00 0.00 C ATOM 1309 CG LYS A 82 -5.962 22.225 -2.923 1.00 0.00 C ATOM 1310 CD LYS A 82 -5.936 23.534 -2.132 1.00 0.00 C ATOM 1311 CE LYS A 82 -6.291 24.723 -3.027 1.00 0.00 C ATOM 1312 NZ LYS A 82 -7.440 25.469 -2.466 1.00 0.00 N ATOM 0 H LYS A 82 -5.360 18.995 -4.015 1.00 0.00 H new ATOM 0 HA LYS A 82 -4.036 21.565 -4.717 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -4.825 20.678 -1.941 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -3.885 22.098 -2.357 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.093 22.439 -3.984 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -6.817 21.625 -2.611 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.641 23.476 -1.302 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.946 23.682 -1.700 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -5.430 25.385 -3.120 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -6.533 24.371 -4.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -7.668 26.273 -3.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -8.264 24.838 -2.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -7.196 25.821 -1.518 1.00 0.00 H new ATOM 1326 N PRO A 83 -2.211 19.830 -5.029 1.00 0.00 N ATOM 1327 CA PRO A 83 -0.953 19.104 -5.051 1.00 0.00 C ATOM 1328 C PRO A 83 0.168 19.928 -4.415 1.00 0.00 C ATOM 1329 O PRO A 83 1.182 19.378 -3.987 1.00 0.00 O ATOM 1330 CB PRO A 83 -0.703 18.794 -6.518 1.00 0.00 C ATOM 1331 CG PRO A 83 -1.582 19.754 -7.302 1.00 0.00 C ATOM 1332 CD PRO A 83 -2.584 20.364 -6.336 1.00 0.00 C ATOM 0 HA PRO A 83 -0.987 18.186 -4.464 1.00 0.00 H new ATOM 0 HB2 PRO A 83 0.348 18.930 -6.772 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -0.955 17.758 -6.747 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -0.977 20.533 -7.766 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -2.098 19.229 -8.106 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -2.533 21.453 -6.348 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -3.605 20.089 -6.599 1.00 0.00 H new ATOM 1340 N GLU A 84 -0.052 21.234 -4.372 1.00 0.00 N ATOM 1341 CA GLU A 84 0.926 22.140 -3.795 1.00 0.00 C ATOM 1342 C GLU A 84 1.041 21.907 -2.288 1.00 0.00 C ATOM 1343 O GLU A 84 2.002 22.348 -1.659 1.00 0.00 O ATOM 1344 CB GLU A 84 0.572 23.596 -4.100 1.00 0.00 C ATOM 1345 CG GLU A 84 -0.811 23.951 -3.548 1.00 0.00 C ATOM 1346 CD GLU A 84 -1.047 25.462 -3.590 1.00 0.00 C ATOM 1347 OE1 GLU A 84 -0.224 26.182 -2.984 1.00 0.00 O ATOM 1348 OE2 GLU A 84 -2.045 25.863 -4.227 1.00 0.00 O ATOM 0 H GLU A 84 -0.894 21.686 -4.728 1.00 0.00 H new ATOM 0 HA GLU A 84 1.895 21.934 -4.249 1.00 0.00 H new ATOM 0 HB2 GLU A 84 1.322 24.256 -3.664 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.591 23.761 -5.177 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.580 23.443 -4.130 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -0.900 23.594 -2.522 1.00 0.00 H new ATOM 1355 N MET A 85 0.048 21.214 -1.751 1.00 0.00 N ATOM 1356 CA MET A 85 0.025 20.917 -0.329 1.00 0.00 C ATOM 1357 C MET A 85 0.653 19.552 -0.043 1.00 0.00 C ATOM 1358 O MET A 85 0.875 19.196 1.113 1.00 0.00 O ATOM 1359 CB MET A 85 -1.420 20.929 0.173 1.00 0.00 C ATOM 1360 CG MET A 85 -1.940 22.361 0.315 1.00 0.00 C ATOM 1361 SD MET A 85 -3.692 22.345 0.652 1.00 0.00 S ATOM 1362 CE MET A 85 -3.679 21.743 2.332 1.00 0.00 C ATOM 0 H MET A 85 -0.747 20.849 -2.276 1.00 0.00 H new ATOM 0 HA MET A 85 0.606 21.679 0.191 1.00 0.00 H new ATOM 0 HB2 MET A 85 -2.054 20.375 -0.520 1.00 0.00 H new ATOM 0 HB3 MET A 85 -1.479 20.420 1.135 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.411 22.870 1.121 1.00 0.00 H new ATOM 0 HG3 MET A 85 -1.743 22.920 -0.599 1.00 0.00 H new ATOM 0 HE1 MET A 85 -4.652 21.920 2.790 1.00 0.00 H new ATOM 0 HE2 MET A 85 -3.466 20.674 2.334 1.00 0.00 H new ATOM 0 HE3 MET A 85 -2.910 22.267 2.900 1.00 0.00 H new ATOM 1372 N PHE A 86 0.923 18.824 -1.117 1.00 0.00 N ATOM 1373 CA PHE A 86 1.521 17.505 -0.997 1.00 0.00 C ATOM 1374 C PHE A 86 3.046 17.600 -0.924 1.00 0.00 C ATOM 1375 O PHE A 86 3.698 16.741 -0.332 1.00 0.00 O ATOM 1376 CB PHE A 86 1.130 16.721 -2.251 1.00 0.00 C ATOM 1377 CG PHE A 86 0.075 15.640 -2.006 1.00 0.00 C ATOM 1378 CD1 PHE A 86 -1.188 15.992 -1.645 1.00 0.00 C ATOM 1379 CD2 PHE A 86 0.401 14.327 -2.148 1.00 0.00 C ATOM 1380 CE1 PHE A 86 -2.167 14.989 -1.418 1.00 0.00 C ATOM 1381 CE2 PHE A 86 -0.578 13.324 -1.920 1.00 0.00 C ATOM 1382 CZ PHE A 86 -1.841 13.676 -1.560 1.00 0.00 C ATOM 0 H PHE A 86 0.738 19.123 -2.075 1.00 0.00 H new ATOM 0 HA PHE A 86 1.170 17.018 -0.087 1.00 0.00 H new ATOM 0 HB2 PHE A 86 0.754 17.418 -3.000 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.023 16.255 -2.669 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -1.446 17.034 -1.531 1.00 0.00 H new ATOM 0 HD2 PHE A 86 1.404 14.047 -2.434 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -3.170 15.269 -1.133 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -0.319 12.281 -2.033 1.00 0.00 H new ATOM 0 HZ PHE A 86 -2.586 12.913 -1.387 1.00 0.00 H new ATOM 1392 N GLU A 87 3.572 18.652 -1.534 1.00 0.00 N ATOM 1393 CA GLU A 87 5.008 18.870 -1.545 1.00 0.00 C ATOM 1394 C GLU A 87 5.609 18.526 -0.180 1.00 0.00 C ATOM 1395 O GLU A 87 6.563 17.754 -0.095 1.00 0.00 O ATOM 1396 CB GLU A 87 5.341 20.310 -1.942 1.00 0.00 C ATOM 1397 CG GLU A 87 6.215 20.344 -3.198 1.00 0.00 C ATOM 1398 CD GLU A 87 7.675 20.632 -2.841 1.00 0.00 C ATOM 1399 OE1 GLU A 87 8.130 20.077 -1.817 1.00 0.00 O ATOM 1400 OE2 GLU A 87 8.304 21.400 -3.601 1.00 0.00 O ATOM 0 H GLU A 87 3.029 19.363 -2.024 1.00 0.00 H new ATOM 0 HA GLU A 87 5.449 18.210 -2.291 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.420 20.864 -2.121 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.858 20.807 -1.121 1.00 0.00 H new ATOM 0 HG2 GLU A 87 6.146 19.390 -3.720 1.00 0.00 H new ATOM 0 HG3 GLU A 87 5.846 21.109 -3.882 1.00 0.00 H new ATOM 1407 N THR A 88 5.024 19.114 0.853 1.00 0.00 N ATOM 1408 CA THR A 88 5.490 18.879 2.209 1.00 0.00 C ATOM 1409 C THR A 88 5.650 17.379 2.465 1.00 0.00 C ATOM 1410 O THR A 88 6.609 16.955 3.109 1.00 0.00 O ATOM 1411 CB THR A 88 4.511 19.558 3.169 1.00 0.00 C ATOM 1412 OG1 THR A 88 4.857 20.938 3.099 1.00 0.00 O ATOM 1413 CG2 THR A 88 4.768 19.182 4.630 1.00 0.00 C ATOM 0 H THR A 88 4.232 19.752 0.778 1.00 0.00 H new ATOM 0 HA THR A 88 6.478 19.311 2.369 1.00 0.00 H new ATOM 0 HB THR A 88 3.490 19.287 2.899 1.00 0.00 H new ATOM 0 HG1 THR A 88 4.269 21.453 3.691 1.00 0.00 H new ATOM 0 HG21 THR A 88 4.046 19.691 5.269 1.00 0.00 H new ATOM 0 HG22 THR A 88 4.664 18.104 4.752 1.00 0.00 H new ATOM 0 HG23 THR A 88 5.777 19.483 4.911 1.00 0.00 H new ATOM 1421 N ALA A 89 4.698 16.617 1.948 1.00 0.00 N ATOM 1422 CA ALA A 89 4.721 15.174 2.112 1.00 0.00 C ATOM 1423 C ALA A 89 5.907 14.596 1.337 1.00 0.00 C ATOM 1424 O ALA A 89 6.738 13.887 1.903 1.00 0.00 O ATOM 1425 CB ALA A 89 3.385 14.586 1.656 1.00 0.00 C ATOM 0 H ALA A 89 3.905 16.972 1.414 1.00 0.00 H new ATOM 0 HA ALA A 89 4.852 14.910 3.161 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.403 13.503 1.779 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.578 15.006 2.257 1.00 0.00 H new ATOM 0 HB3 ALA A 89 3.220 14.829 0.606 1.00 0.00 H new ATOM 1431 N ILE A 90 5.948 14.921 0.053 1.00 0.00 N ATOM 1432 CA ILE A 90 7.018 14.443 -0.806 1.00 0.00 C ATOM 1433 C ILE A 90 8.368 14.801 -0.180 1.00 0.00 C ATOM 1434 O ILE A 90 9.306 14.007 -0.222 1.00 0.00 O ATOM 1435 CB ILE A 90 6.841 14.975 -2.230 1.00 0.00 C ATOM 1436 CG1 ILE A 90 5.518 14.498 -2.832 1.00 0.00 C ATOM 1437 CG2 ILE A 90 8.038 14.603 -3.107 1.00 0.00 C ATOM 1438 CD1 ILE A 90 4.677 15.682 -3.314 1.00 0.00 C ATOM 0 H ILE A 90 5.257 15.510 -0.413 1.00 0.00 H new ATOM 0 HA ILE A 90 6.982 13.357 -0.889 1.00 0.00 H new ATOM 0 HB ILE A 90 6.801 16.063 -2.186 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.716 13.824 -3.666 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.960 13.930 -2.088 1.00 0.00 H new ATOM 0 HG21 ILE A 90 7.887 14.993 -4.114 1.00 0.00 H new ATOM 0 HG22 ILE A 90 8.946 15.032 -2.684 1.00 0.00 H new ATOM 0 HG23 ILE A 90 8.135 13.518 -3.149 1.00 0.00 H new ATOM 0 HD11 ILE A 90 3.742 15.316 -3.738 1.00 0.00 H new ATOM 0 HD12 ILE A 90 4.461 16.341 -2.473 1.00 0.00 H new ATOM 0 HD13 ILE A 90 5.228 16.234 -4.075 1.00 0.00 H new ATOM 1450 N LYS A 91 8.422 15.997 0.387 1.00 0.00 N ATOM 1451 CA LYS A 91 9.641 16.470 1.022 1.00 0.00 C ATOM 1452 C LYS A 91 10.109 15.438 2.050 1.00 0.00 C ATOM 1453 O LYS A 91 11.186 14.861 1.910 1.00 0.00 O ATOM 1454 CB LYS A 91 9.433 17.869 1.605 1.00 0.00 C ATOM 1455 CG LYS A 91 9.850 18.948 0.604 1.00 0.00 C ATOM 1456 CD LYS A 91 10.606 20.081 1.302 1.00 0.00 C ATOM 1457 CE LYS A 91 9.844 21.402 1.183 1.00 0.00 C ATOM 1458 NZ LYS A 91 9.782 22.085 2.495 1.00 0.00 N ATOM 0 H LYS A 91 7.642 16.653 0.420 1.00 0.00 H new ATOM 0 HA LYS A 91 10.439 16.572 0.287 1.00 0.00 H new ATOM 0 HB2 LYS A 91 8.385 18.003 1.874 1.00 0.00 H new ATOM 0 HB3 LYS A 91 10.013 17.975 2.522 1.00 0.00 H new ATOM 0 HG2 LYS A 91 10.480 18.508 -0.169 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.967 19.348 0.106 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.750 19.833 2.354 1.00 0.00 H new ATOM 0 HD3 LYS A 91 11.597 20.188 0.861 1.00 0.00 H new ATOM 0 HE2 LYS A 91 10.334 22.047 0.454 1.00 0.00 H new ATOM 0 HE3 LYS A 91 8.835 21.215 0.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 9.261 22.980 2.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 9.294 21.475 3.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 10.747 22.281 2.830 1.00 0.00 H new ATOM 1472 N GLU A 92 9.275 15.236 3.060 1.00 0.00 N ATOM 1473 CA GLU A 92 9.590 14.284 4.111 1.00 0.00 C ATOM 1474 C GLU A 92 9.524 12.854 3.570 1.00 0.00 C ATOM 1475 O GLU A 92 10.552 12.197 3.414 1.00 0.00 O ATOM 1476 CB GLU A 92 8.655 14.460 5.309 1.00 0.00 C ATOM 1477 CG GLU A 92 8.862 15.825 5.970 1.00 0.00 C ATOM 1478 CD GLU A 92 7.960 15.983 7.195 1.00 0.00 C ATOM 1479 OE1 GLU A 92 6.817 15.483 7.127 1.00 0.00 O ATOM 1480 OE2 GLU A 92 8.435 16.600 8.173 1.00 0.00 O ATOM 0 H GLU A 92 8.382 15.715 3.172 1.00 0.00 H new ATOM 0 HA GLU A 92 10.607 14.475 4.454 1.00 0.00 H new ATOM 0 HB2 GLU A 92 7.619 14.363 4.984 1.00 0.00 H new ATOM 0 HB3 GLU A 92 8.837 13.668 6.036 1.00 0.00 H new ATOM 0 HG2 GLU A 92 9.905 15.936 6.265 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.648 16.617 5.252 1.00 0.00 H new ATOM 1487 N SER A 93 8.304 12.415 3.298 1.00 0.00 N ATOM 1488 CA SER A 93 8.090 11.075 2.777 1.00 0.00 C ATOM 1489 C SER A 93 8.682 10.040 3.735 1.00 0.00 C ATOM 1490 O SER A 93 9.901 9.931 3.860 1.00 0.00 O ATOM 1491 CB SER A 93 8.703 10.921 1.384 1.00 0.00 C ATOM 1492 OG SER A 93 8.609 9.583 0.904 1.00 0.00 O ATOM 0 H SER A 93 7.454 12.963 3.428 1.00 0.00 H new ATOM 0 HA SER A 93 7.016 10.909 2.692 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.197 11.592 0.689 1.00 0.00 H new ATOM 0 HB3 SER A 93 9.750 11.223 1.413 1.00 0.00 H new ATOM 0 HG SER A 93 9.010 9.527 0.012 1.00 0.00 H new ATOM 1498 N SER A 94 7.792 9.307 4.387 1.00 0.00 N ATOM 1499 CA SER A 94 8.212 8.284 5.331 1.00 0.00 C ATOM 1500 C SER A 94 8.990 8.923 6.483 1.00 0.00 C ATOM 1501 O SER A 94 10.204 9.103 6.392 1.00 0.00 O ATOM 1502 CB SER A 94 9.064 7.216 4.642 1.00 0.00 C ATOM 1503 OG SER A 94 8.396 5.959 4.580 1.00 0.00 O ATOM 0 H SER A 94 6.782 9.401 4.281 1.00 0.00 H new ATOM 0 HA SER A 94 7.321 7.798 5.729 1.00 0.00 H new ATOM 0 HB2 SER A 94 9.312 7.545 3.633 1.00 0.00 H new ATOM 0 HB3 SER A 94 10.005 7.100 5.180 1.00 0.00 H new ATOM 0 HG SER A 94 8.971 5.304 4.132 1.00 0.00 H new ATOM 1509 N GLY A 95 8.260 9.248 7.539 1.00 0.00 N ATOM 1510 CA GLY A 95 8.867 9.863 8.708 1.00 0.00 C ATOM 1511 C GLY A 95 9.104 11.357 8.481 1.00 0.00 C ATOM 1512 O GLY A 95 9.808 11.744 7.549 1.00 0.00 O ATOM 0 H GLY A 95 7.254 9.097 7.610 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.221 9.721 9.575 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.813 9.371 8.932 1.00 0.00 H new ATOM 1516 N PRO A 96 8.485 12.179 9.371 1.00 0.00 N ATOM 1517 CA PRO A 96 8.621 13.622 9.277 1.00 0.00 C ATOM 1518 C PRO A 96 10.000 14.076 9.762 1.00 0.00 C ATOM 1519 O PRO A 96 10.211 14.257 10.960 1.00 0.00 O ATOM 1520 CB PRO A 96 7.483 14.180 10.115 1.00 0.00 C ATOM 1521 CG PRO A 96 7.036 13.044 11.020 1.00 0.00 C ATOM 1522 CD PRO A 96 7.644 11.757 10.487 1.00 0.00 C ATOM 0 HA PRO A 96 8.557 13.984 8.251 1.00 0.00 H new ATOM 0 HB2 PRO A 96 7.813 15.038 10.700 1.00 0.00 H new ATOM 0 HB3 PRO A 96 6.663 14.521 9.483 1.00 0.00 H new ATOM 0 HG2 PRO A 96 7.359 13.223 12.045 1.00 0.00 H new ATOM 0 HG3 PRO A 96 5.948 12.974 11.036 1.00 0.00 H new ATOM 0 HD2 PRO A 96 8.229 11.248 11.253 1.00 0.00 H new ATOM 0 HD3 PRO A 96 6.872 11.060 10.160 1.00 0.00 H new ATOM 1530 N SER A 97 10.901 14.247 8.807 1.00 0.00 N ATOM 1531 CA SER A 97 12.253 14.676 9.122 1.00 0.00 C ATOM 1532 C SER A 97 12.950 13.621 9.982 1.00 0.00 C ATOM 1533 O SER A 97 12.379 13.133 10.957 1.00 0.00 O ATOM 1534 CB SER A 97 12.249 16.028 9.839 1.00 0.00 C ATOM 1535 OG SER A 97 13.510 16.320 10.434 1.00 0.00 O ATOM 0 H SER A 97 10.722 14.096 7.814 1.00 0.00 H new ATOM 0 HA SER A 97 12.801 14.793 8.187 1.00 0.00 H new ATOM 0 HB2 SER A 97 11.992 16.814 9.129 1.00 0.00 H new ATOM 0 HB3 SER A 97 11.476 16.028 10.608 1.00 0.00 H new ATOM 0 HG SER A 97 13.467 17.192 10.880 1.00 0.00 H new ATOM 1541 N SER A 98 14.175 13.299 9.591 1.00 0.00 N ATOM 1542 CA SER A 98 14.955 12.310 10.315 1.00 0.00 C ATOM 1543 C SER A 98 16.446 12.635 10.202 1.00 0.00 C ATOM 1544 O SER A 98 17.136 12.105 9.332 1.00 0.00 O ATOM 1545 CB SER A 98 14.679 10.899 9.792 1.00 0.00 C ATOM 1546 OG SER A 98 15.511 9.925 10.416 1.00 0.00 O ATOM 0 H SER A 98 14.646 13.706 8.783 1.00 0.00 H new ATOM 0 HA SER A 98 14.660 12.343 11.364 1.00 0.00 H new ATOM 0 HB2 SER A 98 13.633 10.647 9.965 1.00 0.00 H new ATOM 0 HB3 SER A 98 14.838 10.875 8.714 1.00 0.00 H new ATOM 0 HG SER A 98 15.303 9.038 10.056 1.00 0.00 H new ATOM 1552 N GLY A 99 16.899 13.505 11.093 1.00 0.00 N ATOM 1553 CA GLY A 99 18.295 13.907 11.104 1.00 0.00 C ATOM 1554 C GLY A 99 19.158 12.872 11.828 1.00 0.00 C ATOM 1555 O GLY A 99 19.319 12.934 13.046 1.00 0.00 O ATOM 0 H GLY A 99 16.324 13.943 11.813 1.00 0.00 H new ATOM 0 HA2 GLY A 99 18.650 14.030 10.081 1.00 0.00 H new ATOM 0 HA3 GLY A 99 18.394 14.875 11.594 1.00 0.00 H new TER 1559 GLY A 99