USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=31 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 41 SER OG : rot -163:sc= -0.762 USER MOD Set 1.2: A 119 SER OG : rot -83:sc= 0.832 USER MOD Set 2.1: A 31 GLN : amide:sc= -0.298 K(o=-0.3,f=-1.9) USER MOD Set 2.2: A 34 LYS NZ :NH3+ -173:sc= 0 (180deg=0) USER MOD Set 3.1: A 19 MET CE :methyl -112:sc= 0 (180deg=-1.27) USER MOD Set 3.2: A 115 MET CE :methyl -120:sc= -3.87! (180deg=-5.37!) USER MOD Single : A 9 GLN : amide:sc= -3.11! C(o=-3.1!,f=-4.8!) USER MOD Single : A 10 GLN :FLIP amide:sc= -0.504 F(o=-1.4,f=-0.5) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ -169:sc= -0.014 (180deg=-0.151) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -150:sc= 0.121 USER MOD Single : A 44 ASN : amide:sc= -2.3 K(o=-2.3,f=-8.1!) USER MOD Single : A 55 LYS NZ :NH3+ -157:sc= -1.14 (180deg=-2.2!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -150:sc= -0.516 (180deg=-1.65!) USER MOD Single : A 64 SER OG : rot 150:sc= -0.777 USER MOD Single : A 67 GLN : amide:sc= -0.417 X(o=-0.42,f=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 SER OG : rot 127:sc= 0.00315 USER MOD Single : A 83 ASN :FLIP amide:sc= -0.251 F(o=-1.1,f=-0.25) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -137:sc= -0.358 (180deg=-2.1!) USER MOD Single : A 88 SER OG : rot -73:sc= 0.00054 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 72:sc= 0.872 USER MOD Single : A 93 THR OG1 : rot 73:sc= 0.535 USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot -135:sc= 0.245 USER MOD Single : A 108 GLN :FLIP amide:sc= -1.78 F(o=-3.8!,f=-1.8) USER MOD Single : A 110 HIS :FLIP no HD1:sc= -1.25 F(o=-2.5!,f=-1.3) USER MOD Single : A 112 TYR OH : rot 115:sc= 1.05 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ -130:sc= -0.0588 (180deg=-1.04) USER MOD Single : A 117 SER OG : rot -50:sc= 0.00174 USER MOD Single : A 120 TYR OH : rot 149:sc= 0.422! USER MOD Single : A 126 SER OG : rot -150:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 167:sc= -0.291 USER MOD Single : A 130 GLN : amide:sc= -0.13 K(o=-0.13,f=-1.6!) USER MOD ----------------------------------------------------------------- ATOM 77 N GLN A 9 -18.251 8.024 1.777 1.00 0.00 N ATOM 78 CA GLN A 9 -18.510 7.426 0.473 1.00 0.00 C ATOM 79 C GLN A 9 -17.997 8.323 -0.649 1.00 0.00 C ATOM 80 O GLN A 9 -17.419 7.843 -1.624 1.00 0.00 O ATOM 81 CB GLN A 9 -20.007 7.171 0.294 1.00 0.00 C ATOM 82 CG GLN A 9 -20.368 6.593 -1.065 1.00 0.00 C ATOM 83 CD GLN A 9 -21.775 6.032 -1.106 1.00 0.00 C ATOM 84 OE1 GLN A 9 -22.406 5.830 -0.068 1.00 0.00 O ATOM 85 NE2 GLN A 9 -22.276 5.776 -2.309 1.00 0.00 N ATOM 0 HA GLN A 9 -17.978 6.476 0.425 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -20.346 6.487 1.072 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.546 8.108 0.436 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -20.268 7.369 -1.824 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.659 5.805 -1.320 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -21.718 5.959 -3.143 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -23.219 5.397 -2.399 1.00 0.00 H new ATOM 94 N GLN A 10 -18.213 9.626 -0.504 1.00 0.00 N ATOM 95 CA GLN A 10 -17.774 10.589 -1.506 1.00 0.00 C ATOM 96 C GLN A 10 -16.253 10.702 -1.523 1.00 0.00 C ATOM 97 O GLN A 10 -15.633 10.713 -2.587 1.00 0.00 O ATOM 98 CB GLN A 10 -18.395 11.960 -1.235 1.00 0.00 C ATOM 99 CG GLN A 10 -19.811 12.103 -1.770 1.00 0.00 C ATOM 100 CD GLN A 10 -20.778 11.126 -1.131 1.00 0.00 C ATOM 101 OE1 GLN A 10 -20.800 9.898 -1.635 1.00 0.00 O flip ATOM 102 NE2 GLN A 10 -21.498 11.472 -0.193 1.00 0.00 N flip ATOM 0 H GLN A 10 -18.689 10.039 0.298 1.00 0.00 H new ATOM 0 HA GLN A 10 -18.106 10.235 -2.482 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -18.402 12.141 -0.160 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.767 12.729 -1.684 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -20.160 13.121 -1.595 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.805 11.949 -2.849 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -21.448 12.427 0.163 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -22.144 10.804 0.228 1.00 0.00 H new ATOM 111 N ARG A 11 -15.658 10.784 -0.338 1.00 0.00 N ATOM 112 CA ARG A 11 -14.209 10.898 -0.216 1.00 0.00 C ATOM 113 C ARG A 11 -13.517 9.663 -0.787 1.00 0.00 C ATOM 114 O ARG A 11 -12.508 9.771 -1.484 1.00 0.00 O ATOM 115 CB ARG A 11 -13.812 11.086 1.249 1.00 0.00 C ATOM 116 CG ARG A 11 -12.339 11.404 1.445 1.00 0.00 C ATOM 117 CD ARG A 11 -12.109 12.231 2.700 1.00 0.00 C ATOM 118 NE ARG A 11 -12.559 13.610 2.537 1.00 0.00 N ATOM 119 CZ ARG A 11 -11.738 14.629 2.306 1.00 0.00 C ATOM 120 NH1 ARG A 11 -10.432 14.423 2.211 1.00 0.00 N ATOM 121 NH2 ARG A 11 -12.224 15.856 2.168 1.00 0.00 N ATOM 0 H ARG A 11 -16.157 10.774 0.552 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.889 11.770 -0.787 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.409 11.891 1.678 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.056 10.179 1.802 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -11.771 10.476 1.511 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -11.964 11.946 0.577 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -12.637 11.774 3.537 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -11.048 12.223 2.950 1.00 0.00 H new ATOM 0 HE ARG A 11 -13.559 13.802 2.604 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -10.055 13.481 2.315 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -9.804 15.207 2.034 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -13.229 16.018 2.239 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -11.593 16.638 1.991 1.00 0.00 H new ATOM 135 N VAL A 12 -14.067 8.491 -0.486 1.00 0.00 N ATOM 136 CA VAL A 12 -13.504 7.236 -0.970 1.00 0.00 C ATOM 137 C VAL A 12 -13.343 7.254 -2.486 1.00 0.00 C ATOM 138 O VAL A 12 -12.354 6.753 -3.022 1.00 0.00 O ATOM 139 CB VAL A 12 -14.384 6.036 -0.572 1.00 0.00 C ATOM 140 CG1 VAL A 12 -13.816 4.745 -1.142 1.00 0.00 C ATOM 141 CG2 VAL A 12 -14.513 5.949 0.941 1.00 0.00 C ATOM 0 H VAL A 12 -14.902 8.384 0.091 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.524 7.128 -0.505 1.00 0.00 H new ATOM 0 HB VAL A 12 -15.380 6.183 -0.991 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -14.451 3.908 -0.850 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -13.781 4.812 -2.229 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -12.809 4.588 -0.755 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -15.138 5.096 1.204 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -13.525 5.825 1.384 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -14.969 6.863 1.320 1.00 0.00 H new ATOM 151 N LYS A 13 -14.321 7.835 -3.172 1.00 0.00 N ATOM 152 CA LYS A 13 -14.288 7.921 -4.628 1.00 0.00 C ATOM 153 C LYS A 13 -13.012 8.607 -5.104 1.00 0.00 C ATOM 154 O LYS A 13 -12.297 8.085 -5.959 1.00 0.00 O ATOM 155 CB LYS A 13 -15.512 8.683 -5.142 1.00 0.00 C ATOM 156 CG LYS A 13 -15.697 8.592 -6.646 1.00 0.00 C ATOM 157 CD LYS A 13 -16.209 7.224 -7.065 1.00 0.00 C ATOM 158 CE LYS A 13 -16.827 7.261 -8.454 1.00 0.00 C ATOM 159 NZ LYS A 13 -16.775 5.930 -9.119 1.00 0.00 N ATOM 0 H LYS A 13 -15.147 8.254 -2.744 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.305 6.907 -5.027 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -16.404 8.295 -4.650 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.422 9.732 -4.858 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.398 9.360 -6.974 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -14.748 8.794 -7.143 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.388 6.507 -7.050 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -16.950 6.876 -6.345 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.863 7.591 -8.382 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.301 7.994 -9.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -17.206 5.997 -10.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -15.785 5.626 -9.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -17.298 5.236 -8.548 1.00 0.00 H new ATOM 173 N ARG A 14 -12.732 9.780 -4.544 1.00 0.00 N ATOM 174 CA ARG A 14 -11.541 10.537 -4.911 1.00 0.00 C ATOM 175 C ARG A 14 -10.361 9.604 -5.166 1.00 0.00 C ATOM 176 O ARG A 14 -9.556 9.838 -6.068 1.00 0.00 O ATOM 177 CB ARG A 14 -11.187 11.537 -3.809 1.00 0.00 C ATOM 178 CG ARG A 14 -11.903 12.871 -3.944 1.00 0.00 C ATOM 179 CD ARG A 14 -11.091 13.858 -4.768 1.00 0.00 C ATOM 180 NE ARG A 14 -11.406 15.243 -4.428 1.00 0.00 N ATOM 181 CZ ARG A 14 -12.397 15.930 -4.986 1.00 0.00 C ATOM 182 NH1 ARG A 14 -13.165 15.362 -5.906 1.00 0.00 N ATOM 183 NH2 ARG A 14 -12.621 17.187 -4.624 1.00 0.00 N ATOM 0 H ARG A 14 -13.314 10.226 -3.835 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.756 11.082 -5.830 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -11.431 11.100 -2.841 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -10.111 11.709 -3.818 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -12.875 12.718 -4.412 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -12.088 13.288 -2.954 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -10.028 13.678 -4.606 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -11.285 13.692 -5.828 1.00 0.00 H new ATOM 0 HE ARG A 14 -10.834 15.708 -3.723 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -12.995 14.396 -6.186 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -13.925 15.891 -6.333 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -12.032 17.627 -3.917 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -13.382 17.713 -5.053 1.00 0.00 H new ATOM 197 N TRP A 15 -10.264 8.549 -4.365 1.00 0.00 N ATOM 198 CA TRP A 15 -9.182 7.581 -4.504 1.00 0.00 C ATOM 199 C TRP A 15 -9.244 6.885 -5.859 1.00 0.00 C ATOM 200 O TRP A 15 -8.252 6.829 -6.585 1.00 0.00 O ATOM 201 CB TRP A 15 -9.249 6.546 -3.380 1.00 0.00 C ATOM 202 CG TRP A 15 -9.528 7.146 -2.036 1.00 0.00 C ATOM 203 CD1 TRP A 15 -9.193 8.400 -1.612 1.00 0.00 C ATOM 204 CD2 TRP A 15 -10.197 6.515 -0.938 1.00 0.00 C ATOM 205 NE1 TRP A 15 -9.614 8.587 -0.318 1.00 0.00 N ATOM 206 CE2 TRP A 15 -10.234 7.446 0.118 1.00 0.00 C ATOM 207 CE3 TRP A 15 -10.771 5.255 -0.746 1.00 0.00 C ATOM 208 CZ2 TRP A 15 -10.820 7.155 1.347 1.00 0.00 C ATOM 209 CZ3 TRP A 15 -11.352 4.968 0.474 1.00 0.00 C ATOM 210 CH2 TRP A 15 -11.374 5.914 1.508 1.00 0.00 C ATOM 0 H TRP A 15 -10.921 8.342 -3.613 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.236 8.118 -4.437 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -10.025 5.817 -3.613 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -8.305 6.003 -3.339 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -8.673 9.137 -2.207 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.486 9.438 0.230 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -10.760 4.520 -1.537 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -10.837 7.883 2.145 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -11.797 3.997 0.634 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -11.837 5.659 2.450 1.00 0.00 H new ATOM 221 N GLY A 16 -10.417 6.355 -6.194 1.00 0.00 N ATOM 222 CA GLY A 16 -10.586 5.669 -7.462 1.00 0.00 C ATOM 223 C GLY A 16 -9.871 6.370 -8.600 1.00 0.00 C ATOM 224 O GLY A 16 -9.549 5.752 -9.615 1.00 0.00 O ATOM 0 H GLY A 16 -11.253 6.389 -5.610 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -10.209 4.650 -7.373 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -11.649 5.597 -7.694 1.00 0.00 H new ATOM 228 N PHE A 17 -9.624 7.665 -8.433 1.00 0.00 N ATOM 229 CA PHE A 17 -8.945 8.452 -9.456 1.00 0.00 C ATOM 230 C PHE A 17 -7.447 8.164 -9.459 1.00 0.00 C ATOM 231 O PHE A 17 -6.667 8.883 -10.082 1.00 0.00 O ATOM 232 CB PHE A 17 -9.189 9.945 -9.226 1.00 0.00 C ATOM 233 CG PHE A 17 -10.612 10.363 -9.460 1.00 0.00 C ATOM 234 CD1 PHE A 17 -11.042 10.727 -10.726 1.00 0.00 C ATOM 235 CD2 PHE A 17 -11.520 10.393 -8.413 1.00 0.00 C ATOM 236 CE1 PHE A 17 -12.352 11.112 -10.944 1.00 0.00 C ATOM 237 CE2 PHE A 17 -12.831 10.777 -8.626 1.00 0.00 C ATOM 238 CZ PHE A 17 -13.247 11.138 -9.893 1.00 0.00 C ATOM 0 H PHE A 17 -9.884 8.192 -7.599 1.00 0.00 H new ATOM 0 HA PHE A 17 -9.353 8.170 -10.427 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.908 10.198 -8.204 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.537 10.517 -9.886 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.346 10.710 -11.552 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -11.200 10.113 -7.420 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -12.675 11.392 -11.936 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -13.529 10.795 -7.802 1.00 0.00 H new ATOM 0 HZ PHE A 17 -14.270 11.440 -10.061 1.00 0.00 H new ATOM 248 N GLY A 18 -7.052 7.107 -8.755 1.00 0.00 N ATOM 249 CA GLY A 18 -5.649 6.743 -8.689 1.00 0.00 C ATOM 250 C GLY A 18 -5.084 6.864 -7.287 1.00 0.00 C ATOM 251 O GLY A 18 -5.644 7.564 -6.444 1.00 0.00 O ATOM 0 H GLY A 18 -7.678 6.497 -8.230 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -5.526 5.718 -9.040 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -5.079 7.382 -9.364 1.00 0.00 H new ATOM 255 N MET A 19 -3.972 6.180 -7.038 1.00 0.00 N ATOM 256 CA MET A 19 -3.332 6.214 -5.728 1.00 0.00 C ATOM 257 C MET A 19 -3.039 7.650 -5.304 1.00 0.00 C ATOM 258 O MET A 19 -3.166 7.999 -4.130 1.00 0.00 O ATOM 259 CB MET A 19 -2.036 5.401 -5.748 1.00 0.00 C ATOM 260 CG MET A 19 -1.614 4.896 -4.378 1.00 0.00 C ATOM 261 SD MET A 19 -0.735 3.324 -4.458 1.00 0.00 S ATOM 262 CE MET A 19 0.745 3.808 -5.342 1.00 0.00 C ATOM 0 H MET A 19 -3.496 5.596 -7.725 1.00 0.00 H new ATOM 0 HA MET A 19 -4.018 5.773 -5.005 1.00 0.00 H new ATOM 0 HB2 MET A 19 -2.161 4.550 -6.417 1.00 0.00 H new ATOM 0 HB3 MET A 19 -1.237 6.017 -6.161 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.976 5.640 -3.901 1.00 0.00 H new ATOM 0 HG3 MET A 19 -2.497 4.783 -3.749 1.00 0.00 H new ATOM 0 HE1 MET A 19 0.746 3.347 -6.330 1.00 0.00 H new ATOM 0 HE2 MET A 19 0.767 4.893 -5.448 1.00 0.00 H new ATOM 0 HE3 MET A 19 1.624 3.480 -4.787 1.00 0.00 H new ATOM 272 N ASP A 20 -2.646 8.478 -6.266 1.00 0.00 N ATOM 273 CA ASP A 20 -2.335 9.876 -5.992 1.00 0.00 C ATOM 274 C ASP A 20 -3.278 10.445 -4.937 1.00 0.00 C ATOM 275 O ASP A 20 -2.840 11.072 -3.973 1.00 0.00 O ATOM 276 CB ASP A 20 -2.426 10.702 -7.276 1.00 0.00 C ATOM 277 CG ASP A 20 -2.095 9.889 -8.512 1.00 0.00 C ATOM 278 OD1 ASP A 20 -1.383 8.871 -8.380 1.00 0.00 O ATOM 279 OD2 ASP A 20 -2.547 10.271 -9.611 1.00 0.00 O ATOM 0 H ASP A 20 -2.535 8.205 -7.243 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.316 9.928 -5.608 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.432 11.110 -7.372 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.744 11.549 -7.209 1.00 0.00 H new ATOM 284 N GLU A 21 -4.575 10.224 -5.129 1.00 0.00 N ATOM 285 CA GLU A 21 -5.580 10.718 -4.195 1.00 0.00 C ATOM 286 C GLU A 21 -5.549 9.922 -2.892 1.00 0.00 C ATOM 287 O GLU A 21 -5.466 10.494 -1.806 1.00 0.00 O ATOM 288 CB GLU A 21 -6.973 10.638 -4.821 1.00 0.00 C ATOM 289 CG GLU A 21 -7.240 11.722 -5.852 1.00 0.00 C ATOM 290 CD GLU A 21 -7.431 13.089 -5.225 1.00 0.00 C ATOM 291 OE1 GLU A 21 -6.907 13.312 -4.114 1.00 0.00 O ATOM 292 OE2 GLU A 21 -8.106 13.937 -5.846 1.00 0.00 O ATOM 0 H GLU A 21 -4.954 9.707 -5.922 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.350 11.760 -3.970 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.095 9.663 -5.292 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.721 10.707 -4.032 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.408 11.762 -6.555 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.130 11.462 -6.425 1.00 0.00 H new ATOM 299 N ALA A 22 -5.618 8.601 -3.012 1.00 0.00 N ATOM 300 CA ALA A 22 -5.597 7.726 -1.846 1.00 0.00 C ATOM 301 C ALA A 22 -4.481 8.120 -0.884 1.00 0.00 C ATOM 302 O ALA A 22 -4.724 8.370 0.297 1.00 0.00 O ATOM 303 CB ALA A 22 -5.439 6.276 -2.276 1.00 0.00 C ATOM 0 H ALA A 22 -5.689 8.113 -3.905 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.547 7.836 -1.323 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.425 5.635 -1.395 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.274 5.994 -2.917 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.505 6.159 -2.825 1.00 0.00 H new ATOM 309 N LEU A 23 -3.256 8.171 -1.397 1.00 0.00 N ATOM 310 CA LEU A 23 -2.101 8.534 -0.584 1.00 0.00 C ATOM 311 C LEU A 23 -2.372 9.807 0.211 1.00 0.00 C ATOM 312 O LEU A 23 -2.127 9.865 1.416 1.00 0.00 O ATOM 313 CB LEU A 23 -0.868 8.725 -1.470 1.00 0.00 C ATOM 314 CG LEU A 23 -0.524 7.561 -2.400 1.00 0.00 C ATOM 315 CD1 LEU A 23 0.603 7.948 -3.344 1.00 0.00 C ATOM 316 CD2 LEU A 23 -0.146 6.327 -1.593 1.00 0.00 C ATOM 0 H LEU A 23 -3.038 7.966 -2.372 1.00 0.00 H new ATOM 0 HA LEU A 23 -1.914 7.722 0.119 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -1.016 9.618 -2.077 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -0.009 8.916 -0.827 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.405 7.325 -2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.834 7.107 -3.998 1.00 0.00 H new ATOM 0 HD12 LEU A 23 0.296 8.803 -3.946 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.488 8.212 -2.765 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.096 5.509 -2.271 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.721 6.551 -0.971 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.983 6.037 -0.958 1.00 0.00 H new ATOM 328 N LYS A 24 -2.882 10.827 -0.472 1.00 0.00 N ATOM 329 CA LYS A 24 -3.191 12.099 0.169 1.00 0.00 C ATOM 330 C LYS A 24 -4.072 11.891 1.397 1.00 0.00 C ATOM 331 O LYS A 24 -3.820 12.461 2.458 1.00 0.00 O ATOM 332 CB LYS A 24 -3.890 13.036 -0.820 1.00 0.00 C ATOM 333 CG LYS A 24 -2.937 13.730 -1.777 1.00 0.00 C ATOM 334 CD LYS A 24 -3.682 14.390 -2.925 1.00 0.00 C ATOM 335 CE LYS A 24 -2.724 15.035 -3.915 1.00 0.00 C ATOM 336 NZ LYS A 24 -1.920 16.118 -3.283 1.00 0.00 N ATOM 0 H LYS A 24 -3.090 10.797 -1.470 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.253 12.552 0.489 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.618 12.465 -1.396 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.445 13.790 -0.263 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -2.360 14.481 -1.237 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.225 13.005 -2.173 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.292 13.647 -3.439 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.363 15.145 -2.532 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -2.055 14.276 -4.321 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -3.288 15.444 -4.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -1.420 16.654 -4.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -2.550 16.757 -2.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -1.228 15.700 -2.629 1.00 0.00 H new ATOM 350 N ASP A 25 -5.105 11.069 1.245 1.00 0.00 N ATOM 351 CA ASP A 25 -6.021 10.782 2.343 1.00 0.00 C ATOM 352 C ASP A 25 -5.466 9.681 3.241 1.00 0.00 C ATOM 353 O ASP A 25 -4.845 8.724 2.779 1.00 0.00 O ATOM 354 CB ASP A 25 -7.390 10.372 1.798 1.00 0.00 C ATOM 355 CG ASP A 25 -8.528 10.829 2.690 1.00 0.00 C ATOM 356 OD1 ASP A 25 -8.601 12.040 2.986 1.00 0.00 O ATOM 357 OD2 ASP A 25 -9.347 9.975 3.090 1.00 0.00 O ATOM 0 H ASP A 25 -5.329 10.590 0.373 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.132 11.689 2.938 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.522 10.793 0.801 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.427 9.288 1.694 1.00 0.00 H new ATOM 362 N PRO A 26 -5.694 9.819 4.556 1.00 0.00 N ATOM 363 CA PRO A 26 -5.225 8.845 5.546 1.00 0.00 C ATOM 364 C PRO A 26 -5.973 7.519 5.456 1.00 0.00 C ATOM 365 O PRO A 26 -5.364 6.450 5.465 1.00 0.00 O ATOM 366 CB PRO A 26 -5.514 9.532 6.883 1.00 0.00 C ATOM 367 CG PRO A 26 -6.633 10.472 6.592 1.00 0.00 C ATOM 368 CD PRO A 26 -6.428 10.934 5.176 1.00 0.00 C ATOM 0 HA PRO A 26 -4.176 8.589 5.400 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -5.794 8.808 7.648 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.637 10.063 7.253 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -7.598 9.977 6.705 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.624 11.315 7.283 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.377 11.120 4.673 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -5.858 11.862 5.135 1.00 0.00 H new ATOM 376 N VAL A 27 -7.297 7.597 5.368 1.00 0.00 N ATOM 377 CA VAL A 27 -8.128 6.403 5.274 1.00 0.00 C ATOM 378 C VAL A 27 -7.829 5.624 3.998 1.00 0.00 C ATOM 379 O VAL A 27 -7.638 4.409 4.030 1.00 0.00 O ATOM 380 CB VAL A 27 -9.626 6.758 5.306 1.00 0.00 C ATOM 381 CG1 VAL A 27 -10.475 5.515 5.083 1.00 0.00 C ATOM 382 CG2 VAL A 27 -9.986 7.430 6.622 1.00 0.00 C ATOM 0 H VAL A 27 -7.817 8.475 5.360 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.890 5.783 6.139 1.00 0.00 H new ATOM 0 HB VAL A 27 -9.832 7.459 4.498 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.530 5.786 5.109 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -10.236 5.080 4.113 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.268 4.787 5.868 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -11.048 7.674 6.627 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.765 6.754 7.448 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -9.403 8.344 6.735 1.00 0.00 H new ATOM 392 N GLY A 28 -7.789 6.333 2.874 1.00 0.00 N ATOM 393 CA GLY A 28 -7.512 5.691 1.602 1.00 0.00 C ATOM 394 C GLY A 28 -6.181 4.965 1.596 1.00 0.00 C ATOM 395 O GLY A 28 -6.004 3.986 0.872 1.00 0.00 O ATOM 0 H GLY A 28 -7.943 7.340 2.821 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -8.309 4.983 1.375 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.517 6.441 0.811 1.00 0.00 H new ATOM 399 N ARG A 29 -5.243 5.446 2.405 1.00 0.00 N ATOM 400 CA ARG A 29 -3.921 4.838 2.489 1.00 0.00 C ATOM 401 C ARG A 29 -3.995 3.464 3.149 1.00 0.00 C ATOM 402 O ARG A 29 -3.447 2.489 2.637 1.00 0.00 O ATOM 403 CB ARG A 29 -2.968 5.742 3.273 1.00 0.00 C ATOM 404 CG ARG A 29 -2.208 6.728 2.401 1.00 0.00 C ATOM 405 CD ARG A 29 -1.035 7.342 3.149 1.00 0.00 C ATOM 406 NE ARG A 29 -0.122 8.045 2.251 1.00 0.00 N ATOM 407 CZ ARG A 29 0.646 9.060 2.631 1.00 0.00 C ATOM 408 NH1 ARG A 29 0.611 9.489 3.885 1.00 0.00 N ATOM 409 NH2 ARG A 29 1.451 9.649 1.756 1.00 0.00 N ATOM 0 H ARG A 29 -5.374 6.255 3.012 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.541 4.715 1.475 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.537 6.295 4.020 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -2.253 5.121 3.812 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.846 6.221 1.507 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -2.883 7.517 2.069 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.408 8.036 3.902 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.492 6.559 3.678 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.072 7.740 1.279 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.007 9.039 4.561 1.00 0.00 H new ATOM 0 HH12 ARG A 29 1.202 10.269 4.174 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.481 9.322 0.790 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.040 10.428 2.049 1.00 0.00 H new ATOM 423 N GLU A 30 -4.676 3.397 4.289 1.00 0.00 N ATOM 424 CA GLU A 30 -4.820 2.144 5.019 1.00 0.00 C ATOM 425 C GLU A 30 -5.723 1.174 4.263 1.00 0.00 C ATOM 426 O GLU A 30 -5.432 -0.018 4.173 1.00 0.00 O ATOM 427 CB GLU A 30 -5.389 2.404 6.416 1.00 0.00 C ATOM 428 CG GLU A 30 -6.907 2.424 6.461 1.00 0.00 C ATOM 429 CD GLU A 30 -7.446 2.678 7.855 1.00 0.00 C ATOM 430 OE1 GLU A 30 -6.746 2.343 8.833 1.00 0.00 O ATOM 431 OE2 GLU A 30 -8.570 3.213 7.967 1.00 0.00 O ATOM 0 H GLU A 30 -5.136 4.196 4.726 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.832 1.694 5.115 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.024 1.635 7.097 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.011 3.359 6.781 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.277 3.196 5.786 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -7.290 1.471 6.095 1.00 0.00 H new ATOM 438 N GLN A 31 -6.820 1.695 3.722 1.00 0.00 N ATOM 439 CA GLN A 31 -7.766 0.875 2.975 1.00 0.00 C ATOM 440 C GLN A 31 -7.069 0.142 1.834 1.00 0.00 C ATOM 441 O GLN A 31 -7.120 -1.085 1.748 1.00 0.00 O ATOM 442 CB GLN A 31 -8.899 1.742 2.423 1.00 0.00 C ATOM 443 CG GLN A 31 -9.859 2.241 3.491 1.00 0.00 C ATOM 444 CD GLN A 31 -10.515 1.111 4.260 1.00 0.00 C ATOM 445 OE1 GLN A 31 -11.135 0.223 3.673 1.00 0.00 O ATOM 446 NE2 GLN A 31 -10.382 1.138 5.580 1.00 0.00 N ATOM 0 H GLN A 31 -7.075 2.680 3.787 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.183 0.134 3.657 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.470 2.599 1.903 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.458 1.168 1.684 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -9.320 2.884 4.187 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.630 2.853 3.024 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.860 1.893 6.025 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -10.802 0.404 6.150 1.00 0.00 H new ATOM 455 N PHE A 32 -6.418 0.902 0.959 1.00 0.00 N ATOM 456 CA PHE A 32 -5.711 0.324 -0.178 1.00 0.00 C ATOM 457 C PHE A 32 -4.703 -0.724 0.284 1.00 0.00 C ATOM 458 O PHE A 32 -4.457 -1.713 -0.409 1.00 0.00 O ATOM 459 CB PHE A 32 -4.997 1.420 -0.972 1.00 0.00 C ATOM 460 CG PHE A 32 -4.060 0.888 -2.018 1.00 0.00 C ATOM 461 CD1 PHE A 32 -4.517 0.028 -3.004 1.00 0.00 C ATOM 462 CD2 PHE A 32 -2.722 1.249 -2.017 1.00 0.00 C ATOM 463 CE1 PHE A 32 -3.657 -0.463 -3.967 1.00 0.00 C ATOM 464 CE2 PHE A 32 -1.857 0.761 -2.978 1.00 0.00 C ATOM 465 CZ PHE A 32 -2.325 -0.095 -3.955 1.00 0.00 C ATOM 0 H PHE A 32 -6.366 1.919 1.016 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.444 -0.162 -0.821 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -5.742 2.054 -1.452 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.438 2.052 -0.282 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.557 -0.262 -3.020 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -2.351 1.920 -1.256 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -4.025 -1.134 -4.729 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -0.816 1.049 -2.965 1.00 0.00 H new ATOM 0 HZ PHE A 32 -1.651 -0.476 -4.708 1.00 0.00 H new ATOM 475 N LEU A 33 -4.122 -0.500 1.457 1.00 0.00 N ATOM 476 CA LEU A 33 -3.139 -1.425 2.013 1.00 0.00 C ATOM 477 C LEU A 33 -3.789 -2.755 2.378 1.00 0.00 C ATOM 478 O LEU A 33 -3.316 -3.820 1.980 1.00 0.00 O ATOM 479 CB LEU A 33 -2.475 -0.812 3.247 1.00 0.00 C ATOM 480 CG LEU A 33 -1.831 -1.799 4.222 1.00 0.00 C ATOM 481 CD1 LEU A 33 -0.400 -2.103 3.805 1.00 0.00 C ATOM 482 CD2 LEU A 33 -1.870 -1.249 5.640 1.00 0.00 C ATOM 0 H LEU A 33 -4.314 0.313 2.042 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.379 -1.610 1.254 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -1.710 -0.111 2.913 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.224 -0.233 3.788 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.400 -2.728 4.198 1.00 0.00 H new ATOM 0 HD11 LEU A 33 0.043 -2.807 4.510 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.397 -2.539 2.806 1.00 0.00 H new ATOM 0 HD13 LEU A 33 0.181 -1.181 3.800 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -1.408 -1.964 6.320 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.325 -0.306 5.680 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.905 -1.082 5.937 1.00 0.00 H new ATOM 494 N LYS A 34 -4.877 -2.687 3.138 1.00 0.00 N ATOM 495 CA LYS A 34 -5.595 -3.886 3.555 1.00 0.00 C ATOM 496 C LYS A 34 -5.558 -4.951 2.464 1.00 0.00 C ATOM 497 O LYS A 34 -5.047 -6.051 2.674 1.00 0.00 O ATOM 498 CB LYS A 34 -7.047 -3.542 3.897 1.00 0.00 C ATOM 499 CG LYS A 34 -7.184 -2.540 5.031 1.00 0.00 C ATOM 500 CD LYS A 34 -8.515 -2.690 5.749 1.00 0.00 C ATOM 501 CE LYS A 34 -8.635 -1.714 6.910 1.00 0.00 C ATOM 502 NZ LYS A 34 -10.014 -1.685 7.470 1.00 0.00 N ATOM 0 H LYS A 34 -5.281 -1.814 3.478 1.00 0.00 H new ATOM 0 HA LYS A 34 -5.102 -4.284 4.442 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.536 -3.142 3.009 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -7.575 -4.457 4.166 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.369 -2.679 5.741 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -7.094 -1.528 4.636 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -9.330 -2.522 5.045 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.618 -3.710 6.118 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.931 -1.993 7.694 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.358 -0.715 6.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -10.086 -0.926 8.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -10.696 -1.510 6.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -10.225 -2.599 7.920 1.00 0.00 H new ATOM 516 N PHE A 35 -6.100 -4.616 1.298 1.00 0.00 N ATOM 517 CA PHE A 35 -6.127 -5.543 0.173 1.00 0.00 C ATOM 518 C PHE A 35 -4.724 -6.047 -0.151 1.00 0.00 C ATOM 519 O PHE A 35 -4.489 -7.254 -0.236 1.00 0.00 O ATOM 520 CB PHE A 35 -6.735 -4.868 -1.058 1.00 0.00 C ATOM 521 CG PHE A 35 -6.650 -5.703 -2.303 1.00 0.00 C ATOM 522 CD1 PHE A 35 -5.478 -5.752 -3.041 1.00 0.00 C ATOM 523 CD2 PHE A 35 -7.741 -6.439 -2.736 1.00 0.00 C ATOM 524 CE1 PHE A 35 -5.397 -6.519 -4.188 1.00 0.00 C ATOM 525 CE2 PHE A 35 -7.666 -7.208 -3.882 1.00 0.00 C ATOM 526 CZ PHE A 35 -6.492 -7.249 -4.608 1.00 0.00 C ATOM 0 H PHE A 35 -6.527 -3.709 1.108 1.00 0.00 H new ATOM 0 HA PHE A 35 -6.745 -6.396 0.453 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -7.781 -4.637 -0.856 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -6.226 -3.920 -1.231 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -4.618 -5.185 -2.716 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -8.661 -6.412 -2.171 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.478 -6.548 -4.755 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -8.524 -7.776 -4.209 1.00 0.00 H new ATOM 0 HZ PHE A 35 -6.430 -7.851 -5.503 1.00 0.00 H new ATOM 536 N LEU A 36 -3.794 -5.116 -0.331 1.00 0.00 N ATOM 537 CA LEU A 36 -2.413 -5.464 -0.646 1.00 0.00 C ATOM 538 C LEU A 36 -1.920 -6.597 0.248 1.00 0.00 C ATOM 539 O LEU A 36 -1.458 -7.628 -0.240 1.00 0.00 O ATOM 540 CB LEU A 36 -1.508 -4.241 -0.484 1.00 0.00 C ATOM 541 CG LEU A 36 -1.287 -3.399 -1.741 1.00 0.00 C ATOM 542 CD1 LEU A 36 -2.501 -3.472 -2.653 1.00 0.00 C ATOM 543 CD2 LEU A 36 -0.983 -1.955 -1.369 1.00 0.00 C ATOM 0 H LEU A 36 -3.971 -4.114 -0.264 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.376 -5.801 -1.682 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.932 -3.600 0.289 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.537 -4.578 -0.121 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.430 -3.803 -2.279 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.325 -2.867 -3.542 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.673 -4.507 -2.947 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.376 -3.095 -2.124 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.829 -1.370 -2.276 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.820 -1.540 -0.808 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.082 -1.919 -0.756 1.00 0.00 H new ATOM 555 N GLU A 37 -2.023 -6.399 1.558 1.00 0.00 N ATOM 556 CA GLU A 37 -1.588 -7.405 2.519 1.00 0.00 C ATOM 557 C GLU A 37 -2.210 -8.763 2.204 1.00 0.00 C ATOM 558 O GLU A 37 -1.583 -9.805 2.398 1.00 0.00 O ATOM 559 CB GLU A 37 -1.960 -6.980 3.941 1.00 0.00 C ATOM 560 CG GLU A 37 -1.354 -5.650 4.357 1.00 0.00 C ATOM 561 CD GLU A 37 -1.358 -5.450 5.860 1.00 0.00 C ATOM 562 OE1 GLU A 37 -1.428 -6.459 6.592 1.00 0.00 O ATOM 563 OE2 GLU A 37 -1.292 -4.285 6.303 1.00 0.00 O ATOM 0 H GLU A 37 -2.404 -5.551 1.978 1.00 0.00 H new ATOM 0 HA GLU A 37 -0.504 -7.494 2.446 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -3.045 -6.916 4.020 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -1.635 -7.752 4.639 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -0.330 -5.591 3.989 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -1.909 -4.839 3.885 1.00 0.00 H new ATOM 570 N SER A 38 -3.446 -8.742 1.717 1.00 0.00 N ATOM 571 CA SER A 38 -4.155 -9.970 1.379 1.00 0.00 C ATOM 572 C SER A 38 -3.457 -10.704 0.238 1.00 0.00 C ATOM 573 O SER A 38 -3.198 -11.904 0.325 1.00 0.00 O ATOM 574 CB SER A 38 -5.602 -9.659 0.990 1.00 0.00 C ATOM 575 OG SER A 38 -6.361 -10.847 0.855 1.00 0.00 O ATOM 0 H SER A 38 -3.977 -7.888 1.548 1.00 0.00 H new ATOM 0 HA SER A 38 -4.153 -10.614 2.258 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.055 -9.018 1.746 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.618 -9.105 0.051 1.00 0.00 H new ATOM 0 HG SER A 38 -7.282 -10.621 0.608 1.00 0.00 H new ATOM 581 N GLU A 39 -3.156 -9.974 -0.831 1.00 0.00 N ATOM 582 CA GLU A 39 -2.488 -10.555 -1.990 1.00 0.00 C ATOM 583 C GLU A 39 -0.976 -10.588 -1.786 1.00 0.00 C ATOM 584 O GLU A 39 -0.217 -10.815 -2.729 1.00 0.00 O ATOM 585 CB GLU A 39 -2.827 -9.761 -3.253 1.00 0.00 C ATOM 586 CG GLU A 39 -2.352 -8.319 -3.211 1.00 0.00 C ATOM 587 CD GLU A 39 -2.136 -7.735 -4.594 1.00 0.00 C ATOM 588 OE1 GLU A 39 -1.832 -8.511 -5.524 1.00 0.00 O ATOM 589 OE2 GLU A 39 -2.271 -6.503 -4.746 1.00 0.00 O ATOM 0 H GLU A 39 -3.364 -8.979 -0.919 1.00 0.00 H new ATOM 0 HA GLU A 39 -2.844 -11.579 -2.107 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.380 -10.257 -4.115 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -3.907 -9.775 -3.402 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.084 -7.715 -2.676 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -1.420 -8.264 -2.648 1.00 0.00 H new ATOM 596 N PHE A 40 -0.546 -10.360 -0.550 1.00 0.00 N ATOM 597 CA PHE A 40 0.875 -10.362 -0.222 1.00 0.00 C ATOM 598 C PHE A 40 1.644 -9.407 -1.132 1.00 0.00 C ATOM 599 O PHE A 40 2.723 -9.736 -1.624 1.00 0.00 O ATOM 600 CB PHE A 40 1.447 -11.775 -0.348 1.00 0.00 C ATOM 601 CG PHE A 40 0.959 -12.716 0.717 1.00 0.00 C ATOM 602 CD1 PHE A 40 -0.392 -12.996 0.846 1.00 0.00 C ATOM 603 CD2 PHE A 40 1.851 -13.319 1.588 1.00 0.00 C ATOM 604 CE1 PHE A 40 -0.843 -13.861 1.826 1.00 0.00 C ATOM 605 CE2 PHE A 40 1.406 -14.185 2.570 1.00 0.00 C ATOM 606 CZ PHE A 40 0.057 -14.457 2.688 1.00 0.00 C ATOM 0 H PHE A 40 -1.161 -10.171 0.241 1.00 0.00 H new ATOM 0 HA PHE A 40 0.985 -10.023 0.808 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.185 -12.179 -1.326 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.535 -11.723 -0.305 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.100 -12.534 0.174 1.00 0.00 H new ATOM 0 HD2 PHE A 40 2.907 -13.110 1.499 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.899 -14.071 1.917 1.00 0.00 H new ATOM 0 HE2 PHE A 40 2.112 -14.648 3.244 1.00 0.00 H new ATOM 0 HZ PHE A 40 -0.294 -15.134 3.453 1.00 0.00 H new ATOM 616 N SER A 41 1.079 -8.224 -1.350 1.00 0.00 N ATOM 617 CA SER A 41 1.709 -7.222 -2.203 1.00 0.00 C ATOM 618 C SER A 41 2.112 -5.994 -1.392 1.00 0.00 C ATOM 619 O SER A 41 2.943 -5.197 -1.825 1.00 0.00 O ATOM 620 CB SER A 41 0.760 -6.814 -3.331 1.00 0.00 C ATOM 621 OG SER A 41 -0.248 -5.938 -2.858 1.00 0.00 O ATOM 0 H SER A 41 0.187 -7.936 -0.948 1.00 0.00 H new ATOM 0 HA SER A 41 2.608 -7.661 -2.635 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.324 -6.328 -4.127 1.00 0.00 H new ATOM 0 HB3 SER A 41 0.300 -7.703 -3.763 1.00 0.00 H new ATOM 0 HG SER A 41 -0.985 -5.908 -3.504 1.00 0.00 H new ATOM 627 N SER A 42 1.515 -5.849 -0.213 1.00 0.00 N ATOM 628 CA SER A 42 1.808 -4.716 0.657 1.00 0.00 C ATOM 629 C SER A 42 3.298 -4.390 0.641 1.00 0.00 C ATOM 630 O SER A 42 3.689 -3.224 0.681 1.00 0.00 O ATOM 631 CB SER A 42 1.356 -5.015 2.088 1.00 0.00 C ATOM 632 OG SER A 42 2.196 -5.981 2.697 1.00 0.00 O ATOM 0 H SER A 42 0.826 -6.501 0.161 1.00 0.00 H new ATOM 0 HA SER A 42 1.260 -3.851 0.283 1.00 0.00 H new ATOM 0 HB2 SER A 42 1.367 -4.097 2.675 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.328 -5.376 2.080 1.00 0.00 H new ATOM 0 HG SER A 42 1.680 -6.497 3.351 1.00 0.00 H new ATOM 638 N GLU A 43 4.125 -5.429 0.581 1.00 0.00 N ATOM 639 CA GLU A 43 5.573 -5.253 0.560 1.00 0.00 C ATOM 640 C GLU A 43 5.962 -4.049 -0.293 1.00 0.00 C ATOM 641 O GLU A 43 6.852 -3.281 0.069 1.00 0.00 O ATOM 642 CB GLU A 43 6.254 -6.513 0.024 1.00 0.00 C ATOM 643 CG GLU A 43 5.850 -6.866 -1.398 1.00 0.00 C ATOM 644 CD GLU A 43 5.872 -8.360 -1.657 1.00 0.00 C ATOM 645 OE1 GLU A 43 6.529 -9.086 -0.882 1.00 0.00 O ATOM 646 OE2 GLU A 43 5.233 -8.803 -2.634 1.00 0.00 O ATOM 0 H GLU A 43 3.818 -6.401 0.546 1.00 0.00 H new ATOM 0 HA GLU A 43 5.907 -5.075 1.582 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.335 -6.376 0.062 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.016 -7.351 0.679 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.849 -6.482 -1.593 1.00 0.00 H new ATOM 0 HG3 GLU A 43 6.524 -6.370 -2.097 1.00 0.00 H new ATOM 653 N ASN A 44 5.288 -3.892 -1.427 1.00 0.00 N ATOM 654 CA ASN A 44 5.563 -2.783 -2.333 1.00 0.00 C ATOM 655 C ASN A 44 5.196 -1.450 -1.688 1.00 0.00 C ATOM 656 O ASN A 44 6.013 -0.530 -1.631 1.00 0.00 O ATOM 657 CB ASN A 44 4.788 -2.960 -3.640 1.00 0.00 C ATOM 658 CG ASN A 44 5.042 -4.309 -4.285 1.00 0.00 C ATOM 659 OD1 ASN A 44 5.677 -5.182 -3.694 1.00 0.00 O ATOM 660 ND2 ASN A 44 4.544 -4.485 -5.504 1.00 0.00 N ATOM 0 H ASN A 44 4.547 -4.519 -1.741 1.00 0.00 H new ATOM 0 HA ASN A 44 6.631 -2.780 -2.550 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.721 -2.849 -3.445 1.00 0.00 H new ATOM 0 HB3 ASN A 44 5.069 -2.169 -4.336 1.00 0.00 H new ATOM 0 HD21 ASN A 44 4.682 -5.372 -5.988 1.00 0.00 H new ATOM 0 HD22 ASN A 44 4.024 -3.733 -5.956 1.00 0.00 H new ATOM 667 N LEU A 45 3.963 -1.353 -1.203 1.00 0.00 N ATOM 668 CA LEU A 45 3.487 -0.133 -0.561 1.00 0.00 C ATOM 669 C LEU A 45 4.217 0.109 0.756 1.00 0.00 C ATOM 670 O LEU A 45 4.884 1.129 0.929 1.00 0.00 O ATOM 671 CB LEU A 45 1.980 -0.217 -0.314 1.00 0.00 C ATOM 672 CG LEU A 45 1.341 0.997 0.361 1.00 0.00 C ATOM 673 CD1 LEU A 45 1.384 2.205 -0.562 1.00 0.00 C ATOM 674 CD2 LEU A 45 -0.091 0.687 0.771 1.00 0.00 C ATOM 0 H LEU A 45 3.275 -2.105 -1.242 1.00 0.00 H new ATOM 0 HA LEU A 45 3.693 0.704 -1.229 1.00 0.00 H new ATOM 0 HB2 LEU A 45 1.484 -0.378 -1.271 1.00 0.00 H new ATOM 0 HB3 LEU A 45 1.781 -1.095 0.300 1.00 0.00 H new ATOM 0 HG LEU A 45 1.912 1.232 1.259 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.925 3.059 -0.065 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.420 2.440 -0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.838 1.982 -1.479 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.530 1.562 1.250 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.674 0.426 -0.112 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.096 -0.150 1.470 1.00 0.00 H new ATOM 686 N ARG A 46 4.087 -0.836 1.681 1.00 0.00 N ATOM 687 CA ARG A 46 4.735 -0.726 2.983 1.00 0.00 C ATOM 688 C ARG A 46 6.089 -0.035 2.859 1.00 0.00 C ATOM 689 O ARG A 46 6.447 0.806 3.685 1.00 0.00 O ATOM 690 CB ARG A 46 4.912 -2.111 3.607 1.00 0.00 C ATOM 691 CG ARG A 46 3.600 -2.818 3.905 1.00 0.00 C ATOM 692 CD ARG A 46 3.737 -3.779 5.075 1.00 0.00 C ATOM 693 NE ARG A 46 2.620 -4.716 5.149 1.00 0.00 N ATOM 694 CZ ARG A 46 2.402 -5.521 6.183 1.00 0.00 C ATOM 695 NH1 ARG A 46 3.221 -5.502 7.225 1.00 0.00 N ATOM 696 NH2 ARG A 46 1.363 -6.346 6.176 1.00 0.00 N ATOM 0 H ARG A 46 3.539 -1.687 1.553 1.00 0.00 H new ATOM 0 HA ARG A 46 4.097 -0.123 3.629 1.00 0.00 H new ATOM 0 HB2 ARG A 46 5.504 -2.731 2.933 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.480 -2.013 4.532 1.00 0.00 H new ATOM 0 HG2 ARG A 46 2.830 -2.079 4.128 1.00 0.00 H new ATOM 0 HG3 ARG A 46 3.271 -3.364 3.021 1.00 0.00 H new ATOM 0 HD2 ARG A 46 4.670 -4.334 4.980 1.00 0.00 H new ATOM 0 HD3 ARG A 46 3.797 -3.212 6.004 1.00 0.00 H new ATOM 0 HE ARG A 46 1.971 -4.755 4.363 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.020 -4.868 7.234 1.00 0.00 H new ATOM 0 HH12 ARG A 46 3.052 -6.121 8.018 1.00 0.00 H new ATOM 0 HH21 ARG A 46 0.730 -6.363 5.376 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.197 -6.964 6.971 1.00 0.00 H new ATOM 710 N PHE A 47 6.839 -0.395 1.823 1.00 0.00 N ATOM 711 CA PHE A 47 8.155 0.189 1.591 1.00 0.00 C ATOM 712 C PHE A 47 8.036 1.658 1.194 1.00 0.00 C ATOM 713 O PHE A 47 8.734 2.516 1.734 1.00 0.00 O ATOM 714 CB PHE A 47 8.897 -0.587 0.501 1.00 0.00 C ATOM 715 CG PHE A 47 10.045 0.172 -0.099 1.00 0.00 C ATOM 716 CD1 PHE A 47 11.172 0.459 0.654 1.00 0.00 C ATOM 717 CD2 PHE A 47 9.998 0.597 -1.417 1.00 0.00 C ATOM 718 CE1 PHE A 47 12.230 1.158 0.104 1.00 0.00 C ATOM 719 CE2 PHE A 47 11.053 1.296 -1.973 1.00 0.00 C ATOM 720 CZ PHE A 47 12.171 1.576 -1.211 1.00 0.00 C ATOM 0 H PHE A 47 6.558 -1.089 1.130 1.00 0.00 H new ATOM 0 HA PHE A 47 8.721 0.126 2.520 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.270 -1.521 0.921 1.00 0.00 H new ATOM 0 HB3 PHE A 47 8.194 -0.851 -0.289 1.00 0.00 H new ATOM 0 HD1 PHE A 47 11.224 0.133 1.682 1.00 0.00 H new ATOM 0 HD2 PHE A 47 9.127 0.380 -2.017 1.00 0.00 H new ATOM 0 HE1 PHE A 47 13.102 1.377 0.702 1.00 0.00 H new ATOM 0 HE2 PHE A 47 11.003 1.623 -3.001 1.00 0.00 H new ATOM 0 HZ PHE A 47 12.997 2.121 -1.643 1.00 0.00 H new ATOM 730 N TRP A 48 7.148 1.938 0.247 1.00 0.00 N ATOM 731 CA TRP A 48 6.938 3.302 -0.223 1.00 0.00 C ATOM 732 C TRP A 48 6.770 4.263 0.949 1.00 0.00 C ATOM 733 O TRP A 48 7.522 5.229 1.085 1.00 0.00 O ATOM 734 CB TRP A 48 5.708 3.366 -1.131 1.00 0.00 C ATOM 735 CG TRP A 48 5.561 4.679 -1.839 1.00 0.00 C ATOM 736 CD1 TRP A 48 6.293 5.123 -2.903 1.00 0.00 C ATOM 737 CD2 TRP A 48 4.624 5.718 -1.532 1.00 0.00 C ATOM 738 NE1 TRP A 48 5.868 6.376 -3.276 1.00 0.00 N ATOM 739 CE2 TRP A 48 4.845 6.762 -2.452 1.00 0.00 C ATOM 740 CE3 TRP A 48 3.620 5.867 -0.572 1.00 0.00 C ATOM 741 CZ2 TRP A 48 4.098 7.937 -2.436 1.00 0.00 C ATOM 742 CZ3 TRP A 48 2.880 7.034 -0.558 1.00 0.00 C ATOM 743 CH2 TRP A 48 3.122 8.056 -1.485 1.00 0.00 C ATOM 0 H TRP A 48 6.562 1.239 -0.210 1.00 0.00 H new ATOM 0 HA TRP A 48 7.818 3.603 -0.792 1.00 0.00 H new ATOM 0 HB2 TRP A 48 5.769 2.567 -1.870 1.00 0.00 H new ATOM 0 HB3 TRP A 48 4.815 3.181 -0.535 1.00 0.00 H new ATOM 0 HD1 TRP A 48 7.089 4.571 -3.381 1.00 0.00 H new ATOM 0 HE1 TRP A 48 6.252 6.929 -4.042 1.00 0.00 H new ATOM 0 HE3 TRP A 48 3.426 5.084 0.146 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.283 8.727 -3.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 2.102 7.160 0.180 1.00 0.00 H new ATOM 0 HH2 TRP A 48 2.526 8.956 -1.448 1.00 0.00 H new ATOM 754 N LEU A 49 5.782 3.992 1.793 1.00 0.00 N ATOM 755 CA LEU A 49 5.516 4.833 2.955 1.00 0.00 C ATOM 756 C LEU A 49 6.747 4.928 3.851 1.00 0.00 C ATOM 757 O LEU A 49 7.122 6.013 4.294 1.00 0.00 O ATOM 758 CB LEU A 49 4.333 4.278 3.752 1.00 0.00 C ATOM 759 CG LEU A 49 3.015 4.144 2.989 1.00 0.00 C ATOM 760 CD1 LEU A 49 1.988 3.398 3.826 1.00 0.00 C ATOM 761 CD2 LEU A 49 2.487 5.515 2.591 1.00 0.00 C ATOM 0 H LEU A 49 5.151 3.196 1.695 1.00 0.00 H new ATOM 0 HA LEU A 49 5.269 5.833 2.600 1.00 0.00 H new ATOM 0 HB2 LEU A 49 4.608 3.296 4.137 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.167 4.923 4.614 1.00 0.00 H new ATOM 0 HG LEU A 49 3.200 3.570 2.081 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.056 3.312 3.267 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.364 2.402 4.060 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.807 3.944 4.752 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.548 5.400 2.049 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.318 6.114 3.486 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.216 6.014 1.953 1.00 0.00 H new ATOM 773 N ALA A 50 7.373 3.785 4.112 1.00 0.00 N ATOM 774 CA ALA A 50 8.564 3.740 4.951 1.00 0.00 C ATOM 775 C ALA A 50 9.494 4.910 4.647 1.00 0.00 C ATOM 776 O ALA A 50 10.014 5.555 5.557 1.00 0.00 O ATOM 777 CB ALA A 50 9.294 2.419 4.760 1.00 0.00 C ATOM 0 H ALA A 50 7.075 2.878 3.754 1.00 0.00 H new ATOM 0 HA ALA A 50 8.249 3.821 5.991 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.181 2.399 5.393 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.634 1.596 5.034 1.00 0.00 H new ATOM 0 HB3 ALA A 50 9.590 2.314 3.716 1.00 0.00 H new ATOM 783 N VAL A 51 9.699 5.178 3.361 1.00 0.00 N ATOM 784 CA VAL A 51 10.566 6.271 2.938 1.00 0.00 C ATOM 785 C VAL A 51 9.924 7.624 3.221 1.00 0.00 C ATOM 786 O VAL A 51 10.535 8.495 3.840 1.00 0.00 O ATOM 787 CB VAL A 51 10.896 6.176 1.436 1.00 0.00 C ATOM 788 CG1 VAL A 51 11.785 7.334 1.010 1.00 0.00 C ATOM 789 CG2 VAL A 51 11.555 4.842 1.119 1.00 0.00 C ATOM 0 H VAL A 51 9.277 4.653 2.595 1.00 0.00 H new ATOM 0 HA VAL A 51 11.488 6.183 3.512 1.00 0.00 H new ATOM 0 HB VAL A 51 9.965 6.238 0.873 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.007 7.250 -0.054 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.271 8.276 1.200 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.715 7.307 1.578 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.781 4.792 0.054 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.478 4.747 1.691 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.878 4.030 1.385 1.00 0.00 H new ATOM 799 N GLU A 52 8.687 7.793 2.764 1.00 0.00 N ATOM 800 CA GLU A 52 7.961 9.042 2.968 1.00 0.00 C ATOM 801 C GLU A 52 8.190 9.579 4.378 1.00 0.00 C ATOM 802 O GLU A 52 8.400 10.777 4.571 1.00 0.00 O ATOM 803 CB GLU A 52 6.465 8.833 2.726 1.00 0.00 C ATOM 804 CG GLU A 52 6.081 8.824 1.256 1.00 0.00 C ATOM 805 CD GLU A 52 6.021 10.217 0.661 1.00 0.00 C ATOM 806 OE1 GLU A 52 5.608 11.153 1.377 1.00 0.00 O ATOM 807 OE2 GLU A 52 6.388 10.372 -0.523 1.00 0.00 O ATOM 0 H GLU A 52 8.167 7.082 2.250 1.00 0.00 H new ATOM 0 HA GLU A 52 8.338 9.774 2.253 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.161 7.889 3.178 1.00 0.00 H new ATOM 0 HB3 GLU A 52 5.910 9.622 3.233 1.00 0.00 H new ATOM 0 HG2 GLU A 52 6.803 8.226 0.699 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.110 8.341 1.141 1.00 0.00 H new ATOM 814 N ASP A 53 8.148 8.685 5.359 1.00 0.00 N ATOM 815 CA ASP A 53 8.350 9.068 6.752 1.00 0.00 C ATOM 816 C ASP A 53 9.837 9.202 7.067 1.00 0.00 C ATOM 817 O ASP A 53 10.249 10.109 7.792 1.00 0.00 O ATOM 818 CB ASP A 53 7.709 8.039 7.685 1.00 0.00 C ATOM 819 CG ASP A 53 7.917 8.376 9.148 1.00 0.00 C ATOM 820 OD1 ASP A 53 7.528 9.488 9.562 1.00 0.00 O ATOM 821 OD2 ASP A 53 8.470 7.528 9.880 1.00 0.00 O ATOM 0 H ASP A 53 7.976 7.690 5.216 1.00 0.00 H new ATOM 0 HA ASP A 53 7.874 10.036 6.910 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.641 7.980 7.477 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.129 7.054 7.479 1.00 0.00 H new ATOM 826 N LEU A 54 10.637 8.294 6.520 1.00 0.00 N ATOM 827 CA LEU A 54 12.079 8.310 6.744 1.00 0.00 C ATOM 828 C LEU A 54 12.592 9.739 6.882 1.00 0.00 C ATOM 829 O LEU A 54 13.164 10.109 7.909 1.00 0.00 O ATOM 830 CB LEU A 54 12.801 7.605 5.594 1.00 0.00 C ATOM 831 CG LEU A 54 14.326 7.549 5.694 1.00 0.00 C ATOM 832 CD1 LEU A 54 14.751 6.785 6.939 1.00 0.00 C ATOM 833 CD2 LEU A 54 14.918 6.910 4.446 1.00 0.00 C ATOM 0 H LEU A 54 10.312 7.537 5.918 1.00 0.00 H new ATOM 0 HA LEU A 54 12.284 7.779 7.673 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.423 6.585 5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.536 8.106 4.663 1.00 0.00 H new ATOM 0 HG LEU A 54 14.705 8.568 5.771 1.00 0.00 H new ATOM 0 HD11 LEU A 54 15.839 6.755 6.994 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.357 7.284 7.824 1.00 0.00 H new ATOM 0 HD13 LEU A 54 14.362 5.768 6.892 1.00 0.00 H new ATOM 0 HD21 LEU A 54 16.004 6.878 4.534 1.00 0.00 H new ATOM 0 HD22 LEU A 54 14.533 5.896 4.339 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.642 7.498 3.570 1.00 0.00 H new ATOM 845 N LYS A 55 12.384 10.541 5.843 1.00 0.00 N ATOM 846 CA LYS A 55 12.822 11.932 5.849 1.00 0.00 C ATOM 847 C LYS A 55 12.347 12.647 7.110 1.00 0.00 C ATOM 848 O LYS A 55 13.097 13.403 7.727 1.00 0.00 O ATOM 849 CB LYS A 55 12.296 12.658 4.609 1.00 0.00 C ATOM 850 CG LYS A 55 10.802 12.489 4.392 1.00 0.00 C ATOM 851 CD LYS A 55 10.420 12.718 2.939 1.00 0.00 C ATOM 852 CE LYS A 55 10.563 11.446 2.118 1.00 0.00 C ATOM 853 NZ LYS A 55 11.990 11.105 1.865 1.00 0.00 N ATOM 0 H LYS A 55 11.914 10.251 4.985 1.00 0.00 H new ATOM 0 HA LYS A 55 13.912 11.944 5.835 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.524 13.720 4.697 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.826 12.290 3.731 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.501 11.486 4.695 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.260 13.190 5.027 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.391 13.074 2.884 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.051 13.499 2.515 1.00 0.00 H new ATOM 0 HE2 LYS A 55 10.080 10.621 2.641 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.045 11.568 1.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 12.058 10.502 1.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.534 11.978 1.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.376 10.596 2.686 1.00 0.00 H new ATOM 867 N LYS A 56 11.097 12.401 7.488 1.00 0.00 N ATOM 868 CA LYS A 56 10.522 13.019 8.677 1.00 0.00 C ATOM 869 C LYS A 56 11.311 12.636 9.925 1.00 0.00 C ATOM 870 O LYS A 56 11.544 13.467 10.803 1.00 0.00 O ATOM 871 CB LYS A 56 9.058 12.601 8.837 1.00 0.00 C ATOM 872 CG LYS A 56 8.167 13.056 7.695 1.00 0.00 C ATOM 873 CD LYS A 56 7.957 14.561 7.718 1.00 0.00 C ATOM 874 CE LYS A 56 7.708 15.110 6.321 1.00 0.00 C ATOM 875 NZ LYS A 56 8.121 16.536 6.204 1.00 0.00 N ATOM 0 H LYS A 56 10.463 11.778 6.988 1.00 0.00 H new ATOM 0 HA LYS A 56 10.573 14.101 8.555 1.00 0.00 H new ATOM 0 HB2 LYS A 56 9.006 11.515 8.917 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.673 13.008 9.772 1.00 0.00 H new ATOM 0 HG2 LYS A 56 8.614 12.764 6.745 1.00 0.00 H new ATOM 0 HG3 LYS A 56 7.203 12.552 7.761 1.00 0.00 H new ATOM 0 HD2 LYS A 56 7.110 14.802 8.361 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.833 15.045 8.150 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.256 14.512 5.593 1.00 0.00 H new ATOM 0 HE3 LYS A 56 6.650 15.017 6.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.935 16.873 5.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.580 17.111 6.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 9.137 16.621 6.411 1.00 0.00 H new ATOM 889 N ARG A 57 11.720 11.374 9.996 1.00 0.00 N ATOM 890 CA ARG A 57 12.483 10.881 11.137 1.00 0.00 C ATOM 891 C ARG A 57 13.689 11.775 11.411 1.00 0.00 C ATOM 892 O ARG A 57 14.296 12.337 10.499 1.00 0.00 O ATOM 893 CB ARG A 57 12.945 9.445 10.886 1.00 0.00 C ATOM 894 CG ARG A 57 11.809 8.436 10.856 1.00 0.00 C ATOM 895 CD ARG A 57 11.456 7.951 12.253 1.00 0.00 C ATOM 896 NE ARG A 57 12.256 6.796 12.651 1.00 0.00 N ATOM 897 CZ ARG A 57 11.977 6.035 13.703 1.00 0.00 C ATOM 898 NH1 ARG A 57 10.923 6.306 14.460 1.00 0.00 N ATOM 899 NH2 ARG A 57 12.753 5.001 14.000 1.00 0.00 N ATOM 0 H ARG A 57 11.536 10.674 9.277 1.00 0.00 H new ATOM 0 HA ARG A 57 11.833 10.898 12.012 1.00 0.00 H new ATOM 0 HB2 ARG A 57 13.480 9.405 9.937 1.00 0.00 H new ATOM 0 HB3 ARG A 57 13.653 9.159 11.664 1.00 0.00 H new ATOM 0 HG2 ARG A 57 10.931 8.889 10.395 1.00 0.00 H new ATOM 0 HG3 ARG A 57 12.093 7.586 10.236 1.00 0.00 H new ATOM 0 HD2 ARG A 57 11.608 8.761 12.967 1.00 0.00 H new ATOM 0 HD3 ARG A 57 10.399 7.689 12.289 1.00 0.00 H new ATOM 0 HE ARG A 57 13.075 6.561 12.090 1.00 0.00 H new ATOM 0 HH11 ARG A 57 10.324 7.100 14.235 1.00 0.00 H new ATOM 0 HH12 ARG A 57 10.711 5.720 15.267 1.00 0.00 H new ATOM 0 HH21 ARG A 57 13.565 4.790 13.420 1.00 0.00 H new ATOM 0 HH22 ARG A 57 12.538 4.417 14.808 1.00 0.00 H new ATOM 913 N PRO A 58 14.046 11.910 12.697 1.00 0.00 N ATOM 914 CA PRO A 58 15.182 12.734 13.120 1.00 0.00 C ATOM 915 C PRO A 58 16.521 12.130 12.710 1.00 0.00 C ATOM 916 O PRO A 58 16.597 10.956 12.346 1.00 0.00 O ATOM 917 CB PRO A 58 15.052 12.760 14.645 1.00 0.00 C ATOM 918 CG PRO A 58 14.308 11.514 14.983 1.00 0.00 C ATOM 919 CD PRO A 58 13.368 11.269 13.836 1.00 0.00 C ATOM 0 HA PRO A 58 15.163 13.722 12.659 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.030 12.780 15.125 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.514 13.646 14.981 1.00 0.00 H new ATOM 0 HG2 PRO A 58 14.991 10.675 15.114 1.00 0.00 H new ATOM 0 HG3 PRO A 58 13.761 11.628 15.919 1.00 0.00 H new ATOM 0 HD2 PRO A 58 13.213 10.204 13.664 1.00 0.00 H new ATOM 0 HD3 PRO A 58 12.387 11.708 14.019 1.00 0.00 H new ATOM 927 N ILE A 59 17.573 12.938 12.773 1.00 0.00 N ATOM 928 CA ILE A 59 18.909 12.482 12.410 1.00 0.00 C ATOM 929 C ILE A 59 19.292 11.227 13.187 1.00 0.00 C ATOM 930 O ILE A 59 20.063 10.397 12.706 1.00 0.00 O ATOM 931 CB ILE A 59 19.966 13.573 12.667 1.00 0.00 C ATOM 932 CG1 ILE A 59 21.330 13.127 12.137 1.00 0.00 C ATOM 933 CG2 ILE A 59 20.047 13.892 14.152 1.00 0.00 C ATOM 934 CD1 ILE A 59 21.449 13.206 10.631 1.00 0.00 C ATOM 0 H ILE A 59 17.526 13.912 13.072 1.00 0.00 H new ATOM 0 HA ILE A 59 18.885 12.254 11.344 1.00 0.00 H new ATOM 0 HB ILE A 59 19.670 14.478 12.137 1.00 0.00 H new ATOM 0 HG12 ILE A 59 22.106 13.746 12.588 1.00 0.00 H new ATOM 0 HG13 ILE A 59 21.516 12.101 12.455 1.00 0.00 H new ATOM 0 HG21 ILE A 59 20.798 14.664 14.318 1.00 0.00 H new ATOM 0 HG22 ILE A 59 19.078 14.248 14.501 1.00 0.00 H new ATOM 0 HG23 ILE A 59 20.324 12.993 14.703 1.00 0.00 H new ATOM 0 HD11 ILE A 59 22.442 12.875 10.327 1.00 0.00 H new ATOM 0 HD12 ILE A 59 20.696 12.565 10.172 1.00 0.00 H new ATOM 0 HD13 ILE A 59 21.295 14.235 10.307 1.00 0.00 H new ATOM 946 N LYS A 60 18.745 11.093 14.390 1.00 0.00 N ATOM 947 CA LYS A 60 19.025 9.937 15.234 1.00 0.00 C ATOM 948 C LYS A 60 18.390 8.676 14.657 1.00 0.00 C ATOM 949 O LYS A 60 18.939 7.582 14.782 1.00 0.00 O ATOM 950 CB LYS A 60 18.506 10.179 16.653 1.00 0.00 C ATOM 951 CG LYS A 60 17.004 10.391 16.724 1.00 0.00 C ATOM 952 CD LYS A 60 16.572 10.862 18.103 1.00 0.00 C ATOM 953 CE LYS A 60 16.590 12.379 18.205 1.00 0.00 C ATOM 954 NZ LYS A 60 17.974 12.908 18.359 1.00 0.00 N ATOM 0 H LYS A 60 18.105 11.771 14.803 1.00 0.00 H new ATOM 0 HA LYS A 60 20.105 9.796 15.268 1.00 0.00 H new ATOM 0 HB2 LYS A 60 18.774 9.328 17.279 1.00 0.00 H new ATOM 0 HB3 LYS A 60 19.008 11.052 17.070 1.00 0.00 H new ATOM 0 HG2 LYS A 60 16.704 11.126 15.977 1.00 0.00 H new ATOM 0 HG3 LYS A 60 16.492 9.460 16.480 1.00 0.00 H new ATOM 0 HD2 LYS A 60 15.568 10.494 18.316 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.234 10.438 18.858 1.00 0.00 H new ATOM 0 HE2 LYS A 60 16.134 12.808 17.313 1.00 0.00 H new ATOM 0 HE3 LYS A 60 15.984 12.693 19.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 17.949 13.791 18.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 18.560 12.207 18.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 18.380 13.096 17.420 1.00 0.00 H new ATOM 968 N GLU A 61 17.231 8.837 14.025 1.00 0.00 N ATOM 969 CA GLU A 61 16.523 7.711 13.429 1.00 0.00 C ATOM 970 C GLU A 61 16.553 7.794 11.906 1.00 0.00 C ATOM 971 O GLU A 61 15.831 7.071 11.219 1.00 0.00 O ATOM 972 CB GLU A 61 15.075 7.672 13.921 1.00 0.00 C ATOM 973 CG GLU A 61 14.935 7.247 15.373 1.00 0.00 C ATOM 974 CD GLU A 61 15.886 6.126 15.746 1.00 0.00 C ATOM 975 OE1 GLU A 61 17.096 6.397 15.890 1.00 0.00 O ATOM 976 OE2 GLU A 61 15.418 4.978 15.895 1.00 0.00 O ATOM 0 H GLU A 61 16.763 9.736 13.913 1.00 0.00 H new ATOM 0 HA GLU A 61 17.027 6.795 13.735 1.00 0.00 H new ATOM 0 HB2 GLU A 61 14.631 8.660 13.796 1.00 0.00 H new ATOM 0 HB3 GLU A 61 14.506 6.986 13.294 1.00 0.00 H new ATOM 0 HG2 GLU A 61 15.120 8.106 16.019 1.00 0.00 H new ATOM 0 HG3 GLU A 61 13.910 6.925 15.556 1.00 0.00 H new ATOM 983 N VAL A 62 17.394 8.681 11.384 1.00 0.00 N ATOM 984 CA VAL A 62 17.519 8.859 9.942 1.00 0.00 C ATOM 985 C VAL A 62 18.344 7.738 9.320 1.00 0.00 C ATOM 986 O VAL A 62 17.878 6.998 8.453 1.00 0.00 O ATOM 987 CB VAL A 62 18.170 10.212 9.598 1.00 0.00 C ATOM 988 CG1 VAL A 62 18.972 10.107 8.310 1.00 0.00 C ATOM 989 CG2 VAL A 62 17.112 11.300 9.490 1.00 0.00 C ATOM 0 H VAL A 62 17.999 9.287 11.938 1.00 0.00 H new ATOM 0 HA VAL A 62 16.510 8.835 9.531 1.00 0.00 H new ATOM 0 HB VAL A 62 18.854 10.481 10.403 1.00 0.00 H new ATOM 0 HG11 VAL A 62 19.424 11.072 8.083 1.00 0.00 H new ATOM 0 HG12 VAL A 62 19.755 9.358 8.429 1.00 0.00 H new ATOM 0 HG13 VAL A 62 18.312 9.815 7.493 1.00 0.00 H new ATOM 0 HG21 VAL A 62 17.590 12.249 9.246 1.00 0.00 H new ATOM 0 HG22 VAL A 62 16.401 11.040 8.706 1.00 0.00 H new ATOM 0 HG23 VAL A 62 16.586 11.392 10.440 1.00 0.00 H new ATOM 999 N PRO A 63 19.600 7.607 9.771 1.00 0.00 N ATOM 1000 CA PRO A 63 20.517 6.577 9.272 1.00 0.00 C ATOM 1001 C PRO A 63 20.109 5.176 9.712 1.00 0.00 C ATOM 1002 O PRO A 63 19.950 4.277 8.886 1.00 0.00 O ATOM 1003 CB PRO A 63 21.859 6.965 9.898 1.00 0.00 C ATOM 1004 CG PRO A 63 21.499 7.727 11.126 1.00 0.00 C ATOM 1005 CD PRO A 63 20.223 8.454 10.803 1.00 0.00 C ATOM 0 HA PRO A 63 20.534 6.539 8.183 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.453 6.083 10.139 1.00 0.00 H new ATOM 0 HB3 PRO A 63 22.453 7.572 9.215 1.00 0.00 H new ATOM 0 HG2 PRO A 63 21.362 7.057 11.975 1.00 0.00 H new ATOM 0 HG3 PRO A 63 22.289 8.427 11.397 1.00 0.00 H new ATOM 0 HD2 PRO A 63 19.584 8.554 11.680 1.00 0.00 H new ATOM 0 HD3 PRO A 63 20.417 9.461 10.433 1.00 0.00 H new ATOM 1013 N SER A 64 19.940 4.996 11.019 1.00 0.00 N ATOM 1014 CA SER A 64 19.553 3.702 11.568 1.00 0.00 C ATOM 1015 C SER A 64 18.441 3.069 10.738 1.00 0.00 C ATOM 1016 O SER A 64 18.391 1.851 10.572 1.00 0.00 O ATOM 1017 CB SER A 64 19.097 3.857 13.020 1.00 0.00 C ATOM 1018 OG SER A 64 18.155 4.908 13.149 1.00 0.00 O ATOM 0 H SER A 64 20.065 5.730 11.716 1.00 0.00 H new ATOM 0 HA SER A 64 20.423 3.046 11.536 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.655 2.923 13.367 1.00 0.00 H new ATOM 0 HB3 SER A 64 19.959 4.057 13.656 1.00 0.00 H new ATOM 0 HG SER A 64 17.542 4.709 13.888 1.00 0.00 H new ATOM 1024 N ARG A 65 17.549 3.907 10.219 1.00 0.00 N ATOM 1025 CA ARG A 65 16.436 3.432 9.407 1.00 0.00 C ATOM 1026 C ARG A 65 16.904 3.070 8.000 1.00 0.00 C ATOM 1027 O ARG A 65 16.505 2.047 7.445 1.00 0.00 O ATOM 1028 CB ARG A 65 15.339 4.495 9.333 1.00 0.00 C ATOM 1029 CG ARG A 65 13.941 3.919 9.184 1.00 0.00 C ATOM 1030 CD ARG A 65 13.396 3.428 10.517 1.00 0.00 C ATOM 1031 NE ARG A 65 11.937 3.465 10.558 1.00 0.00 N ATOM 1032 CZ ARG A 65 11.213 2.859 11.493 1.00 0.00 C ATOM 1033 NH1 ARG A 65 11.810 2.174 12.458 1.00 0.00 N ATOM 1034 NH2 ARG A 65 9.888 2.938 11.463 1.00 0.00 N ATOM 0 H ARG A 65 17.576 4.919 10.347 1.00 0.00 H new ATOM 0 HA ARG A 65 16.033 2.536 9.879 1.00 0.00 H new ATOM 0 HB2 ARG A 65 15.376 5.107 10.234 1.00 0.00 H new ATOM 0 HB3 ARG A 65 15.542 5.156 8.490 1.00 0.00 H new ATOM 0 HG2 ARG A 65 13.275 4.679 8.775 1.00 0.00 H new ATOM 0 HG3 ARG A 65 13.960 3.094 8.471 1.00 0.00 H new ATOM 0 HD2 ARG A 65 13.738 2.408 10.695 1.00 0.00 H new ATOM 0 HD3 ARG A 65 13.797 4.044 11.322 1.00 0.00 H new ATOM 0 HE ARG A 65 11.447 3.984 9.829 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.828 2.111 12.484 1.00 0.00 H new ATOM 0 HH12 ARG A 65 11.252 1.710 13.174 1.00 0.00 H new ATOM 0 HH21 ARG A 65 9.425 3.464 10.722 1.00 0.00 H new ATOM 0 HH22 ARG A 65 9.333 2.473 12.181 1.00 0.00 H new ATOM 1048 N VAL A 66 17.754 3.918 7.429 1.00 0.00 N ATOM 1049 CA VAL A 66 18.278 3.689 6.088 1.00 0.00 C ATOM 1050 C VAL A 66 18.472 2.200 5.821 1.00 0.00 C ATOM 1051 O VAL A 66 17.847 1.634 4.924 1.00 0.00 O ATOM 1052 CB VAL A 66 19.619 4.416 5.877 1.00 0.00 C ATOM 1053 CG1 VAL A 66 20.299 3.925 4.607 1.00 0.00 C ATOM 1054 CG2 VAL A 66 19.407 5.921 5.830 1.00 0.00 C ATOM 0 H VAL A 66 18.094 4.770 7.875 1.00 0.00 H new ATOM 0 HA VAL A 66 17.543 4.088 5.389 1.00 0.00 H new ATOM 0 HB VAL A 66 20.271 4.190 6.720 1.00 0.00 H new ATOM 0 HG11 VAL A 66 21.245 4.450 4.475 1.00 0.00 H new ATOM 0 HG12 VAL A 66 20.486 2.854 4.685 1.00 0.00 H new ATOM 0 HG13 VAL A 66 19.653 4.119 3.750 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.365 6.419 5.680 1.00 0.00 H new ATOM 0 HG22 VAL A 66 18.737 6.169 5.007 1.00 0.00 H new ATOM 0 HG23 VAL A 66 18.967 6.256 6.769 1.00 0.00 H new ATOM 1064 N GLN A 67 19.341 1.572 6.606 1.00 0.00 N ATOM 1065 CA GLN A 67 19.617 0.149 6.453 1.00 0.00 C ATOM 1066 C GLN A 67 18.369 -0.681 6.733 1.00 0.00 C ATOM 1067 O GLN A 67 17.997 -1.545 5.940 1.00 0.00 O ATOM 1068 CB GLN A 67 20.748 -0.277 7.393 1.00 0.00 C ATOM 1069 CG GLN A 67 20.362 -0.243 8.863 1.00 0.00 C ATOM 1070 CD GLN A 67 21.563 -0.336 9.783 1.00 0.00 C ATOM 1071 OE1 GLN A 67 22.356 -1.274 9.695 1.00 0.00 O ATOM 1072 NE2 GLN A 67 21.704 0.639 10.673 1.00 0.00 N ATOM 0 H GLN A 67 19.866 2.026 7.354 1.00 0.00 H new ATOM 0 HA GLN A 67 19.924 -0.027 5.422 1.00 0.00 H new ATOM 0 HB2 GLN A 67 21.065 -1.287 7.132 1.00 0.00 H new ATOM 0 HB3 GLN A 67 21.606 0.377 7.236 1.00 0.00 H new ATOM 0 HG2 GLN A 67 19.820 0.679 9.071 1.00 0.00 H new ATOM 0 HG3 GLN A 67 19.681 -1.068 9.075 1.00 0.00 H new ATOM 0 HE21 GLN A 67 21.023 1.397 10.711 1.00 0.00 H new ATOM 0 HE22 GLN A 67 22.493 0.630 11.319 1.00 0.00 H new ATOM 1081 N GLU A 68 17.726 -0.412 7.865 1.00 0.00 N ATOM 1082 CA GLU A 68 16.520 -1.135 8.249 1.00 0.00 C ATOM 1083 C GLU A 68 15.621 -1.375 7.039 1.00 0.00 C ATOM 1084 O GLU A 68 15.445 -2.511 6.599 1.00 0.00 O ATOM 1085 CB GLU A 68 15.753 -0.360 9.322 1.00 0.00 C ATOM 1086 CG GLU A 68 16.298 -0.563 10.726 1.00 0.00 C ATOM 1087 CD GLU A 68 16.630 -2.014 11.019 1.00 0.00 C ATOM 1088 OE1 GLU A 68 15.746 -2.874 10.826 1.00 0.00 O ATOM 1089 OE2 GLU A 68 17.773 -2.288 11.440 1.00 0.00 O ATOM 0 H GLU A 68 18.020 0.301 8.532 1.00 0.00 H new ATOM 0 HA GLU A 68 16.821 -2.101 8.654 1.00 0.00 H new ATOM 0 HB2 GLU A 68 15.781 0.703 9.081 1.00 0.00 H new ATOM 0 HB3 GLU A 68 14.707 -0.664 9.300 1.00 0.00 H new ATOM 0 HG2 GLU A 68 17.194 0.044 10.855 1.00 0.00 H new ATOM 0 HG3 GLU A 68 15.565 -0.208 11.451 1.00 0.00 H new ATOM 1096 N ILE A 69 15.055 -0.296 6.508 1.00 0.00 N ATOM 1097 CA ILE A 69 14.175 -0.389 5.350 1.00 0.00 C ATOM 1098 C ILE A 69 14.757 -1.318 4.290 1.00 0.00 C ATOM 1099 O ILE A 69 14.062 -2.187 3.764 1.00 0.00 O ATOM 1100 CB ILE A 69 13.924 0.995 4.722 1.00 0.00 C ATOM 1101 CG1 ILE A 69 13.246 1.922 5.732 1.00 0.00 C ATOM 1102 CG2 ILE A 69 13.076 0.861 3.466 1.00 0.00 C ATOM 1103 CD1 ILE A 69 13.535 3.388 5.496 1.00 0.00 C ATOM 0 H ILE A 69 15.190 0.651 6.861 1.00 0.00 H new ATOM 0 HA ILE A 69 13.228 -0.796 5.705 1.00 0.00 H new ATOM 0 HB ILE A 69 14.884 1.431 4.444 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.169 1.762 5.694 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.573 1.653 6.736 1.00 0.00 H new ATOM 0 HG21 ILE A 69 12.907 1.847 3.034 1.00 0.00 H new ATOM 0 HG22 ILE A 69 13.594 0.232 2.742 1.00 0.00 H new ATOM 0 HG23 ILE A 69 12.118 0.408 3.720 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.022 3.986 6.249 1.00 0.00 H new ATOM 0 HD12 ILE A 69 14.609 3.563 5.564 1.00 0.00 H new ATOM 0 HD13 ILE A 69 13.183 3.673 4.505 1.00 0.00 H new ATOM 1115 N TRP A 70 16.035 -1.128 3.983 1.00 0.00 N ATOM 1116 CA TRP A 70 16.712 -1.951 2.987 1.00 0.00 C ATOM 1117 C TRP A 70 16.895 -3.378 3.493 1.00 0.00 C ATOM 1118 O TRP A 70 17.024 -4.313 2.703 1.00 0.00 O ATOM 1119 CB TRP A 70 18.070 -1.344 2.631 1.00 0.00 C ATOM 1120 CG TRP A 70 19.139 -2.370 2.409 1.00 0.00 C ATOM 1121 CD1 TRP A 70 19.819 -3.067 3.367 1.00 0.00 C ATOM 1122 CD2 TRP A 70 19.652 -2.814 1.148 1.00 0.00 C ATOM 1123 NE1 TRP A 70 20.724 -3.916 2.777 1.00 0.00 N ATOM 1124 CE2 TRP A 70 20.640 -3.781 1.416 1.00 0.00 C ATOM 1125 CE3 TRP A 70 19.371 -2.489 -0.182 1.00 0.00 C ATOM 1126 CZ2 TRP A 70 21.348 -4.423 0.404 1.00 0.00 C ATOM 1127 CZ3 TRP A 70 20.074 -3.128 -1.186 1.00 0.00 C ATOM 1128 CH2 TRP A 70 21.052 -4.086 -0.889 1.00 0.00 C ATOM 0 H TRP A 70 16.623 -0.412 4.409 1.00 0.00 H new ATOM 0 HA TRP A 70 16.090 -1.980 2.092 1.00 0.00 H new ATOM 0 HB2 TRP A 70 17.965 -0.739 1.731 1.00 0.00 H new ATOM 0 HB3 TRP A 70 18.381 -0.673 3.432 1.00 0.00 H new ATOM 0 HD1 TRP A 70 19.668 -2.966 4.432 1.00 0.00 H new ATOM 0 HE1 TRP A 70 21.356 -4.545 3.272 1.00 0.00 H new ATOM 0 HE3 TRP A 70 18.618 -1.752 -0.421 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 22.104 -5.160 0.631 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 19.866 -2.884 -2.217 1.00 0.00 H new ATOM 0 HH2 TRP A 70 21.583 -4.568 -1.696 1.00 0.00 H new ATOM 1139 N GLN A 71 16.906 -3.536 4.812 1.00 0.00 N ATOM 1140 CA GLN A 71 17.075 -4.850 5.422 1.00 0.00 C ATOM 1141 C GLN A 71 15.752 -5.609 5.454 1.00 0.00 C ATOM 1142 O GLN A 71 15.714 -6.793 5.786 1.00 0.00 O ATOM 1143 CB GLN A 71 17.631 -4.710 6.840 1.00 0.00 C ATOM 1144 CG GLN A 71 19.104 -4.340 6.881 1.00 0.00 C ATOM 1145 CD GLN A 71 19.815 -4.908 8.094 1.00 0.00 C ATOM 1146 OE1 GLN A 71 19.485 -4.577 9.233 1.00 0.00 O ATOM 1147 NE2 GLN A 71 20.797 -5.770 7.855 1.00 0.00 N ATOM 0 H GLN A 71 16.800 -2.771 5.479 1.00 0.00 H new ATOM 0 HA GLN A 71 17.783 -5.416 4.816 1.00 0.00 H new ATOM 0 HB2 GLN A 71 17.059 -3.950 7.372 1.00 0.00 H new ATOM 0 HB3 GLN A 71 17.486 -5.650 7.373 1.00 0.00 H new ATOM 0 HG2 GLN A 71 19.591 -4.703 5.976 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.202 -3.254 6.882 1.00 0.00 H new ATOM 0 HE21 GLN A 71 21.037 -6.016 6.895 1.00 0.00 H new ATOM 0 HE22 GLN A 71 21.311 -6.186 8.632 1.00 0.00 H new ATOM 1156 N GLU A 72 14.670 -4.918 5.107 1.00 0.00 N ATOM 1157 CA GLU A 72 13.346 -5.528 5.098 1.00 0.00 C ATOM 1158 C GLU A 72 12.873 -5.780 3.669 1.00 0.00 C ATOM 1159 O GLU A 72 12.453 -6.886 3.329 1.00 0.00 O ATOM 1160 CB GLU A 72 12.343 -4.633 5.828 1.00 0.00 C ATOM 1161 CG GLU A 72 10.898 -5.067 5.651 1.00 0.00 C ATOM 1162 CD GLU A 72 9.996 -4.558 6.759 1.00 0.00 C ATOM 1163 OE1 GLU A 72 10.341 -3.534 7.383 1.00 0.00 O ATOM 1164 OE2 GLU A 72 8.943 -5.185 7.001 1.00 0.00 O ATOM 0 H GLU A 72 14.685 -3.937 4.829 1.00 0.00 H new ATOM 0 HA GLU A 72 13.412 -6.485 5.615 1.00 0.00 H new ATOM 0 HB2 GLU A 72 12.583 -4.625 6.891 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.453 -3.610 5.468 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.529 -4.705 4.692 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.851 -6.156 5.620 1.00 0.00 H new ATOM 1171 N PHE A 73 12.944 -4.747 2.838 1.00 0.00 N ATOM 1172 CA PHE A 73 12.522 -4.855 1.446 1.00 0.00 C ATOM 1173 C PHE A 73 13.720 -5.088 0.531 1.00 0.00 C ATOM 1174 O PHE A 73 13.848 -6.147 -0.086 1.00 0.00 O ATOM 1175 CB PHE A 73 11.777 -3.588 1.017 1.00 0.00 C ATOM 1176 CG PHE A 73 10.829 -3.068 2.059 1.00 0.00 C ATOM 1177 CD1 PHE A 73 9.585 -3.651 2.236 1.00 0.00 C ATOM 1178 CD2 PHE A 73 11.183 -1.996 2.863 1.00 0.00 C ATOM 1179 CE1 PHE A 73 8.710 -3.175 3.195 1.00 0.00 C ATOM 1180 CE2 PHE A 73 10.312 -1.516 3.823 1.00 0.00 C ATOM 1181 CZ PHE A 73 9.074 -2.105 3.989 1.00 0.00 C ATOM 0 H PHE A 73 13.290 -3.825 3.104 1.00 0.00 H new ATOM 0 HA PHE A 73 11.851 -5.710 1.361 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.504 -2.812 0.779 1.00 0.00 H new ATOM 0 HB3 PHE A 73 11.221 -3.795 0.103 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.295 -4.487 1.617 1.00 0.00 H new ATOM 0 HD2 PHE A 73 12.150 -1.531 2.738 1.00 0.00 H new ATOM 0 HE1 PHE A 73 7.743 -3.639 3.323 1.00 0.00 H new ATOM 0 HE2 PHE A 73 10.600 -0.680 4.443 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.392 -1.730 4.738 1.00 0.00 H new ATOM 1191 N LEU A 74 14.595 -4.092 0.446 1.00 0.00 N ATOM 1192 CA LEU A 74 15.784 -4.188 -0.394 1.00 0.00 C ATOM 1193 C LEU A 74 16.758 -5.225 0.156 1.00 0.00 C ATOM 1194 O LEU A 74 17.936 -5.233 -0.197 1.00 0.00 O ATOM 1195 CB LEU A 74 16.474 -2.826 -0.492 1.00 0.00 C ATOM 1196 CG LEU A 74 15.565 -1.634 -0.794 1.00 0.00 C ATOM 1197 CD1 LEU A 74 16.366 -0.341 -0.805 1.00 0.00 C ATOM 1198 CD2 LEU A 74 14.850 -1.831 -2.123 1.00 0.00 C ATOM 0 H LEU A 74 14.504 -3.209 0.948 1.00 0.00 H new ATOM 0 HA LEU A 74 15.471 -4.503 -1.389 1.00 0.00 H new ATOM 0 HB2 LEU A 74 16.991 -2.634 0.448 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.236 -2.882 -1.269 1.00 0.00 H new ATOM 0 HG LEU A 74 14.814 -1.566 -0.007 1.00 0.00 H new ATOM 0 HD11 LEU A 74 15.702 0.496 -1.022 1.00 0.00 H new ATOM 0 HD12 LEU A 74 16.831 -0.193 0.170 1.00 0.00 H new ATOM 0 HD13 LEU A 74 17.139 -0.399 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.208 -0.973 -2.321 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.586 -1.926 -2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 74 14.244 -2.736 -2.079 1.00 0.00 H new ATOM 1210 N ALA A 75 16.256 -6.100 1.021 1.00 0.00 N ATOM 1211 CA ALA A 75 17.080 -7.145 1.616 1.00 0.00 C ATOM 1212 C ALA A 75 16.612 -8.529 1.180 1.00 0.00 C ATOM 1213 O ALA A 75 15.416 -8.796 1.055 1.00 0.00 O ATOM 1214 CB ALA A 75 17.060 -7.033 3.133 1.00 0.00 C ATOM 0 H ALA A 75 15.283 -6.106 1.325 1.00 0.00 H new ATOM 0 HA ALA A 75 18.103 -7.009 1.266 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.679 -7.820 3.564 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.450 -6.060 3.431 1.00 0.00 H new ATOM 0 HB3 ALA A 75 16.036 -7.139 3.492 1.00 0.00 H new ATOM 1220 N PRO A 76 17.575 -9.432 0.940 1.00 0.00 N ATOM 1221 CA PRO A 76 17.284 -10.804 0.514 1.00 0.00 C ATOM 1222 C PRO A 76 16.646 -11.633 1.623 1.00 0.00 C ATOM 1223 O PRO A 76 16.758 -11.302 2.802 1.00 0.00 O ATOM 1224 CB PRO A 76 18.664 -11.363 0.155 1.00 0.00 C ATOM 1225 CG PRO A 76 19.621 -10.557 0.964 1.00 0.00 C ATOM 1226 CD PRO A 76 19.020 -9.183 1.069 1.00 0.00 C ATOM 0 HA PRO A 76 16.569 -10.833 -0.308 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.737 -12.423 0.396 1.00 0.00 H new ATOM 0 HB3 PRO A 76 18.866 -11.264 -0.912 1.00 0.00 H new ATOM 0 HG2 PRO A 76 19.764 -10.997 1.951 1.00 0.00 H new ATOM 0 HG3 PRO A 76 20.600 -10.519 0.487 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.263 -8.710 2.020 1.00 0.00 H new ATOM 0 HD3 PRO A 76 19.386 -8.523 0.282 1.00 0.00 H new ATOM 1234 N GLY A 77 15.976 -12.715 1.236 1.00 0.00 N ATOM 1235 CA GLY A 77 15.330 -13.575 2.210 1.00 0.00 C ATOM 1236 C GLY A 77 14.447 -12.802 3.171 1.00 0.00 C ATOM 1237 O GLY A 77 14.049 -13.322 4.212 1.00 0.00 O ATOM 0 H GLY A 77 15.869 -13.011 0.266 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.729 -14.321 1.690 1.00 0.00 H new ATOM 0 HA3 GLY A 77 16.090 -14.115 2.774 1.00 0.00 H new ATOM 1241 N ALA A 78 14.142 -11.557 2.820 1.00 0.00 N ATOM 1242 CA ALA A 78 13.301 -10.712 3.659 1.00 0.00 C ATOM 1243 C ALA A 78 11.824 -11.017 3.439 1.00 0.00 C ATOM 1244 O ALA A 78 11.424 -11.564 2.411 1.00 0.00 O ATOM 1245 CB ALA A 78 13.585 -9.243 3.381 1.00 0.00 C ATOM 0 H ALA A 78 14.464 -11.111 1.961 1.00 0.00 H new ATOM 0 HA ALA A 78 13.538 -10.926 4.701 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.950 -8.623 4.014 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.632 -9.028 3.595 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.377 -9.024 2.334 1.00 0.00 H new ATOM 1251 N PRO A 79 10.991 -10.658 4.427 1.00 0.00 N ATOM 1252 CA PRO A 79 9.544 -10.884 4.365 1.00 0.00 C ATOM 1253 C PRO A 79 8.862 -9.993 3.333 1.00 0.00 C ATOM 1254 O PRO A 79 8.053 -10.461 2.532 1.00 0.00 O ATOM 1255 CB PRO A 79 9.068 -10.529 5.776 1.00 0.00 C ATOM 1256 CG PRO A 79 10.091 -9.577 6.292 1.00 0.00 C ATOM 1257 CD PRO A 79 11.398 -10.002 5.681 1.00 0.00 C ATOM 0 HA PRO A 79 9.304 -11.904 4.063 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.078 -10.074 5.757 1.00 0.00 H new ATOM 0 HB3 PRO A 79 8.999 -11.416 6.406 1.00 0.00 H new ATOM 0 HG2 PRO A 79 9.845 -8.552 6.014 1.00 0.00 H new ATOM 0 HG3 PRO A 79 10.140 -9.609 7.380 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.051 -9.149 5.495 1.00 0.00 H new ATOM 0 HD3 PRO A 79 11.943 -10.684 6.333 1.00 0.00 H new ATOM 1265 N SER A 80 9.193 -8.706 3.357 1.00 0.00 N ATOM 1266 CA SER A 80 8.610 -7.748 2.425 1.00 0.00 C ATOM 1267 C SER A 80 9.569 -7.454 1.276 1.00 0.00 C ATOM 1268 O SER A 80 9.425 -6.454 0.573 1.00 0.00 O ATOM 1269 CB SER A 80 8.253 -6.450 3.152 1.00 0.00 C ATOM 1270 OG SER A 80 7.569 -6.715 4.364 1.00 0.00 O ATOM 0 H SER A 80 9.862 -8.302 4.012 1.00 0.00 H new ATOM 0 HA SER A 80 7.701 -8.187 2.013 1.00 0.00 H new ATOM 0 HB2 SER A 80 9.161 -5.884 3.360 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.631 -5.828 2.508 1.00 0.00 H new ATOM 0 HG SER A 80 8.023 -6.258 5.103 1.00 0.00 H new ATOM 1276 N ALA A 81 10.549 -8.333 1.092 1.00 0.00 N ATOM 1277 CA ALA A 81 11.532 -8.170 0.028 1.00 0.00 C ATOM 1278 C ALA A 81 10.853 -7.876 -1.305 1.00 0.00 C ATOM 1279 O ALA A 81 10.090 -8.695 -1.818 1.00 0.00 O ATOM 1280 CB ALA A 81 12.401 -9.414 -0.083 1.00 0.00 C ATOM 0 H ALA A 81 10.683 -9.165 1.666 1.00 0.00 H new ATOM 0 HA ALA A 81 12.166 -7.319 0.279 1.00 0.00 H new ATOM 0 HB1 ALA A 81 13.130 -9.278 -0.881 1.00 0.00 H new ATOM 0 HB2 ALA A 81 12.922 -9.579 0.860 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.774 -10.277 -0.307 1.00 0.00 H new ATOM 1286 N ILE A 82 11.135 -6.702 -1.861 1.00 0.00 N ATOM 1287 CA ILE A 82 10.552 -6.301 -3.135 1.00 0.00 C ATOM 1288 C ILE A 82 11.560 -6.444 -4.270 1.00 0.00 C ATOM 1289 O ILE A 82 12.702 -6.846 -4.053 1.00 0.00 O ATOM 1290 CB ILE A 82 10.049 -4.846 -3.090 1.00 0.00 C ATOM 1291 CG1 ILE A 82 11.224 -3.883 -2.904 1.00 0.00 C ATOM 1292 CG2 ILE A 82 9.031 -4.671 -1.974 1.00 0.00 C ATOM 1293 CD1 ILE A 82 10.929 -2.473 -3.366 1.00 0.00 C ATOM 0 H ILE A 82 11.764 -6.012 -1.449 1.00 0.00 H new ATOM 0 HA ILE A 82 9.706 -6.964 -3.318 1.00 0.00 H new ATOM 0 HB ILE A 82 9.562 -4.616 -4.038 1.00 0.00 H new ATOM 0 HG12 ILE A 82 11.502 -3.861 -1.850 1.00 0.00 H new ATOM 0 HG13 ILE A 82 12.086 -4.264 -3.453 1.00 0.00 H new ATOM 0 HG21 ILE A 82 8.685 -3.637 -1.956 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.183 -5.334 -2.147 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.494 -4.916 -1.018 1.00 0.00 H new ATOM 0 HD11 ILE A 82 11.806 -1.846 -3.204 1.00 0.00 H new ATOM 0 HD12 ILE A 82 10.681 -2.482 -4.427 1.00 0.00 H new ATOM 0 HD13 ILE A 82 10.088 -2.073 -2.800 1.00 0.00 H new ATOM 1305 N ASN A 83 11.129 -6.111 -5.483 1.00 0.00 N ATOM 1306 CA ASN A 83 11.994 -6.201 -6.653 1.00 0.00 C ATOM 1307 C ASN A 83 12.059 -4.865 -7.386 1.00 0.00 C ATOM 1308 O ASN A 83 11.036 -4.213 -7.602 1.00 0.00 O ATOM 1309 CB ASN A 83 11.492 -7.292 -7.601 1.00 0.00 C ATOM 1310 CG ASN A 83 12.339 -7.404 -8.854 1.00 0.00 C ATOM 1311 OD1 ASN A 83 12.141 -6.480 -9.787 1.00 0.00 O flip ATOM 1312 ND2 ASN A 83 13.162 -8.311 -8.981 1.00 0.00 N flip ATOM 0 H ASN A 83 10.186 -5.776 -5.681 1.00 0.00 H new ATOM 0 HA ASN A 83 12.997 -6.457 -6.313 1.00 0.00 H new ATOM 0 HB2 ASN A 83 11.490 -8.249 -7.080 1.00 0.00 H new ATOM 0 HB3 ASN A 83 10.460 -7.080 -7.881 1.00 0.00 H new ATOM 0 HD21 ASN A 83 13.281 -9.000 -8.238 1.00 0.00 H new ATOM 0 HD22 ASN A 83 13.725 -8.374 -9.829 1.00 0.00 H new ATOM 1319 N LEU A 84 13.266 -4.463 -7.767 1.00 0.00 N ATOM 1320 CA LEU A 84 13.465 -3.204 -8.477 1.00 0.00 C ATOM 1321 C LEU A 84 14.151 -3.438 -9.819 1.00 0.00 C ATOM 1322 O LEU A 84 14.528 -4.564 -10.146 1.00 0.00 O ATOM 1323 CB LEU A 84 14.297 -2.243 -7.627 1.00 0.00 C ATOM 1324 CG LEU A 84 13.611 -1.684 -6.380 1.00 0.00 C ATOM 1325 CD1 LEU A 84 14.611 -0.936 -5.510 1.00 0.00 C ATOM 1326 CD2 LEU A 84 12.456 -0.774 -6.769 1.00 0.00 C ATOM 0 H LEU A 84 14.122 -4.990 -7.596 1.00 0.00 H new ATOM 0 HA LEU A 84 12.486 -2.761 -8.663 1.00 0.00 H new ATOM 0 HB2 LEU A 84 15.206 -2.758 -7.317 1.00 0.00 H new ATOM 0 HB3 LEU A 84 14.603 -1.406 -8.255 1.00 0.00 H new ATOM 0 HG LEU A 84 13.212 -2.519 -5.804 1.00 0.00 H new ATOM 0 HD11 LEU A 84 14.105 -0.545 -4.627 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.405 -1.616 -5.202 1.00 0.00 H new ATOM 0 HD13 LEU A 84 15.040 -0.110 -6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 84 11.980 -0.386 -5.869 1.00 0.00 H new ATOM 0 HD22 LEU A 84 12.832 0.056 -7.367 1.00 0.00 H new ATOM 0 HD23 LEU A 84 11.727 -1.339 -7.350 1.00 0.00 H new ATOM 1338 N ASP A 85 14.312 -2.369 -10.590 1.00 0.00 N ATOM 1339 CA ASP A 85 14.956 -2.457 -11.895 1.00 0.00 C ATOM 1340 C ASP A 85 16.459 -2.672 -11.746 1.00 0.00 C ATOM 1341 O ASP A 85 17.021 -2.474 -10.669 1.00 0.00 O ATOM 1342 CB ASP A 85 14.688 -1.188 -12.707 1.00 0.00 C ATOM 1343 CG ASP A 85 14.722 -1.439 -14.201 1.00 0.00 C ATOM 1344 OD1 ASP A 85 14.315 -2.540 -14.628 1.00 0.00 O ATOM 1345 OD2 ASP A 85 15.156 -0.534 -14.944 1.00 0.00 O ATOM 0 H ASP A 85 14.005 -1.431 -10.334 1.00 0.00 H new ATOM 0 HA ASP A 85 14.535 -3.313 -12.423 1.00 0.00 H new ATOM 0 HB2 ASP A 85 13.714 -0.783 -12.432 1.00 0.00 H new ATOM 0 HB3 ASP A 85 15.431 -0.433 -12.451 1.00 0.00 H new ATOM 1350 N SER A 86 17.103 -3.081 -12.834 1.00 0.00 N ATOM 1351 CA SER A 86 18.540 -3.329 -12.824 1.00 0.00 C ATOM 1352 C SER A 86 19.310 -2.049 -12.513 1.00 0.00 C ATOM 1353 O SER A 86 20.298 -2.067 -11.779 1.00 0.00 O ATOM 1354 CB SER A 86 18.992 -3.894 -14.172 1.00 0.00 C ATOM 1355 OG SER A 86 18.732 -5.285 -14.254 1.00 0.00 O ATOM 0 H SER A 86 16.653 -3.248 -13.734 1.00 0.00 H new ATOM 0 HA SER A 86 18.752 -4.059 -12.043 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.474 -3.376 -14.979 1.00 0.00 H new ATOM 0 HB3 SER A 86 20.058 -3.711 -14.308 1.00 0.00 H new ATOM 0 HG SER A 86 19.028 -5.622 -15.125 1.00 0.00 H new ATOM 1361 N LYS A 87 18.849 -0.937 -13.076 1.00 0.00 N ATOM 1362 CA LYS A 87 19.491 0.354 -12.860 1.00 0.00 C ATOM 1363 C LYS A 87 19.137 0.914 -11.486 1.00 0.00 C ATOM 1364 O LYS A 87 20.007 1.384 -10.754 1.00 0.00 O ATOM 1365 CB LYS A 87 19.073 1.344 -13.950 1.00 0.00 C ATOM 1366 CG LYS A 87 17.578 1.609 -13.989 1.00 0.00 C ATOM 1367 CD LYS A 87 17.227 2.674 -15.015 1.00 0.00 C ATOM 1368 CE LYS A 87 17.157 2.094 -16.419 1.00 0.00 C ATOM 1369 NZ LYS A 87 18.504 1.996 -17.046 1.00 0.00 N ATOM 0 H LYS A 87 18.032 -0.904 -13.686 1.00 0.00 H new ATOM 0 HA LYS A 87 20.570 0.207 -12.906 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.597 2.287 -13.793 1.00 0.00 H new ATOM 0 HB3 LYS A 87 19.391 0.960 -14.919 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.050 0.686 -14.227 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.238 1.926 -13.003 1.00 0.00 H new ATOM 0 HD2 LYS A 87 16.269 3.126 -14.759 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.972 3.469 -14.985 1.00 0.00 H new ATOM 0 HE2 LYS A 87 16.701 1.105 -16.381 1.00 0.00 H new ATOM 0 HE3 LYS A 87 16.513 2.718 -17.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 18.450 2.313 -18.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 19.174 2.597 -16.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 18.830 1.009 -17.016 1.00 0.00 H new ATOM 1383 N SER A 88 17.854 0.860 -11.143 1.00 0.00 N ATOM 1384 CA SER A 88 17.384 1.364 -9.858 1.00 0.00 C ATOM 1385 C SER A 88 18.035 0.605 -8.706 1.00 0.00 C ATOM 1386 O SER A 88 18.702 1.196 -7.856 1.00 0.00 O ATOM 1387 CB SER A 88 15.862 1.247 -9.765 1.00 0.00 C ATOM 1388 OG SER A 88 15.232 1.918 -10.843 1.00 0.00 O ATOM 0 H SER A 88 17.121 0.472 -11.737 1.00 0.00 H new ATOM 0 HA SER A 88 17.665 2.414 -9.783 1.00 0.00 H new ATOM 0 HB2 SER A 88 15.574 0.196 -9.769 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.519 1.668 -8.820 1.00 0.00 H new ATOM 0 HG SER A 88 15.293 2.886 -10.706 1.00 0.00 H new ATOM 1394 N TYR A 89 17.836 -0.708 -8.684 1.00 0.00 N ATOM 1395 CA TYR A 89 18.401 -1.549 -7.635 1.00 0.00 C ATOM 1396 C TYR A 89 19.899 -1.301 -7.485 1.00 0.00 C ATOM 1397 O TYR A 89 20.378 -0.961 -6.404 1.00 0.00 O ATOM 1398 CB TYR A 89 18.146 -3.025 -7.944 1.00 0.00 C ATOM 1399 CG TYR A 89 18.311 -3.932 -6.745 1.00 0.00 C ATOM 1400 CD1 TYR A 89 17.332 -4.002 -5.762 1.00 0.00 C ATOM 1401 CD2 TYR A 89 19.447 -4.718 -6.595 1.00 0.00 C ATOM 1402 CE1 TYR A 89 17.479 -4.828 -4.665 1.00 0.00 C ATOM 1403 CE2 TYR A 89 19.602 -5.548 -5.502 1.00 0.00 C ATOM 1404 CZ TYR A 89 18.615 -5.600 -4.539 1.00 0.00 C ATOM 1405 OH TYR A 89 18.766 -6.424 -3.448 1.00 0.00 O ATOM 0 H TYR A 89 17.288 -1.213 -9.380 1.00 0.00 H new ATOM 0 HA TYR A 89 17.913 -1.291 -6.695 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.135 -3.136 -8.337 1.00 0.00 H new ATOM 0 HB3 TYR A 89 18.830 -3.347 -8.729 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.440 -3.400 -5.857 1.00 0.00 H new ATOM 0 HD2 TYR A 89 20.222 -4.679 -7.346 1.00 0.00 H new ATOM 0 HE1 TYR A 89 16.708 -4.869 -3.910 1.00 0.00 H new ATOM 0 HE2 TYR A 89 20.491 -6.153 -5.402 1.00 0.00 H new ATOM 0 HH TYR A 89 19.621 -6.899 -3.513 1.00 0.00 H new ATOM 1415 N ASP A 90 20.632 -1.473 -8.580 1.00 0.00 N ATOM 1416 CA ASP A 90 22.076 -1.267 -8.572 1.00 0.00 C ATOM 1417 C ASP A 90 22.427 0.099 -7.990 1.00 0.00 C ATOM 1418 O ASP A 90 23.223 0.202 -7.056 1.00 0.00 O ATOM 1419 CB ASP A 90 22.637 -1.390 -9.990 1.00 0.00 C ATOM 1420 CG ASP A 90 22.988 -2.820 -10.351 1.00 0.00 C ATOM 1421 OD1 ASP A 90 23.195 -3.632 -9.425 1.00 0.00 O ATOM 1422 OD2 ASP A 90 23.056 -3.126 -11.560 1.00 0.00 O ATOM 0 H ASP A 90 20.251 -1.754 -9.483 1.00 0.00 H new ATOM 0 HA ASP A 90 22.525 -2.036 -7.943 1.00 0.00 H new ATOM 0 HB2 ASP A 90 21.905 -1.008 -10.702 1.00 0.00 H new ATOM 0 HB3 ASP A 90 23.526 -0.766 -10.081 1.00 0.00 H new ATOM 1427 N LYS A 91 21.828 1.146 -8.548 1.00 0.00 N ATOM 1428 CA LYS A 91 22.076 2.506 -8.085 1.00 0.00 C ATOM 1429 C LYS A 91 21.772 2.638 -6.596 1.00 0.00 C ATOM 1430 O LYS A 91 22.500 3.303 -5.859 1.00 0.00 O ATOM 1431 CB LYS A 91 21.226 3.500 -8.880 1.00 0.00 C ATOM 1432 CG LYS A 91 21.464 4.949 -8.493 1.00 0.00 C ATOM 1433 CD LYS A 91 22.726 5.499 -9.136 1.00 0.00 C ATOM 1434 CE LYS A 91 22.955 6.955 -8.759 1.00 0.00 C ATOM 1435 NZ LYS A 91 24.179 7.508 -9.402 1.00 0.00 N ATOM 0 H LYS A 91 21.167 1.078 -9.322 1.00 0.00 H new ATOM 0 HA LYS A 91 23.131 2.731 -8.244 1.00 0.00 H new ATOM 0 HB2 LYS A 91 21.437 3.377 -9.942 1.00 0.00 H new ATOM 0 HB3 LYS A 91 20.172 3.262 -8.734 1.00 0.00 H new ATOM 0 HG2 LYS A 91 20.608 5.552 -8.795 1.00 0.00 H new ATOM 0 HG3 LYS A 91 21.543 5.029 -7.409 1.00 0.00 H new ATOM 0 HD2 LYS A 91 23.584 4.902 -8.825 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.652 5.410 -10.220 1.00 0.00 H new ATOM 0 HE2 LYS A 91 22.090 7.547 -9.056 1.00 0.00 H new ATOM 0 HE3 LYS A 91 23.044 7.040 -7.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 24.300 8.502 -9.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 25.009 6.959 -9.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 24.084 7.450 -10.436 1.00 0.00 H new ATOM 1449 N THR A 92 20.691 1.999 -6.158 1.00 0.00 N ATOM 1450 CA THR A 92 20.291 2.045 -4.758 1.00 0.00 C ATOM 1451 C THR A 92 21.314 1.346 -3.870 1.00 0.00 C ATOM 1452 O THR A 92 21.949 1.975 -3.022 1.00 0.00 O ATOM 1453 CB THR A 92 18.913 1.390 -4.546 1.00 0.00 C ATOM 1454 OG1 THR A 92 17.915 2.094 -5.294 1.00 0.00 O ATOM 1455 CG2 THR A 92 18.537 1.385 -3.071 1.00 0.00 C ATOM 0 H THR A 92 20.077 1.443 -6.754 1.00 0.00 H new ATOM 0 HA THR A 92 20.232 3.098 -4.481 1.00 0.00 H new ATOM 0 HB THR A 92 18.969 0.359 -4.895 1.00 0.00 H new ATOM 0 HG1 THR A 92 18.027 1.904 -6.249 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.560 0.918 -2.946 1.00 0.00 H new ATOM 0 HG22 THR A 92 19.282 0.824 -2.507 1.00 0.00 H new ATOM 0 HG23 THR A 92 18.499 2.410 -2.702 1.00 0.00 H new ATOM 1463 N THR A 93 21.472 0.042 -4.071 1.00 0.00 N ATOM 1464 CA THR A 93 22.419 -0.743 -3.288 1.00 0.00 C ATOM 1465 C THR A 93 23.661 0.073 -2.949 1.00 0.00 C ATOM 1466 O THR A 93 24.137 0.055 -1.813 1.00 0.00 O ATOM 1467 CB THR A 93 22.846 -2.019 -4.037 1.00 0.00 C ATOM 1468 OG1 THR A 93 21.691 -2.716 -4.515 1.00 0.00 O ATOM 1469 CG2 THR A 93 23.658 -2.932 -3.132 1.00 0.00 C ATOM 0 H THR A 93 20.956 -0.493 -4.769 1.00 0.00 H new ATOM 0 HA THR A 93 21.910 -1.025 -2.366 1.00 0.00 H new ATOM 0 HB THR A 93 23.468 -1.726 -4.883 1.00 0.00 H new ATOM 0 HG1 THR A 93 21.304 -2.227 -5.271 1.00 0.00 H new ATOM 0 HG21 THR A 93 23.948 -3.826 -3.683 1.00 0.00 H new ATOM 0 HG22 THR A 93 24.552 -2.408 -2.794 1.00 0.00 H new ATOM 0 HG23 THR A 93 23.057 -3.217 -2.269 1.00 0.00 H new ATOM 1477 N HIS A 94 24.182 0.790 -3.940 1.00 0.00 N ATOM 1478 CA HIS A 94 25.369 1.615 -3.745 1.00 0.00 C ATOM 1479 C HIS A 94 25.043 2.846 -2.905 1.00 0.00 C ATOM 1480 O HIS A 94 25.785 3.198 -1.989 1.00 0.00 O ATOM 1481 CB HIS A 94 25.946 2.042 -5.095 1.00 0.00 C ATOM 1482 CG HIS A 94 27.174 2.892 -4.980 1.00 0.00 C ATOM 1483 ND1 HIS A 94 28.203 2.613 -4.106 1.00 0.00 N ATOM 1484 CD2 HIS A 94 27.534 4.020 -5.635 1.00 0.00 C ATOM 1485 CE1 HIS A 94 29.143 3.533 -4.228 1.00 0.00 C ATOM 1486 NE2 HIS A 94 28.762 4.398 -5.150 1.00 0.00 N ATOM 0 H HIS A 94 23.801 0.816 -4.886 1.00 0.00 H new ATOM 0 HA HIS A 94 26.111 1.020 -3.213 1.00 0.00 H new ATOM 0 HB2 HIS A 94 26.184 1.152 -5.677 1.00 0.00 H new ATOM 0 HB3 HIS A 94 25.185 2.591 -5.649 1.00 0.00 H new ATOM 0 HD2 HIS A 94 26.962 4.528 -6.397 1.00 0.00 H new ATOM 0 HE1 HIS A 94 30.066 3.571 -3.669 1.00 0.00 H new ATOM 0 HE2 HIS A 94 29.293 5.214 -5.453 1.00 0.00 H new ATOM 1494 N ASN A 95 23.929 3.497 -3.225 1.00 0.00 N ATOM 1495 CA ASN A 95 23.506 4.690 -2.501 1.00 0.00 C ATOM 1496 C ASN A 95 23.321 4.389 -1.017 1.00 0.00 C ATOM 1497 O ASN A 95 23.670 5.200 -0.159 1.00 0.00 O ATOM 1498 CB ASN A 95 22.203 5.234 -3.089 1.00 0.00 C ATOM 1499 CG ASN A 95 22.441 6.167 -4.260 1.00 0.00 C ATOM 1500 OD1 ASN A 95 23.436 6.042 -4.975 1.00 0.00 O ATOM 1501 ND2 ASN A 95 21.528 7.110 -4.460 1.00 0.00 N ATOM 0 H ASN A 95 23.303 3.218 -3.981 1.00 0.00 H new ATOM 0 HA ASN A 95 24.286 5.444 -2.606 1.00 0.00 H new ATOM 0 HB2 ASN A 95 21.578 4.401 -3.413 1.00 0.00 H new ATOM 0 HB3 ASN A 95 21.651 5.764 -2.313 1.00 0.00 H new ATOM 0 HD21 ASN A 95 21.635 7.768 -5.232 1.00 0.00 H new ATOM 0 HD22 ASN A 95 20.719 7.176 -3.842 1.00 0.00 H new ATOM 1508 N VAL A 96 22.769 3.216 -0.721 1.00 0.00 N ATOM 1509 CA VAL A 96 22.539 2.805 0.659 1.00 0.00 C ATOM 1510 C VAL A 96 23.717 3.185 1.549 1.00 0.00 C ATOM 1511 O VAL A 96 23.551 3.874 2.556 1.00 0.00 O ATOM 1512 CB VAL A 96 22.302 1.287 0.760 1.00 0.00 C ATOM 1513 CG1 VAL A 96 22.160 0.865 2.215 1.00 0.00 C ATOM 1514 CG2 VAL A 96 21.074 0.885 -0.042 1.00 0.00 C ATOM 0 H VAL A 96 22.473 2.534 -1.419 1.00 0.00 H new ATOM 0 HA VAL A 96 21.646 3.328 1.001 1.00 0.00 H new ATOM 0 HB VAL A 96 23.166 0.773 0.340 1.00 0.00 H new ATOM 0 HG11 VAL A 96 21.993 -0.211 2.267 1.00 0.00 H new ATOM 0 HG12 VAL A 96 23.071 1.118 2.758 1.00 0.00 H new ATOM 0 HG13 VAL A 96 21.314 1.386 2.664 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.922 -0.191 0.041 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.199 1.406 0.346 1.00 0.00 H new ATOM 0 HG23 VAL A 96 21.220 1.151 -1.089 1.00 0.00 H new ATOM 1524 N LYS A 97 24.908 2.733 1.171 1.00 0.00 N ATOM 1525 CA LYS A 97 26.115 3.027 1.933 1.00 0.00 C ATOM 1526 C LYS A 97 26.048 4.423 2.543 1.00 0.00 C ATOM 1527 O LYS A 97 26.515 4.645 3.660 1.00 0.00 O ATOM 1528 CB LYS A 97 27.350 2.909 1.036 1.00 0.00 C ATOM 1529 CG LYS A 97 27.903 1.498 0.944 1.00 0.00 C ATOM 1530 CD LYS A 97 27.256 0.719 -0.190 1.00 0.00 C ATOM 1531 CE LYS A 97 27.648 -0.750 -0.151 1.00 0.00 C ATOM 1532 NZ LYS A 97 29.001 -0.979 -0.728 1.00 0.00 N ATOM 0 H LYS A 97 25.063 2.161 0.341 1.00 0.00 H new ATOM 0 HA LYS A 97 26.190 2.300 2.742 1.00 0.00 H new ATOM 0 HB2 LYS A 97 27.096 3.256 0.035 1.00 0.00 H new ATOM 0 HB3 LYS A 97 28.128 3.571 1.415 1.00 0.00 H new ATOM 0 HG2 LYS A 97 28.981 1.538 0.790 1.00 0.00 H new ATOM 0 HG3 LYS A 97 27.734 0.978 1.887 1.00 0.00 H new ATOM 0 HD2 LYS A 97 26.172 0.809 -0.123 1.00 0.00 H new ATOM 0 HD3 LYS A 97 27.553 1.151 -1.146 1.00 0.00 H new ATOM 0 HE2 LYS A 97 27.628 -1.104 0.880 1.00 0.00 H new ATOM 0 HE3 LYS A 97 26.914 -1.336 -0.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 29.231 -1.992 -0.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 29.013 -0.665 -1.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 29.706 -0.440 -0.185 1.00 0.00 H new ATOM 1546 N GLU A 98 25.463 5.360 1.803 1.00 0.00 N ATOM 1547 CA GLU A 98 25.334 6.734 2.274 1.00 0.00 C ATOM 1548 C GLU A 98 23.966 6.966 2.908 1.00 0.00 C ATOM 1549 O GLU A 98 22.948 7.078 2.225 1.00 0.00 O ATOM 1550 CB GLU A 98 25.546 7.714 1.118 1.00 0.00 C ATOM 1551 CG GLU A 98 26.759 7.393 0.261 1.00 0.00 C ATOM 1552 CD GLU A 98 27.252 8.591 -0.525 1.00 0.00 C ATOM 1553 OE1 GLU A 98 26.575 8.983 -1.499 1.00 0.00 O ATOM 1554 OE2 GLU A 98 28.316 9.139 -0.166 1.00 0.00 O ATOM 0 H GLU A 98 25.071 5.193 0.876 1.00 0.00 H new ATOM 0 HA GLU A 98 26.099 6.905 3.031 1.00 0.00 H new ATOM 0 HB2 GLU A 98 24.657 7.716 0.487 1.00 0.00 H new ATOM 0 HB3 GLU A 98 25.653 8.721 1.522 1.00 0.00 H new ATOM 0 HG2 GLU A 98 27.563 7.026 0.899 1.00 0.00 H new ATOM 0 HG3 GLU A 98 26.508 6.588 -0.430 1.00 0.00 H new ATOM 1561 N PRO A 99 23.940 7.040 4.247 1.00 0.00 N ATOM 1562 CA PRO A 99 22.704 7.260 5.004 1.00 0.00 C ATOM 1563 C PRO A 99 22.153 8.669 4.818 1.00 0.00 C ATOM 1564 O PRO A 99 22.792 9.651 5.193 1.00 0.00 O ATOM 1565 CB PRO A 99 23.134 7.041 6.457 1.00 0.00 C ATOM 1566 CG PRO A 99 24.593 7.343 6.469 1.00 0.00 C ATOM 1567 CD PRO A 99 25.116 6.916 5.125 1.00 0.00 C ATOM 0 HA PRO A 99 21.903 6.597 4.678 1.00 0.00 H new ATOM 0 HB2 PRO A 99 22.588 7.697 7.135 1.00 0.00 H new ATOM 0 HB3 PRO A 99 22.939 6.018 6.778 1.00 0.00 H new ATOM 0 HG2 PRO A 99 24.770 8.405 6.637 1.00 0.00 H new ATOM 0 HG3 PRO A 99 25.096 6.805 7.272 1.00 0.00 H new ATOM 0 HD2 PRO A 99 25.935 7.553 4.792 1.00 0.00 H new ATOM 0 HD3 PRO A 99 25.495 5.894 5.147 1.00 0.00 H new ATOM 1575 N GLY A 100 20.961 8.761 4.236 1.00 0.00 N ATOM 1576 CA GLY A 100 20.343 10.055 4.011 1.00 0.00 C ATOM 1577 C GLY A 100 18.834 10.007 4.138 1.00 0.00 C ATOM 1578 O GLY A 100 18.292 9.184 4.875 1.00 0.00 O ATOM 0 H GLY A 100 20.412 7.963 3.916 1.00 0.00 H new ATOM 0 HA2 GLY A 100 20.742 10.774 4.727 1.00 0.00 H new ATOM 0 HA3 GLY A 100 20.610 10.413 3.017 1.00 0.00 H new ATOM 1582 N ARG A 101 18.153 10.893 3.418 1.00 0.00 N ATOM 1583 CA ARG A 101 16.696 10.950 3.456 1.00 0.00 C ATOM 1584 C ARG A 101 16.102 10.570 2.103 1.00 0.00 C ATOM 1585 O ARG A 101 15.051 9.933 2.032 1.00 0.00 O ATOM 1586 CB ARG A 101 16.230 12.352 3.854 1.00 0.00 C ATOM 1587 CG ARG A 101 16.588 12.730 5.282 1.00 0.00 C ATOM 1588 CD ARG A 101 16.584 14.238 5.477 1.00 0.00 C ATOM 1589 NE ARG A 101 16.758 14.609 6.879 1.00 0.00 N ATOM 1590 CZ ARG A 101 17.337 15.738 7.274 1.00 0.00 C ATOM 1591 NH1 ARG A 101 17.795 16.600 6.378 1.00 0.00 N ATOM 1592 NH2 ARG A 101 17.458 16.005 8.568 1.00 0.00 N ATOM 0 H ARG A 101 18.586 11.581 2.802 1.00 0.00 H new ATOM 0 HA ARG A 101 16.348 10.234 4.200 1.00 0.00 H new ATOM 0 HB2 ARG A 101 16.672 13.079 3.173 1.00 0.00 H new ATOM 0 HB3 ARG A 101 15.149 12.415 3.731 1.00 0.00 H new ATOM 0 HG2 ARG A 101 15.878 12.271 5.970 1.00 0.00 H new ATOM 0 HG3 ARG A 101 17.573 12.333 5.529 1.00 0.00 H new ATOM 0 HD2 ARG A 101 17.382 14.683 4.883 1.00 0.00 H new ATOM 0 HD3 ARG A 101 15.645 14.649 5.107 1.00 0.00 H new ATOM 0 HE ARG A 101 16.416 13.966 7.594 1.00 0.00 H new ATOM 0 HH11 ARG A 101 17.704 16.398 5.382 1.00 0.00 H new ATOM 0 HH12 ARG A 101 18.239 17.466 6.684 1.00 0.00 H new ATOM 0 HH21 ARG A 101 17.107 15.343 9.260 1.00 0.00 H new ATOM 0 HH22 ARG A 101 17.903 16.872 8.871 1.00 0.00 H new ATOM 1606 N TYR A 102 16.781 10.966 1.032 1.00 0.00 N ATOM 1607 CA TYR A 102 16.319 10.670 -0.319 1.00 0.00 C ATOM 1608 C TYR A 102 17.168 9.574 -0.957 1.00 0.00 C ATOM 1609 O TYR A 102 17.168 9.402 -2.176 1.00 0.00 O ATOM 1610 CB TYR A 102 16.362 11.931 -1.183 1.00 0.00 C ATOM 1611 CG TYR A 102 15.747 13.142 -0.518 1.00 0.00 C ATOM 1612 CD1 TYR A 102 14.392 13.177 -0.210 1.00 0.00 C ATOM 1613 CD2 TYR A 102 16.520 14.250 -0.197 1.00 0.00 C ATOM 1614 CE1 TYR A 102 13.826 14.281 0.397 1.00 0.00 C ATOM 1615 CE2 TYR A 102 15.963 15.358 0.411 1.00 0.00 C ATOM 1616 CZ TYR A 102 14.615 15.369 0.705 1.00 0.00 C ATOM 1617 OH TYR A 102 14.055 16.471 1.311 1.00 0.00 O ATOM 0 H TYR A 102 17.653 11.493 1.073 1.00 0.00 H new ATOM 0 HA TYR A 102 15.290 10.317 -0.254 1.00 0.00 H new ATOM 0 HB2 TYR A 102 17.399 12.153 -1.436 1.00 0.00 H new ATOM 0 HB3 TYR A 102 15.840 11.737 -2.120 1.00 0.00 H new ATOM 0 HD1 TYR A 102 13.771 12.326 -0.449 1.00 0.00 H new ATOM 0 HD2 TYR A 102 17.575 14.245 -0.427 1.00 0.00 H new ATOM 0 HE1 TYR A 102 12.771 14.292 0.629 1.00 0.00 H new ATOM 0 HE2 TYR A 102 16.579 16.211 0.655 1.00 0.00 H new ATOM 0 HH TYR A 102 14.747 17.149 1.461 1.00 0.00 H new ATOM 1627 N THR A 103 17.890 8.833 -0.122 1.00 0.00 N ATOM 1628 CA THR A 103 18.744 7.753 -0.602 1.00 0.00 C ATOM 1629 C THR A 103 17.947 6.747 -1.424 1.00 0.00 C ATOM 1630 O THR A 103 18.407 6.278 -2.466 1.00 0.00 O ATOM 1631 CB THR A 103 19.429 7.018 0.565 1.00 0.00 C ATOM 1632 OG1 THR A 103 20.081 7.961 1.423 1.00 0.00 O ATOM 1633 CG2 THR A 103 20.444 6.009 0.047 1.00 0.00 C ATOM 0 H THR A 103 17.900 8.961 0.890 1.00 0.00 H new ATOM 0 HA THR A 103 19.508 8.209 -1.232 1.00 0.00 H new ATOM 0 HB THR A 103 18.664 6.484 1.129 1.00 0.00 H new ATOM 0 HG1 THR A 103 20.978 7.635 1.646 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.915 5.502 0.889 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.940 5.276 -0.582 1.00 0.00 H new ATOM 0 HG23 THR A 103 21.205 6.526 -0.537 1.00 0.00 H new ATOM 1641 N PHE A 104 16.750 6.418 -0.951 1.00 0.00 N ATOM 1642 CA PHE A 104 15.889 5.466 -1.643 1.00 0.00 C ATOM 1643 C PHE A 104 14.854 6.191 -2.498 1.00 0.00 C ATOM 1644 O PHE A 104 13.850 5.606 -2.903 1.00 0.00 O ATOM 1645 CB PHE A 104 15.185 4.556 -0.634 1.00 0.00 C ATOM 1646 CG PHE A 104 16.132 3.822 0.273 1.00 0.00 C ATOM 1647 CD1 PHE A 104 16.783 2.679 -0.161 1.00 0.00 C ATOM 1648 CD2 PHE A 104 16.370 4.276 1.561 1.00 0.00 C ATOM 1649 CE1 PHE A 104 17.655 2.002 0.671 1.00 0.00 C ATOM 1650 CE2 PHE A 104 17.240 3.603 2.397 1.00 0.00 C ATOM 1651 CZ PHE A 104 17.883 2.464 1.952 1.00 0.00 C ATOM 0 H PHE A 104 16.354 6.797 -0.091 1.00 0.00 H new ATOM 0 HA PHE A 104 16.514 4.858 -2.297 1.00 0.00 H new ATOM 0 HB2 PHE A 104 14.505 5.155 -0.028 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.576 3.831 -1.174 1.00 0.00 H new ATOM 0 HD1 PHE A 104 16.607 2.312 -1.162 1.00 0.00 H new ATOM 0 HD2 PHE A 104 15.870 5.165 1.915 1.00 0.00 H new ATOM 0 HE1 PHE A 104 18.157 1.113 0.319 1.00 0.00 H new ATOM 0 HE2 PHE A 104 17.417 3.967 3.398 1.00 0.00 H new ATOM 0 HZ PHE A 104 18.563 1.936 2.605 1.00 0.00 H new ATOM 1661 N GLU A 105 15.107 7.468 -2.768 1.00 0.00 N ATOM 1662 CA GLU A 105 14.197 8.273 -3.574 1.00 0.00 C ATOM 1663 C GLU A 105 13.839 7.554 -4.872 1.00 0.00 C ATOM 1664 O GLU A 105 12.665 7.320 -5.160 1.00 0.00 O ATOM 1665 CB GLU A 105 14.825 9.632 -3.889 1.00 0.00 C ATOM 1666 CG GLU A 105 13.859 10.617 -4.524 1.00 0.00 C ATOM 1667 CD GLU A 105 12.584 10.784 -3.721 1.00 0.00 C ATOM 1668 OE1 GLU A 105 12.596 11.564 -2.745 1.00 0.00 O ATOM 1669 OE2 GLU A 105 11.574 10.136 -4.066 1.00 0.00 O ATOM 0 H GLU A 105 15.934 7.967 -2.440 1.00 0.00 H new ATOM 0 HA GLU A 105 13.284 8.427 -2.999 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.217 10.063 -2.968 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.673 9.485 -4.558 1.00 0.00 H new ATOM 0 HG2 GLU A 105 14.349 11.585 -4.627 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.609 10.278 -5.529 1.00 0.00 H new ATOM 1676 N ASP A 106 14.858 7.206 -5.650 1.00 0.00 N ATOM 1677 CA ASP A 106 14.651 6.513 -6.916 1.00 0.00 C ATOM 1678 C ASP A 106 13.715 5.322 -6.738 1.00 0.00 C ATOM 1679 O ASP A 106 12.660 5.249 -7.368 1.00 0.00 O ATOM 1680 CB ASP A 106 15.990 6.044 -7.489 1.00 0.00 C ATOM 1681 CG ASP A 106 15.852 4.788 -8.327 1.00 0.00 C ATOM 1682 OD1 ASP A 106 15.683 3.699 -7.739 1.00 0.00 O ATOM 1683 OD2 ASP A 106 15.915 4.893 -9.570 1.00 0.00 O ATOM 0 H ASP A 106 15.836 7.392 -5.426 1.00 0.00 H new ATOM 0 HA ASP A 106 14.190 7.212 -7.614 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.420 6.839 -8.099 1.00 0.00 H new ATOM 0 HB3 ASP A 106 16.687 5.857 -6.672 1.00 0.00 H new ATOM 1688 N ALA A 107 14.109 4.390 -5.875 1.00 0.00 N ATOM 1689 CA ALA A 107 13.305 3.203 -5.614 1.00 0.00 C ATOM 1690 C ALA A 107 11.863 3.578 -5.288 1.00 0.00 C ATOM 1691 O ALA A 107 10.926 3.067 -5.902 1.00 0.00 O ATOM 1692 CB ALA A 107 13.912 2.395 -4.477 1.00 0.00 C ATOM 0 H ALA A 107 14.980 4.435 -5.346 1.00 0.00 H new ATOM 0 HA ALA A 107 13.299 2.592 -6.517 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.301 1.511 -4.292 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.922 2.088 -4.748 1.00 0.00 H new ATOM 0 HB3 ALA A 107 13.948 3.006 -3.575 1.00 0.00 H new ATOM 1698 N GLN A 108 11.693 4.471 -4.318 1.00 0.00 N ATOM 1699 CA GLN A 108 10.364 4.912 -3.911 1.00 0.00 C ATOM 1700 C GLN A 108 9.526 5.305 -5.123 1.00 0.00 C ATOM 1701 O GLN A 108 8.326 5.034 -5.173 1.00 0.00 O ATOM 1702 CB GLN A 108 10.470 6.093 -2.944 1.00 0.00 C ATOM 1703 CG GLN A 108 9.133 6.749 -2.637 1.00 0.00 C ATOM 1704 CD GLN A 108 9.234 7.793 -1.542 1.00 0.00 C ATOM 1705 OE1 GLN A 108 8.624 7.510 -0.397 1.00 0.00 O flip ATOM 1706 NE2 GLN A 108 9.852 8.842 -1.723 1.00 0.00 N flip ATOM 0 H GLN A 108 12.458 4.903 -3.800 1.00 0.00 H new ATOM 0 HA GLN A 108 9.871 4.081 -3.406 1.00 0.00 H new ATOM 0 HB2 GLN A 108 10.920 5.750 -2.012 1.00 0.00 H new ATOM 0 HB3 GLN A 108 11.143 6.839 -3.367 1.00 0.00 H new ATOM 0 HG2 GLN A 108 8.744 7.214 -3.543 1.00 0.00 H new ATOM 0 HG3 GLN A 108 8.417 5.983 -2.339 1.00 0.00 H new ATOM 0 HE21 GLN A 108 10.306 9.018 -2.619 1.00 0.00 H new ATOM 0 HE22 GLN A 108 9.910 9.535 -0.977 1.00 0.00 H new ATOM 1715 N GLU A 109 10.165 5.946 -6.096 1.00 0.00 N ATOM 1716 CA GLU A 109 9.477 6.377 -7.307 1.00 0.00 C ATOM 1717 C GLU A 109 9.179 5.188 -8.216 1.00 0.00 C ATOM 1718 O GLU A 109 8.090 5.081 -8.780 1.00 0.00 O ATOM 1719 CB GLU A 109 10.319 7.410 -8.059 1.00 0.00 C ATOM 1720 CG GLU A 109 9.936 7.559 -9.522 1.00 0.00 C ATOM 1721 CD GLU A 109 10.608 8.747 -10.183 1.00 0.00 C ATOM 1722 OE1 GLU A 109 11.746 9.079 -9.790 1.00 0.00 O ATOM 1723 OE2 GLU A 109 9.995 9.344 -11.093 1.00 0.00 O ATOM 0 H GLU A 109 11.158 6.178 -6.069 1.00 0.00 H new ATOM 0 HA GLU A 109 8.532 6.834 -7.014 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.219 8.377 -7.566 1.00 0.00 H new ATOM 0 HB3 GLU A 109 11.370 7.127 -7.994 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.205 6.649 -10.059 1.00 0.00 H new ATOM 0 HG3 GLU A 109 8.854 7.668 -9.601 1.00 0.00 H new ATOM 1730 N HIS A 110 10.156 4.297 -8.355 1.00 0.00 N ATOM 1731 CA HIS A 110 10.000 3.115 -9.195 1.00 0.00 C ATOM 1732 C HIS A 110 8.814 2.274 -8.734 1.00 0.00 C ATOM 1733 O HIS A 110 8.013 1.814 -9.549 1.00 0.00 O ATOM 1734 CB HIS A 110 11.276 2.275 -9.172 1.00 0.00 C ATOM 1735 CG HIS A 110 11.281 1.165 -10.178 1.00 0.00 C ATOM 1736 ND1 HIS A 110 10.902 -0.130 -10.069 1.00 0.00 N flip ATOM 1737 CD2 HIS A 110 11.716 1.327 -11.476 1.00 0.00 C flip ATOM 1738 CE1 HIS A 110 11.111 -0.720 -11.292 1.00 0.00 C flip ATOM 1739 NE2 HIS A 110 11.602 0.181 -12.123 1.00 0.00 N flip ATOM 0 H HIS A 110 11.064 4.371 -7.897 1.00 0.00 H new ATOM 0 HA HIS A 110 9.812 3.447 -10.216 1.00 0.00 H new ATOM 0 HB2 HIS A 110 12.132 2.924 -9.356 1.00 0.00 H new ATOM 0 HB3 HIS A 110 11.405 1.852 -8.176 1.00 0.00 H new ATOM 0 HD2 HIS A 110 12.091 2.247 -11.898 1.00 0.00 H new ATOM 0 HE1 HIS A 110 10.907 -1.753 -11.534 1.00 0.00 H new ATOM 0 HE2 HIS A 110 11.851 0.020 -13.099 1.00 0.00 H new ATOM 1747 N ILE A 111 8.709 2.075 -7.424 1.00 0.00 N ATOM 1748 CA ILE A 111 7.621 1.289 -6.856 1.00 0.00 C ATOM 1749 C ILE A 111 6.279 1.988 -7.049 1.00 0.00 C ATOM 1750 O ILE A 111 5.290 1.362 -7.432 1.00 0.00 O ATOM 1751 CB ILE A 111 7.840 1.028 -5.354 1.00 0.00 C ATOM 1752 CG1 ILE A 111 9.150 0.271 -5.132 1.00 0.00 C ATOM 1753 CG2 ILE A 111 6.667 0.251 -4.775 1.00 0.00 C ATOM 1754 CD1 ILE A 111 9.171 -1.101 -5.770 1.00 0.00 C ATOM 0 H ILE A 111 9.364 2.447 -6.737 1.00 0.00 H new ATOM 0 HA ILE A 111 7.611 0.336 -7.384 1.00 0.00 H new ATOM 0 HB ILE A 111 7.905 1.986 -4.839 1.00 0.00 H new ATOM 0 HG12 ILE A 111 9.974 0.862 -5.533 1.00 0.00 H new ATOM 0 HG13 ILE A 111 9.323 0.167 -4.061 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.836 0.074 -3.713 1.00 0.00 H new ATOM 0 HG22 ILE A 111 5.750 0.826 -4.905 1.00 0.00 H new ATOM 0 HG23 ILE A 111 6.573 -0.704 -5.291 1.00 0.00 H new ATOM 0 HD11 ILE A 111 10.130 -1.580 -5.572 1.00 0.00 H new ATOM 0 HD12 ILE A 111 8.369 -1.709 -5.352 1.00 0.00 H new ATOM 0 HD13 ILE A 111 9.029 -1.004 -6.846 1.00 0.00 H new ATOM 1766 N TYR A 112 6.252 3.289 -6.783 1.00 0.00 N ATOM 1767 CA TYR A 112 5.031 4.073 -6.926 1.00 0.00 C ATOM 1768 C TYR A 112 4.434 3.902 -8.320 1.00 0.00 C ATOM 1769 O TYR A 112 3.254 3.585 -8.468 1.00 0.00 O ATOM 1770 CB TYR A 112 5.316 5.552 -6.660 1.00 0.00 C ATOM 1771 CG TYR A 112 4.178 6.468 -7.049 1.00 0.00 C ATOM 1772 CD1 TYR A 112 3.890 6.723 -8.384 1.00 0.00 C ATOM 1773 CD2 TYR A 112 3.389 7.078 -6.081 1.00 0.00 C ATOM 1774 CE1 TYR A 112 2.851 7.560 -8.743 1.00 0.00 C ATOM 1775 CE2 TYR A 112 2.347 7.915 -6.431 1.00 0.00 C ATOM 1776 CZ TYR A 112 2.083 8.153 -7.764 1.00 0.00 C ATOM 1777 OH TYR A 112 1.046 8.986 -8.118 1.00 0.00 O ATOM 0 H TYR A 112 7.062 3.823 -6.467 1.00 0.00 H new ATOM 0 HA TYR A 112 4.309 3.711 -6.194 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.533 5.686 -5.600 1.00 0.00 H new ATOM 0 HB3 TYR A 112 6.211 5.845 -7.209 1.00 0.00 H new ATOM 0 HD1 TYR A 112 4.488 6.259 -9.154 1.00 0.00 H new ATOM 0 HD2 TYR A 112 3.594 6.894 -5.037 1.00 0.00 H new ATOM 0 HE1 TYR A 112 2.642 7.749 -9.786 1.00 0.00 H new ATOM 0 HE2 TYR A 112 1.743 8.380 -5.666 1.00 0.00 H new ATOM 0 HH TYR A 112 0.195 8.583 -7.846 1.00 0.00 H new ATOM 1787 N LYS A 113 5.259 4.114 -9.340 1.00 0.00 N ATOM 1788 CA LYS A 113 4.817 3.982 -10.723 1.00 0.00 C ATOM 1789 C LYS A 113 4.365 2.555 -11.016 1.00 0.00 C ATOM 1790 O LYS A 113 3.719 2.293 -12.031 1.00 0.00 O ATOM 1791 CB LYS A 113 5.942 4.379 -11.680 1.00 0.00 C ATOM 1792 CG LYS A 113 6.508 5.763 -11.413 1.00 0.00 C ATOM 1793 CD LYS A 113 7.761 6.021 -12.234 1.00 0.00 C ATOM 1794 CE LYS A 113 8.901 5.106 -11.814 1.00 0.00 C ATOM 1795 NZ LYS A 113 10.170 5.443 -12.516 1.00 0.00 N ATOM 0 H LYS A 113 6.238 4.378 -9.234 1.00 0.00 H new ATOM 0 HA LYS A 113 3.969 4.651 -10.872 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.746 3.647 -11.606 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.568 4.340 -12.703 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.756 6.516 -11.648 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.739 5.864 -10.353 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.542 5.870 -13.291 1.00 0.00 H new ATOM 0 HD3 LYS A 113 8.066 7.061 -12.117 1.00 0.00 H new ATOM 0 HE2 LYS A 113 9.050 5.183 -10.737 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.633 4.071 -12.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.922 4.797 -12.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.035 5.345 -13.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.440 6.422 -12.294 1.00 0.00 H new ATOM 1809 N LEU A 114 4.708 1.635 -10.120 1.00 0.00 N ATOM 1810 CA LEU A 114 4.337 0.234 -10.282 1.00 0.00 C ATOM 1811 C LEU A 114 3.013 -0.063 -9.585 1.00 0.00 C ATOM 1812 O LEU A 114 2.003 -0.328 -10.236 1.00 0.00 O ATOM 1813 CB LEU A 114 5.435 -0.673 -9.723 1.00 0.00 C ATOM 1814 CG LEU A 114 5.035 -2.125 -9.457 1.00 0.00 C ATOM 1815 CD1 LEU A 114 5.520 -3.027 -10.581 1.00 0.00 C ATOM 1816 CD2 LEU A 114 5.589 -2.593 -8.119 1.00 0.00 C ATOM 0 H LEU A 114 5.242 1.835 -9.274 1.00 0.00 H new ATOM 0 HA LEU A 114 4.218 0.036 -11.347 1.00 0.00 H new ATOM 0 HB2 LEU A 114 6.272 -0.670 -10.421 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.797 -0.240 -8.790 1.00 0.00 H new ATOM 0 HG LEU A 114 3.947 -2.181 -9.418 1.00 0.00 H new ATOM 0 HD11 LEU A 114 5.226 -4.056 -10.374 1.00 0.00 H new ATOM 0 HD12 LEU A 114 5.076 -2.705 -11.523 1.00 0.00 H new ATOM 0 HD13 LEU A 114 6.606 -2.967 -10.653 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.295 -3.628 -7.945 1.00 0.00 H new ATOM 0 HD22 LEU A 114 6.677 -2.522 -8.131 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.193 -1.965 -7.321 1.00 0.00 H new ATOM 1828 N MET A 115 3.025 -0.013 -8.257 1.00 0.00 N ATOM 1829 CA MET A 115 1.824 -0.273 -7.472 1.00 0.00 C ATOM 1830 C MET A 115 0.636 0.510 -8.021 1.00 0.00 C ATOM 1831 O MET A 115 -0.502 0.041 -7.982 1.00 0.00 O ATOM 1832 CB MET A 115 2.058 0.094 -6.005 1.00 0.00 C ATOM 1833 CG MET A 115 3.341 -0.487 -5.431 1.00 0.00 C ATOM 1834 SD MET A 115 3.625 0.014 -3.722 1.00 0.00 S ATOM 1835 CE MET A 115 3.846 1.781 -3.919 1.00 0.00 C ATOM 0 H MET A 115 3.853 0.205 -7.702 1.00 0.00 H new ATOM 0 HA MET A 115 1.598 -1.337 -7.541 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.086 1.180 -5.910 1.00 0.00 H new ATOM 0 HB3 MET A 115 1.213 -0.256 -5.412 1.00 0.00 H new ATOM 0 HG2 MET A 115 3.299 -1.575 -5.485 1.00 0.00 H new ATOM 0 HG3 MET A 115 4.185 -0.170 -6.044 1.00 0.00 H new ATOM 0 HE1 MET A 115 4.836 2.066 -3.562 1.00 0.00 H new ATOM 0 HE2 MET A 115 3.750 2.044 -4.972 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.087 2.309 -3.343 1.00 0.00 H new ATOM 1845 N LYS A 116 0.907 1.706 -8.531 1.00 0.00 N ATOM 1846 CA LYS A 116 -0.139 2.555 -9.089 1.00 0.00 C ATOM 1847 C LYS A 116 -0.939 1.807 -10.150 1.00 0.00 C ATOM 1848 O LYS A 116 -2.170 1.848 -10.158 1.00 0.00 O ATOM 1849 CB LYS A 116 0.471 3.821 -9.694 1.00 0.00 C ATOM 1850 CG LYS A 116 1.161 3.587 -11.027 1.00 0.00 C ATOM 1851 CD LYS A 116 1.719 4.878 -11.601 1.00 0.00 C ATOM 1852 CE LYS A 116 0.628 5.720 -12.244 1.00 0.00 C ATOM 1853 NZ LYS A 116 0.074 6.728 -11.297 1.00 0.00 N ATOM 0 H LYS A 116 1.843 2.110 -8.570 1.00 0.00 H new ATOM 0 HA LYS A 116 -0.814 2.835 -8.280 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.314 4.565 -9.827 1.00 0.00 H new ATOM 0 HB3 LYS A 116 1.191 4.239 -8.990 1.00 0.00 H new ATOM 0 HG2 LYS A 116 1.969 2.866 -10.898 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.454 3.150 -11.732 1.00 0.00 H new ATOM 0 HD2 LYS A 116 2.203 5.450 -10.809 1.00 0.00 H new ATOM 0 HD3 LYS A 116 2.485 4.647 -12.341 1.00 0.00 H new ATOM 0 HE2 LYS A 116 1.030 6.228 -13.120 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -0.174 5.070 -12.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -0.964 6.671 -11.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 0.430 6.537 -10.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 0.369 7.681 -11.592 1.00 0.00 H new ATOM 1867 N SER A 117 -0.233 1.123 -11.044 1.00 0.00 N ATOM 1868 CA SER A 117 -0.878 0.366 -12.112 1.00 0.00 C ATOM 1869 C SER A 117 -0.691 -1.134 -11.904 1.00 0.00 C ATOM 1870 O SER A 117 -0.917 -1.930 -12.815 1.00 0.00 O ATOM 1871 CB SER A 117 -0.311 0.779 -13.472 1.00 0.00 C ATOM 1872 OG SER A 117 -1.262 0.576 -14.503 1.00 0.00 O ATOM 0 H SER A 117 0.786 1.077 -11.051 1.00 0.00 H new ATOM 0 HA SER A 117 -1.945 0.588 -12.089 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.018 1.829 -13.444 1.00 0.00 H new ATOM 0 HB3 SER A 117 0.589 0.203 -13.685 1.00 0.00 H new ATOM 0 HG SER A 117 -1.620 -0.334 -14.443 1.00 0.00 H new ATOM 1878 N ASP A 118 -0.277 -1.510 -10.699 1.00 0.00 N ATOM 1879 CA ASP A 118 -0.060 -2.914 -10.370 1.00 0.00 C ATOM 1880 C ASP A 118 -1.159 -3.433 -9.448 1.00 0.00 C ATOM 1881 O ASP A 118 -1.913 -4.335 -9.812 1.00 0.00 O ATOM 1882 CB ASP A 118 1.307 -3.100 -9.709 1.00 0.00 C ATOM 1883 CG ASP A 118 2.385 -3.482 -10.704 1.00 0.00 C ATOM 1884 OD1 ASP A 118 2.712 -2.648 -11.573 1.00 0.00 O ATOM 1885 OD2 ASP A 118 2.901 -4.616 -10.614 1.00 0.00 O ATOM 0 H ASP A 118 -0.085 -0.863 -9.934 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.088 -3.487 -11.297 1.00 0.00 H new ATOM 0 HB2 ASP A 118 1.592 -2.176 -9.206 1.00 0.00 H new ATOM 0 HB3 ASP A 118 1.235 -3.872 -8.942 1.00 0.00 H new ATOM 1890 N SER A 119 -1.244 -2.855 -8.254 1.00 0.00 N ATOM 1891 CA SER A 119 -2.248 -3.262 -7.278 1.00 0.00 C ATOM 1892 C SER A 119 -3.511 -2.416 -7.412 1.00 0.00 C ATOM 1893 O SER A 119 -4.617 -2.944 -7.529 1.00 0.00 O ATOM 1894 CB SER A 119 -1.689 -3.143 -5.859 1.00 0.00 C ATOM 1895 OG SER A 119 -0.776 -4.190 -5.581 1.00 0.00 O ATOM 0 H SER A 119 -0.630 -2.104 -7.939 1.00 0.00 H new ATOM 0 HA SER A 119 -2.507 -4.303 -7.473 1.00 0.00 H new ATOM 0 HB2 SER A 119 -1.191 -2.181 -5.741 1.00 0.00 H new ATOM 0 HB3 SER A 119 -2.507 -3.169 -5.139 1.00 0.00 H new ATOM 0 HG SER A 119 -1.270 -4.991 -5.309 1.00 0.00 H new ATOM 1901 N TYR A 120 -3.336 -1.099 -7.395 1.00 0.00 N ATOM 1902 CA TYR A 120 -4.461 -0.178 -7.513 1.00 0.00 C ATOM 1903 C TYR A 120 -5.501 -0.709 -8.494 1.00 0.00 C ATOM 1904 O TYR A 120 -6.695 -0.767 -8.202 1.00 0.00 O ATOM 1905 CB TYR A 120 -3.973 1.200 -7.965 1.00 0.00 C ATOM 1906 CG TYR A 120 -4.675 2.347 -7.274 1.00 0.00 C ATOM 1907 CD1 TYR A 120 -4.403 2.657 -5.947 1.00 0.00 C ATOM 1908 CD2 TYR A 120 -5.610 3.123 -7.949 1.00 0.00 C ATOM 1909 CE1 TYR A 120 -5.042 3.704 -5.313 1.00 0.00 C ATOM 1910 CE2 TYR A 120 -6.253 4.173 -7.323 1.00 0.00 C ATOM 1911 CZ TYR A 120 -5.966 4.459 -6.004 1.00 0.00 C ATOM 1912 OH TYR A 120 -6.604 5.503 -5.376 1.00 0.00 O ATOM 0 H TYR A 120 -2.427 -0.646 -7.301 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.928 -0.088 -6.532 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.902 1.276 -7.779 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -4.117 1.292 -9.041 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -3.679 2.069 -5.402 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -5.838 2.901 -8.981 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -4.819 3.931 -4.281 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -6.976 4.767 -7.863 1.00 0.00 H new ATOM 0 HH TYR A 120 -6.803 6.205 -6.030 1.00 0.00 H new ATOM 1922 N PRO A 121 -5.036 -1.108 -9.688 1.00 0.00 N ATOM 1923 CA PRO A 121 -5.908 -1.644 -10.737 1.00 0.00 C ATOM 1924 C PRO A 121 -6.862 -2.710 -10.210 1.00 0.00 C ATOM 1925 O PRO A 121 -8.078 -2.519 -10.201 1.00 0.00 O ATOM 1926 CB PRO A 121 -4.924 -2.254 -11.739 1.00 0.00 C ATOM 1927 CG PRO A 121 -3.660 -1.491 -11.540 1.00 0.00 C ATOM 1928 CD PRO A 121 -3.625 -1.068 -10.104 1.00 0.00 C ATOM 0 HA PRO A 121 -6.551 -0.875 -11.165 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -4.778 -3.318 -11.553 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -5.289 -2.157 -12.762 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.795 -2.109 -11.781 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -3.626 -0.623 -12.199 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -3.013 -1.741 -9.504 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -3.204 -0.069 -9.992 1.00 0.00 H new ATOM 1936 N ARG A 122 -6.303 -3.834 -9.773 1.00 0.00 N ATOM 1937 CA ARG A 122 -7.104 -4.931 -9.245 1.00 0.00 C ATOM 1938 C ARG A 122 -7.865 -4.497 -7.995 1.00 0.00 C ATOM 1939 O ARG A 122 -9.080 -4.673 -7.902 1.00 0.00 O ATOM 1940 CB ARG A 122 -6.214 -6.132 -8.922 1.00 0.00 C ATOM 1941 CG ARG A 122 -5.785 -6.920 -10.148 1.00 0.00 C ATOM 1942 CD ARG A 122 -4.875 -8.080 -9.775 1.00 0.00 C ATOM 1943 NE ARG A 122 -3.476 -7.672 -9.689 1.00 0.00 N ATOM 1944 CZ ARG A 122 -2.660 -7.618 -10.736 1.00 0.00 C ATOM 1945 NH1 ARG A 122 -3.102 -7.943 -11.942 1.00 0.00 N ATOM 1946 NH2 ARG A 122 -1.399 -7.236 -10.576 1.00 0.00 N ATOM 0 H ARG A 122 -5.298 -4.008 -9.774 1.00 0.00 H new ATOM 0 HA ARG A 122 -7.827 -5.219 -10.008 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -5.325 -5.784 -8.395 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -6.748 -6.796 -8.242 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -6.667 -7.299 -10.665 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -5.268 -6.259 -10.844 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -5.191 -8.495 -8.818 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -4.976 -8.873 -10.516 1.00 0.00 H new ATOM 0 HE ARG A 122 -3.105 -7.414 -8.775 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -4.071 -8.236 -12.068 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -2.473 -7.901 -12.744 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -1.056 -6.984 -9.649 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -0.773 -7.195 -11.380 1.00 0.00 H new ATOM 1960 N PHE A 123 -7.141 -3.929 -7.036 1.00 0.00 N ATOM 1961 CA PHE A 123 -7.747 -3.471 -5.791 1.00 0.00 C ATOM 1962 C PHE A 123 -9.122 -2.861 -6.047 1.00 0.00 C ATOM 1963 O PHE A 123 -10.062 -3.083 -5.284 1.00 0.00 O ATOM 1964 CB PHE A 123 -6.841 -2.446 -5.106 1.00 0.00 C ATOM 1965 CG PHE A 123 -7.567 -1.561 -4.133 1.00 0.00 C ATOM 1966 CD1 PHE A 123 -8.096 -2.082 -2.963 1.00 0.00 C ATOM 1967 CD2 PHE A 123 -7.720 -0.208 -4.389 1.00 0.00 C ATOM 1968 CE1 PHE A 123 -8.764 -1.270 -2.066 1.00 0.00 C ATOM 1969 CE2 PHE A 123 -8.387 0.609 -3.495 1.00 0.00 C ATOM 1970 CZ PHE A 123 -8.910 0.077 -2.333 1.00 0.00 C ATOM 0 H PHE A 123 -6.135 -3.775 -7.097 1.00 0.00 H new ATOM 0 HA PHE A 123 -7.869 -4.334 -5.136 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -6.043 -2.971 -4.582 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -6.368 -1.825 -5.867 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -7.985 -3.135 -2.750 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -7.314 0.213 -5.297 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -9.171 -1.688 -1.157 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -8.499 1.662 -3.705 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.432 0.713 -1.634 1.00 0.00 H new ATOM 1980 N ILE A 124 -9.230 -2.093 -7.126 1.00 0.00 N ATOM 1981 CA ILE A 124 -10.489 -1.451 -7.483 1.00 0.00 C ATOM 1982 C ILE A 124 -11.510 -2.476 -7.966 1.00 0.00 C ATOM 1983 O ILE A 124 -12.691 -2.396 -7.628 1.00 0.00 O ATOM 1984 CB ILE A 124 -10.288 -0.388 -8.579 1.00 0.00 C ATOM 1985 CG1 ILE A 124 -9.322 0.697 -8.096 1.00 0.00 C ATOM 1986 CG2 ILE A 124 -11.624 0.223 -8.975 1.00 0.00 C ATOM 1987 CD1 ILE A 124 -8.607 1.413 -9.221 1.00 0.00 C ATOM 0 H ILE A 124 -8.461 -1.900 -7.768 1.00 0.00 H new ATOM 0 HA ILE A 124 -10.863 -0.965 -6.582 1.00 0.00 H new ATOM 0 HB ILE A 124 -9.856 -0.869 -9.457 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -9.875 1.427 -7.505 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -8.582 0.246 -7.435 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -11.466 0.973 -9.750 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.283 -0.558 -9.354 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -12.082 0.693 -8.104 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.939 2.168 -8.806 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.027 0.694 -9.799 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -9.339 1.894 -9.870 1.00 0.00 H new ATOM 1999 N ARG A 125 -11.047 -3.438 -8.756 1.00 0.00 N ATOM 2000 CA ARG A 125 -11.919 -4.479 -9.285 1.00 0.00 C ATOM 2001 C ARG A 125 -12.596 -5.248 -8.154 1.00 0.00 C ATOM 2002 O ARG A 125 -13.799 -5.505 -8.197 1.00 0.00 O ATOM 2003 CB ARG A 125 -11.123 -5.443 -10.166 1.00 0.00 C ATOM 2004 CG ARG A 125 -10.258 -4.746 -11.204 1.00 0.00 C ATOM 2005 CD ARG A 125 -11.100 -3.946 -12.185 1.00 0.00 C ATOM 2006 NE ARG A 125 -10.473 -3.857 -13.500 1.00 0.00 N ATOM 2007 CZ ARG A 125 -10.587 -4.796 -14.433 1.00 0.00 C ATOM 2008 NH1 ARG A 125 -11.301 -5.887 -14.197 1.00 0.00 N ATOM 2009 NH2 ARG A 125 -9.986 -4.643 -15.607 1.00 0.00 N ATOM 0 H ARG A 125 -10.072 -3.518 -9.044 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.690 -3.999 -9.888 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -10.488 -6.061 -9.532 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -11.816 -6.114 -10.674 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -9.551 -4.083 -10.704 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -9.671 -5.487 -11.747 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -12.082 -4.410 -12.282 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -11.260 -2.942 -11.791 1.00 0.00 H new ATOM 0 HE ARG A 125 -9.917 -3.029 -13.714 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -11.765 -6.008 -13.297 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -11.386 -6.606 -14.916 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -9.436 -3.804 -15.793 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -10.074 -5.364 -16.323 1.00 0.00 H new ATOM 2023 N SER A 126 -11.814 -5.613 -7.143 1.00 0.00 N ATOM 2024 CA SER A 126 -12.336 -6.356 -6.002 1.00 0.00 C ATOM 2025 C SER A 126 -13.358 -5.524 -5.233 1.00 0.00 C ATOM 2026 O SER A 126 -13.267 -4.298 -5.186 1.00 0.00 O ATOM 2027 CB SER A 126 -11.195 -6.770 -5.071 1.00 0.00 C ATOM 2028 OG SER A 126 -10.670 -8.034 -5.438 1.00 0.00 O ATOM 0 H SER A 126 -10.817 -5.406 -7.091 1.00 0.00 H new ATOM 0 HA SER A 126 -12.831 -7.251 -6.379 1.00 0.00 H new ATOM 0 HB2 SER A 126 -10.404 -6.021 -5.105 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.556 -6.807 -4.043 1.00 0.00 H new ATOM 0 HG SER A 126 -10.325 -8.489 -4.641 1.00 0.00 H new ATOM 2034 N SER A 127 -14.331 -6.201 -4.633 1.00 0.00 N ATOM 2035 CA SER A 127 -15.374 -5.526 -3.869 1.00 0.00 C ATOM 2036 C SER A 127 -14.773 -4.733 -2.713 1.00 0.00 C ATOM 2037 O SER A 127 -15.290 -3.684 -2.330 1.00 0.00 O ATOM 2038 CB SER A 127 -16.384 -6.543 -3.334 1.00 0.00 C ATOM 2039 OG SER A 127 -17.092 -7.164 -4.393 1.00 0.00 O ATOM 0 H SER A 127 -14.419 -7.217 -4.661 1.00 0.00 H new ATOM 0 HA SER A 127 -15.887 -4.832 -4.535 1.00 0.00 H new ATOM 0 HB2 SER A 127 -15.866 -7.300 -2.746 1.00 0.00 H new ATOM 0 HB3 SER A 127 -17.086 -6.045 -2.665 1.00 0.00 H new ATOM 0 HG SER A 127 -17.730 -7.811 -4.025 1.00 0.00 H new ATOM 2045 N ALA A 128 -13.676 -5.242 -2.161 1.00 0.00 N ATOM 2046 CA ALA A 128 -13.003 -4.581 -1.050 1.00 0.00 C ATOM 2047 C ALA A 128 -13.050 -3.065 -1.202 1.00 0.00 C ATOM 2048 O ALA A 128 -13.224 -2.338 -0.224 1.00 0.00 O ATOM 2049 CB ALA A 128 -11.561 -5.058 -0.948 1.00 0.00 C ATOM 0 H ALA A 128 -13.235 -6.110 -2.465 1.00 0.00 H new ATOM 0 HA ALA A 128 -13.528 -4.844 -0.132 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -11.070 -4.556 -0.114 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -11.545 -6.135 -0.784 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -11.034 -4.824 -1.873 1.00 0.00 H new ATOM 2055 N TYR A 129 -12.895 -2.594 -2.435 1.00 0.00 N ATOM 2056 CA TYR A 129 -12.917 -1.163 -2.714 1.00 0.00 C ATOM 2057 C TYR A 129 -14.343 -0.623 -2.678 1.00 0.00 C ATOM 2058 O TYR A 129 -14.606 0.427 -2.092 1.00 0.00 O ATOM 2059 CB TYR A 129 -12.287 -0.879 -4.079 1.00 0.00 C ATOM 2060 CG TYR A 129 -12.676 0.462 -4.659 1.00 0.00 C ATOM 2061 CD1 TYR A 129 -12.001 1.621 -4.295 1.00 0.00 C ATOM 2062 CD2 TYR A 129 -13.719 0.570 -5.571 1.00 0.00 C ATOM 2063 CE1 TYR A 129 -12.354 2.848 -4.822 1.00 0.00 C ATOM 2064 CE2 TYR A 129 -14.078 1.793 -6.104 1.00 0.00 C ATOM 2065 CZ TYR A 129 -13.393 2.929 -5.726 1.00 0.00 C ATOM 2066 OH TYR A 129 -13.747 4.149 -6.254 1.00 0.00 O ATOM 0 H TYR A 129 -12.753 -3.182 -3.256 1.00 0.00 H new ATOM 0 HA TYR A 129 -12.337 -0.659 -1.941 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -11.202 -0.924 -3.985 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -12.579 -1.665 -4.775 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -11.187 1.561 -3.588 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -14.258 -0.317 -5.868 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -11.820 3.739 -4.528 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -14.890 1.859 -6.813 1.00 0.00 H new ATOM 0 HH TYR A 129 -14.345 4.013 -7.018 1.00 0.00 H new ATOM 2076 N GLN A 130 -15.260 -1.349 -3.309 1.00 0.00 N ATOM 2077 CA GLN A 130 -16.660 -0.944 -3.349 1.00 0.00 C ATOM 2078 C GLN A 130 -17.243 -0.859 -1.943 1.00 0.00 C ATOM 2079 O GLN A 130 -18.028 0.039 -1.639 1.00 0.00 O ATOM 2080 CB GLN A 130 -17.474 -1.927 -4.193 1.00 0.00 C ATOM 2081 CG GLN A 130 -17.006 -2.022 -5.636 1.00 0.00 C ATOM 2082 CD GLN A 130 -17.598 -0.937 -6.514 1.00 0.00 C ATOM 2083 OE1 GLN A 130 -18.678 -0.415 -6.234 1.00 0.00 O ATOM 2084 NE2 GLN A 130 -16.893 -0.591 -7.585 1.00 0.00 N ATOM 0 H GLN A 130 -15.059 -2.220 -3.799 1.00 0.00 H new ATOM 0 HA GLN A 130 -16.712 0.045 -3.804 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -17.421 -2.915 -3.737 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -18.521 -1.625 -4.178 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -15.918 -1.956 -5.666 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -17.277 -2.998 -6.038 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -16.003 -1.049 -7.779 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -17.242 0.133 -8.213 1.00 0.00 H new ATOM 2093 N GLU A 131 -16.854 -1.801 -1.088 1.00 0.00 N ATOM 2094 CA GLU A 131 -17.340 -1.832 0.286 1.00 0.00 C ATOM 2095 C GLU A 131 -17.518 -0.419 0.833 1.00 0.00 C ATOM 2096 O GLU A 131 -18.593 -0.058 1.314 1.00 0.00 O ATOM 2097 CB GLU A 131 -16.372 -2.616 1.175 1.00 0.00 C ATOM 2098 CG GLU A 131 -16.146 -4.047 0.714 1.00 0.00 C ATOM 2099 CD GLU A 131 -15.774 -4.974 1.855 1.00 0.00 C ATOM 2100 OE1 GLU A 131 -14.596 -4.963 2.269 1.00 0.00 O ATOM 2101 OE2 GLU A 131 -16.661 -5.712 2.333 1.00 0.00 O ATOM 0 H GLU A 131 -16.204 -2.552 -1.323 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.310 -2.329 0.290 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.414 -2.096 1.202 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.757 -2.628 2.195 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -17.050 -4.416 0.230 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -15.355 -4.063 -0.035 1.00 0.00 H new ATOM 2108 N LEU A 132 -16.457 0.377 0.756 1.00 0.00 N ATOM 2109 CA LEU A 132 -16.495 1.751 1.243 1.00 0.00 C ATOM 2110 C LEU A 132 -17.552 2.563 0.501 1.00 0.00 C ATOM 2111 O LEU A 132 -18.395 3.216 1.118 1.00 0.00 O ATOM 2112 CB LEU A 132 -15.123 2.409 1.079 1.00 0.00 C ATOM 2113 CG LEU A 132 -13.960 1.723 1.797 1.00 0.00 C ATOM 2114 CD1 LEU A 132 -14.430 1.106 3.106 1.00 0.00 C ATOM 2115 CD2 LEU A 132 -13.330 0.666 0.903 1.00 0.00 C ATOM 0 H LEU A 132 -15.560 0.094 0.361 1.00 0.00 H new ATOM 0 HA LEU A 132 -16.757 1.728 2.301 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -14.890 2.457 0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.190 3.436 1.437 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.204 2.475 2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -13.589 0.622 3.603 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -14.833 1.886 3.752 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -15.205 0.367 2.902 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.504 0.188 1.430 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.077 -0.084 0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -12.956 1.135 -0.007 1.00 0.00 H new ATOM 2127 N LEU A 133 -17.503 2.517 -0.825 1.00 0.00 N ATOM 2128 CA LEU A 133 -18.458 3.247 -1.652 1.00 0.00 C ATOM 2129 C LEU A 133 -19.891 2.887 -1.275 1.00 0.00 C ATOM 2130 O LEU A 133 -20.672 3.748 -0.871 1.00 0.00 O ATOM 2131 CB LEU A 133 -18.217 2.944 -3.132 1.00 0.00 C ATOM 2132 CG LEU A 133 -17.090 3.729 -3.803 1.00 0.00 C ATOM 2133 CD1 LEU A 133 -16.825 3.194 -5.202 1.00 0.00 C ATOM 2134 CD2 LEU A 133 -17.428 5.212 -3.853 1.00 0.00 C ATOM 0 H LEU A 133 -16.812 1.982 -1.351 1.00 0.00 H new ATOM 0 HA LEU A 133 -18.312 4.313 -1.477 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -18.003 1.880 -3.234 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -19.141 3.137 -3.677 1.00 0.00 H new ATOM 0 HG LEU A 133 -16.184 3.603 -3.210 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -16.020 3.765 -5.664 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -16.537 2.144 -5.142 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -17.728 3.288 -5.805 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -16.614 5.755 -4.334 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -18.347 5.357 -4.422 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -17.566 5.588 -2.839 1.00 0.00 H new