USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1024 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 19 MET CE :methyl -140:sc= -1.15 (180deg=-0.845) USER MOD Set 1.2: A 115 MET CE :methyl -115:sc= -1.41 (180deg=-0.665) USER MOD Set 2.1: A 88 SER OG : rot -150:sc= 0 USER MOD Set 2.2: A 110 HIS :FLIP no HD1:sc= -0.695 F(o=-1.6!,f=-0.69) USER MOD Set 3.1: A 55 LYS NZ :NH3+ 179:sc= 0 (180deg=0) USER MOD Set 3.2: A 108 GLN :FLIP amide:sc= -0.969 F(o=-3.1!,f=-0.97) USER MOD Set 4.1: A 94 HIS : no HD1:sc= -0.361 K(o=-0.5,f=-1.2) USER MOD Set 4.2: A 97 LYS NZ :NH3+ -131:sc= -0.141 (180deg=-0.646) USER MOD Set 5.1: A 41 SER OG : rot -15:sc= 0.0691! USER MOD Set 5.2: A 44 ASN : amide:sc= 0 K(o=0.069,f=-1.3) USER MOD Set 6.1: A 10 GLN : amide:sc= -0.334 X(o=-0.41,f=-0.38) USER MOD Set 6.2: A 13 LYS NZ :NH3+ -155:sc= -0.0789 (180deg=-0.818) USER MOD Single : A 9 GLN : amide:sc= -0.0232 K(o=-0.023,f=-0.78) USER MOD Single : A 24 LYS NZ :NH3+ -105:sc= -0.985 (180deg=-3.34!) USER MOD Single : A 31 GLN : amide:sc= -1.14 K(o=-1.1,f=-4.7!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 160:sc=-0.00466 USER MOD Single : A 56 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0198) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0.11) USER MOD Single : A 80 SER OG : rot 122:sc= 0.589 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 130:sc= -0.0569 USER MOD Single : A 93 THR OG1 : rot 74:sc= 0.53 USER MOD Single : A 95 ASN : amide:sc= -4.56! C(o=-4.6!,f=-5!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -134:sc= 0.0329 USER MOD Single : A 112 TYR OH : rot 43:sc= -0.0824 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.278) USER MOD Single : A 117 SER OG : rot -45:sc= 0.6 USER MOD Single : A 119 SER OG : rot 180:sc= 0.0282 USER MOD Single : A 120 TYR OH : rot -16:sc= 0.541 USER MOD Single : A 126 SER OG : rot 126:sc= 1.41 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot -30:sc= -1.86 USER MOD Single : A 130 GLN : amide:sc= -0.0701 K(o=-0.07,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -18.903 8.799 2.118 1.00 0.00 N ATOM 78 CA GLN A 9 -19.009 7.960 0.930 1.00 0.00 C ATOM 79 C GLN A 9 -18.332 8.622 -0.266 1.00 0.00 C ATOM 80 O GLN A 9 -17.527 7.998 -0.958 1.00 0.00 O ATOM 81 CB GLN A 9 -20.477 7.678 0.608 1.00 0.00 C ATOM 82 CG GLN A 9 -20.686 6.995 -0.734 1.00 0.00 C ATOM 83 CD GLN A 9 -22.093 6.458 -0.903 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.693 5.947 0.044 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.629 6.571 -2.112 1.00 0.00 N ATOM 0 HA GLN A 9 -18.502 7.017 1.136 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.899 7.052 1.394 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -21.029 8.618 0.618 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.473 7.703 -1.535 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.974 6.176 -0.835 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -22.096 7.001 -2.868 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.574 6.228 -2.285 1.00 0.00 H new ATOM 94 N GLN A 10 -18.663 9.887 -0.502 1.00 0.00 N ATOM 95 CA GLN A 10 -18.087 10.632 -1.615 1.00 0.00 C ATOM 96 C GLN A 10 -16.571 10.728 -1.480 1.00 0.00 C ATOM 97 O GLN A 10 -15.839 10.546 -2.453 1.00 0.00 O ATOM 98 CB GLN A 10 -18.695 12.034 -1.687 1.00 0.00 C ATOM 99 CG GLN A 10 -20.184 12.037 -1.990 1.00 0.00 C ATOM 100 CD GLN A 10 -20.558 11.063 -3.090 1.00 0.00 C ATOM 101 OE1 GLN A 10 -20.269 11.294 -4.264 1.00 0.00 O ATOM 102 NE2 GLN A 10 -21.204 9.965 -2.714 1.00 0.00 N ATOM 0 H GLN A 10 -19.327 10.417 0.062 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.318 10.096 -2.536 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.525 12.544 -0.739 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -18.175 12.607 -2.455 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -20.736 11.785 -1.084 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -20.490 13.042 -2.281 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -21.423 9.814 -1.729 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.481 9.273 -3.410 1.00 0.00 H new ATOM 111 N ARG A 11 -16.107 11.014 -0.268 1.00 0.00 N ATOM 112 CA ARG A 11 -14.678 11.135 -0.006 1.00 0.00 C ATOM 113 C ARG A 11 -13.942 9.859 -0.404 1.00 0.00 C ATOM 114 O ARG A 11 -12.932 9.906 -1.105 1.00 0.00 O ATOM 115 CB ARG A 11 -14.434 11.438 1.474 1.00 0.00 C ATOM 116 CG ARG A 11 -13.017 11.901 1.774 1.00 0.00 C ATOM 117 CD ARG A 11 -12.940 12.626 3.109 1.00 0.00 C ATOM 118 NE ARG A 11 -11.712 13.407 3.237 1.00 0.00 N ATOM 119 CZ ARG A 11 -11.599 14.669 2.839 1.00 0.00 C ATOM 120 NH1 ARG A 11 -12.634 15.291 2.292 1.00 0.00 N ATOM 121 NH2 ARG A 11 -10.448 15.313 2.990 1.00 0.00 N ATOM 0 H ARG A 11 -16.700 11.166 0.548 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.292 11.958 -0.607 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.135 12.206 1.800 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.647 10.544 2.059 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.347 11.041 1.786 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -12.673 12.562 0.979 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -13.802 13.285 3.214 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.994 11.900 3.920 1.00 0.00 H new ATOM 0 HE ARG A 11 -10.897 12.958 3.655 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.521 14.800 2.176 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -12.544 16.260 1.987 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -9.650 14.839 3.412 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -10.362 16.282 2.684 1.00 0.00 H new ATOM 135 N VAL A 12 -14.456 8.720 0.050 1.00 0.00 N ATOM 136 CA VAL A 12 -13.848 7.431 -0.259 1.00 0.00 C ATOM 137 C VAL A 12 -13.550 7.307 -1.749 1.00 0.00 C ATOM 138 O VAL A 12 -12.400 7.129 -2.150 1.00 0.00 O ATOM 139 CB VAL A 12 -14.758 6.265 0.170 1.00 0.00 C ATOM 140 CG1 VAL A 12 -14.147 4.933 -0.238 1.00 0.00 C ATOM 141 CG2 VAL A 12 -15.008 6.309 1.670 1.00 0.00 C ATOM 0 H VAL A 12 -15.291 8.664 0.633 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.914 7.379 0.301 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.717 6.369 -0.338 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -14.804 4.121 0.073 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.024 4.906 -1.321 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -13.175 4.817 0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.653 5.478 1.956 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -14.059 6.230 2.200 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -15.492 7.250 1.931 1.00 0.00 H new ATOM 151 N LYS A 13 -14.593 7.404 -2.565 1.00 0.00 N ATOM 152 CA LYS A 13 -14.445 7.304 -4.012 1.00 0.00 C ATOM 153 C LYS A 13 -13.249 8.120 -4.494 1.00 0.00 C ATOM 154 O LYS A 13 -12.446 7.646 -5.297 1.00 0.00 O ATOM 155 CB LYS A 13 -15.718 7.785 -4.711 1.00 0.00 C ATOM 156 CG LYS A 13 -15.952 7.137 -6.064 1.00 0.00 C ATOM 157 CD LYS A 13 -17.434 6.966 -6.352 1.00 0.00 C ATOM 158 CE LYS A 13 -18.044 8.241 -6.914 1.00 0.00 C ATOM 159 NZ LYS A 13 -18.280 9.258 -5.852 1.00 0.00 N ATOM 0 H LYS A 13 -15.551 7.552 -2.249 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.274 6.257 -4.263 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.574 7.582 -4.068 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.665 8.866 -4.840 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -15.497 7.747 -6.844 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.460 6.165 -6.093 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -17.576 6.150 -7.061 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.954 6.686 -5.436 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.382 8.656 -7.674 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -18.987 8.006 -7.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -19.042 9.900 -6.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -18.554 8.781 -4.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -17.409 9.804 -5.694 1.00 0.00 H new ATOM 173 N ARG A 14 -13.137 9.347 -3.997 1.00 0.00 N ATOM 174 CA ARG A 14 -12.039 10.228 -4.377 1.00 0.00 C ATOM 175 C ARG A 14 -10.742 9.441 -4.538 1.00 0.00 C ATOM 176 O ARG A 14 -9.884 9.798 -5.346 1.00 0.00 O ATOM 177 CB ARG A 14 -11.854 11.328 -3.330 1.00 0.00 C ATOM 178 CG ARG A 14 -11.313 12.628 -3.901 1.00 0.00 C ATOM 179 CD ARG A 14 -12.311 13.280 -4.846 1.00 0.00 C ATOM 180 NE ARG A 14 -12.020 14.695 -5.059 1.00 0.00 N ATOM 181 CZ ARG A 14 -11.277 15.149 -6.062 1.00 0.00 C ATOM 182 NH1 ARG A 14 -10.754 14.303 -6.940 1.00 0.00 N ATOM 183 NH2 ARG A 14 -11.057 16.451 -6.190 1.00 0.00 N ATOM 0 H ARG A 14 -13.793 9.754 -3.330 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.288 10.685 -5.335 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.812 11.524 -2.848 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -11.175 10.971 -2.556 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -11.079 13.314 -3.087 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -10.381 12.433 -4.432 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -12.297 12.759 -5.803 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -13.317 13.174 -4.440 1.00 0.00 H new ATOM 0 HE ARG A 14 -12.408 15.372 -4.402 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -10.922 13.301 -6.846 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -10.184 14.654 -7.709 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -11.459 17.105 -5.518 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -10.486 16.798 -6.961 1.00 0.00 H new ATOM 197 N TRP A 15 -10.605 8.371 -3.764 1.00 0.00 N ATOM 198 CA TRP A 15 -9.412 7.534 -3.820 1.00 0.00 C ATOM 199 C TRP A 15 -9.397 6.692 -5.092 1.00 0.00 C ATOM 200 O TRP A 15 -8.453 6.756 -5.878 1.00 0.00 O ATOM 201 CB TRP A 15 -9.343 6.625 -2.592 1.00 0.00 C ATOM 202 CG TRP A 15 -9.732 7.315 -1.320 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.498 8.619 -0.990 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.422 6.736 -0.207 1.00 0.00 C ATOM 205 NE1 TRP A 15 -10.001 8.886 0.260 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.573 7.747 0.762 1.00 0.00 C ATOM 207 CE3 TRP A 15 -10.929 5.462 0.065 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -11.209 7.522 1.980 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.559 5.240 1.274 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.695 6.265 2.219 1.00 0.00 C ATOM 0 H TRP A 15 -11.305 8.062 -3.090 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.540 8.188 -3.829 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -9.998 5.767 -2.747 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.329 6.238 -2.492 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.992 9.336 -1.620 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.956 9.786 0.737 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -10.830 4.665 -0.657 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -11.315 8.311 2.710 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -11.954 4.259 1.495 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -12.193 6.059 3.155 1.00 0.00 H new ATOM 221 N GLY A 16 -10.450 5.904 -5.288 1.00 0.00 N ATOM 222 CA GLY A 16 -10.537 5.062 -6.466 1.00 0.00 C ATOM 223 C GLY A 16 -9.959 5.728 -7.699 1.00 0.00 C ATOM 224 O GLY A 16 -9.369 5.065 -8.553 1.00 0.00 O ATOM 0 H GLY A 16 -11.244 5.834 -4.652 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.008 4.127 -6.280 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.581 4.807 -6.650 1.00 0.00 H new ATOM 228 N PHE A 17 -10.129 7.043 -7.794 1.00 0.00 N ATOM 229 CA PHE A 17 -9.622 7.799 -8.933 1.00 0.00 C ATOM 230 C PHE A 17 -8.180 7.409 -9.246 1.00 0.00 C ATOM 231 O PHE A 17 -7.818 7.204 -10.404 1.00 0.00 O ATOM 232 CB PHE A 17 -9.707 9.301 -8.654 1.00 0.00 C ATOM 233 CG PHE A 17 -11.112 9.830 -8.647 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.934 9.635 -7.549 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.611 10.524 -9.738 1.00 0.00 C ATOM 236 CE1 PHE A 17 -13.228 10.121 -7.540 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.904 11.012 -9.734 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.713 10.811 -8.633 1.00 0.00 C ATOM 0 H PHE A 17 -10.614 7.607 -7.096 1.00 0.00 H new ATOM 0 HA PHE A 17 -10.240 7.562 -9.799 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.244 9.510 -7.690 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -9.130 9.836 -9.408 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -11.560 9.097 -6.690 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -10.982 10.685 -10.601 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -13.859 9.961 -6.678 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.281 11.550 -10.591 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.723 11.193 -8.627 1.00 0.00 H new ATOM 248 N GLY A 18 -7.361 7.309 -8.204 1.00 0.00 N ATOM 249 CA GLY A 18 -5.968 6.945 -8.388 1.00 0.00 C ATOM 250 C GLY A 18 -5.186 6.971 -7.090 1.00 0.00 C ATOM 251 O GLY A 18 -5.566 7.658 -6.142 1.00 0.00 O ATOM 0 H GLY A 18 -7.637 7.473 -7.236 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.911 5.947 -8.823 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -5.508 7.630 -9.100 1.00 0.00 H new ATOM 255 N MET A 19 -4.091 6.219 -7.045 1.00 0.00 N ATOM 256 CA MET A 19 -3.253 6.159 -5.852 1.00 0.00 C ATOM 257 C MET A 19 -2.941 7.560 -5.336 1.00 0.00 C ATOM 258 O MET A 19 -3.275 7.902 -4.201 1.00 0.00 O ATOM 259 CB MET A 19 -1.953 5.412 -6.154 1.00 0.00 C ATOM 260 CG MET A 19 -1.281 4.838 -4.917 1.00 0.00 C ATOM 261 SD MET A 19 -0.009 3.624 -5.317 1.00 0.00 S ATOM 262 CE MET A 19 1.233 4.672 -6.070 1.00 0.00 C ATOM 0 H MET A 19 -3.763 5.643 -7.820 1.00 0.00 H new ATOM 0 HA MET A 19 -3.802 5.621 -5.079 1.00 0.00 H new ATOM 0 HB2 MET A 19 -2.163 4.602 -6.853 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.261 6.091 -6.652 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.835 5.649 -4.341 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.035 4.373 -4.282 1.00 0.00 H new ATOM 0 HE1 MET A 19 1.668 4.161 -6.929 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.773 5.604 -6.397 1.00 0.00 H new ATOM 0 HE3 MET A 19 2.015 4.890 -5.343 1.00 0.00 H new ATOM 272 N ASP A 20 -2.300 8.366 -6.175 1.00 0.00 N ATOM 273 CA ASP A 20 -1.944 9.730 -5.803 1.00 0.00 C ATOM 274 C ASP A 20 -2.977 10.321 -4.849 1.00 0.00 C ATOM 275 O ASP A 20 -2.630 11.031 -3.906 1.00 0.00 O ATOM 276 CB ASP A 20 -1.823 10.606 -7.051 1.00 0.00 C ATOM 277 CG ASP A 20 -0.460 10.497 -7.706 1.00 0.00 C ATOM 278 OD1 ASP A 20 0.553 10.708 -7.006 1.00 0.00 O ATOM 279 OD2 ASP A 20 -0.406 10.201 -8.917 1.00 0.00 O ATOM 0 H ASP A 20 -2.016 8.098 -7.117 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.981 9.702 -5.293 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.592 10.319 -7.769 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.011 11.645 -6.781 1.00 0.00 H new ATOM 284 N GLU A 21 -4.248 10.023 -5.103 1.00 0.00 N ATOM 285 CA GLU A 21 -5.331 10.526 -4.267 1.00 0.00 C ATOM 286 C GLU A 21 -5.478 9.686 -3.002 1.00 0.00 C ATOM 287 O GLU A 21 -5.364 10.197 -1.888 1.00 0.00 O ATOM 288 CB GLU A 21 -6.648 10.528 -5.047 1.00 0.00 C ATOM 289 CG GLU A 21 -6.592 11.335 -6.333 1.00 0.00 C ATOM 290 CD GLU A 21 -6.509 12.829 -6.082 1.00 0.00 C ATOM 291 OE1 GLU A 21 -5.700 13.243 -5.226 1.00 0.00 O ATOM 292 OE2 GLU A 21 -7.255 13.583 -6.742 1.00 0.00 O ATOM 0 H GLU A 21 -4.552 9.436 -5.880 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.087 11.548 -3.977 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.921 9.500 -5.285 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.437 10.929 -4.411 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -5.728 11.020 -6.918 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.477 11.120 -6.931 1.00 0.00 H new ATOM 299 N ALA A 22 -5.733 8.394 -3.183 1.00 0.00 N ATOM 300 CA ALA A 22 -5.894 7.483 -2.057 1.00 0.00 C ATOM 301 C ALA A 22 -4.825 7.725 -0.997 1.00 0.00 C ATOM 302 O ALA A 22 -5.090 7.621 0.202 1.00 0.00 O ATOM 303 CB ALA A 22 -5.848 6.039 -2.536 1.00 0.00 C ATOM 0 H ALA A 22 -5.832 7.955 -4.098 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.867 7.674 -1.604 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.969 5.369 -1.685 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.653 5.867 -3.251 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.889 5.845 -3.016 1.00 0.00 H new ATOM 309 N LEU A 23 -3.617 8.048 -1.445 1.00 0.00 N ATOM 310 CA LEU A 23 -2.506 8.304 -0.534 1.00 0.00 C ATOM 311 C LEU A 23 -2.778 9.537 0.321 1.00 0.00 C ATOM 312 O LEU A 23 -2.762 9.470 1.551 1.00 0.00 O ATOM 313 CB LEU A 23 -1.208 8.491 -1.321 1.00 0.00 C ATOM 314 CG LEU A 23 -0.830 7.354 -2.272 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.337 7.764 -3.156 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.492 6.094 -1.489 1.00 0.00 C ATOM 0 H LEU A 23 -3.381 8.139 -2.433 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.402 7.442 0.125 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.287 9.411 -1.900 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.393 8.630 -0.611 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.686 7.141 -2.912 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.592 6.943 -3.826 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.058 8.639 -3.744 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.198 8.005 -2.533 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.226 5.296 -2.182 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.349 6.293 -0.824 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.357 5.789 -0.899 1.00 0.00 H new ATOM 328 N LYS A 24 -3.028 10.664 -0.337 1.00 0.00 N ATOM 329 CA LYS A 24 -3.306 11.913 0.362 1.00 0.00 C ATOM 330 C LYS A 24 -4.172 11.667 1.593 1.00 0.00 C ATOM 331 O LYS A 24 -4.003 12.319 2.623 1.00 0.00 O ATOM 332 CB LYS A 24 -4.004 12.901 -0.576 1.00 0.00 C ATOM 333 CG LYS A 24 -5.520 12.808 -0.539 1.00 0.00 C ATOM 334 CD LYS A 24 -6.137 13.245 -1.857 1.00 0.00 C ATOM 335 CE LYS A 24 -7.420 12.482 -2.152 1.00 0.00 C ATOM 336 NZ LYS A 24 -8.268 13.189 -3.151 1.00 0.00 N ATOM 0 H LYS A 24 -3.044 10.738 -1.354 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.356 12.338 0.687 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -3.704 13.915 -0.311 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.662 12.724 -1.596 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.817 11.783 -0.319 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.904 13.431 0.268 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.347 14.314 -1.825 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.423 13.085 -2.665 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.174 11.487 -2.524 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.983 12.347 -1.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.075 13.633 -2.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.705 13.921 -3.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.617 12.507 -3.854 1.00 0.00 H new ATOM 350 N ASP A 25 -5.098 10.721 1.480 1.00 0.00 N ATOM 351 CA ASP A 25 -5.989 10.386 2.585 1.00 0.00 C ATOM 352 C ASP A 25 -5.362 9.326 3.486 1.00 0.00 C ATOM 353 O ASP A 25 -4.713 8.388 3.023 1.00 0.00 O ATOM 354 CB ASP A 25 -7.334 9.890 2.052 1.00 0.00 C ATOM 355 CG ASP A 25 -8.399 9.836 3.129 1.00 0.00 C ATOM 356 OD1 ASP A 25 -8.499 8.795 3.812 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.133 10.834 3.289 1.00 0.00 O ATOM 0 H ASP A 25 -5.251 10.172 0.634 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.152 11.288 3.175 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.667 10.546 1.248 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.207 8.897 1.621 1.00 0.00 H new ATOM 362 N PRO A 26 -5.559 9.478 4.804 1.00 0.00 N ATOM 363 CA PRO A 26 -5.021 8.544 5.797 1.00 0.00 C ATOM 364 C PRO A 26 -5.713 7.186 5.751 1.00 0.00 C ATOM 365 O PRO A 26 -5.058 6.144 5.759 1.00 0.00 O ATOM 366 CB PRO A 26 -5.303 9.242 7.130 1.00 0.00 C ATOM 367 CG PRO A 26 -6.470 10.127 6.855 1.00 0.00 C ATOM 368 CD PRO A 26 -6.323 10.573 5.426 1.00 0.00 C ATOM 0 HA PRO A 26 -3.966 8.331 5.626 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.530 8.520 7.915 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.440 9.817 7.466 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.408 9.593 7.003 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.480 10.982 7.532 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.292 10.710 4.946 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.794 11.523 5.354 1.00 0.00 H new ATOM 376 N VAL A 27 -7.042 7.205 5.702 1.00 0.00 N ATOM 377 CA VAL A 27 -7.823 5.975 5.652 1.00 0.00 C ATOM 378 C VAL A 27 -7.522 5.184 4.384 1.00 0.00 C ATOM 379 O VAL A 27 -7.295 3.976 4.432 1.00 0.00 O ATOM 380 CB VAL A 27 -9.334 6.266 5.716 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.134 4.999 5.457 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.702 6.873 7.062 1.00 0.00 C ATOM 0 H VAL A 27 -7.600 8.059 5.696 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.538 5.384 6.522 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.581 6.988 4.937 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.199 5.225 5.506 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.891 4.611 4.468 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -9.886 4.252 6.211 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -10.773 7.073 7.090 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.441 6.176 7.859 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.155 7.806 7.202 1.00 0.00 H new ATOM 392 N GLY A 28 -7.522 5.875 3.248 1.00 0.00 N ATOM 393 CA GLY A 28 -7.248 5.221 1.982 1.00 0.00 C ATOM 394 C GLY A 28 -5.880 4.568 1.951 1.00 0.00 C ATOM 395 O GLY A 28 -5.669 3.587 1.237 1.00 0.00 O ATOM 0 H GLY A 28 -7.707 6.876 3.182 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.012 4.466 1.794 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.317 5.952 1.176 1.00 0.00 H new ATOM 399 N ARG A 29 -4.948 5.114 2.725 1.00 0.00 N ATOM 400 CA ARG A 29 -3.593 4.580 2.781 1.00 0.00 C ATOM 401 C ARG A 29 -3.583 3.185 3.399 1.00 0.00 C ATOM 402 O ARG A 29 -2.971 2.262 2.862 1.00 0.00 O ATOM 403 CB ARG A 29 -2.687 5.513 3.587 1.00 0.00 C ATOM 404 CG ARG A 29 -2.020 6.590 2.747 1.00 0.00 C ATOM 405 CD ARG A 29 -0.796 7.163 3.445 1.00 0.00 C ATOM 406 NE ARG A 29 -1.128 7.736 4.747 1.00 0.00 N ATOM 407 CZ ARG A 29 -0.276 7.788 5.765 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.951 7.304 5.633 1.00 0.00 N ATOM 409 NH2 ARG A 29 -0.651 8.326 6.918 1.00 0.00 N ATOM 0 H ARG A 29 -5.107 5.926 3.322 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.215 4.509 1.761 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.275 5.989 4.372 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -1.917 4.920 4.081 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.728 6.173 1.783 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.733 7.390 2.546 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.051 6.378 3.574 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.345 7.930 2.815 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.065 8.117 4.882 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.243 6.890 4.748 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.603 7.346 6.417 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -1.594 8.700 7.023 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.004 8.366 7.699 1.00 0.00 H new ATOM 423 N GLU A 30 -4.265 3.040 4.531 1.00 0.00 N ATOM 424 CA GLU A 30 -4.333 1.758 5.222 1.00 0.00 C ATOM 425 C GLU A 30 -5.255 0.791 4.485 1.00 0.00 C ATOM 426 O GLU A 30 -4.953 -0.395 4.358 1.00 0.00 O ATOM 427 CB GLU A 30 -4.824 1.953 6.658 1.00 0.00 C ATOM 428 CG GLU A 30 -6.338 1.969 6.788 1.00 0.00 C ATOM 429 CD GLU A 30 -6.799 2.233 8.208 1.00 0.00 C ATOM 430 OE1 GLU A 30 -6.141 1.741 9.148 1.00 0.00 O ATOM 431 OE2 GLU A 30 -7.820 2.933 8.378 1.00 0.00 O ATOM 0 H GLU A 30 -4.778 3.794 4.988 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.330 1.332 5.243 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.423 1.154 7.282 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.425 2.890 7.045 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -6.747 2.735 6.129 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.738 1.012 6.452 1.00 0.00 H new ATOM 438 N GLN A 31 -6.381 1.307 4.003 1.00 0.00 N ATOM 439 CA GLN A 31 -7.347 0.489 3.280 1.00 0.00 C ATOM 440 C GLN A 31 -6.697 -0.186 2.077 1.00 0.00 C ATOM 441 O GLN A 31 -6.699 -1.412 1.964 1.00 0.00 O ATOM 442 CB GLN A 31 -8.530 1.345 2.822 1.00 0.00 C ATOM 443 CG GLN A 31 -9.551 1.608 3.917 1.00 0.00 C ATOM 444 CD GLN A 31 -10.136 0.332 4.488 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.121 -0.198 3.974 1.00 0.00 O ATOM 446 NE2 GLN A 31 -9.531 -0.170 5.559 1.00 0.00 N ATOM 0 H GLN A 31 -6.647 2.287 4.100 1.00 0.00 H new ATOM 0 HA GLN A 31 -7.708 -0.286 3.957 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.155 2.298 2.450 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.025 0.849 1.987 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.080 2.178 4.718 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.356 2.225 3.517 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -8.717 0.302 5.953 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.881 -1.027 5.987 1.00 0.00 H new ATOM 455 N PHE A 32 -6.142 0.621 1.179 1.00 0.00 N ATOM 456 CA PHE A 32 -5.489 0.101 -0.016 1.00 0.00 C ATOM 457 C PHE A 32 -4.435 -0.939 0.349 1.00 0.00 C ATOM 458 O PHE A 32 -4.248 -1.927 -0.364 1.00 0.00 O ATOM 459 CB PHE A 32 -4.844 1.241 -0.808 1.00 0.00 C ATOM 460 CG PHE A 32 -3.982 0.770 -1.943 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.539 0.105 -3.024 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.614 0.992 -1.930 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.747 -0.331 -4.069 1.00 0.00 C ATOM 464 CE2 PHE A 32 -1.817 0.559 -2.974 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.385 -0.102 -4.045 1.00 0.00 C ATOM 0 H PHE A 32 -6.132 1.638 1.256 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.248 -0.378 -0.635 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -5.628 1.888 -1.202 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.241 1.847 -0.132 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.604 -0.074 -3.050 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.165 1.509 -1.095 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.193 -0.851 -4.904 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.752 0.738 -2.952 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.765 -0.439 -4.863 1.00 0.00 H new ATOM 475 N LEU A 33 -3.748 -0.711 1.462 1.00 0.00 N ATOM 476 CA LEU A 33 -2.711 -1.628 1.923 1.00 0.00 C ATOM 477 C LEU A 33 -3.299 -2.999 2.243 1.00 0.00 C ATOM 478 O LEU A 33 -2.882 -4.012 1.680 1.00 0.00 O ATOM 479 CB LEU A 33 -2.012 -1.060 3.160 1.00 0.00 C ATOM 480 CG LEU A 33 -1.322 -2.077 4.068 1.00 0.00 C ATOM 481 CD1 LEU A 33 0.122 -2.283 3.639 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.390 -1.628 5.521 1.00 0.00 C ATOM 0 H LEU A 33 -3.890 0.101 2.063 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.981 -1.743 1.122 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.269 -0.334 2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -2.749 -0.516 3.751 1.00 0.00 H new ATOM 0 HG LEU A 33 -1.845 -3.029 3.978 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.597 -3.010 4.297 1.00 0.00 H new ATOM 0 HD12 LEU A 33 0.148 -2.651 2.613 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.658 -1.336 3.699 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.894 -2.364 6.153 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -0.892 -0.664 5.628 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.433 -1.534 5.824 1.00 0.00 H new ATOM 494 N LYS A 34 -4.271 -3.024 3.148 1.00 0.00 N ATOM 495 CA LYS A 34 -4.920 -4.269 3.540 1.00 0.00 C ATOM 496 C LYS A 34 -5.077 -5.201 2.344 1.00 0.00 C ATOM 497 O LYS A 34 -4.600 -6.336 2.361 1.00 0.00 O ATOM 498 CB LYS A 34 -6.290 -3.981 4.159 1.00 0.00 C ATOM 499 CG LYS A 34 -6.232 -3.052 5.360 1.00 0.00 C ATOM 500 CD LYS A 34 -7.412 -3.271 6.292 1.00 0.00 C ATOM 501 CE LYS A 34 -7.391 -2.292 7.456 1.00 0.00 C ATOM 502 NZ LYS A 34 -6.404 -2.690 8.497 1.00 0.00 N ATOM 0 H LYS A 34 -4.627 -2.195 3.624 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.289 -4.761 4.281 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -6.937 -3.540 3.400 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -6.748 -4.923 4.461 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.302 -3.217 5.904 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -6.223 -2.016 5.020 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.342 -3.157 5.736 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -7.392 -4.292 6.673 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.149 -1.295 7.088 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.385 -2.235 7.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.420 -1.998 9.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -6.650 -3.631 8.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.452 -2.720 8.079 1.00 0.00 H new ATOM 516 N PHE A 35 -5.748 -4.715 1.305 1.00 0.00 N ATOM 517 CA PHE A 35 -5.968 -5.505 0.099 1.00 0.00 C ATOM 518 C PHE A 35 -4.663 -6.128 -0.388 1.00 0.00 C ATOM 519 O PHE A 35 -4.571 -7.342 -0.573 1.00 0.00 O ATOM 520 CB PHE A 35 -6.573 -4.635 -1.004 1.00 0.00 C ATOM 521 CG PHE A 35 -6.623 -5.312 -2.344 1.00 0.00 C ATOM 522 CD1 PHE A 35 -7.327 -6.493 -2.512 1.00 0.00 C ATOM 523 CD2 PHE A 35 -5.964 -4.768 -3.434 1.00 0.00 C ATOM 524 CE1 PHE A 35 -7.374 -7.119 -3.744 1.00 0.00 C ATOM 525 CE2 PHE A 35 -6.009 -5.388 -4.668 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.713 -6.566 -4.823 1.00 0.00 C ATOM 0 H PHE A 35 -6.149 -3.778 1.274 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.665 -6.307 0.343 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.583 -4.346 -0.714 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -5.992 -3.717 -1.091 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -7.845 -6.930 -1.671 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -5.409 -3.849 -3.318 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -7.927 -8.039 -3.862 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -5.494 -4.952 -5.511 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.747 -7.054 -5.786 1.00 0.00 H new ATOM 536 N LEU A 36 -3.655 -5.288 -0.596 1.00 0.00 N ATOM 537 CA LEU A 36 -2.354 -5.754 -1.063 1.00 0.00 C ATOM 538 C LEU A 36 -1.883 -6.957 -0.251 1.00 0.00 C ATOM 539 O LEU A 36 -1.591 -8.016 -0.807 1.00 0.00 O ATOM 540 CB LEU A 36 -1.323 -4.628 -0.970 1.00 0.00 C ATOM 541 CG LEU A 36 -1.675 -3.333 -1.704 1.00 0.00 C ATOM 542 CD1 LEU A 36 -0.670 -2.241 -1.373 1.00 0.00 C ATOM 543 CD2 LEU A 36 -1.732 -3.571 -3.206 1.00 0.00 C ATOM 0 H LEU A 36 -3.714 -4.280 -0.449 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.458 -6.059 -2.104 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.164 -4.394 0.083 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.375 -4.997 -1.361 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.659 -3.005 -1.370 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.937 -1.328 -1.904 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.678 -2.052 -0.300 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.327 -2.560 -1.677 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -1.984 -2.639 -3.713 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.762 -3.924 -3.556 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.492 -4.321 -3.427 1.00 0.00 H new ATOM 555 N GLU A 37 -1.816 -6.787 1.065 1.00 0.00 N ATOM 556 CA GLU A 37 -1.382 -7.860 1.952 1.00 0.00 C ATOM 557 C GLU A 37 -1.835 -9.218 1.425 1.00 0.00 C ATOM 558 O GLU A 37 -1.076 -10.187 1.441 1.00 0.00 O ATOM 559 CB GLU A 37 -1.933 -7.639 3.363 1.00 0.00 C ATOM 560 CG GLU A 37 -1.221 -6.537 4.129 1.00 0.00 C ATOM 561 CD GLU A 37 -1.269 -6.744 5.630 1.00 0.00 C ATOM 562 OE1 GLU A 37 -1.404 -7.907 6.065 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.172 -5.743 6.370 1.00 0.00 O ATOM 0 H GLU A 37 -2.056 -5.917 1.541 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.293 -7.849 1.989 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -2.994 -7.396 3.296 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.854 -8.570 3.925 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.181 -6.489 3.806 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -1.676 -5.577 3.884 1.00 0.00 H new ATOM 570 N SER A 38 -3.078 -9.281 0.957 1.00 0.00 N ATOM 571 CA SER A 38 -3.634 -10.521 0.429 1.00 0.00 C ATOM 572 C SER A 38 -2.784 -11.050 -0.722 1.00 0.00 C ATOM 573 O SER A 38 -2.323 -12.191 -0.693 1.00 0.00 O ATOM 574 CB SER A 38 -5.072 -10.298 -0.045 1.00 0.00 C ATOM 575 OG SER A 38 -5.537 -11.404 -0.799 1.00 0.00 O ATOM 0 H SER A 38 -3.719 -8.488 0.933 1.00 0.00 H new ATOM 0 HA SER A 38 -3.633 -11.261 1.229 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.722 -10.142 0.816 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.122 -9.393 -0.651 1.00 0.00 H new ATOM 0 HG SER A 38 -6.458 -11.238 -1.089 1.00 0.00 H new ATOM 581 N GLU A 39 -2.581 -10.213 -1.734 1.00 0.00 N ATOM 582 CA GLU A 39 -1.787 -10.597 -2.895 1.00 0.00 C ATOM 583 C GLU A 39 -0.295 -10.478 -2.598 1.00 0.00 C ATOM 584 O GLU A 39 0.530 -10.439 -3.510 1.00 0.00 O ATOM 585 CB GLU A 39 -2.149 -9.725 -4.100 1.00 0.00 C ATOM 586 CG GLU A 39 -2.189 -8.239 -3.785 1.00 0.00 C ATOM 587 CD GLU A 39 -3.565 -7.771 -3.351 1.00 0.00 C ATOM 588 OE1 GLU A 39 -4.292 -8.570 -2.725 1.00 0.00 O ATOM 589 OE2 GLU A 39 -3.914 -6.607 -3.638 1.00 0.00 O ATOM 0 H GLU A 39 -2.955 -9.265 -1.774 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.012 -11.638 -3.128 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -1.424 -9.900 -4.895 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.122 -10.033 -4.482 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -1.469 -8.019 -2.997 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.879 -7.676 -4.666 1.00 0.00 H new ATOM 596 N PHE A 40 0.043 -10.421 -1.314 1.00 0.00 N ATOM 597 CA PHE A 40 1.435 -10.305 -0.895 1.00 0.00 C ATOM 598 C PHE A 40 2.138 -9.180 -1.648 1.00 0.00 C ATOM 599 O PHE A 40 3.336 -9.255 -1.922 1.00 0.00 O ATOM 600 CB PHE A 40 2.171 -11.626 -1.125 1.00 0.00 C ATOM 601 CG PHE A 40 1.625 -12.423 -2.276 1.00 0.00 C ATOM 602 CD1 PHE A 40 0.470 -13.173 -2.129 1.00 0.00 C ATOM 603 CD2 PHE A 40 2.269 -12.423 -3.503 1.00 0.00 C ATOM 604 CE1 PHE A 40 -0.035 -13.908 -3.186 1.00 0.00 C ATOM 605 CE2 PHE A 40 1.768 -13.156 -4.563 1.00 0.00 C ATOM 606 CZ PHE A 40 0.615 -13.900 -4.404 1.00 0.00 C ATOM 0 H PHE A 40 -0.628 -10.453 -0.546 1.00 0.00 H new ATOM 0 HA PHE A 40 1.449 -10.070 0.169 1.00 0.00 H new ATOM 0 HB2 PHE A 40 3.226 -11.419 -1.305 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.114 -12.227 -0.218 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -0.042 -13.184 -1.178 1.00 0.00 H new ATOM 0 HD2 PHE A 40 3.172 -11.844 -3.633 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -0.937 -14.488 -3.059 1.00 0.00 H new ATOM 0 HE2 PHE A 40 2.278 -13.147 -5.515 1.00 0.00 H new ATOM 0 HZ PHE A 40 0.223 -14.474 -5.231 1.00 0.00 H new ATOM 616 N SER A 41 1.384 -8.137 -1.981 1.00 0.00 N ATOM 617 CA SER A 41 1.933 -6.997 -2.707 1.00 0.00 C ATOM 618 C SER A 41 2.117 -5.800 -1.779 1.00 0.00 C ATOM 619 O SER A 41 2.803 -4.836 -2.121 1.00 0.00 O ATOM 620 CB SER A 41 1.016 -6.618 -3.871 1.00 0.00 C ATOM 621 OG SER A 41 1.332 -5.330 -4.371 1.00 0.00 O ATOM 0 H SER A 41 0.391 -8.058 -1.760 1.00 0.00 H new ATOM 0 HA SER A 41 2.908 -7.283 -3.100 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.112 -7.355 -4.669 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.023 -6.639 -3.541 1.00 0.00 H new ATOM 0 HG SER A 41 1.902 -4.860 -3.727 1.00 0.00 H new ATOM 627 N SER A 42 1.501 -5.870 -0.604 1.00 0.00 N ATOM 628 CA SER A 42 1.593 -4.791 0.373 1.00 0.00 C ATOM 629 C SER A 42 3.018 -4.252 0.454 1.00 0.00 C ATOM 630 O SER A 42 3.230 -3.048 0.592 1.00 0.00 O ATOM 631 CB SER A 42 1.141 -5.281 1.750 1.00 0.00 C ATOM 632 OG SER A 42 2.054 -6.228 2.278 1.00 0.00 O ATOM 0 H SER A 42 0.933 -6.662 -0.305 1.00 0.00 H new ATOM 0 HA SER A 42 0.936 -3.984 0.049 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.056 -4.434 2.431 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.150 -5.729 1.673 1.00 0.00 H new ATOM 0 HG SER A 42 1.939 -6.287 3.249 1.00 0.00 H new ATOM 638 N GLU A 43 3.991 -5.154 0.367 1.00 0.00 N ATOM 639 CA GLU A 43 5.396 -4.770 0.432 1.00 0.00 C ATOM 640 C GLU A 43 5.697 -3.641 -0.549 1.00 0.00 C ATOM 641 O GLU A 43 6.429 -2.705 -0.229 1.00 0.00 O ATOM 642 CB GLU A 43 6.291 -5.974 0.132 1.00 0.00 C ATOM 643 CG GLU A 43 5.903 -6.721 -1.133 1.00 0.00 C ATOM 644 CD GLU A 43 6.951 -7.730 -1.559 1.00 0.00 C ATOM 645 OE1 GLU A 43 7.261 -8.637 -0.758 1.00 0.00 O ATOM 646 OE2 GLU A 43 7.462 -7.614 -2.693 1.00 0.00 O ATOM 0 H GLU A 43 3.832 -6.155 0.251 1.00 0.00 H new ATOM 0 HA GLU A 43 5.603 -4.415 1.442 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.323 -5.635 0.042 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.254 -6.663 0.976 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.955 -7.234 -0.971 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.745 -6.005 -1.939 1.00 0.00 H new ATOM 653 N ASN A 44 5.128 -3.738 -1.746 1.00 0.00 N ATOM 654 CA ASN A 44 5.335 -2.726 -2.776 1.00 0.00 C ATOM 655 C ASN A 44 5.109 -1.325 -2.215 1.00 0.00 C ATOM 656 O ASN A 44 5.952 -0.440 -2.367 1.00 0.00 O ATOM 657 CB ASN A 44 4.397 -2.972 -3.959 1.00 0.00 C ATOM 658 CG ASN A 44 4.783 -4.202 -4.757 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.706 -4.929 -4.390 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.077 -4.440 -5.856 1.00 0.00 N ATOM 0 H ASN A 44 4.520 -4.507 -2.027 1.00 0.00 H new ATOM 0 HA ASN A 44 6.367 -2.799 -3.119 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.377 -3.085 -3.593 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.406 -2.100 -4.613 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.292 -5.253 -6.434 1.00 0.00 H new ATOM 0 HD22 ASN A 44 3.320 -3.810 -6.122 1.00 0.00 H new ATOM 667 N LEU A 45 3.966 -1.131 -1.566 1.00 0.00 N ATOM 668 CA LEU A 45 3.628 0.162 -0.981 1.00 0.00 C ATOM 669 C LEU A 45 4.386 0.384 0.324 1.00 0.00 C ATOM 670 O LEU A 45 4.946 1.456 0.553 1.00 0.00 O ATOM 671 CB LEU A 45 2.122 0.252 -0.731 1.00 0.00 C ATOM 672 CG LEU A 45 1.654 1.426 0.130 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.666 2.717 -0.675 1.00 0.00 C ATOM 674 CD2 LEU A 45 0.264 1.157 0.689 1.00 0.00 C ATOM 0 H LEU A 45 3.258 -1.853 -1.432 1.00 0.00 H new ATOM 0 HA LEU A 45 3.920 0.940 -1.686 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.617 0.310 -1.695 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.797 -0.674 -0.256 1.00 0.00 H new ATOM 0 HG LEU A 45 2.345 1.537 0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.330 3.541 -0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.678 2.918 -1.026 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.998 2.618 -1.531 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.053 2.003 1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.438 1.019 -0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.286 0.256 1.302 1.00 0.00 H new ATOM 686 N ARG A 46 4.402 -0.637 1.174 1.00 0.00 N ATOM 687 CA ARG A 46 5.092 -0.553 2.456 1.00 0.00 C ATOM 688 C ARG A 46 6.386 0.245 2.325 1.00 0.00 C ATOM 689 O ARG A 46 6.549 1.291 2.955 1.00 0.00 O ATOM 690 CB ARG A 46 5.396 -1.955 2.988 1.00 0.00 C ATOM 691 CG ARG A 46 4.187 -2.654 3.587 1.00 0.00 C ATOM 692 CD ARG A 46 3.845 -2.096 4.960 1.00 0.00 C ATOM 693 NE ARG A 46 4.780 -2.553 5.985 1.00 0.00 N ATOM 694 CZ ARG A 46 4.428 -2.803 7.242 1.00 0.00 C ATOM 695 NH1 ARG A 46 3.169 -2.642 7.626 1.00 0.00 N ATOM 696 NH2 ARG A 46 5.336 -3.216 8.116 1.00 0.00 N ATOM 0 H ARG A 46 3.945 -1.532 0.999 1.00 0.00 H new ATOM 0 HA ARG A 46 4.438 -0.039 3.160 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.792 -2.565 2.176 1.00 0.00 H new ATOM 0 HB3 ARG A 46 6.177 -1.886 3.745 1.00 0.00 H new ATOM 0 HG2 ARG A 46 3.331 -2.537 2.922 1.00 0.00 H new ATOM 0 HG3 ARG A 46 4.385 -3.723 3.666 1.00 0.00 H new ATOM 0 HD2 ARG A 46 3.854 -1.007 4.921 1.00 0.00 H new ATOM 0 HD3 ARG A 46 2.833 -2.397 5.232 1.00 0.00 H new ATOM 0 HE ARG A 46 5.756 -2.688 5.722 1.00 0.00 H new ATOM 0 HH11 ARG A 46 2.468 -2.326 6.956 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.902 -2.835 8.591 1.00 0.00 H new ATOM 0 HH21 ARG A 46 6.305 -3.342 7.824 1.00 0.00 H new ATOM 0 HH22 ARG A 46 5.065 -3.408 9.081 1.00 0.00 H new ATOM 710 N PHE A 47 7.303 -0.255 1.504 1.00 0.00 N ATOM 711 CA PHE A 47 8.584 0.410 1.292 1.00 0.00 C ATOM 712 C PHE A 47 8.380 1.875 0.916 1.00 0.00 C ATOM 713 O PHE A 47 9.043 2.762 1.454 1.00 0.00 O ATOM 714 CB PHE A 47 9.378 -0.304 0.196 1.00 0.00 C ATOM 715 CG PHE A 47 10.362 0.587 -0.507 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.452 1.107 0.171 1.00 0.00 C ATOM 717 CD2 PHE A 47 10.198 0.902 -1.846 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.359 1.927 -0.473 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.102 1.721 -2.496 1.00 0.00 C ATOM 720 CZ PHE A 47 12.185 2.233 -1.809 1.00 0.00 C ATOM 0 H PHE A 47 7.183 -1.118 0.974 1.00 0.00 H new ATOM 0 HA PHE A 47 9.146 0.367 2.225 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.912 -1.147 0.635 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.683 -0.714 -0.537 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.595 0.869 1.215 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.354 0.503 -2.388 1.00 0.00 H new ATOM 0 HE1 PHE A 47 13.203 2.328 0.068 1.00 0.00 H new ATOM 0 HE2 PHE A 47 10.962 1.960 -3.540 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.894 2.871 -2.315 1.00 0.00 H new ATOM 730 N TRP A 48 7.459 2.119 -0.009 1.00 0.00 N ATOM 731 CA TRP A 48 7.168 3.476 -0.458 1.00 0.00 C ATOM 732 C TRP A 48 6.884 4.392 0.728 1.00 0.00 C ATOM 733 O TRP A 48 7.582 5.385 0.939 1.00 0.00 O ATOM 734 CB TRP A 48 5.974 3.474 -1.414 1.00 0.00 C ATOM 735 CG TRP A 48 5.844 4.740 -2.205 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.614 5.128 -3.264 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.889 5.786 -1.997 1.00 0.00 C ATOM 738 NE1 TRP A 48 6.194 6.351 -3.728 1.00 0.00 N ATOM 739 CE2 TRP A 48 5.137 6.776 -2.968 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.846 5.981 -1.087 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.381 7.942 -3.052 1.00 0.00 C ATOM 742 CZ3 TRP A 48 3.097 7.139 -1.171 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.366 8.107 -2.148 1.00 0.00 C ATOM 0 H TRP A 48 6.901 1.396 -0.463 1.00 0.00 H new ATOM 0 HA TRP A 48 8.045 3.854 -0.984 1.00 0.00 H new ATOM 0 HB2 TRP A 48 6.069 2.633 -2.101 1.00 0.00 H new ATOM 0 HB3 TRP A 48 5.060 3.316 -0.842 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.433 4.557 -3.676 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.603 6.860 -4.512 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.630 5.240 -0.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.588 8.690 -3.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.290 7.301 -0.472 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.761 9.001 -2.189 1.00 0.00 H new ATOM 754 N LEU A 49 5.856 4.053 1.498 1.00 0.00 N ATOM 755 CA LEU A 49 5.480 4.846 2.664 1.00 0.00 C ATOM 756 C LEU A 49 6.662 5.010 3.615 1.00 0.00 C ATOM 757 O LEU A 49 6.932 6.108 4.101 1.00 0.00 O ATOM 758 CB LEU A 49 4.309 4.188 3.396 1.00 0.00 C ATOM 759 CG LEU A 49 2.982 4.148 2.638 1.00 0.00 C ATOM 760 CD1 LEU A 49 1.977 3.271 3.369 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.430 5.554 2.453 1.00 0.00 C ATOM 0 H LEU A 49 5.268 3.235 1.337 1.00 0.00 H new ATOM 0 HA LEU A 49 5.176 5.834 2.319 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.592 3.166 3.648 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.152 4.716 4.337 1.00 0.00 H new ATOM 0 HG LEU A 49 3.161 3.718 1.653 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.038 3.254 2.815 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.369 2.257 3.449 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.802 3.672 4.367 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.485 5.506 1.911 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.266 6.012 3.429 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.143 6.153 1.886 1.00 0.00 H new ATOM 773 N ALA A 50 7.363 3.912 3.874 1.00 0.00 N ATOM 774 CA ALA A 50 8.518 3.935 4.763 1.00 0.00 C ATOM 775 C ALA A 50 9.490 5.043 4.372 1.00 0.00 C ATOM 776 O ALA A 50 10.021 5.748 5.230 1.00 0.00 O ATOM 777 CB ALA A 50 9.221 2.585 4.751 1.00 0.00 C ATOM 0 H ALA A 50 7.151 2.995 3.481 1.00 0.00 H new ATOM 0 HA ALA A 50 8.163 4.139 5.773 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.082 2.617 5.419 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.530 1.812 5.086 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.556 2.358 3.739 1.00 0.00 H new ATOM 783 N VAL A 51 9.718 5.192 3.071 1.00 0.00 N ATOM 784 CA VAL A 51 10.626 6.215 2.566 1.00 0.00 C ATOM 785 C VAL A 51 10.038 7.609 2.747 1.00 0.00 C ATOM 786 O VAL A 51 10.652 8.476 3.368 1.00 0.00 O ATOM 787 CB VAL A 51 10.947 5.994 1.076 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.853 7.100 0.556 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.582 4.629 0.864 1.00 0.00 C ATOM 0 H VAL A 51 9.286 4.617 2.347 1.00 0.00 H new ATOM 0 HA VAL A 51 11.547 6.135 3.144 1.00 0.00 H new ATOM 0 HB VAL A 51 10.014 6.026 0.513 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.069 6.928 -0.498 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.355 8.063 0.671 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.785 7.103 1.122 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.802 4.490 -0.195 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.506 4.565 1.438 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.894 3.852 1.196 1.00 0.00 H new ATOM 799 N GLU A 52 8.844 7.818 2.201 1.00 0.00 N ATOM 800 CA GLU A 52 8.172 9.108 2.303 1.00 0.00 C ATOM 801 C GLU A 52 8.274 9.664 3.721 1.00 0.00 C ATOM 802 O GLU A 52 8.554 10.847 3.916 1.00 0.00 O ATOM 803 CB GLU A 52 6.702 8.977 1.899 1.00 0.00 C ATOM 804 CG GLU A 52 6.503 8.588 0.444 1.00 0.00 C ATOM 805 CD GLU A 52 6.860 9.709 -0.513 1.00 0.00 C ATOM 806 OE1 GLU A 52 7.986 10.240 -0.411 1.00 0.00 O ATOM 807 OE2 GLU A 52 6.014 10.056 -1.363 1.00 0.00 O ATOM 0 H GLU A 52 8.322 7.111 1.684 1.00 0.00 H new ATOM 0 HA GLU A 52 8.667 9.801 1.623 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.224 8.231 2.534 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.197 9.925 2.085 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.114 7.714 0.218 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.464 8.299 0.288 1.00 0.00 H new ATOM 814 N ASP A 53 8.044 8.803 4.705 1.00 0.00 N ATOM 815 CA ASP A 53 8.110 9.206 6.105 1.00 0.00 C ATOM 816 C ASP A 53 9.555 9.244 6.592 1.00 0.00 C ATOM 817 O ASP A 53 9.959 10.168 7.301 1.00 0.00 O ATOM 818 CB ASP A 53 7.291 8.250 6.973 1.00 0.00 C ATOM 819 CG ASP A 53 7.353 8.607 8.445 1.00 0.00 C ATOM 820 OD1 ASP A 53 8.456 8.539 9.026 1.00 0.00 O ATOM 821 OD2 ASP A 53 6.298 8.954 9.016 1.00 0.00 O ATOM 0 H ASP A 53 7.810 7.821 4.560 1.00 0.00 H new ATOM 0 HA ASP A 53 7.691 10.209 6.189 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.252 8.263 6.642 1.00 0.00 H new ATOM 0 HB3 ASP A 53 7.657 7.233 6.833 1.00 0.00 H new ATOM 826 N LEU A 54 10.329 8.235 6.210 1.00 0.00 N ATOM 827 CA LEU A 54 11.730 8.152 6.608 1.00 0.00 C ATOM 828 C LEU A 54 12.356 9.540 6.691 1.00 0.00 C ATOM 829 O LEU A 54 12.774 9.982 7.761 1.00 0.00 O ATOM 830 CB LEU A 54 12.512 7.285 5.619 1.00 0.00 C ATOM 831 CG LEU A 54 14.035 7.384 5.699 1.00 0.00 C ATOM 832 CD1 LEU A 54 14.537 6.831 7.024 1.00 0.00 C ATOM 833 CD2 LEU A 54 14.679 6.646 4.533 1.00 0.00 C ATOM 0 H LEU A 54 10.010 7.463 5.625 1.00 0.00 H new ATOM 0 HA LEU A 54 11.774 7.694 7.596 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.227 6.244 5.774 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.203 7.553 4.609 1.00 0.00 H new ATOM 0 HG LEU A 54 14.316 8.436 5.638 1.00 0.00 H new ATOM 0 HD11 LEU A 54 15.623 6.910 7.063 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.102 7.402 7.845 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.246 5.785 7.115 1.00 0.00 H new ATOM 0 HD21 LEU A 54 15.764 6.727 4.606 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.391 5.595 4.563 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.345 7.087 3.594 1.00 0.00 H new ATOM 845 N LYS A 55 12.416 10.225 5.554 1.00 0.00 N ATOM 846 CA LYS A 55 12.988 11.565 5.496 1.00 0.00 C ATOM 847 C LYS A 55 12.452 12.434 6.630 1.00 0.00 C ATOM 848 O LYS A 55 13.211 13.135 7.300 1.00 0.00 O ATOM 849 CB LYS A 55 12.675 12.218 4.148 1.00 0.00 C ATOM 850 CG LYS A 55 11.195 12.236 3.810 1.00 0.00 C ATOM 851 CD LYS A 55 10.965 12.431 2.320 1.00 0.00 C ATOM 852 CE LYS A 55 11.290 11.169 1.536 1.00 0.00 C ATOM 853 NZ LYS A 55 11.304 11.416 0.068 1.00 0.00 N ATOM 0 H LYS A 55 12.075 9.874 4.659 1.00 0.00 H new ATOM 0 HA LYS A 55 14.069 11.477 5.608 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.050 13.241 4.154 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.212 11.686 3.363 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.736 11.301 4.130 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.704 13.037 4.363 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.927 12.712 2.145 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.583 13.254 1.960 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.262 10.787 1.849 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.555 10.398 1.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.546 10.536 -0.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.365 11.740 -0.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.011 12.145 -0.155 1.00 0.00 H new ATOM 867 N LYS A 56 11.142 12.382 6.840 1.00 0.00 N ATOM 868 CA LYS A 56 10.504 13.161 7.895 1.00 0.00 C ATOM 869 C LYS A 56 11.199 12.936 9.234 1.00 0.00 C ATOM 870 O LYS A 56 11.430 13.879 9.990 1.00 0.00 O ATOM 871 CB LYS A 56 9.023 12.791 8.007 1.00 0.00 C ATOM 872 CG LYS A 56 8.256 12.950 6.706 1.00 0.00 C ATOM 873 CD LYS A 56 7.979 14.411 6.397 1.00 0.00 C ATOM 874 CE LYS A 56 7.249 14.573 5.072 1.00 0.00 C ATOM 875 NZ LYS A 56 5.846 14.079 5.148 1.00 0.00 N ATOM 0 H LYS A 56 10.500 11.808 6.293 1.00 0.00 H new ATOM 0 HA LYS A 56 10.589 14.216 7.635 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.940 11.758 8.344 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.558 13.414 8.771 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.826 12.506 5.890 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.314 12.406 6.769 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.382 14.846 7.198 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.919 14.962 6.365 1.00 0.00 H new ATOM 0 HE2 LYS A 56 7.249 15.624 4.784 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.784 14.029 4.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.352 14.299 4.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 5.848 13.050 5.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.357 14.543 5.940 1.00 0.00 H new ATOM 889 N ARG A 57 11.529 11.681 9.520 1.00 0.00 N ATOM 890 CA ARG A 57 12.198 11.333 10.768 1.00 0.00 C ATOM 891 C ARG A 57 13.436 12.198 10.981 1.00 0.00 C ATOM 892 O ARG A 57 14.052 12.688 10.034 1.00 0.00 O ATOM 893 CB ARG A 57 12.590 9.854 10.766 1.00 0.00 C ATOM 894 CG ARG A 57 11.403 8.909 10.862 1.00 0.00 C ATOM 895 CD ARG A 57 10.747 8.977 12.233 1.00 0.00 C ATOM 896 NE ARG A 57 9.692 9.985 12.286 1.00 0.00 N ATOM 897 CZ ARG A 57 8.874 10.139 13.321 1.00 0.00 C ATOM 898 NH1 ARG A 57 8.988 9.354 14.383 1.00 0.00 N ATOM 899 NH2 ARG A 57 7.938 11.080 13.295 1.00 0.00 N ATOM 0 H ARG A 57 11.344 10.889 8.905 1.00 0.00 H new ATOM 0 HA ARG A 57 11.503 11.517 11.587 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.145 9.635 9.854 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.263 9.664 11.602 1.00 0.00 H new ATOM 0 HG2 ARG A 57 10.672 9.162 10.094 1.00 0.00 H new ATOM 0 HG3 ARG A 57 11.732 7.889 10.665 1.00 0.00 H new ATOM 0 HD2 ARG A 57 10.329 8.002 12.484 1.00 0.00 H new ATOM 0 HD3 ARG A 57 11.502 9.203 12.985 1.00 0.00 H new ATOM 0 HE ARG A 57 9.577 10.605 11.484 1.00 0.00 H new ATOM 0 HH11 ARG A 57 9.705 8.629 14.407 1.00 0.00 H new ATOM 0 HH12 ARG A 57 8.358 9.475 15.176 1.00 0.00 H new ATOM 0 HH21 ARG A 57 7.846 11.686 12.480 1.00 0.00 H new ATOM 0 HH22 ARG A 57 7.310 11.197 14.090 1.00 0.00 H new ATOM 913 N PRO A 58 13.811 12.391 12.254 1.00 0.00 N ATOM 914 CA PRO A 58 14.979 13.198 12.622 1.00 0.00 C ATOM 915 C PRO A 58 16.292 12.526 12.234 1.00 0.00 C ATOM 916 O PRO A 58 16.322 11.337 11.916 1.00 0.00 O ATOM 917 CB PRO A 58 14.866 13.313 14.144 1.00 0.00 C ATOM 918 CG PRO A 58 14.084 12.114 14.557 1.00 0.00 C ATOM 919 CD PRO A 58 13.124 11.838 13.433 1.00 0.00 C ATOM 0 HA PRO A 58 14.989 14.159 12.108 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.849 13.326 14.614 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.362 14.234 14.435 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.740 11.260 14.728 1.00 0.00 H new ATOM 0 HG3 PRO A 58 13.550 12.298 15.489 1.00 0.00 H new ATOM 0 HD2 PRO A 58 12.931 10.771 13.322 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.161 12.320 13.600 1.00 0.00 H new ATOM 927 N ILE A 59 17.376 13.295 12.264 1.00 0.00 N ATOM 928 CA ILE A 59 18.692 12.773 11.917 1.00 0.00 C ATOM 929 C ILE A 59 19.065 11.589 12.804 1.00 0.00 C ATOM 930 O ILE A 59 19.797 10.692 12.386 1.00 0.00 O ATOM 931 CB ILE A 59 19.778 13.857 12.043 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.064 13.404 11.347 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.045 14.173 13.507 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.768 12.270 12.059 1.00 0.00 C ATOM 0 H ILE A 59 17.368 14.281 12.525 1.00 0.00 H new ATOM 0 HA ILE A 59 18.638 12.444 10.879 1.00 0.00 H new ATOM 0 HB ILE A 59 19.423 14.765 11.555 1.00 0.00 H new ATOM 0 HG12 ILE A 59 20.827 13.092 10.330 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.744 14.252 11.270 1.00 0.00 H new ATOM 0 HG21 ILE A 59 20.815 14.941 13.579 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.129 14.533 13.974 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.383 13.271 14.018 1.00 0.00 H new ATOM 0 HD11 ILE A 59 22.671 12.001 11.511 1.00 0.00 H new ATOM 0 HD12 ILE A 59 22.036 12.585 13.068 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.105 11.407 12.113 1.00 0.00 H new ATOM 946 N LYS A 60 18.555 11.593 14.031 1.00 0.00 N ATOM 947 CA LYS A 60 18.831 10.519 14.978 1.00 0.00 C ATOM 948 C LYS A 60 18.150 9.224 14.546 1.00 0.00 C ATOM 949 O LYS A 60 18.648 8.132 14.813 1.00 0.00 O ATOM 950 CB LYS A 60 18.359 10.913 16.379 1.00 0.00 C ATOM 951 CG LYS A 60 16.858 11.121 16.479 1.00 0.00 C ATOM 952 CD LYS A 60 16.454 11.611 17.860 1.00 0.00 C ATOM 953 CE LYS A 60 16.705 13.103 18.016 1.00 0.00 C ATOM 954 NZ LYS A 60 16.472 13.561 19.414 1.00 0.00 N ATOM 0 H LYS A 60 17.948 12.328 14.393 1.00 0.00 H new ATOM 0 HA LYS A 60 19.908 10.353 14.997 1.00 0.00 H new ATOM 0 HB2 LYS A 60 18.658 10.138 17.085 1.00 0.00 H new ATOM 0 HB3 LYS A 60 18.865 11.830 16.679 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.539 11.843 15.728 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.345 10.185 16.259 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.398 11.399 18.028 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.014 11.065 18.619 1.00 0.00 H new ATOM 0 HE2 LYS A 60 17.730 13.331 17.725 1.00 0.00 H new ATOM 0 HE3 LYS A 60 16.052 13.654 17.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 16.653 14.583 19.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 15.487 13.366 19.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 17.113 13.054 20.057 1.00 0.00 H new ATOM 968 N GLU A 61 17.009 9.356 13.876 1.00 0.00 N ATOM 969 CA GLU A 61 16.261 8.196 13.407 1.00 0.00 C ATOM 970 C GLU A 61 16.260 8.129 11.882 1.00 0.00 C ATOM 971 O GLU A 61 15.511 7.357 11.284 1.00 0.00 O ATOM 972 CB GLU A 61 14.823 8.244 13.926 1.00 0.00 C ATOM 973 CG GLU A 61 14.684 7.808 15.375 1.00 0.00 C ATOM 974 CD GLU A 61 15.430 6.522 15.672 1.00 0.00 C ATOM 975 OE1 GLU A 61 15.012 5.462 15.159 1.00 0.00 O ATOM 976 OE2 GLU A 61 16.432 6.574 16.415 1.00 0.00 O ATOM 0 H GLU A 61 16.583 10.254 13.646 1.00 0.00 H new ATOM 0 HA GLU A 61 16.750 7.301 13.793 1.00 0.00 H new ATOM 0 HB2 GLU A 61 14.442 9.260 13.823 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.199 7.605 13.302 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.057 8.599 16.026 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.628 7.674 15.610 1.00 0.00 H new ATOM 983 N VAL A 62 17.106 8.944 11.259 1.00 0.00 N ATOM 984 CA VAL A 62 17.204 8.977 9.805 1.00 0.00 C ATOM 985 C VAL A 62 17.981 7.776 9.279 1.00 0.00 C ATOM 986 O VAL A 62 17.478 6.978 8.488 1.00 0.00 O ATOM 987 CB VAL A 62 17.887 10.270 9.319 1.00 0.00 C ATOM 988 CG1 VAL A 62 18.672 10.011 8.042 1.00 0.00 C ATOM 989 CG2 VAL A 62 16.857 11.369 9.107 1.00 0.00 C ATOM 0 H VAL A 62 17.733 9.590 11.739 1.00 0.00 H new ATOM 0 HA VAL A 62 16.186 8.944 9.418 1.00 0.00 H new ATOM 0 HB VAL A 62 18.586 10.602 10.087 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.148 10.935 7.713 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.436 9.257 8.231 1.00 0.00 H new ATOM 0 HG13 VAL A 62 17.996 9.655 7.265 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.357 12.275 8.764 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.132 11.049 8.359 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.343 11.572 10.046 1.00 0.00 H new ATOM 999 N PRO A 63 19.238 7.642 9.727 1.00 0.00 N ATOM 1000 CA PRO A 63 20.112 6.539 9.315 1.00 0.00 C ATOM 1001 C PRO A 63 19.661 5.198 9.885 1.00 0.00 C ATOM 1002 O PRO A 63 19.521 4.218 9.154 1.00 0.00 O ATOM 1003 CB PRO A 63 21.475 6.933 9.890 1.00 0.00 C ATOM 1004 CG PRO A 63 21.157 7.816 11.047 1.00 0.00 C ATOM 1005 CD PRO A 63 19.903 8.555 10.671 1.00 0.00 C ATOM 0 HA PRO A 63 20.113 6.402 8.234 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.040 6.056 10.205 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.082 7.454 9.149 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.008 7.231 11.955 1.00 0.00 H new ATOM 0 HG3 PRO A 63 21.974 8.510 11.245 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.279 8.757 11.542 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.127 9.517 10.210 1.00 0.00 H new ATOM 1013 N SER A 64 19.435 5.163 11.194 1.00 0.00 N ATOM 1014 CA SER A 64 19.003 3.941 11.862 1.00 0.00 C ATOM 1015 C SER A 64 17.897 3.250 11.070 1.00 0.00 C ATOM 1016 O SER A 64 17.859 2.024 10.976 1.00 0.00 O ATOM 1017 CB SER A 64 18.513 4.254 13.277 1.00 0.00 C ATOM 1018 OG SER A 64 19.601 4.509 14.149 1.00 0.00 O ATOM 0 H SER A 64 19.544 5.966 11.813 1.00 0.00 H new ATOM 0 HA SER A 64 19.858 3.268 11.922 1.00 0.00 H new ATOM 0 HB2 SER A 64 17.852 5.120 13.253 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.928 3.416 13.656 1.00 0.00 H new ATOM 0 HG SER A 64 19.261 4.708 15.046 1.00 0.00 H new ATOM 1024 N ARG A 65 16.998 4.048 10.503 1.00 0.00 N ATOM 1025 CA ARG A 65 15.889 3.515 9.720 1.00 0.00 C ATOM 1026 C ARG A 65 16.355 3.109 8.325 1.00 0.00 C ATOM 1027 O ARG A 65 16.011 2.035 7.832 1.00 0.00 O ATOM 1028 CB ARG A 65 14.768 4.550 9.614 1.00 0.00 C ATOM 1029 CG ARG A 65 13.384 3.937 9.477 1.00 0.00 C ATOM 1030 CD ARG A 65 12.890 3.376 10.801 1.00 0.00 C ATOM 1031 NE ARG A 65 11.434 3.413 10.901 1.00 0.00 N ATOM 1032 CZ ARG A 65 10.737 2.673 11.757 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.361 1.843 12.582 1.00 0.00 N ATOM 1034 NH2 ARG A 65 9.414 2.762 11.789 1.00 0.00 N ATOM 0 H ARG A 65 17.016 5.066 10.571 1.00 0.00 H new ATOM 0 HA ARG A 65 15.509 2.630 10.230 1.00 0.00 H new ATOM 0 HB2 ARG A 65 14.788 5.187 10.498 1.00 0.00 H new ATOM 0 HB3 ARG A 65 14.958 5.192 8.754 1.00 0.00 H new ATOM 0 HG2 ARG A 65 12.685 4.691 9.117 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.409 3.143 8.731 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.235 2.348 10.910 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.324 3.947 11.622 1.00 0.00 H new ATOM 0 HE ARG A 65 10.924 4.041 10.280 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.378 1.772 12.560 1.00 0.00 H new ATOM 0 HH12 ARG A 65 10.824 1.276 13.238 1.00 0.00 H new ATOM 0 HH21 ARG A 65 8.930 3.399 11.156 1.00 0.00 H new ATOM 0 HH22 ARG A 65 8.880 2.193 12.447 1.00 0.00 H new ATOM 1048 N VAL A 66 17.140 3.976 7.693 1.00 0.00 N ATOM 1049 CA VAL A 66 17.654 3.707 6.355 1.00 0.00 C ATOM 1050 C VAL A 66 17.941 2.222 6.164 1.00 0.00 C ATOM 1051 O VAL A 66 17.319 1.562 5.333 1.00 0.00 O ATOM 1052 CB VAL A 66 18.940 4.508 6.077 1.00 0.00 C ATOM 1053 CG1 VAL A 66 19.670 3.942 4.868 1.00 0.00 C ATOM 1054 CG2 VAL A 66 18.617 5.980 5.873 1.00 0.00 C ATOM 0 H VAL A 66 17.434 4.870 8.086 1.00 0.00 H new ATOM 0 HA VAL A 66 16.882 4.017 5.651 1.00 0.00 H new ATOM 0 HB VAL A 66 19.597 4.420 6.943 1.00 0.00 H new ATOM 0 HG11 VAL A 66 20.576 4.520 4.686 1.00 0.00 H new ATOM 0 HG12 VAL A 66 19.935 2.902 5.057 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.022 3.998 3.993 1.00 0.00 H new ATOM 0 HG21 VAL A 66 19.537 6.531 5.678 1.00 0.00 H new ATOM 0 HG22 VAL A 66 17.941 6.090 5.025 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.141 6.376 6.770 1.00 0.00 H new ATOM 1064 N GLN A 67 18.887 1.704 6.941 1.00 0.00 N ATOM 1065 CA GLN A 67 19.257 0.296 6.857 1.00 0.00 C ATOM 1066 C GLN A 67 18.059 -0.600 7.154 1.00 0.00 C ATOM 1067 O GLN A 67 17.731 -1.491 6.372 1.00 0.00 O ATOM 1068 CB GLN A 67 20.395 -0.013 7.832 1.00 0.00 C ATOM 1069 CG GLN A 67 19.958 -0.041 9.287 1.00 0.00 C ATOM 1070 CD GLN A 67 21.120 -0.232 10.242 1.00 0.00 C ATOM 1071 OE1 GLN A 67 21.594 -1.350 10.446 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.587 0.862 10.833 1.00 0.00 N ATOM 0 H GLN A 67 19.411 2.238 7.635 1.00 0.00 H new ATOM 0 HA GLN A 67 19.595 0.095 5.840 1.00 0.00 H new ATOM 0 HB2 GLN A 67 20.832 -0.978 7.574 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.179 0.734 7.711 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.445 0.891 9.526 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.238 -0.847 9.431 1.00 0.00 H new ATOM 0 HE21 GLN A 67 21.164 1.769 10.635 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.369 0.795 11.485 1.00 0.00 H new ATOM 1081 N GLU A 68 17.412 -0.357 8.290 1.00 0.00 N ATOM 1082 CA GLU A 68 16.251 -1.144 8.690 1.00 0.00 C ATOM 1083 C GLU A 68 15.336 -1.408 7.498 1.00 0.00 C ATOM 1084 O GLU A 68 15.072 -2.559 7.148 1.00 0.00 O ATOM 1085 CB GLU A 68 15.474 -0.423 9.793 1.00 0.00 C ATOM 1086 CG GLU A 68 16.086 -0.587 11.175 1.00 0.00 C ATOM 1087 CD GLU A 68 16.431 -2.029 11.493 1.00 0.00 C ATOM 1088 OE1 GLU A 68 17.557 -2.456 11.166 1.00 0.00 O ATOM 1089 OE2 GLU A 68 15.573 -2.730 12.069 1.00 0.00 O ATOM 0 H GLU A 68 17.672 0.377 8.949 1.00 0.00 H new ATOM 0 HA GLU A 68 16.607 -2.101 9.072 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.419 0.639 9.553 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.451 -0.799 9.811 1.00 0.00 H new ATOM 0 HG2 GLU A 68 16.987 0.022 11.244 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.389 -0.210 11.924 1.00 0.00 H new ATOM 1096 N ILE A 69 14.855 -0.335 6.879 1.00 0.00 N ATOM 1097 CA ILE A 69 13.970 -0.451 5.727 1.00 0.00 C ATOM 1098 C ILE A 69 14.562 -1.377 4.670 1.00 0.00 C ATOM 1099 O ILE A 69 13.894 -2.292 4.188 1.00 0.00 O ATOM 1100 CB ILE A 69 13.692 0.924 5.090 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.008 1.848 6.099 1.00 0.00 C ATOM 1102 CG2 ILE A 69 12.837 0.767 3.842 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.060 3.310 5.712 1.00 0.00 C ATOM 0 H ILE A 69 15.063 0.624 7.156 1.00 0.00 H new ATOM 0 HA ILE A 69 13.032 -0.871 6.091 1.00 0.00 H new ATOM 0 HB ILE A 69 14.642 1.373 4.801 1.00 0.00 H new ATOM 0 HG12 ILE A 69 11.966 1.546 6.208 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.480 1.721 7.073 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.649 1.747 3.404 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.360 0.140 3.119 1.00 0.00 H new ATOM 0 HG23 ILE A 69 11.888 0.301 4.107 1.00 0.00 H new ATOM 0 HD11 ILE A 69 12.556 3.906 6.473 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.099 3.628 5.631 1.00 0.00 H new ATOM 0 HD13 ILE A 69 12.562 3.450 4.753 1.00 0.00 H new ATOM 1115 N TRP A 70 15.819 -1.135 4.316 1.00 0.00 N ATOM 1116 CA TRP A 70 16.502 -1.949 3.317 1.00 0.00 C ATOM 1117 C TRP A 70 16.755 -3.358 3.843 1.00 0.00 C ATOM 1118 O TRP A 70 17.106 -4.259 3.083 1.00 0.00 O ATOM 1119 CB TRP A 70 17.826 -1.296 2.915 1.00 0.00 C ATOM 1120 CG TRP A 70 18.943 -2.279 2.739 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.618 -2.939 3.727 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.518 -2.711 1.501 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.577 -3.755 3.177 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.535 -3.634 1.813 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.270 -2.410 0.159 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.303 -4.255 0.832 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.033 -3.027 -0.814 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.039 -3.942 -0.474 1.00 0.00 C ATOM 0 H TRP A 70 16.386 -0.382 4.706 1.00 0.00 H new ATOM 0 HA TRP A 70 15.858 -2.019 2.440 1.00 0.00 H new ATOM 0 HB2 TRP A 70 17.684 -0.747 1.984 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.109 -0.567 3.675 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.426 -2.835 4.785 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.216 -4.354 3.700 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.496 -1.708 -0.113 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 22.080 -4.959 1.092 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.851 -2.800 -1.854 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.617 -4.409 -1.258 1.00 0.00 H new ATOM 1139 N GLN A 71 16.574 -3.539 5.147 1.00 0.00 N ATOM 1140 CA GLN A 71 16.784 -4.839 5.774 1.00 0.00 C ATOM 1141 C GLN A 71 15.474 -5.614 5.869 1.00 0.00 C ATOM 1142 O GLN A 71 15.454 -6.763 6.309 1.00 0.00 O ATOM 1143 CB GLN A 71 17.391 -4.665 7.167 1.00 0.00 C ATOM 1144 CG GLN A 71 18.856 -4.263 7.147 1.00 0.00 C ATOM 1145 CD GLN A 71 19.600 -4.702 8.393 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.413 -4.139 9.472 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.449 -5.713 8.250 1.00 0.00 N ATOM 0 H GLN A 71 16.283 -2.803 5.790 1.00 0.00 H new ATOM 0 HA GLN A 71 17.477 -5.407 5.153 1.00 0.00 H new ATOM 0 HB2 GLN A 71 16.823 -3.909 7.710 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.287 -5.599 7.719 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.336 -4.698 6.270 1.00 0.00 H new ATOM 0 HG3 GLN A 71 18.930 -3.180 7.047 1.00 0.00 H new ATOM 0 HE21 GLN A 71 20.572 -6.150 7.337 1.00 0.00 H new ATOM 0 HE22 GLN A 71 20.978 -6.053 9.054 1.00 0.00 H new ATOM 1156 N GLU A 72 14.383 -4.977 5.455 1.00 0.00 N ATOM 1157 CA GLU A 72 13.069 -5.609 5.496 1.00 0.00 C ATOM 1158 C GLU A 72 12.513 -5.799 4.088 1.00 0.00 C ATOM 1159 O GLU A 72 11.875 -6.809 3.792 1.00 0.00 O ATOM 1160 CB GLU A 72 12.101 -4.767 6.329 1.00 0.00 C ATOM 1161 CG GLU A 72 10.795 -5.477 6.646 1.00 0.00 C ATOM 1162 CD GLU A 72 10.825 -6.182 7.988 1.00 0.00 C ATOM 1163 OE1 GLU A 72 11.715 -7.034 8.191 1.00 0.00 O ATOM 1164 OE2 GLU A 72 9.957 -5.882 8.834 1.00 0.00 O ATOM 0 H GLU A 72 14.383 -4.025 5.088 1.00 0.00 H new ATOM 0 HA GLU A 72 13.179 -6.589 5.960 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.588 -4.486 7.263 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.882 -3.843 5.793 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.981 -4.752 6.639 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.582 -6.204 5.863 1.00 0.00 H new ATOM 1171 N PHE A 73 12.760 -4.820 3.223 1.00 0.00 N ATOM 1172 CA PHE A 73 12.283 -4.878 1.846 1.00 0.00 C ATOM 1173 C PHE A 73 13.448 -5.036 0.874 1.00 0.00 C ATOM 1174 O PHE A 73 13.403 -5.864 -0.038 1.00 0.00 O ATOM 1175 CB PHE A 73 11.487 -3.617 1.506 1.00 0.00 C ATOM 1176 CG PHE A 73 10.424 -3.288 2.515 1.00 0.00 C ATOM 1177 CD1 PHE A 73 10.738 -2.590 3.670 1.00 0.00 C ATOM 1178 CD2 PHE A 73 9.111 -3.677 2.308 1.00 0.00 C ATOM 1179 CE1 PHE A 73 9.762 -2.287 4.600 1.00 0.00 C ATOM 1180 CE2 PHE A 73 8.130 -3.377 3.235 1.00 0.00 C ATOM 1181 CZ PHE A 73 8.456 -2.680 4.382 1.00 0.00 C ATOM 0 H PHE A 73 13.288 -3.977 3.451 1.00 0.00 H new ATOM 0 HA PHE A 73 11.632 -5.747 1.749 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.174 -2.774 1.426 1.00 0.00 H new ATOM 0 HB3 PHE A 73 11.022 -3.743 0.528 1.00 0.00 H new ATOM 0 HD1 PHE A 73 11.757 -2.279 3.845 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.850 -4.221 1.412 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.020 -1.743 5.497 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.110 -3.687 3.062 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.691 -2.443 5.107 1.00 0.00 H new ATOM 1191 N LEU A 74 14.490 -4.237 1.073 1.00 0.00 N ATOM 1192 CA LEU A 74 15.668 -4.286 0.214 1.00 0.00 C ATOM 1193 C LEU A 74 16.690 -5.285 0.748 1.00 0.00 C ATOM 1194 O LEU A 74 17.875 -5.207 0.427 1.00 0.00 O ATOM 1195 CB LEU A 74 16.303 -2.899 0.106 1.00 0.00 C ATOM 1196 CG LEU A 74 15.343 -1.740 -0.165 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.065 -0.408 -0.040 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.713 -1.880 -1.543 1.00 0.00 C ATOM 0 H LEU A 74 14.543 -3.547 1.822 1.00 0.00 H new ATOM 0 HA LEU A 74 15.351 -4.612 -0.777 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.837 -2.693 1.034 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.046 -2.923 -0.691 1.00 0.00 H new ATOM 0 HG LEU A 74 14.548 -1.770 0.581 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.366 0.405 -0.236 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.467 -0.305 0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 74 16.881 -0.367 -0.762 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.033 -1.047 -1.718 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.495 -1.877 -2.303 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.159 -2.817 -1.596 1.00 0.00 H new ATOM 1210 N ALA A 75 16.221 -6.225 1.562 1.00 0.00 N ATOM 1211 CA ALA A 75 17.093 -7.243 2.136 1.00 0.00 C ATOM 1212 C ALA A 75 16.678 -8.639 1.685 1.00 0.00 C ATOM 1213 O ALA A 75 15.494 -8.947 1.546 1.00 0.00 O ATOM 1214 CB ALA A 75 17.081 -7.151 3.655 1.00 0.00 C ATOM 0 H ALA A 75 15.242 -6.303 1.839 1.00 0.00 H new ATOM 0 HA ALA A 75 18.107 -7.062 1.780 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.736 -7.916 4.071 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.433 -6.166 3.963 1.00 0.00 H new ATOM 0 HB3 ALA A 75 16.066 -7.304 4.021 1.00 0.00 H new ATOM 1220 N PRO A 76 17.674 -9.506 1.449 1.00 0.00 N ATOM 1221 CA PRO A 76 17.437 -10.884 1.010 1.00 0.00 C ATOM 1222 C PRO A 76 16.818 -11.744 2.106 1.00 0.00 C ATOM 1223 O PRO A 76 17.002 -11.479 3.294 1.00 0.00 O ATOM 1224 CB PRO A 76 18.839 -11.391 0.660 1.00 0.00 C ATOM 1225 CG PRO A 76 19.759 -10.558 1.485 1.00 0.00 C ATOM 1226 CD PRO A 76 19.109 -9.207 1.594 1.00 0.00 C ATOM 0 HA PRO A 76 16.732 -10.931 0.180 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.947 -12.450 0.894 1.00 0.00 H new ATOM 0 HB3 PRO A 76 19.048 -11.276 -0.404 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.908 -11.000 2.470 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.741 -10.482 1.018 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.326 -8.733 2.551 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.459 -8.529 0.816 1.00 0.00 H new ATOM 1234 N GLY A 77 16.083 -12.774 1.700 1.00 0.00 N ATOM 1235 CA GLY A 77 15.448 -13.657 2.661 1.00 0.00 C ATOM 1236 C GLY A 77 14.525 -12.916 3.608 1.00 0.00 C ATOM 1237 O GLY A 77 14.101 -13.462 4.626 1.00 0.00 O ATOM 0 H GLY A 77 15.916 -13.013 0.723 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.881 -14.420 2.129 1.00 0.00 H new ATOM 0 HA3 GLY A 77 16.215 -14.174 3.237 1.00 0.00 H new ATOM 1241 N ALA A 78 14.215 -11.668 3.273 1.00 0.00 N ATOM 1242 CA ALA A 78 13.336 -10.851 4.101 1.00 0.00 C ATOM 1243 C ALA A 78 11.873 -11.217 3.876 1.00 0.00 C ATOM 1244 O ALA A 78 11.498 -11.773 2.843 1.00 0.00 O ATOM 1245 CB ALA A 78 13.563 -9.374 3.813 1.00 0.00 C ATOM 0 H ALA A 78 14.559 -11.201 2.434 1.00 0.00 H new ATOM 0 HA ALA A 78 13.576 -11.048 5.146 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.900 -8.775 4.438 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.599 -9.116 4.031 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.352 -9.171 2.763 1.00 0.00 H new ATOM 1251 N PRO A 79 11.025 -10.901 4.866 1.00 0.00 N ATOM 1252 CA PRO A 79 9.589 -11.188 4.800 1.00 0.00 C ATOM 1253 C PRO A 79 8.870 -10.318 3.773 1.00 0.00 C ATOM 1254 O PRO A 79 8.017 -10.798 3.028 1.00 0.00 O ATOM 1255 CB PRO A 79 9.097 -10.865 6.212 1.00 0.00 C ATOM 1256 CG PRO A 79 10.077 -9.874 6.738 1.00 0.00 C ATOM 1257 CD PRO A 79 11.402 -10.238 6.125 1.00 0.00 C ATOM 0 HA PRO A 79 9.393 -12.214 4.490 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.088 -10.453 6.195 1.00 0.00 H new ATOM 0 HB3 PRO A 79 9.066 -11.759 6.834 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.788 -8.858 6.468 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.126 -9.913 7.826 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.018 -9.356 5.946 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.976 -10.901 6.772 1.00 0.00 H new ATOM 1265 N SER A 80 9.222 -9.037 3.741 1.00 0.00 N ATOM 1266 CA SER A 80 8.608 -8.099 2.808 1.00 0.00 C ATOM 1267 C SER A 80 9.587 -7.711 1.704 1.00 0.00 C ATOM 1268 O SER A 80 9.400 -6.707 1.018 1.00 0.00 O ATOM 1269 CB SER A 80 8.134 -6.847 3.548 1.00 0.00 C ATOM 1270 OG SER A 80 9.225 -6.154 4.129 1.00 0.00 O ATOM 0 H SER A 80 9.929 -8.625 4.350 1.00 0.00 H new ATOM 0 HA SER A 80 7.748 -8.590 2.351 1.00 0.00 H new ATOM 0 HB2 SER A 80 7.608 -6.189 2.856 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.422 -7.127 4.324 1.00 0.00 H new ATOM 0 HG SER A 80 9.257 -5.240 3.776 1.00 0.00 H new ATOM 1276 N ALA A 81 10.633 -8.515 1.540 1.00 0.00 N ATOM 1277 CA ALA A 81 11.641 -8.258 0.519 1.00 0.00 C ATOM 1278 C ALA A 81 10.996 -8.003 -0.838 1.00 0.00 C ATOM 1279 O ALA A 81 10.459 -8.920 -1.462 1.00 0.00 O ATOM 1280 CB ALA A 81 12.614 -9.424 0.433 1.00 0.00 C ATOM 0 H ALA A 81 10.804 -9.349 2.101 1.00 0.00 H new ATOM 0 HA ALA A 81 12.191 -7.361 0.804 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.361 -9.219 -0.333 1.00 0.00 H new ATOM 0 HB2 ALA A 81 13.108 -9.557 1.395 1.00 0.00 H new ATOM 0 HB3 ALA A 81 12.071 -10.333 0.175 1.00 0.00 H new ATOM 1286 N ILE A 82 11.051 -6.755 -1.290 1.00 0.00 N ATOM 1287 CA ILE A 82 10.472 -6.382 -2.575 1.00 0.00 C ATOM 1288 C ILE A 82 11.434 -6.680 -3.719 1.00 0.00 C ATOM 1289 O ILE A 82 12.534 -7.188 -3.503 1.00 0.00 O ATOM 1290 CB ILE A 82 10.097 -4.888 -2.610 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.344 -4.022 -2.419 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.060 -4.577 -1.541 1.00 0.00 C ATOM 1293 CD1 ILE A 82 11.209 -2.632 -2.999 1.00 0.00 C ATOM 0 H ILE A 82 11.490 -5.985 -0.786 1.00 0.00 H new ATOM 0 HA ILE A 82 9.568 -6.979 -2.699 1.00 0.00 H new ATOM 0 HB ILE A 82 9.665 -4.660 -3.584 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.562 -3.943 -1.354 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.196 -4.519 -2.883 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.805 -3.518 -1.578 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.164 -5.172 -1.719 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.466 -4.818 -0.559 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.130 -2.075 -2.827 1.00 0.00 H new ATOM 0 HD12 ILE A 82 11.022 -2.701 -4.071 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.378 -2.116 -2.518 1.00 0.00 H new ATOM 1305 N ASN A 83 11.013 -6.359 -4.938 1.00 0.00 N ATOM 1306 CA ASN A 83 11.838 -6.591 -6.118 1.00 0.00 C ATOM 1307 C ASN A 83 11.952 -5.324 -6.960 1.00 0.00 C ATOM 1308 O ASN A 83 10.978 -4.590 -7.133 1.00 0.00 O ATOM 1309 CB ASN A 83 11.253 -7.726 -6.960 1.00 0.00 C ATOM 1310 CG ASN A 83 12.196 -8.177 -8.059 1.00 0.00 C ATOM 1311 OD1 ASN A 83 12.261 -7.567 -9.126 1.00 0.00 O ATOM 1312 ND2 ASN A 83 12.932 -9.252 -7.801 1.00 0.00 N ATOM 0 H ASN A 83 10.105 -5.937 -5.135 1.00 0.00 H new ATOM 0 HA ASN A 83 12.836 -6.874 -5.783 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.022 -8.572 -6.313 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.313 -7.398 -7.404 1.00 0.00 H new ATOM 0 HD21 ASN A 83 13.584 -9.604 -8.502 1.00 0.00 H new ATOM 0 HD22 ASN A 83 12.845 -9.726 -6.902 1.00 0.00 H new ATOM 1319 N LEU A 84 13.148 -5.074 -7.483 1.00 0.00 N ATOM 1320 CA LEU A 84 13.390 -3.895 -8.308 1.00 0.00 C ATOM 1321 C LEU A 84 14.185 -4.260 -9.558 1.00 0.00 C ATOM 1322 O LEU A 84 14.602 -5.406 -9.728 1.00 0.00 O ATOM 1323 CB LEU A 84 14.140 -2.831 -7.505 1.00 0.00 C ATOM 1324 CG LEU A 84 13.506 -2.425 -6.174 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.542 -1.782 -5.265 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.337 -1.479 -6.407 1.00 0.00 C ATOM 0 H LEU A 84 13.964 -5.671 -7.351 1.00 0.00 H new ATOM 0 HA LEU A 84 12.425 -3.494 -8.617 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.148 -3.196 -7.308 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.239 -1.940 -8.124 1.00 0.00 H new ATOM 0 HG LEU A 84 13.129 -3.322 -5.683 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.074 -1.499 -4.322 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.347 -2.491 -5.072 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.949 -0.894 -5.748 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.898 -1.200 -5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.690 -0.584 -6.918 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.585 -1.975 -7.021 1.00 0.00 H new ATOM 1338 N ASP A 85 14.394 -3.278 -10.428 1.00 0.00 N ATOM 1339 CA ASP A 85 15.142 -3.494 -11.660 1.00 0.00 C ATOM 1340 C ASP A 85 16.634 -3.632 -11.373 1.00 0.00 C ATOM 1341 O ASP A 85 17.103 -3.283 -10.290 1.00 0.00 O ATOM 1342 CB ASP A 85 14.903 -2.342 -12.637 1.00 0.00 C ATOM 1343 CG ASP A 85 14.990 -2.782 -14.085 1.00 0.00 C ATOM 1344 OD1 ASP A 85 15.699 -3.771 -14.362 1.00 0.00 O ATOM 1345 OD2 ASP A 85 14.349 -2.137 -14.941 1.00 0.00 O ATOM 0 H ASP A 85 14.055 -2.324 -10.302 1.00 0.00 H new ATOM 0 HA ASP A 85 14.789 -4.421 -12.111 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.920 -1.910 -12.450 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.637 -1.557 -12.454 1.00 0.00 H new ATOM 1350 N SER A 86 17.375 -4.145 -12.350 1.00 0.00 N ATOM 1351 CA SER A 86 18.813 -4.334 -12.201 1.00 0.00 C ATOM 1352 C SER A 86 19.525 -2.992 -12.059 1.00 0.00 C ATOM 1353 O SER A 86 20.428 -2.839 -11.236 1.00 0.00 O ATOM 1354 CB SER A 86 19.376 -5.099 -13.400 1.00 0.00 C ATOM 1355 OG SER A 86 19.331 -6.498 -13.180 1.00 0.00 O ATOM 0 H SER A 86 17.003 -4.437 -13.254 1.00 0.00 H new ATOM 0 HA SER A 86 18.986 -4.915 -11.295 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.805 -4.850 -14.295 1.00 0.00 H new ATOM 0 HB3 SER A 86 20.405 -4.789 -13.582 1.00 0.00 H new ATOM 0 HG SER A 86 19.695 -6.964 -13.962 1.00 0.00 H new ATOM 1361 N LYS A 87 19.113 -2.022 -12.867 1.00 0.00 N ATOM 1362 CA LYS A 87 19.708 -0.692 -12.834 1.00 0.00 C ATOM 1363 C LYS A 87 19.303 0.054 -11.566 1.00 0.00 C ATOM 1364 O LYS A 87 20.128 0.707 -10.928 1.00 0.00 O ATOM 1365 CB LYS A 87 19.287 0.110 -14.067 1.00 0.00 C ATOM 1366 CG LYS A 87 17.797 0.402 -14.122 1.00 0.00 C ATOM 1367 CD LYS A 87 17.350 0.752 -15.531 1.00 0.00 C ATOM 1368 CE LYS A 87 15.833 0.761 -15.649 1.00 0.00 C ATOM 1369 NZ LYS A 87 15.244 2.025 -15.126 1.00 0.00 N ATOM 0 H LYS A 87 18.368 -2.132 -13.554 1.00 0.00 H new ATOM 0 HA LYS A 87 20.792 -0.807 -12.837 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.834 1.052 -14.082 1.00 0.00 H new ATOM 0 HB3 LYS A 87 19.575 -0.440 -14.963 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.242 -0.467 -13.768 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.562 1.227 -13.449 1.00 0.00 H new ATOM 0 HD2 LYS A 87 17.743 1.731 -15.806 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.766 0.032 -16.235 1.00 0.00 H new ATOM 0 HE2 LYS A 87 15.549 0.633 -16.694 1.00 0.00 H new ATOM 0 HE3 LYS A 87 15.421 -0.086 -15.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 14.209 1.992 -15.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 15.493 2.135 -14.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 15.618 2.832 -15.666 1.00 0.00 H new ATOM 1383 N SER A 88 18.027 -0.050 -11.206 1.00 0.00 N ATOM 1384 CA SER A 88 17.512 0.616 -10.016 1.00 0.00 C ATOM 1385 C SER A 88 18.136 0.032 -8.753 1.00 0.00 C ATOM 1386 O SER A 88 18.763 0.745 -7.969 1.00 0.00 O ATOM 1387 CB SER A 88 15.989 0.488 -9.953 1.00 0.00 C ATOM 1388 OG SER A 88 15.389 0.935 -11.156 1.00 0.00 O ATOM 0 H SER A 88 17.332 -0.589 -11.722 1.00 0.00 H new ATOM 0 HA SER A 88 17.778 1.671 -10.077 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.716 -0.551 -9.771 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.607 1.070 -9.114 1.00 0.00 H new ATOM 0 HG SER A 88 14.498 1.295 -10.963 1.00 0.00 H new ATOM 1394 N TYR A 89 17.960 -1.271 -8.562 1.00 0.00 N ATOM 1395 CA TYR A 89 18.503 -1.953 -7.394 1.00 0.00 C ATOM 1396 C TYR A 89 19.949 -1.534 -7.141 1.00 0.00 C ATOM 1397 O TYR A 89 20.325 -1.209 -6.015 1.00 0.00 O ATOM 1398 CB TYR A 89 18.425 -3.469 -7.579 1.00 0.00 C ATOM 1399 CG TYR A 89 18.601 -4.246 -6.294 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.707 -4.097 -5.241 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.661 -5.130 -6.133 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.864 -4.804 -4.065 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.825 -5.843 -4.962 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.925 -5.676 -3.930 1.00 0.00 C ATOM 1405 OH TYR A 89 19.086 -6.383 -2.761 1.00 0.00 O ATOM 0 H TYR A 89 17.445 -1.876 -9.202 1.00 0.00 H new ATOM 0 HA TYR A 89 17.904 -1.668 -6.529 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.461 -3.724 -8.018 1.00 0.00 H new ATOM 0 HB3 TYR A 89 19.191 -3.780 -8.289 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.875 -3.416 -5.344 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.369 -5.262 -6.938 1.00 0.00 H new ATOM 0 HE1 TYR A 89 17.160 -4.675 -3.256 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.653 -6.528 -4.855 1.00 0.00 H new ATOM 0 HH TYR A 89 19.881 -6.953 -2.830 1.00 0.00 H new ATOM 1415 N ASP A 90 20.753 -1.545 -8.198 1.00 0.00 N ATOM 1416 CA ASP A 90 22.158 -1.165 -8.094 1.00 0.00 C ATOM 1417 C ASP A 90 22.304 0.193 -7.414 1.00 0.00 C ATOM 1418 O ASP A 90 23.059 0.340 -6.453 1.00 0.00 O ATOM 1419 CB ASP A 90 22.802 -1.129 -9.480 1.00 0.00 C ATOM 1420 CG ASP A 90 24.272 -0.759 -9.425 1.00 0.00 C ATOM 1421 OD1 ASP A 90 24.576 0.434 -9.210 1.00 0.00 O ATOM 1422 OD2 ASP A 90 25.117 -1.661 -9.597 1.00 0.00 O ATOM 0 H ASP A 90 20.457 -1.813 -9.137 1.00 0.00 H new ATOM 0 HA ASP A 90 22.668 -1.912 -7.485 1.00 0.00 H new ATOM 0 HB2 ASP A 90 22.693 -2.105 -9.954 1.00 0.00 H new ATOM 0 HB3 ASP A 90 22.272 -0.410 -10.105 1.00 0.00 H new ATOM 1427 N LYS A 91 21.578 1.183 -7.921 1.00 0.00 N ATOM 1428 CA LYS A 91 21.626 2.530 -7.365 1.00 0.00 C ATOM 1429 C LYS A 91 21.347 2.510 -5.865 1.00 0.00 C ATOM 1430 O LYS A 91 22.090 3.095 -5.077 1.00 0.00 O ATOM 1431 CB LYS A 91 20.610 3.432 -8.071 1.00 0.00 C ATOM 1432 CG LYS A 91 20.446 4.792 -7.415 1.00 0.00 C ATOM 1433 CD LYS A 91 21.653 5.681 -7.664 1.00 0.00 C ATOM 1434 CE LYS A 91 21.585 6.958 -6.840 1.00 0.00 C ATOM 1435 NZ LYS A 91 22.699 7.890 -7.168 1.00 0.00 N ATOM 0 H LYS A 91 20.949 1.078 -8.717 1.00 0.00 H new ATOM 0 HA LYS A 91 22.629 2.927 -7.525 1.00 0.00 H new ATOM 0 HB2 LYS A 91 20.919 3.572 -9.107 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.643 2.929 -8.092 1.00 0.00 H new ATOM 0 HG2 LYS A 91 19.550 5.277 -7.801 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.302 4.664 -6.342 1.00 0.00 H new ATOM 0 HD2 LYS A 91 22.564 5.136 -7.418 1.00 0.00 H new ATOM 0 HD3 LYS A 91 21.708 5.933 -8.723 1.00 0.00 H new ATOM 0 HE2 LYS A 91 20.631 7.455 -7.018 1.00 0.00 H new ATOM 0 HE3 LYS A 91 21.621 6.708 -5.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 22.617 8.748 -6.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 23.609 7.425 -6.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 22.650 8.149 -8.174 1.00 0.00 H new ATOM 1449 N THR A 92 20.272 1.831 -5.477 1.00 0.00 N ATOM 1450 CA THR A 92 19.895 1.733 -4.072 1.00 0.00 C ATOM 1451 C THR A 92 21.017 1.118 -3.244 1.00 0.00 C ATOM 1452 O THR A 92 21.598 1.776 -2.380 1.00 0.00 O ATOM 1453 CB THR A 92 18.618 0.892 -3.890 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.550 1.450 -4.664 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.212 0.835 -2.425 1.00 0.00 C ATOM 0 H THR A 92 19.647 1.341 -6.116 1.00 0.00 H new ATOM 0 HA THR A 92 19.705 2.748 -3.724 1.00 0.00 H new ATOM 0 HB THR A 92 18.825 -0.122 -4.233 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.132 0.745 -5.201 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.308 0.236 -2.321 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.015 0.384 -1.842 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.022 1.845 -2.061 1.00 0.00 H new ATOM 1463 N THR A 93 21.319 -0.148 -3.512 1.00 0.00 N ATOM 1464 CA THR A 93 22.372 -0.852 -2.791 1.00 0.00 C ATOM 1465 C THR A 93 23.552 0.069 -2.503 1.00 0.00 C ATOM 1466 O THR A 93 23.947 0.246 -1.350 1.00 0.00 O ATOM 1467 CB THR A 93 22.872 -2.076 -3.581 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.759 -2.812 -4.101 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.717 -2.982 -2.698 1.00 0.00 C ATOM 0 H THR A 93 20.849 -0.707 -4.224 1.00 0.00 H new ATOM 0 HA THR A 93 21.939 -1.189 -1.849 1.00 0.00 H new ATOM 0 HB THR A 93 23.489 -1.720 -4.406 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.372 -2.327 -4.860 1.00 0.00 H new ATOM 0 HG21 THR A 93 24.059 -3.839 -3.278 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.579 -2.428 -2.327 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.119 -3.329 -1.855 1.00 0.00 H new ATOM 1477 N HIS A 94 24.111 0.654 -3.557 1.00 0.00 N ATOM 1478 CA HIS A 94 25.246 1.560 -3.416 1.00 0.00 C ATOM 1479 C HIS A 94 24.884 2.753 -2.538 1.00 0.00 C ATOM 1480 O HIS A 94 25.638 3.127 -1.641 1.00 0.00 O ATOM 1481 CB HIS A 94 25.712 2.045 -4.789 1.00 0.00 C ATOM 1482 CG HIS A 94 26.636 1.091 -5.480 1.00 0.00 C ATOM 1483 ND1 HIS A 94 27.696 0.477 -4.846 1.00 0.00 N ATOM 1484 CD2 HIS A 94 26.655 0.644 -6.758 1.00 0.00 C ATOM 1485 CE1 HIS A 94 28.327 -0.305 -5.704 1.00 0.00 C ATOM 1486 NE2 HIS A 94 27.715 -0.221 -6.872 1.00 0.00 N ATOM 0 H HIS A 94 23.797 0.517 -4.518 1.00 0.00 H new ATOM 0 HA HIS A 94 26.058 1.013 -2.937 1.00 0.00 H new ATOM 0 HB2 HIS A 94 24.840 2.215 -5.420 1.00 0.00 H new ATOM 0 HB3 HIS A 94 26.214 3.006 -4.674 1.00 0.00 H new ATOM 0 HD2 HIS A 94 25.964 0.917 -7.542 1.00 0.00 H new ATOM 0 HE1 HIS A 94 29.195 -0.910 -5.487 1.00 0.00 H new ATOM 0 HE2 HIS A 94 27.986 -0.718 -7.720 1.00 0.00 H new ATOM 1494 N ASN A 95 23.725 3.347 -2.803 1.00 0.00 N ATOM 1495 CA ASN A 95 23.263 4.499 -2.037 1.00 0.00 C ATOM 1496 C ASN A 95 23.195 4.171 -0.549 1.00 0.00 C ATOM 1497 O ASN A 95 23.557 4.990 0.296 1.00 0.00 O ATOM 1498 CB ASN A 95 21.888 4.950 -2.534 1.00 0.00 C ATOM 1499 CG ASN A 95 21.667 6.439 -2.350 1.00 0.00 C ATOM 1500 OD1 ASN A 95 22.138 7.032 -1.379 1.00 0.00 O ATOM 1501 ND2 ASN A 95 20.947 7.050 -3.283 1.00 0.00 N ATOM 0 H ASN A 95 23.088 3.050 -3.542 1.00 0.00 H new ATOM 0 HA ASN A 95 23.978 5.309 -2.180 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.785 4.698 -3.589 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.113 4.401 -1.998 1.00 0.00 H new ATOM 0 HD21 ASN A 95 20.764 8.051 -3.212 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.576 6.518 -4.071 1.00 0.00 H new ATOM 1508 N VAL A 96 22.730 2.966 -0.234 1.00 0.00 N ATOM 1509 CA VAL A 96 22.616 2.528 1.152 1.00 0.00 C ATOM 1510 C VAL A 96 23.866 2.890 1.947 1.00 0.00 C ATOM 1511 O VAL A 96 23.779 3.380 3.073 1.00 0.00 O ATOM 1512 CB VAL A 96 22.384 1.008 1.243 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.275 0.571 2.696 1.00 0.00 C ATOM 1514 CG2 VAL A 96 21.140 0.612 0.463 1.00 0.00 C ATOM 0 H VAL A 96 22.426 2.276 -0.920 1.00 0.00 H new ATOM 0 HA VAL A 96 21.756 3.045 1.578 1.00 0.00 H new ATOM 0 HB VAL A 96 23.240 0.499 0.799 1.00 0.00 H new ATOM 0 HG11 VAL A 96 22.111 -0.506 2.741 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.197 0.820 3.221 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.438 1.085 3.169 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.991 -0.465 0.538 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.273 1.128 0.875 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.263 0.889 -0.584 1.00 0.00 H new ATOM 1524 N LYS A 97 25.029 2.645 1.353 1.00 0.00 N ATOM 1525 CA LYS A 97 26.299 2.945 2.003 1.00 0.00 C ATOM 1526 C LYS A 97 26.179 4.186 2.883 1.00 0.00 C ATOM 1527 O LYS A 97 26.586 4.175 4.044 1.00 0.00 O ATOM 1528 CB LYS A 97 27.395 3.154 0.956 1.00 0.00 C ATOM 1529 CG LYS A 97 28.170 1.890 0.627 1.00 0.00 C ATOM 1530 CD LYS A 97 27.291 0.861 -0.064 1.00 0.00 C ATOM 1531 CE LYS A 97 28.120 -0.250 -0.690 1.00 0.00 C ATOM 1532 NZ LYS A 97 29.047 0.270 -1.733 1.00 0.00 N ATOM 0 H LYS A 97 25.118 2.239 0.422 1.00 0.00 H new ATOM 0 HA LYS A 97 26.565 2.097 2.634 1.00 0.00 H new ATOM 0 HB2 LYS A 97 26.944 3.542 0.043 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.090 3.913 1.316 1.00 0.00 H new ATOM 0 HG2 LYS A 97 29.016 2.137 -0.015 1.00 0.00 H new ATOM 0 HG3 LYS A 97 28.579 1.464 1.543 1.00 0.00 H new ATOM 0 HD2 LYS A 97 26.594 0.434 0.657 1.00 0.00 H new ATOM 0 HD3 LYS A 97 26.694 1.349 -0.834 1.00 0.00 H new ATOM 0 HE2 LYS A 97 28.694 -0.756 0.086 1.00 0.00 H new ATOM 0 HE3 LYS A 97 27.456 -0.993 -1.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 28.958 -0.305 -2.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 28.806 1.258 -1.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 30.025 0.221 -1.384 1.00 0.00 H new ATOM 1546 N GLU A 98 25.617 5.252 2.322 1.00 0.00 N ATOM 1547 CA GLU A 98 25.444 6.499 3.057 1.00 0.00 C ATOM 1548 C GLU A 98 23.966 6.781 3.310 1.00 0.00 C ATOM 1549 O GLU A 98 23.187 7.018 2.386 1.00 0.00 O ATOM 1550 CB GLU A 98 26.072 7.663 2.287 1.00 0.00 C ATOM 1551 CG GLU A 98 25.685 7.700 0.818 1.00 0.00 C ATOM 1552 CD GLU A 98 25.961 9.045 0.176 1.00 0.00 C ATOM 1553 OE1 GLU A 98 25.685 10.079 0.820 1.00 0.00 O ATOM 1554 OE2 GLU A 98 26.453 9.064 -0.972 1.00 0.00 O ATOM 0 H GLU A 98 25.274 5.277 1.362 1.00 0.00 H new ATOM 0 HA GLU A 98 25.947 6.396 4.019 1.00 0.00 H new ATOM 0 HB2 GLU A 98 25.774 8.601 2.756 1.00 0.00 H new ATOM 0 HB3 GLU A 98 27.157 7.597 2.367 1.00 0.00 H new ATOM 0 HG2 GLU A 98 26.234 6.926 0.282 1.00 0.00 H new ATOM 0 HG3 GLU A 98 24.625 7.465 0.719 1.00 0.00 H new ATOM 1561 N PRO A 99 23.570 6.755 4.591 1.00 0.00 N ATOM 1562 CA PRO A 99 22.183 7.006 4.996 1.00 0.00 C ATOM 1563 C PRO A 99 21.775 8.461 4.797 1.00 0.00 C ATOM 1564 O PRO A 99 22.446 9.375 5.274 1.00 0.00 O ATOM 1565 CB PRO A 99 22.178 6.648 6.484 1.00 0.00 C ATOM 1566 CG PRO A 99 23.588 6.841 6.925 1.00 0.00 C ATOM 1567 CD PRO A 99 24.444 6.480 5.743 1.00 0.00 C ATOM 0 HA PRO A 99 21.474 6.429 4.402 1.00 0.00 H new ATOM 0 HB2 PRO A 99 21.497 7.290 7.043 1.00 0.00 H new ATOM 0 HB3 PRO A 99 21.851 5.621 6.643 1.00 0.00 H new ATOM 0 HG2 PRO A 99 23.763 7.872 7.233 1.00 0.00 H new ATOM 0 HG3 PRO A 99 23.819 6.208 7.782 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.354 7.079 5.709 1.00 0.00 H new ATOM 0 HD3 PRO A 99 24.751 5.435 5.774 1.00 0.00 H new ATOM 1575 N GLY A 100 20.669 8.670 4.089 1.00 0.00 N ATOM 1576 CA GLY A 100 20.190 10.017 3.840 1.00 0.00 C ATOM 1577 C GLY A 100 18.678 10.112 3.879 1.00 0.00 C ATOM 1578 O GLY A 100 18.030 9.467 4.703 1.00 0.00 O ATOM 0 H GLY A 100 20.096 7.930 3.683 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.613 10.693 4.584 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.547 10.352 2.866 1.00 0.00 H new ATOM 1582 N ARG A 101 18.114 10.919 2.986 1.00 0.00 N ATOM 1583 CA ARG A 101 16.668 11.098 2.923 1.00 0.00 C ATOM 1584 C ARG A 101 16.119 10.621 1.582 1.00 0.00 C ATOM 1585 O ARG A 101 15.014 10.083 1.509 1.00 0.00 O ATOM 1586 CB ARG A 101 16.305 12.568 3.141 1.00 0.00 C ATOM 1587 CG ARG A 101 16.721 13.103 4.502 1.00 0.00 C ATOM 1588 CD ARG A 101 15.815 14.237 4.955 1.00 0.00 C ATOM 1589 NE ARG A 101 15.859 14.427 6.403 1.00 0.00 N ATOM 1590 CZ ARG A 101 15.293 15.454 7.026 1.00 0.00 C ATOM 1591 NH1 ARG A 101 14.643 16.379 6.333 1.00 0.00 N ATOM 1592 NH2 ARG A 101 15.376 15.558 8.347 1.00 0.00 N ATOM 0 H ARG A 101 18.636 11.459 2.296 1.00 0.00 H new ATOM 0 HA ARG A 101 16.218 10.498 3.714 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.777 13.169 2.364 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.228 12.688 3.027 1.00 0.00 H new ATOM 0 HG2 ARG A 101 16.692 12.297 5.235 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.752 13.455 4.456 1.00 0.00 H new ATOM 0 HD2 ARG A 101 16.114 15.160 4.459 1.00 0.00 H new ATOM 0 HD3 ARG A 101 14.790 14.027 4.648 1.00 0.00 H new ATOM 0 HE ARG A 101 16.351 13.733 6.966 1.00 0.00 H new ATOM 0 HH11 ARG A 101 14.577 16.303 5.318 1.00 0.00 H new ATOM 0 HH12 ARG A 101 14.209 17.167 6.815 1.00 0.00 H new ATOM 0 HH21 ARG A 101 15.875 14.849 8.884 1.00 0.00 H new ATOM 0 HH22 ARG A 101 14.941 16.347 8.825 1.00 0.00 H new ATOM 1606 N TYR A 102 16.897 10.822 0.525 1.00 0.00 N ATOM 1607 CA TYR A 102 16.488 10.415 -0.814 1.00 0.00 C ATOM 1608 C TYR A 102 17.307 9.221 -1.295 1.00 0.00 C ATOM 1609 O TYR A 102 17.358 8.928 -2.490 1.00 0.00 O ATOM 1610 CB TYR A 102 16.641 11.580 -1.793 1.00 0.00 C ATOM 1611 CG TYR A 102 16.163 12.903 -1.239 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.906 13.022 -0.658 1.00 0.00 C ATOM 1613 CD2 TYR A 102 16.968 14.034 -1.296 1.00 0.00 C ATOM 1614 CE1 TYR A 102 14.465 14.229 -0.152 1.00 0.00 C ATOM 1615 CE2 TYR A 102 16.535 15.245 -0.791 1.00 0.00 C ATOM 1616 CZ TYR A 102 15.283 15.338 -0.220 1.00 0.00 C ATOM 1617 OH TYR A 102 14.848 16.542 0.285 1.00 0.00 O ATOM 0 H TYR A 102 17.815 11.265 0.569 1.00 0.00 H new ATOM 0 HA TYR A 102 15.440 10.120 -0.772 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.690 11.671 -2.075 1.00 0.00 H new ATOM 0 HB3 TYR A 102 16.085 11.354 -2.703 1.00 0.00 H new ATOM 0 HD1 TYR A 102 14.263 12.156 -0.601 1.00 0.00 H new ATOM 0 HD2 TYR A 102 17.949 13.965 -1.743 1.00 0.00 H new ATOM 0 HE1 TYR A 102 13.485 14.304 0.295 1.00 0.00 H new ATOM 0 HE2 TYR A 102 17.174 16.114 -0.843 1.00 0.00 H new ATOM 0 HH TYR A 102 15.544 17.220 0.159 1.00 0.00 H new ATOM 1627 N THR A 103 17.947 8.533 -0.354 1.00 0.00 N ATOM 1628 CA THR A 103 18.765 7.372 -0.680 1.00 0.00 C ATOM 1629 C THR A 103 17.957 6.328 -1.443 1.00 0.00 C ATOM 1630 O THR A 103 18.472 5.671 -2.349 1.00 0.00 O ATOM 1631 CB THR A 103 19.351 6.724 0.589 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.259 7.629 1.226 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.073 5.428 0.251 1.00 0.00 C ATOM 0 H THR A 103 17.914 8.760 0.640 1.00 0.00 H new ATOM 0 HA THR A 103 19.582 7.727 -1.309 1.00 0.00 H new ATOM 0 HB THR A 103 18.529 6.497 1.267 1.00 0.00 H new ATOM 0 HG1 THR A 103 21.078 7.151 1.474 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.478 4.989 1.163 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.372 4.730 -0.208 1.00 0.00 H new ATOM 0 HG23 THR A 103 20.886 5.635 -0.444 1.00 0.00 H new ATOM 1641 N PHE A 104 16.690 6.180 -1.072 1.00 0.00 N ATOM 1642 CA PHE A 104 15.811 5.215 -1.723 1.00 0.00 C ATOM 1643 C PHE A 104 14.912 5.902 -2.747 1.00 0.00 C ATOM 1644 O PHE A 104 13.901 5.345 -3.172 1.00 0.00 O ATOM 1645 CB PHE A 104 14.955 4.490 -0.681 1.00 0.00 C ATOM 1646 CG PHE A 104 15.756 3.885 0.436 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.564 2.783 0.209 1.00 0.00 C ATOM 1648 CD2 PHE A 104 15.700 4.418 1.714 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.302 2.223 1.235 1.00 0.00 C ATOM 1650 CE2 PHE A 104 16.436 3.863 2.744 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.237 2.764 2.504 1.00 0.00 C ATOM 0 H PHE A 104 16.249 6.715 -0.324 1.00 0.00 H new ATOM 0 HA PHE A 104 16.433 4.487 -2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.235 5.192 -0.262 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.384 3.704 -1.175 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.618 2.356 -0.782 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.074 5.277 1.907 1.00 0.00 H new ATOM 0 HE1 PHE A 104 17.928 1.364 1.045 1.00 0.00 H new ATOM 0 HE2 PHE A 104 16.385 4.288 3.735 1.00 0.00 H new ATOM 0 HZ PHE A 104 17.812 2.328 3.308 1.00 0.00 H new ATOM 1661 N GLU A 105 15.290 7.115 -3.138 1.00 0.00 N ATOM 1662 CA GLU A 105 14.518 7.878 -4.111 1.00 0.00 C ATOM 1663 C GLU A 105 14.259 7.053 -5.368 1.00 0.00 C ATOM 1664 O GLU A 105 13.116 6.898 -5.798 1.00 0.00 O ATOM 1665 CB GLU A 105 15.251 9.170 -4.477 1.00 0.00 C ATOM 1666 CG GLU A 105 14.397 10.154 -5.259 1.00 0.00 C ATOM 1667 CD GLU A 105 15.224 11.082 -6.127 1.00 0.00 C ATOM 1668 OE1 GLU A 105 15.760 10.613 -7.153 1.00 0.00 O ATOM 1669 OE2 GLU A 105 15.335 12.277 -5.782 1.00 0.00 O ATOM 0 H GLU A 105 16.125 7.590 -2.796 1.00 0.00 H new ATOM 0 HA GLU A 105 13.559 8.129 -3.659 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.600 9.651 -3.563 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.135 8.922 -5.065 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.697 9.603 -5.887 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.803 10.747 -4.563 1.00 0.00 H new ATOM 1676 N ASP A 106 15.330 6.526 -5.953 1.00 0.00 N ATOM 1677 CA ASP A 106 15.220 5.716 -7.161 1.00 0.00 C ATOM 1678 C ASP A 106 14.188 4.607 -6.980 1.00 0.00 C ATOM 1679 O ASP A 106 13.154 4.593 -7.646 1.00 0.00 O ATOM 1680 CB ASP A 106 16.578 5.112 -7.521 1.00 0.00 C ATOM 1681 CG ASP A 106 16.697 4.792 -8.998 1.00 0.00 C ATOM 1682 OD1 ASP A 106 15.934 3.929 -9.480 1.00 0.00 O ATOM 1683 OD2 ASP A 106 17.553 5.404 -9.671 1.00 0.00 O ATOM 0 H ASP A 106 16.283 6.645 -5.610 1.00 0.00 H new ATOM 0 HA ASP A 106 14.892 6.364 -7.974 1.00 0.00 H new ATOM 0 HB2 ASP A 106 17.368 5.808 -7.238 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.732 4.202 -6.942 1.00 0.00 H new ATOM 1688 N ALA A 107 14.478 3.678 -6.074 1.00 0.00 N ATOM 1689 CA ALA A 107 13.576 2.566 -5.805 1.00 0.00 C ATOM 1690 C ALA A 107 12.156 3.060 -5.550 1.00 0.00 C ATOM 1691 O ALA A 107 11.203 2.580 -6.162 1.00 0.00 O ATOM 1692 CB ALA A 107 14.076 1.756 -4.618 1.00 0.00 C ATOM 0 H ALA A 107 15.331 3.674 -5.514 1.00 0.00 H new ATOM 0 HA ALA A 107 13.557 1.925 -6.686 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.392 0.928 -4.428 1.00 0.00 H new ATOM 0 HB2 ALA A 107 15.069 1.363 -4.838 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.125 2.395 -3.736 1.00 0.00 H new ATOM 1698 N GLN A 108 12.023 4.022 -4.641 1.00 0.00 N ATOM 1699 CA GLN A 108 10.719 4.579 -4.304 1.00 0.00 C ATOM 1700 C GLN A 108 9.955 4.975 -5.563 1.00 0.00 C ATOM 1701 O GLN A 108 8.742 4.785 -5.650 1.00 0.00 O ATOM 1702 CB GLN A 108 10.881 5.794 -3.389 1.00 0.00 C ATOM 1703 CG GLN A 108 9.568 6.480 -3.050 1.00 0.00 C ATOM 1704 CD GLN A 108 9.750 7.665 -2.123 1.00 0.00 C ATOM 1705 OE1 GLN A 108 9.050 7.648 -0.995 1.00 0.00 O flip ATOM 1706 NE2 GLN A 108 10.513 8.586 -2.416 1.00 0.00 N flip ATOM 0 H GLN A 108 12.802 4.431 -4.126 1.00 0.00 H new ATOM 0 HA GLN A 108 10.149 3.812 -3.780 1.00 0.00 H new ATOM 0 HB2 GLN A 108 11.366 5.480 -2.465 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.544 6.514 -3.869 1.00 0.00 H new ATOM 0 HG2 GLN A 108 9.089 6.814 -3.970 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.896 5.759 -2.584 1.00 0.00 H new ATOM 0 HE21 GLN A 108 11.032 8.559 -3.294 1.00 0.00 H new ATOM 0 HE22 GLN A 108 10.626 9.376 -1.781 1.00 0.00 H new ATOM 1715 N GLU A 109 10.673 5.527 -6.537 1.00 0.00 N ATOM 1716 CA GLU A 109 10.061 5.951 -7.790 1.00 0.00 C ATOM 1717 C GLU A 109 9.712 4.747 -8.660 1.00 0.00 C ATOM 1718 O GLU A 109 8.628 4.678 -9.240 1.00 0.00 O ATOM 1719 CB GLU A 109 11.001 6.889 -8.551 1.00 0.00 C ATOM 1720 CG GLU A 109 10.685 6.995 -10.034 1.00 0.00 C ATOM 1721 CD GLU A 109 11.598 7.967 -10.756 1.00 0.00 C ATOM 1722 OE1 GLU A 109 12.797 8.024 -10.411 1.00 0.00 O ATOM 1723 OE2 GLU A 109 11.113 8.670 -11.667 1.00 0.00 O ATOM 0 H GLU A 109 11.678 5.691 -6.482 1.00 0.00 H new ATOM 0 HA GLU A 109 9.141 6.485 -7.553 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.949 7.882 -8.105 1.00 0.00 H new ATOM 0 HB3 GLU A 109 12.026 6.539 -8.431 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.774 6.010 -10.492 1.00 0.00 H new ATOM 0 HG3 GLU A 109 9.650 7.313 -10.160 1.00 0.00 H new ATOM 1730 N HIS A 110 10.640 3.798 -8.747 1.00 0.00 N ATOM 1731 CA HIS A 110 10.432 2.596 -9.546 1.00 0.00 C ATOM 1732 C HIS A 110 9.134 1.898 -9.149 1.00 0.00 C ATOM 1733 O HIS A 110 8.333 1.524 -10.006 1.00 0.00 O ATOM 1734 CB HIS A 110 11.611 1.637 -9.380 1.00 0.00 C ATOM 1735 CG HIS A 110 11.556 0.455 -10.297 1.00 0.00 C ATOM 1736 ND1 HIS A 110 11.108 -0.806 -10.090 1.00 0.00 N flip ATOM 1737 CD2 HIS A 110 11.998 0.494 -11.603 1.00 0.00 C flip ATOM 1738 CE1 HIS A 110 11.285 -1.498 -11.263 1.00 0.00 C flip ATOM 1739 NE2 HIS A 110 11.823 -0.691 -12.160 1.00 0.00 N flip ATOM 0 H HIS A 110 11.543 3.839 -8.274 1.00 0.00 H new ATOM 0 HA HIS A 110 10.360 2.893 -10.592 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.539 2.181 -9.557 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.640 1.285 -8.349 1.00 0.00 H new ATOM 0 HD2 HIS A 110 12.421 1.358 -12.094 1.00 0.00 H new ATOM 0 HE1 HIS A 110 11.026 -2.534 -11.426 1.00 0.00 H new ATOM 0 HE2 HIS A 110 12.063 -0.941 -13.120 1.00 0.00 H new ATOM 1747 N ILE A 111 8.935 1.726 -7.847 1.00 0.00 N ATOM 1748 CA ILE A 111 7.735 1.074 -7.338 1.00 0.00 C ATOM 1749 C ILE A 111 6.494 1.921 -7.602 1.00 0.00 C ATOM 1750 O ILE A 111 5.489 1.426 -8.111 1.00 0.00 O ATOM 1751 CB ILE A 111 7.842 0.798 -5.827 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.028 -0.125 -5.538 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.549 0.186 -5.307 1.00 0.00 C ATOM 1754 CD1 ILE A 111 8.905 -1.488 -6.182 1.00 0.00 C ATOM 0 H ILE A 111 9.589 2.029 -7.125 1.00 0.00 H new ATOM 0 HA ILE A 111 7.644 0.125 -7.867 1.00 0.00 H new ATOM 0 HB ILE A 111 8.007 1.744 -5.311 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.943 0.352 -5.889 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.127 -0.249 -4.460 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.640 -0.003 -4.237 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.723 0.875 -5.484 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.356 -0.753 -5.826 1.00 0.00 H new ATOM 0 HD11 ILE A 111 9.781 -2.088 -5.934 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.008 -1.985 -5.813 1.00 0.00 H new ATOM 0 HD13 ILE A 111 8.837 -1.374 -7.264 1.00 0.00 H new ATOM 1766 N TYR A 112 6.574 3.200 -7.254 1.00 0.00 N ATOM 1767 CA TYR A 112 5.458 4.117 -7.452 1.00 0.00 C ATOM 1768 C TYR A 112 4.841 3.934 -8.836 1.00 0.00 C ATOM 1769 O TYR A 112 3.672 3.571 -8.965 1.00 0.00 O ATOM 1770 CB TYR A 112 5.922 5.564 -7.276 1.00 0.00 C ATOM 1771 CG TYR A 112 4.873 6.586 -7.654 1.00 0.00 C ATOM 1772 CD1 TYR A 112 3.901 6.982 -6.744 1.00 0.00 C ATOM 1773 CD2 TYR A 112 4.854 7.156 -8.921 1.00 0.00 C ATOM 1774 CE1 TYR A 112 2.940 7.915 -7.084 1.00 0.00 C ATOM 1775 CE2 TYR A 112 3.899 8.091 -9.270 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.944 8.466 -8.348 1.00 0.00 C ATOM 1777 OH TYR A 112 1.990 9.396 -8.692 1.00 0.00 O ATOM 0 H TYR A 112 7.400 3.626 -6.833 1.00 0.00 H new ATOM 0 HA TYR A 112 4.699 3.892 -6.703 1.00 0.00 H new ATOM 0 HB2 TYR A 112 6.212 5.720 -6.237 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.812 5.728 -7.883 1.00 0.00 H new ATOM 0 HD1 TYR A 112 3.896 6.553 -5.753 1.00 0.00 H new ATOM 0 HD2 TYR A 112 5.599 6.863 -9.646 1.00 0.00 H new ATOM 0 HE1 TYR A 112 2.191 8.211 -6.364 1.00 0.00 H new ATOM 0 HE2 TYR A 112 3.900 8.526 -10.259 1.00 0.00 H new ATOM 0 HH TYR A 112 1.866 10.026 -7.952 1.00 0.00 H new ATOM 1787 N LYS A 113 5.637 4.186 -9.869 1.00 0.00 N ATOM 1788 CA LYS A 113 5.174 4.048 -11.244 1.00 0.00 C ATOM 1789 C LYS A 113 4.468 2.711 -11.449 1.00 0.00 C ATOM 1790 O LYS A 113 3.488 2.621 -12.190 1.00 0.00 O ATOM 1791 CB LYS A 113 6.350 4.170 -12.216 1.00 0.00 C ATOM 1792 CG LYS A 113 7.212 5.397 -11.976 1.00 0.00 C ATOM 1793 CD LYS A 113 8.457 5.384 -12.847 1.00 0.00 C ATOM 1794 CE LYS A 113 9.414 4.276 -12.435 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.176 3.740 -13.597 1.00 0.00 N ATOM 0 H LYS A 113 6.607 4.487 -9.780 1.00 0.00 H new ATOM 0 HA LYS A 113 4.462 4.849 -11.443 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.971 3.278 -12.135 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.966 4.200 -13.236 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.632 6.296 -12.183 1.00 0.00 H new ATOM 0 HG3 LYS A 113 7.502 5.439 -10.926 1.00 0.00 H new ATOM 0 HD2 LYS A 113 8.171 5.250 -13.890 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.962 6.347 -12.776 1.00 0.00 H new ATOM 0 HE2 LYS A 113 10.111 4.657 -11.688 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.853 3.468 -11.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.817 2.987 -13.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.513 3.353 -14.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.731 4.505 -14.031 1.00 0.00 H new ATOM 1809 N LEU A 114 4.971 1.675 -10.787 1.00 0.00 N ATOM 1810 CA LEU A 114 4.388 0.342 -10.895 1.00 0.00 C ATOM 1811 C LEU A 114 2.990 0.308 -10.286 1.00 0.00 C ATOM 1812 O LEU A 114 2.001 0.111 -10.990 1.00 0.00 O ATOM 1813 CB LEU A 114 5.284 -0.686 -10.202 1.00 0.00 C ATOM 1814 CG LEU A 114 4.629 -2.024 -9.857 1.00 0.00 C ATOM 1815 CD1 LEU A 114 4.824 -3.021 -10.989 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.193 -2.575 -8.556 1.00 0.00 C ATOM 0 H LEU A 114 5.781 1.732 -10.170 1.00 0.00 H new ATOM 0 HA LEU A 114 4.309 0.091 -11.953 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.144 -0.880 -10.843 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.666 -0.244 -9.282 1.00 0.00 H new ATOM 0 HG LEU A 114 3.560 -1.859 -9.725 1.00 0.00 H new ATOM 0 HD11 LEU A 114 4.351 -3.967 -10.726 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.371 -2.630 -11.900 1.00 0.00 H new ATOM 0 HD13 LEU A 114 5.890 -3.181 -11.153 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.715 -3.527 -8.327 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.268 -2.724 -8.660 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.001 -1.869 -7.748 1.00 0.00 H new ATOM 1828 N MET A 115 2.918 0.504 -8.973 1.00 0.00 N ATOM 1829 CA MET A 115 1.640 0.499 -8.270 1.00 0.00 C ATOM 1830 C MET A 115 0.591 1.292 -9.043 1.00 0.00 C ATOM 1831 O MET A 115 -0.566 0.882 -9.138 1.00 0.00 O ATOM 1832 CB MET A 115 1.805 1.084 -6.866 1.00 0.00 C ATOM 1833 CG MET A 115 2.817 0.337 -6.012 1.00 0.00 C ATOM 1834 SD MET A 115 2.799 0.869 -4.289 1.00 0.00 S ATOM 1835 CE MET A 115 3.342 2.567 -4.452 1.00 0.00 C ATOM 0 H MET A 115 3.728 0.668 -8.375 1.00 0.00 H new ATOM 0 HA MET A 115 1.302 -0.534 -8.189 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.111 2.127 -6.949 1.00 0.00 H new ATOM 0 HB3 MET A 115 0.839 1.075 -6.362 1.00 0.00 H new ATOM 0 HG2 MET A 115 2.609 -0.732 -6.060 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.815 0.486 -6.424 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.308 2.689 -3.961 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.438 2.819 -5.508 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.612 3.229 -3.986 1.00 0.00 H new ATOM 1845 N LYS A 116 1.002 2.428 -9.595 1.00 0.00 N ATOM 1846 CA LYS A 116 0.099 3.278 -10.361 1.00 0.00 C ATOM 1847 C LYS A 116 -0.931 2.440 -11.111 1.00 0.00 C ATOM 1848 O LYS A 116 -2.123 2.485 -10.807 1.00 0.00 O ATOM 1849 CB LYS A 116 0.890 4.139 -11.349 1.00 0.00 C ATOM 1850 CG LYS A 116 1.642 5.283 -10.692 1.00 0.00 C ATOM 1851 CD LYS A 116 2.408 6.107 -11.714 1.00 0.00 C ATOM 1852 CE LYS A 116 1.593 7.299 -12.193 1.00 0.00 C ATOM 1853 NZ LYS A 116 2.464 8.425 -12.631 1.00 0.00 N ATOM 0 H LYS A 116 1.956 2.782 -9.526 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.427 3.929 -9.663 1.00 0.00 H new ATOM 0 HB2 LYS A 116 1.600 3.507 -11.881 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.205 4.545 -12.093 1.00 0.00 H new ATOM 0 HG2 LYS A 116 0.939 5.924 -10.160 1.00 0.00 H new ATOM 0 HG3 LYS A 116 2.335 4.886 -9.950 1.00 0.00 H new ATOM 0 HD2 LYS A 116 3.342 6.457 -11.275 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.671 5.479 -12.565 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.952 6.992 -13.020 1.00 0.00 H new ATOM 0 HE3 LYS A 116 0.938 7.637 -11.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 1.944 9.026 -13.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 2.742 8.991 -11.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 3.315 8.046 -13.093 1.00 0.00 H new ATOM 1867 N SER A 117 -0.463 1.676 -12.093 1.00 0.00 N ATOM 1868 CA SER A 117 -1.345 0.829 -12.889 1.00 0.00 C ATOM 1869 C SER A 117 -1.037 -0.647 -12.654 1.00 0.00 C ATOM 1870 O SER A 117 -1.422 -1.506 -13.448 1.00 0.00 O ATOM 1871 CB SER A 117 -1.201 1.162 -14.375 1.00 0.00 C ATOM 1872 OG SER A 117 -2.196 0.507 -15.143 1.00 0.00 O ATOM 0 H SER A 117 0.521 1.626 -12.357 1.00 0.00 H new ATOM 0 HA SER A 117 -2.372 1.022 -12.579 1.00 0.00 H new ATOM 0 HB2 SER A 117 -1.277 2.240 -14.518 1.00 0.00 H new ATOM 0 HB3 SER A 117 -0.212 0.863 -14.724 1.00 0.00 H new ATOM 0 HG SER A 117 -2.276 -0.424 -14.849 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.342 -0.933 -11.559 1.00 0.00 N ATOM 1879 CA ASP A 118 0.017 -2.304 -11.217 1.00 0.00 C ATOM 1880 C ASP A 118 -0.960 -2.884 -10.198 1.00 0.00 C ATOM 1881 O ASP A 118 -1.730 -3.793 -10.509 1.00 0.00 O ATOM 1882 CB ASP A 118 1.442 -2.359 -10.665 1.00 0.00 C ATOM 1883 CG ASP A 118 1.836 -3.752 -10.215 1.00 0.00 C ATOM 1884 OD1 ASP A 118 1.855 -4.666 -11.066 1.00 0.00 O ATOM 1885 OD2 ASP A 118 2.123 -3.929 -9.012 1.00 0.00 O ATOM 0 H ASP A 118 -0.016 -0.233 -10.893 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.035 -2.904 -12.126 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.138 -2.017 -11.431 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.530 -1.671 -9.824 1.00 0.00 H new ATOM 1890 N SER A 119 -0.921 -2.353 -8.981 1.00 0.00 N ATOM 1891 CA SER A 119 -1.799 -2.820 -7.914 1.00 0.00 C ATOM 1892 C SER A 119 -3.078 -1.990 -7.860 1.00 0.00 C ATOM 1893 O SER A 119 -4.182 -2.533 -7.804 1.00 0.00 O ATOM 1894 CB SER A 119 -1.078 -2.756 -6.566 1.00 0.00 C ATOM 1895 OG SER A 119 -0.285 -1.586 -6.468 1.00 0.00 O ATOM 0 H SER A 119 -0.291 -1.599 -8.709 1.00 0.00 H new ATOM 0 HA SER A 119 -2.067 -3.855 -8.125 1.00 0.00 H new ATOM 0 HB2 SER A 119 -1.809 -2.773 -5.758 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.448 -3.637 -6.444 1.00 0.00 H new ATOM 0 HG SER A 119 0.164 -1.567 -5.597 1.00 0.00 H new ATOM 1901 N TYR A 120 -2.921 -0.671 -7.878 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.062 0.235 -7.828 1.00 0.00 C ATOM 1903 C TYR A 120 -5.244 -0.334 -8.607 1.00 0.00 C ATOM 1904 O TYR A 120 -6.372 -0.393 -8.118 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.677 1.604 -8.392 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.844 2.368 -8.976 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -5.696 3.104 -8.161 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.094 2.355 -10.343 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -6.764 3.802 -8.690 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.159 3.052 -10.881 1.00 0.00 C ATOM 1911 CZ TYR A 120 -6.991 3.774 -10.051 1.00 0.00 C ATOM 1912 OH TYR A 120 -8.052 4.469 -10.582 1.00 0.00 O ATOM 0 H TYR A 120 -2.015 -0.206 -7.927 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.358 0.349 -6.785 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -3.224 2.200 -7.600 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -2.919 1.470 -9.163 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -5.520 3.131 -7.096 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -4.445 1.791 -10.996 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -7.418 4.367 -8.042 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.339 3.032 -11.946 1.00 0.00 H new ATOM 0 HH TYR A 120 -8.681 4.702 -9.867 1.00 0.00 H new ATOM 1922 N PRO A 121 -4.980 -0.766 -9.849 1.00 0.00 N ATOM 1923 CA PRO A 121 -6.008 -1.339 -10.723 1.00 0.00 C ATOM 1924 C PRO A 121 -6.847 -2.397 -10.014 1.00 0.00 C ATOM 1925 O PRO A 121 -8.072 -2.292 -9.951 1.00 0.00 O ATOM 1926 CB PRO A 121 -5.197 -1.972 -11.857 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.928 -1.193 -11.894 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.658 -0.727 -10.497 1.00 0.00 C ATOM 0 HA PRO A 121 -6.722 -0.587 -11.059 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -5.008 -3.028 -11.667 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.728 -1.909 -12.807 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -3.107 -1.810 -12.260 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -4.016 -0.345 -12.573 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.945 -1.377 -9.990 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.237 0.278 -10.486 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.180 -3.416 -9.481 1.00 0.00 N ATOM 1937 CA ARG A 122 -6.865 -4.493 -8.777 1.00 0.00 C ATOM 1938 C ARG A 122 -7.735 -3.940 -7.652 1.00 0.00 C ATOM 1939 O ARG A 122 -8.925 -4.245 -7.567 1.00 0.00 O ATOM 1940 CB ARG A 122 -5.849 -5.486 -8.209 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.217 -6.380 -9.263 1.00 0.00 C ATOM 1942 CD ARG A 122 -6.110 -7.565 -9.597 1.00 0.00 C ATOM 1943 NE ARG A 122 -5.911 -8.678 -8.673 1.00 0.00 N ATOM 1944 CZ ARG A 122 -4.999 -9.627 -8.851 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -4.205 -9.598 -9.912 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -4.878 -10.608 -7.965 1.00 0.00 N ATOM 0 H ARG A 122 -5.166 -3.518 -9.524 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.508 -5.009 -9.490 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.063 -4.934 -7.694 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.341 -6.110 -7.463 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -5.027 -5.801 -10.166 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -4.252 -6.740 -8.906 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -7.154 -7.252 -9.568 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -5.905 -7.898 -10.615 1.00 0.00 H new ATOM 0 HE ARG A 122 -6.505 -8.729 -7.845 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -4.293 -8.845 -10.595 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -3.506 -10.328 -10.046 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -5.486 -10.634 -7.146 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -4.177 -11.336 -8.103 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.134 -3.126 -6.791 1.00 0.00 N ATOM 1961 CA PHE A 123 -7.854 -2.532 -5.670 1.00 0.00 C ATOM 1962 C PHE A 123 -9.288 -2.190 -6.065 1.00 0.00 C ATOM 1963 O PHE A 123 -10.240 -2.595 -5.397 1.00 0.00 O ATOM 1964 CB PHE A 123 -7.133 -1.274 -5.183 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.723 -0.691 -3.931 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -7.766 -1.431 -2.761 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -8.236 0.596 -3.925 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.309 -0.898 -1.606 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.779 1.135 -2.774 1.00 0.00 C ATOM 1970 CZ PHE A 123 -8.817 0.387 -1.614 1.00 0.00 C ATOM 0 H PHE A 123 -6.150 -2.862 -6.848 1.00 0.00 H new ATOM 0 HA PHE A 123 -7.883 -3.262 -4.861 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.085 -1.512 -5.004 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -7.159 -0.522 -5.972 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -7.371 -2.436 -2.750 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -8.211 1.185 -4.830 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -8.336 -1.485 -0.700 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.173 2.140 -2.782 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.243 0.806 -0.714 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.433 -1.442 -7.154 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.749 -1.046 -7.638 1.00 0.00 C ATOM 1982 C ILE A 124 -11.587 -2.264 -8.011 1.00 0.00 C ATOM 1983 O ILE A 124 -12.783 -2.320 -7.722 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.643 -0.115 -8.860 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.859 1.149 -8.500 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -12.029 0.243 -9.375 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -9.490 1.993 -9.699 1.00 0.00 C ATOM 0 H ILE A 124 -8.655 -1.098 -7.717 1.00 0.00 H new ATOM 0 HA ILE A 124 -11.236 -0.509 -6.824 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.107 -0.639 -9.651 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -10.452 1.751 -7.811 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -8.949 0.864 -7.972 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.937 0.902 -10.239 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.555 -0.666 -9.666 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.589 0.751 -8.590 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -8.936 2.872 -9.369 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.870 1.408 -10.379 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -10.397 2.308 -10.215 1.00 0.00 H new ATOM 1999 N ARG A 125 -10.951 -3.238 -8.654 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.638 -4.456 -9.067 1.00 0.00 C ATOM 2001 C ARG A 125 -12.253 -5.168 -7.865 1.00 0.00 C ATOM 2002 O ARG A 125 -13.427 -5.535 -7.882 1.00 0.00 O ATOM 2003 CB ARG A 125 -10.668 -5.394 -9.787 1.00 0.00 C ATOM 2004 CG ARG A 125 -9.918 -4.733 -10.932 1.00 0.00 C ATOM 2005 CD ARG A 125 -10.819 -4.518 -12.138 1.00 0.00 C ATOM 2006 NE ARG A 125 -11.390 -5.770 -12.625 1.00 0.00 N ATOM 2007 CZ ARG A 125 -12.058 -5.878 -13.768 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -12.238 -4.813 -14.538 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -12.548 -7.053 -14.144 1.00 0.00 N ATOM 0 H ARG A 125 -9.962 -3.207 -8.900 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.439 -4.177 -9.751 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -9.947 -5.780 -9.066 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.222 -6.250 -10.173 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.517 -3.775 -10.601 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -9.068 -5.353 -11.217 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -11.623 -3.832 -11.872 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -10.248 -4.045 -12.937 1.00 0.00 H new ATOM 0 HE ARG A 125 -11.269 -6.608 -12.056 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -11.863 -3.908 -14.253 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -12.751 -4.899 -15.415 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -12.412 -7.874 -13.555 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -13.061 -7.134 -15.022 1.00 0.00 H new ATOM 2023 N SER A 126 -11.450 -5.359 -6.823 1.00 0.00 N ATOM 2024 CA SER A 126 -11.913 -6.031 -5.614 1.00 0.00 C ATOM 2025 C SER A 126 -13.072 -5.268 -4.979 1.00 0.00 C ATOM 2026 O SER A 126 -13.443 -4.187 -5.437 1.00 0.00 O ATOM 2027 CB SER A 126 -10.767 -6.169 -4.611 1.00 0.00 C ATOM 2028 OG SER A 126 -9.971 -7.306 -4.898 1.00 0.00 O ATOM 0 H SER A 126 -10.476 -5.058 -6.792 1.00 0.00 H new ATOM 0 HA SER A 126 -12.264 -7.025 -5.892 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.148 -5.272 -4.636 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.171 -6.249 -3.602 1.00 0.00 H new ATOM 0 HG SER A 126 -9.033 -7.036 -4.981 1.00 0.00 H new ATOM 2034 N SER A 127 -13.639 -5.838 -3.921 1.00 0.00 N ATOM 2035 CA SER A 127 -14.758 -5.215 -3.224 1.00 0.00 C ATOM 2036 C SER A 127 -14.267 -4.387 -2.041 1.00 0.00 C ATOM 2037 O SER A 127 -14.888 -3.394 -1.663 1.00 0.00 O ATOM 2038 CB SER A 127 -15.743 -6.281 -2.742 1.00 0.00 C ATOM 2039 OG SER A 127 -16.512 -6.790 -3.818 1.00 0.00 O ATOM 0 H SER A 127 -13.342 -6.731 -3.527 1.00 0.00 H new ATOM 0 HA SER A 127 -15.266 -4.551 -3.923 1.00 0.00 H new ATOM 0 HB2 SER A 127 -15.198 -7.095 -2.264 1.00 0.00 H new ATOM 0 HB3 SER A 127 -16.405 -5.855 -1.988 1.00 0.00 H new ATOM 0 HG SER A 127 -17.132 -7.471 -3.483 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.147 -4.804 -1.459 1.00 0.00 N ATOM 2046 CA ALA A 128 -12.571 -4.101 -0.319 1.00 0.00 C ATOM 2047 C ALA A 128 -12.750 -2.593 -0.457 1.00 0.00 C ATOM 2048 O ALA A 128 -13.053 -1.902 0.516 1.00 0.00 O ATOM 2049 CB ALA A 128 -11.096 -4.448 -0.176 1.00 0.00 C ATOM 0 H ALA A 128 -12.621 -5.625 -1.758 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.098 -4.423 0.579 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -10.678 -3.916 0.679 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -10.988 -5.522 -0.024 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -10.564 -4.155 -1.081 1.00 0.00 H new ATOM 2055 N TYR A 129 -12.560 -2.087 -1.671 1.00 0.00 N ATOM 2056 CA TYR A 129 -12.698 -0.660 -1.935 1.00 0.00 C ATOM 2057 C TYR A 129 -14.166 -0.243 -1.921 1.00 0.00 C ATOM 2058 O TYR A 129 -14.537 0.735 -1.271 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.069 -0.306 -3.283 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.629 0.955 -3.901 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -13.763 0.915 -4.703 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -12.024 2.187 -3.683 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -14.278 2.065 -5.270 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -12.533 3.342 -4.244 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.660 3.276 -5.037 1.00 0.00 C ATOM 2066 OH TYR A 129 -14.169 4.424 -5.599 1.00 0.00 O ATOM 0 H TYR A 129 -12.310 -2.645 -2.488 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.177 -0.118 -1.145 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -10.993 -0.190 -3.153 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.219 -1.136 -3.973 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -14.250 -0.031 -4.886 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.141 2.242 -3.064 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -15.159 2.016 -5.892 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -12.051 4.292 -4.063 1.00 0.00 H new ATOM 0 HH TYR A 129 -14.606 4.206 -6.449 1.00 0.00 H new ATOM 2076 N GLN A 130 -14.994 -0.991 -2.641 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.421 -0.700 -2.712 1.00 0.00 C ATOM 2078 C GLN A 130 -17.048 -0.707 -1.322 1.00 0.00 C ATOM 2079 O GLN A 130 -17.962 0.066 -1.039 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.127 -1.718 -3.608 1.00 0.00 C ATOM 2081 CG GLN A 130 -16.542 -1.806 -5.009 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.166 -0.810 -5.966 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -17.970 0.033 -5.565 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.799 -0.901 -7.238 1.00 0.00 N ATOM 0 H GLN A 130 -14.702 -1.804 -3.184 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.542 0.295 -3.140 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.074 -2.701 -3.139 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.182 -1.456 -3.680 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.467 -1.633 -4.961 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -16.686 -2.815 -5.396 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -16.130 -1.615 -7.526 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -17.186 -0.257 -7.928 1.00 0.00 H new ATOM 2093 N GLU A 131 -16.550 -1.587 -0.458 1.00 0.00 N ATOM 2094 CA GLU A 131 -17.063 -1.695 0.903 1.00 0.00 C ATOM 2095 C GLU A 131 -17.387 -0.317 1.473 1.00 0.00 C ATOM 2096 O GLU A 131 -18.543 -0.009 1.764 1.00 0.00 O ATOM 2097 CB GLU A 131 -16.046 -2.404 1.800 1.00 0.00 C ATOM 2098 CG GLU A 131 -15.656 -3.786 1.303 1.00 0.00 C ATOM 2099 CD GLU A 131 -15.062 -4.653 2.397 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -14.023 -4.260 2.967 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -15.637 -5.724 2.682 1.00 0.00 O ATOM 0 H GLU A 131 -15.793 -2.235 -0.676 1.00 0.00 H new ATOM 0 HA GLU A 131 -17.981 -2.282 0.873 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.150 -1.788 1.876 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.459 -2.492 2.805 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.535 -4.281 0.889 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -14.935 -3.686 0.492 1.00 0.00 H new ATOM 2108 N LEU A 132 -16.358 0.508 1.631 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.531 1.854 2.167 1.00 0.00 C ATOM 2110 C LEU A 132 -17.680 2.574 1.469 1.00 0.00 C ATOM 2111 O LEU A 132 -18.592 3.087 2.120 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.239 2.658 2.008 1.00 0.00 C ATOM 2113 CG LEU A 132 -13.989 2.051 2.645 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -14.334 1.384 3.968 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -13.337 1.055 1.698 1.00 0.00 C ATOM 0 H LEU A 132 -15.395 0.269 1.396 1.00 0.00 H new ATOM 0 HA LEU A 132 -16.770 1.768 3.227 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.049 2.796 0.944 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.396 3.648 2.435 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.278 2.854 2.841 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -13.432 0.958 4.407 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -14.754 2.123 4.650 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -15.063 0.592 3.797 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.449 0.633 2.169 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.041 0.255 1.470 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -13.053 1.562 0.776 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.632 2.607 0.142 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.671 3.262 -0.645 1.00 0.00 C ATOM 2129 C LEU A 133 -20.059 2.833 -0.181 1.00 0.00 C ATOM 2130 O LEU A 133 -20.877 3.663 0.213 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.494 2.938 -2.130 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.520 3.830 -2.901 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -17.296 3.287 -4.303 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -18.037 5.260 -2.956 1.00 0.00 C ATOM 0 H LEU A 133 -16.885 2.188 -0.412 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.577 4.338 -0.500 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.157 1.905 -2.218 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.469 2.997 -2.613 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.564 3.831 -2.377 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.600 3.934 -4.837 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.881 2.281 -4.242 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -18.246 3.256 -4.837 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -17.332 5.881 -3.508 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -19.005 5.278 -3.456 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -18.145 5.647 -1.943 1.00 0.00 H new