USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 967 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 LYS NZ :NH3+ -175:sc= 0.719 (180deg=0) USER MOD Set 1.2: A 107 HIS : no HE2:sc= 0.785 K(o=1.4,f=-3.2) USER MOD Set 1.3: A 111 ASN : amide:sc= -0.0995 K(o=1.4,f=0.49) USER MOD Set 2.1: A 60 ASN : amide:sc= -0.0573 K(o=-0.055,f=-2.4) USER MOD Set 2.2: A 62 THR OG1 : rot 180:sc= 0.00257 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.225 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -175:sc= 1.33 (180deg=1.2) USER MOD Single : A 26 THR OG1 : rot -47:sc= 1.26 USER MOD Single : A 28 THR OG1 : rot -69:sc= 0.285 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.00454 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 74:sc= 0.841 USER MOD Single : A 36 MET CE :methyl -172:sc= 0 (180deg=-0.0446) USER MOD Single : A 38 SER OG : rot 72:sc= 1.21 USER MOD Single : A 41 GLN : amide:sc= -0.054 X(o=-0.054,f=-0.054) USER MOD Single : A 42 ASN : amide:sc= 0.0512 K(o=0.051,f=-1.4) USER MOD Single : A 44 THR OG1 : rot -95:sc= 1.66 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 MET CE :methyl 164:sc= 0 (180deg=-0.0279) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 64:sc= 0.65 USER MOD Single : A 71 MET CE :methyl -171:sc= -3.07! (180deg=-3.29!) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.0456 K(o=-0.046,f=-4.1!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= -0.455 USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.00445 USER MOD Single : A 115 LYS NZ :NH3+ -107:sc= 1.3 (180deg=-0.553) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.0416 USER MOD Single : A 124 MET CE :methyl -173:sc= -1.16 (180deg=-1.21) USER MOD Single : A 135 GLN : amide:sc=-7.65e-05 K(o=-7.6e-05,f=-0.51) USER MOD Single : A 137 ASN : amide:sc= -0.323 K(o=-0.32,f=-3.7!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0198 K(o=-0.02,f=-1.7) USER MOD Single : A 144 MET CE :methyl 178:sc=-0.00384 (180deg=-0.00841) USER MOD Single : A 145 MET CE :methyl 162:sc= -0.148 (180deg=-0.536) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -12.592 17.587 -0.112 1.00 0.00 N ATOM 59 CA THR A 5 -13.281 18.512 -0.957 1.00 0.00 C ATOM 60 C THR A 5 -14.591 17.910 -1.333 1.00 0.00 C ATOM 61 O THR A 5 -14.783 16.708 -1.153 1.00 0.00 O ATOM 62 CB THR A 5 -12.590 18.975 -2.205 1.00 0.00 C ATOM 63 OG1 THR A 5 -12.462 17.919 -3.145 1.00 0.00 O ATOM 64 CG2 THR A 5 -11.203 19.617 -2.028 1.00 0.00 C ATOM 0 HA THR A 5 -13.358 19.417 -0.355 1.00 0.00 H new ATOM 0 HB THR A 5 -13.251 19.766 -2.560 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.010 18.250 -3.949 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.810 19.909 -3.002 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.288 20.498 -1.393 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.526 18.899 -1.564 1.00 0.00 H new ATOM 72 N GLU A 6 -15.546 18.749 -1.770 1.00 0.00 N ATOM 73 CA GLU A 6 -16.831 18.295 -2.205 1.00 0.00 C ATOM 74 C GLU A 6 -16.702 17.283 -3.291 1.00 0.00 C ATOM 75 O GLU A 6 -17.266 16.203 -3.122 1.00 0.00 O ATOM 76 CB GLU A 6 -17.714 19.467 -2.664 1.00 0.00 C ATOM 77 CG GLU A 6 -17.823 20.581 -1.621 1.00 0.00 C ATOM 78 CD GLU A 6 -18.552 20.104 -0.372 1.00 0.00 C ATOM 79 OE1 GLU A 6 -19.748 19.737 -0.520 1.00 0.00 O ATOM 80 OE2 GLU A 6 -18.048 20.045 0.781 1.00 0.00 O ATOM 0 H GLU A 6 -15.425 19.760 -1.823 1.00 0.00 H new ATOM 0 HA GLU A 6 -17.316 17.822 -1.351 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -17.308 19.880 -3.587 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -18.712 19.094 -2.894 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -16.825 20.928 -1.352 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -18.352 21.432 -2.050 1.00 0.00 H new ATOM 87 N GLU A 7 -15.951 17.510 -4.384 1.00 0.00 N ATOM 88 CA GLU A 7 -15.650 16.637 -5.476 1.00 0.00 C ATOM 89 C GLU A 7 -15.211 15.291 -5.010 1.00 0.00 C ATOM 90 O GLU A 7 -15.671 14.322 -5.613 1.00 0.00 O ATOM 91 CB GLU A 7 -14.646 17.235 -6.475 1.00 0.00 C ATOM 92 CG GLU A 7 -15.103 18.536 -7.138 1.00 0.00 C ATOM 93 CD GLU A 7 -16.160 18.264 -8.199 1.00 0.00 C ATOM 94 OE1 GLU A 7 -16.436 17.109 -8.620 1.00 0.00 O ATOM 95 OE2 GLU A 7 -16.707 19.285 -8.695 1.00 0.00 O ATOM 0 H GLU A 7 -15.502 18.417 -4.514 1.00 0.00 H new ATOM 0 HA GLU A 7 -16.588 16.514 -6.018 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.704 17.418 -5.958 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.445 16.498 -7.252 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.505 19.211 -6.383 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -14.248 19.038 -7.591 1.00 0.00 H new ATOM 102 N GLN A 8 -14.342 15.273 -3.984 1.00 0.00 N ATOM 103 CA GLN A 8 -13.796 14.045 -3.496 1.00 0.00 C ATOM 104 C GLN A 8 -14.802 13.195 -2.801 1.00 0.00 C ATOM 105 O GLN A 8 -14.956 12.058 -3.245 1.00 0.00 O ATOM 106 CB GLN A 8 -12.660 14.237 -2.477 1.00 0.00 C ATOM 107 CG GLN A 8 -11.391 14.741 -3.166 1.00 0.00 C ATOM 108 CD GLN A 8 -10.188 14.860 -2.242 1.00 0.00 C ATOM 109 OE1 GLN A 8 -10.335 15.156 -1.057 1.00 0.00 O ATOM 110 NE2 GLN A 8 -8.958 14.599 -2.758 1.00 0.00 N ATOM 0 H GLN A 8 -14.018 16.106 -3.493 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.428 13.569 -4.405 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.969 14.947 -1.710 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.455 13.293 -1.972 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.142 14.065 -3.984 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.594 15.716 -3.609 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.860 14.355 -3.744 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.133 14.647 -2.160 1.00 0.00 H new ATOM 119 N ILE A 9 -15.688 13.763 -1.963 1.00 0.00 N ATOM 120 CA ILE A 9 -16.750 13.001 -1.383 1.00 0.00 C ATOM 121 C ILE A 9 -17.797 12.637 -2.379 1.00 0.00 C ATOM 122 O ILE A 9 -18.319 11.524 -2.327 1.00 0.00 O ATOM 123 CB ILE A 9 -17.414 13.836 -0.328 1.00 0.00 C ATOM 124 CG1 ILE A 9 -16.340 14.248 0.693 1.00 0.00 C ATOM 125 CG2 ILE A 9 -18.554 13.002 0.280 1.00 0.00 C ATOM 126 CD1 ILE A 9 -16.943 14.857 1.958 1.00 0.00 C ATOM 0 H ILE A 9 -15.669 14.745 -1.688 1.00 0.00 H new ATOM 0 HA ILE A 9 -16.314 12.086 -0.982 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.855 14.752 -0.721 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.744 13.376 0.961 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -15.663 14.968 0.234 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.058 13.583 1.053 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.268 12.739 -0.500 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -18.145 12.092 0.719 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -16.144 15.131 2.647 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -17.517 15.746 1.696 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.599 14.129 2.435 1.00 0.00 H new ATOM 138 N ALA A 10 -18.034 13.517 -3.368 1.00 0.00 N ATOM 139 CA ALA A 10 -18.943 13.278 -4.445 1.00 0.00 C ATOM 140 C ALA A 10 -18.479 12.175 -5.332 1.00 0.00 C ATOM 141 O ALA A 10 -19.229 11.330 -5.820 1.00 0.00 O ATOM 142 CB ALA A 10 -19.309 14.554 -5.221 1.00 0.00 C ATOM 0 H ALA A 10 -17.576 14.427 -3.419 1.00 0.00 H new ATOM 0 HA ALA A 10 -19.874 12.941 -3.990 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -20.002 14.305 -6.025 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -19.779 15.268 -4.545 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.406 14.994 -5.644 1.00 0.00 H new ATOM 148 N GLU A 11 -17.172 12.084 -5.635 1.00 0.00 N ATOM 149 CA GLU A 11 -16.589 10.970 -6.317 1.00 0.00 C ATOM 150 C GLU A 11 -16.678 9.652 -5.626 1.00 0.00 C ATOM 151 O GLU A 11 -17.024 8.617 -6.193 1.00 0.00 O ATOM 152 CB GLU A 11 -15.106 11.218 -6.639 1.00 0.00 C ATOM 153 CG GLU A 11 -14.503 10.206 -7.615 1.00 0.00 C ATOM 154 CD GLU A 11 -13.010 10.433 -7.801 1.00 0.00 C ATOM 155 OE1 GLU A 11 -12.276 10.414 -6.777 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.548 10.697 -8.943 1.00 0.00 O ATOM 0 H GLU A 11 -16.497 12.811 -5.397 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.201 10.901 -7.216 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.998 12.219 -7.057 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.535 11.197 -5.711 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -14.675 9.195 -7.245 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -15.007 10.283 -8.579 1.00 0.00 H new ATOM 163 N PHE A 12 -16.408 9.689 -4.309 1.00 0.00 N ATOM 164 CA PHE A 12 -16.568 8.554 -3.454 1.00 0.00 C ATOM 165 C PHE A 12 -17.986 8.107 -3.361 1.00 0.00 C ATOM 166 O PHE A 12 -18.292 6.941 -3.114 1.00 0.00 O ATOM 167 CB PHE A 12 -15.934 8.696 -2.060 1.00 0.00 C ATOM 168 CG PHE A 12 -14.484 9.035 -1.996 1.00 0.00 C ATOM 169 CD1 PHE A 12 -13.655 8.890 -3.084 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.010 9.299 -0.733 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.312 9.094 -2.866 1.00 0.00 C ATOM 172 CE2 PHE A 12 -12.666 9.540 -0.566 1.00 0.00 C ATOM 173 CZ PHE A 12 -11.818 9.494 -1.647 1.00 0.00 C ATOM 0 H PHE A 12 -16.072 10.524 -3.829 1.00 0.00 H new ATOM 0 HA PHE A 12 -15.996 7.770 -3.950 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.484 9.465 -1.517 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.084 7.758 -1.525 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.039 8.629 -4.059 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -14.681 9.317 0.113 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -11.622 8.934 -3.681 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.277 9.766 0.416 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.779 9.768 -1.540 1.00 0.00 H new ATOM 183 N LYS A 13 -18.910 9.063 -3.564 1.00 0.00 N ATOM 184 CA LYS A 13 -20.313 8.875 -3.359 1.00 0.00 C ATOM 185 C LYS A 13 -20.881 8.185 -4.551 1.00 0.00 C ATOM 186 O LYS A 13 -21.616 7.216 -4.368 1.00 0.00 O ATOM 187 CB LYS A 13 -20.971 10.234 -3.067 1.00 0.00 C ATOM 188 CG LYS A 13 -22.443 10.137 -2.659 1.00 0.00 C ATOM 189 CD LYS A 13 -23.146 11.369 -2.088 1.00 0.00 C ATOM 190 CE LYS A 13 -23.195 12.604 -2.991 1.00 0.00 C ATOM 191 NZ LYS A 13 -23.954 13.679 -2.314 1.00 0.00 N ATOM 0 H LYS A 13 -18.671 10.002 -3.883 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.510 8.242 -2.494 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.416 10.732 -2.272 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -20.891 10.863 -3.953 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.005 9.817 -3.536 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -22.526 9.341 -1.919 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -24.169 11.091 -1.833 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -22.649 11.645 -1.158 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -22.184 12.944 -3.216 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -23.666 12.354 -3.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -23.988 14.519 -2.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -24.922 13.352 -2.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -23.486 13.923 -1.418 1.00 0.00 H new ATOM 205 N GLU A 14 -20.514 8.639 -5.762 1.00 0.00 N ATOM 206 CA GLU A 14 -20.728 8.029 -7.038 1.00 0.00 C ATOM 207 C GLU A 14 -19.960 6.764 -7.213 1.00 0.00 C ATOM 208 O GLU A 14 -20.530 5.804 -7.728 1.00 0.00 O ATOM 209 CB GLU A 14 -20.226 8.928 -8.181 1.00 0.00 C ATOM 210 CG GLU A 14 -21.004 10.229 -8.393 1.00 0.00 C ATOM 211 CD GLU A 14 -20.429 10.960 -9.598 1.00 0.00 C ATOM 212 OE1 GLU A 14 -19.214 11.290 -9.627 1.00 0.00 O ATOM 213 OE2 GLU A 14 -21.188 11.151 -10.586 1.00 0.00 O ATOM 0 H GLU A 14 -20.016 9.525 -5.854 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.803 7.853 -7.072 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.182 9.177 -7.991 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.253 8.355 -9.108 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -22.061 10.014 -8.552 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.937 10.857 -7.505 1.00 0.00 H new ATOM 220 N ALA A 15 -18.742 6.591 -6.670 1.00 0.00 N ATOM 221 CA ALA A 15 -18.021 5.359 -6.740 1.00 0.00 C ATOM 222 C ALA A 15 -18.734 4.238 -6.064 1.00 0.00 C ATOM 223 O ALA A 15 -18.912 3.166 -6.640 1.00 0.00 O ATOM 224 CB ALA A 15 -16.624 5.588 -6.138 1.00 0.00 C ATOM 0 H ALA A 15 -18.245 7.328 -6.169 1.00 0.00 H new ATOM 0 HA ALA A 15 -17.934 5.057 -7.784 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.053 4.660 -6.180 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.105 6.360 -6.707 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.723 5.907 -5.100 1.00 0.00 H new ATOM 230 N PHE A 16 -19.485 4.680 -5.040 1.00 0.00 N ATOM 231 CA PHE A 16 -20.325 3.817 -4.269 1.00 0.00 C ATOM 232 C PHE A 16 -21.580 3.382 -4.945 1.00 0.00 C ATOM 233 O PHE A 16 -21.977 2.220 -4.873 1.00 0.00 O ATOM 234 CB PHE A 16 -20.831 4.459 -2.966 1.00 0.00 C ATOM 235 CG PHE A 16 -21.268 3.484 -1.927 1.00 0.00 C ATOM 236 CD1 PHE A 16 -22.547 2.983 -1.982 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.471 3.266 -0.828 1.00 0.00 C ATOM 238 CE1 PHE A 16 -22.991 2.096 -1.028 1.00 0.00 C ATOM 239 CE2 PHE A 16 -20.961 2.447 0.163 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.149 1.773 0.010 1.00 0.00 C ATOM 0 H PHE A 16 -19.509 5.655 -4.742 1.00 0.00 H new ATOM 0 HA PHE A 16 -19.652 2.976 -4.101 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.039 5.082 -2.551 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.666 5.119 -3.201 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.208 3.288 -2.780 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.495 3.721 -0.746 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -23.978 1.663 -1.093 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.401 2.331 1.079 1.00 0.00 H new ATOM 0 HZ PHE A 16 -22.421 0.991 0.704 1.00 0.00 H new ATOM 250 N SER A 17 -22.242 4.314 -5.654 1.00 0.00 N ATOM 251 CA SER A 17 -23.377 3.945 -6.441 1.00 0.00 C ATOM 252 C SER A 17 -23.128 3.060 -7.613 1.00 0.00 C ATOM 253 O SER A 17 -23.989 2.359 -8.141 1.00 0.00 O ATOM 254 CB SER A 17 -24.191 5.076 -7.093 1.00 0.00 C ATOM 255 OG SER A 17 -24.559 6.044 -6.121 1.00 0.00 O ATOM 0 H SER A 17 -21.998 5.304 -5.683 1.00 0.00 H new ATOM 0 HA SER A 17 -23.910 3.453 -5.627 1.00 0.00 H new ATOM 0 HB2 SER A 17 -23.604 5.548 -7.881 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.085 4.665 -7.563 1.00 0.00 H new ATOM 0 HG SER A 17 -25.075 6.758 -6.550 1.00 0.00 H new ATOM 261 N LEU A 18 -21.875 3.023 -8.100 1.00 0.00 N ATOM 262 CA LEU A 18 -21.580 2.015 -9.071 1.00 0.00 C ATOM 263 C LEU A 18 -21.259 0.745 -8.361 1.00 0.00 C ATOM 264 O LEU A 18 -21.205 -0.340 -8.939 1.00 0.00 O ATOM 265 CB LEU A 18 -20.234 2.414 -9.700 1.00 0.00 C ATOM 266 CG LEU A 18 -20.264 3.634 -10.636 1.00 0.00 C ATOM 267 CD1 LEU A 18 -18.857 4.118 -11.025 1.00 0.00 C ATOM 268 CD2 LEU A 18 -20.890 3.177 -11.964 1.00 0.00 C ATOM 0 H LEU A 18 -21.110 3.647 -7.844 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.409 1.910 -9.771 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -19.525 2.614 -8.897 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.849 1.561 -10.259 1.00 0.00 H new ATOM 0 HG LEU A 18 -20.803 4.427 -10.117 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -18.939 4.981 -11.686 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -18.308 4.400 -10.127 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -18.326 3.317 -11.538 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.929 4.018 -12.656 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -20.286 2.379 -12.396 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -21.900 2.810 -11.783 1.00 0.00 H new ATOM 280 N PHE A 19 -21.029 0.759 -7.036 1.00 0.00 N ATOM 281 CA PHE A 19 -20.825 -0.453 -6.306 1.00 0.00 C ATOM 282 C PHE A 19 -22.097 -1.139 -5.942 1.00 0.00 C ATOM 283 O PHE A 19 -22.171 -2.363 -6.037 1.00 0.00 O ATOM 284 CB PHE A 19 -19.868 -0.235 -5.122 1.00 0.00 C ATOM 285 CG PHE A 19 -18.461 0.047 -5.524 1.00 0.00 C ATOM 286 CD1 PHE A 19 -17.923 -0.620 -6.600 1.00 0.00 C ATOM 287 CD2 PHE A 19 -17.584 0.779 -4.759 1.00 0.00 C ATOM 288 CE1 PHE A 19 -16.592 -0.532 -6.934 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.264 0.965 -5.098 1.00 0.00 C ATOM 290 CZ PHE A 19 -15.786 0.318 -6.213 1.00 0.00 C ATOM 0 H PHE A 19 -20.984 1.607 -6.471 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.328 -1.156 -6.975 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.236 0.595 -4.519 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -19.883 -1.121 -4.488 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.571 -1.236 -7.206 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -17.949 1.230 -3.848 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.188 -1.118 -7.746 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -15.622 1.600 -4.506 1.00 0.00 H new ATOM 0 HZ PHE A 19 -14.765 0.479 -6.527 1.00 0.00 H new ATOM 300 N ASP A 20 -23.064 -0.348 -5.445 1.00 0.00 N ATOM 301 CA ASP A 20 -24.287 -0.881 -4.930 1.00 0.00 C ATOM 302 C ASP A 20 -25.108 -1.225 -6.125 1.00 0.00 C ATOM 303 O ASP A 20 -25.268 -0.405 -7.027 1.00 0.00 O ATOM 304 CB ASP A 20 -24.903 0.173 -3.995 1.00 0.00 C ATOM 305 CG ASP A 20 -26.065 -0.380 -3.182 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.342 -1.606 -3.273 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.618 0.376 -2.339 1.00 0.00 O ATOM 0 H ASP A 20 -22.998 0.669 -5.400 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.182 -1.782 -4.326 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.135 0.547 -3.318 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.248 1.022 -4.586 1.00 0.00 H new ATOM 312 N LYS A 21 -25.565 -2.490 -6.120 1.00 0.00 N ATOM 313 CA LYS A 21 -26.183 -3.080 -7.267 1.00 0.00 C ATOM 314 C LYS A 21 -27.663 -3.078 -7.095 1.00 0.00 C ATOM 315 O LYS A 21 -28.358 -2.746 -8.054 1.00 0.00 O ATOM 316 CB LYS A 21 -25.611 -4.489 -7.495 1.00 0.00 C ATOM 317 CG LYS A 21 -24.085 -4.557 -7.587 1.00 0.00 C ATOM 318 CD LYS A 21 -23.474 -3.849 -8.798 1.00 0.00 C ATOM 319 CE LYS A 21 -21.950 -3.930 -8.904 1.00 0.00 C ATOM 320 NZ LYS A 21 -21.462 -2.881 -9.827 1.00 0.00 N ATOM 0 H LYS A 21 -25.505 -3.110 -5.312 1.00 0.00 H new ATOM 0 HA LYS A 21 -25.963 -2.496 -8.161 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.941 -5.135 -6.682 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.034 -4.893 -8.415 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -23.663 -4.123 -6.681 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -23.784 -5.605 -7.609 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -23.908 -4.274 -9.703 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -23.764 -2.799 -8.768 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -21.499 -3.802 -7.920 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -21.652 -4.914 -9.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -20.437 -2.990 -9.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -21.946 -2.972 -10.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -21.659 -1.943 -9.423 1.00 0.00 H new ATOM 334 N ASP A 22 -28.267 -3.408 -5.939 1.00 0.00 N ATOM 335 CA ASP A 22 -29.682 -3.279 -5.779 1.00 0.00 C ATOM 336 C ASP A 22 -30.192 -1.894 -5.571 1.00 0.00 C ATOM 337 O ASP A 22 -30.951 -1.353 -6.372 1.00 0.00 O ATOM 338 CB ASP A 22 -30.343 -4.211 -4.749 1.00 0.00 C ATOM 339 CG ASP A 22 -29.686 -4.321 -3.381 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.654 -3.612 -3.241 1.00 0.00 O ATOM 341 OD2 ASP A 22 -30.178 -5.081 -2.505 1.00 0.00 O ATOM 0 H ASP A 22 -27.777 -3.763 -5.118 1.00 0.00 H new ATOM 0 HA ASP A 22 -29.992 -3.610 -6.770 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.370 -3.877 -4.603 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.391 -5.211 -5.181 1.00 0.00 H new ATOM 346 N GLY A 23 -29.652 -1.227 -4.535 1.00 0.00 N ATOM 347 CA GLY A 23 -29.508 0.193 -4.440 1.00 0.00 C ATOM 348 C GLY A 23 -29.778 0.737 -3.079 1.00 0.00 C ATOM 349 O GLY A 23 -30.474 1.751 -3.053 1.00 0.00 O ATOM 0 H GLY A 23 -29.293 -1.711 -3.712 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.495 0.466 -4.736 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.186 0.666 -5.151 1.00 0.00 H new ATOM 353 N ASP A 24 -29.534 -0.071 -2.032 1.00 0.00 N ATOM 354 CA ASP A 24 -30.226 0.093 -0.791 1.00 0.00 C ATOM 355 C ASP A 24 -29.578 1.152 0.033 1.00 0.00 C ATOM 356 O ASP A 24 -30.319 1.826 0.747 1.00 0.00 O ATOM 357 CB ASP A 24 -30.406 -1.234 -0.033 1.00 0.00 C ATOM 358 CG ASP A 24 -29.087 -1.862 0.393 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.229 -2.093 -0.501 1.00 0.00 O ATOM 360 OD2 ASP A 24 -28.864 -2.063 1.617 1.00 0.00 O ATOM 0 H ASP A 24 -28.859 -0.836 -2.044 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.238 0.429 -1.016 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.021 -1.061 0.850 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -30.948 -1.936 -0.666 1.00 0.00 H new ATOM 365 N GLY A 25 -28.234 1.173 -0.013 1.00 0.00 N ATOM 366 CA GLY A 25 -27.465 1.829 0.998 1.00 0.00 C ATOM 367 C GLY A 25 -26.239 1.086 1.401 1.00 0.00 C ATOM 368 O GLY A 25 -25.387 1.629 2.103 1.00 0.00 O ATOM 0 H GLY A 25 -27.680 0.736 -0.750 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.177 2.817 0.638 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.092 1.980 1.877 1.00 0.00 H new ATOM 372 N THR A 26 -26.167 -0.229 1.126 1.00 0.00 N ATOM 373 CA THR A 26 -25.164 -1.061 1.714 1.00 0.00 C ATOM 374 C THR A 26 -24.455 -1.912 0.717 1.00 0.00 C ATOM 375 O THR A 26 -25.041 -2.301 -0.292 1.00 0.00 O ATOM 376 CB THR A 26 -25.505 -1.900 2.910 1.00 0.00 C ATOM 377 OG1 THR A 26 -26.481 -2.861 2.533 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.072 -1.054 4.063 1.00 0.00 C ATOM 0 H THR A 26 -26.804 -0.716 0.496 1.00 0.00 H new ATOM 0 HA THR A 26 -24.519 -0.280 2.117 1.00 0.00 H new ATOM 0 HB THR A 26 -24.589 -2.379 3.256 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.192 -2.422 2.022 1.00 0.00 H new ATOM 0 HG21 THR A 26 -26.305 -1.701 4.909 1.00 0.00 H new ATOM 0 HG22 THR A 26 -25.334 -0.312 4.367 1.00 0.00 H new ATOM 0 HG23 THR A 26 -26.979 -0.549 3.732 1.00 0.00 H new ATOM 386 N ILE A 27 -23.140 -2.116 0.907 1.00 0.00 N ATOM 387 CA ILE A 27 -22.379 -3.077 0.171 1.00 0.00 C ATOM 388 C ILE A 27 -22.260 -4.349 0.937 1.00 0.00 C ATOM 389 O ILE A 27 -21.799 -4.419 2.075 1.00 0.00 O ATOM 390 CB ILE A 27 -21.106 -2.617 -0.475 1.00 0.00 C ATOM 391 CG1 ILE A 27 -20.916 -1.093 -0.560 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.873 -3.293 -1.837 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.552 -0.729 -1.146 1.00 0.00 C ATOM 0 H ILE A 27 -22.590 -1.598 1.592 1.00 0.00 H new ATOM 0 HA ILE A 27 -22.972 -3.264 -0.724 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.330 -2.948 0.215 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.705 -0.661 -1.176 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.014 -0.657 0.434 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.940 -2.930 -2.268 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.814 -4.373 -1.702 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.699 -3.055 -2.507 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.453 0.356 -1.191 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -18.764 -1.139 -0.515 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.465 -1.143 -2.151 1.00 0.00 H new ATOM 405 N THR A 28 -22.741 -5.380 0.220 1.00 0.00 N ATOM 406 CA THR A 28 -22.693 -6.704 0.759 1.00 0.00 C ATOM 407 C THR A 28 -21.511 -7.470 0.274 1.00 0.00 C ATOM 408 O THR A 28 -20.833 -7.006 -0.642 1.00 0.00 O ATOM 409 CB THR A 28 -23.955 -7.428 0.397 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.239 -7.502 -0.993 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.203 -6.754 0.992 1.00 0.00 C ATOM 0 H THR A 28 -23.153 -5.303 -0.710 1.00 0.00 H new ATOM 0 HA THR A 28 -22.599 -6.622 1.842 1.00 0.00 H new ATOM 0 HB THR A 28 -23.761 -8.423 0.798 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.472 -6.611 -1.327 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.092 -7.314 0.703 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.123 -6.736 2.079 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.279 -5.733 0.617 1.00 0.00 H new ATOM 419 N THR A 29 -21.164 -8.626 0.868 1.00 0.00 N ATOM 420 CA THR A 29 -20.118 -9.512 0.459 1.00 0.00 C ATOM 421 C THR A 29 -20.276 -9.919 -0.965 1.00 0.00 C ATOM 422 O THR A 29 -19.310 -9.812 -1.719 1.00 0.00 O ATOM 423 CB THR A 29 -19.970 -10.699 1.364 1.00 0.00 C ATOM 424 OG1 THR A 29 -21.176 -11.266 1.854 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.073 -10.245 2.528 1.00 0.00 C ATOM 0 H THR A 29 -21.652 -8.966 1.697 1.00 0.00 H new ATOM 0 HA THR A 29 -19.187 -8.951 0.543 1.00 0.00 H new ATOM 0 HB THR A 29 -19.540 -11.510 0.776 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.967 -12.031 2.430 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.930 -11.073 3.222 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.106 -9.927 2.139 1.00 0.00 H new ATOM 0 HG23 THR A 29 -19.546 -9.413 3.049 1.00 0.00 H new ATOM 433 N LYS A 30 -21.501 -10.284 -1.385 1.00 0.00 N ATOM 434 CA LYS A 30 -21.845 -10.487 -2.758 1.00 0.00 C ATOM 435 C LYS A 30 -21.676 -9.318 -3.666 1.00 0.00 C ATOM 436 O LYS A 30 -21.331 -9.411 -4.842 1.00 0.00 O ATOM 437 CB LYS A 30 -23.271 -11.021 -2.969 1.00 0.00 C ATOM 438 CG LYS A 30 -24.492 -10.124 -2.753 1.00 0.00 C ATOM 439 CD LYS A 30 -25.834 -10.751 -3.137 1.00 0.00 C ATOM 440 CE LYS A 30 -27.085 -9.935 -2.805 1.00 0.00 C ATOM 441 NZ LYS A 30 -27.519 -10.027 -1.393 1.00 0.00 N ATOM 0 H LYS A 30 -22.279 -10.443 -0.746 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.103 -11.236 -3.034 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.324 -11.391 -3.993 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.389 -11.883 -2.312 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -24.531 -9.836 -1.702 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -24.358 -9.209 -3.330 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.827 -10.944 -4.210 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.914 -11.718 -2.640 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -26.896 -8.889 -3.047 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -27.902 -10.268 -3.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -28.371 -9.447 -1.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -27.733 -11.018 -1.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -26.759 -9.681 -0.773 1.00 0.00 H new ATOM 455 N GLU A 31 -21.830 -8.059 -3.217 1.00 0.00 N ATOM 456 CA GLU A 31 -21.621 -6.920 -4.057 1.00 0.00 C ATOM 457 C GLU A 31 -20.180 -6.586 -4.231 1.00 0.00 C ATOM 458 O GLU A 31 -19.719 -6.061 -5.243 1.00 0.00 O ATOM 459 CB GLU A 31 -22.533 -5.721 -3.746 1.00 0.00 C ATOM 460 CG GLU A 31 -24.029 -5.963 -3.961 1.00 0.00 C ATOM 461 CD GLU A 31 -24.905 -4.963 -3.221 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.743 -4.730 -1.993 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.868 -4.448 -3.850 1.00 0.00 O ATOM 0 H GLU A 31 -22.102 -7.829 -2.261 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.958 -7.226 -5.048 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.375 -5.425 -2.709 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -22.225 -4.880 -4.368 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -24.250 -5.912 -5.027 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.280 -6.971 -3.631 1.00 0.00 H new ATOM 470 N LEU A 32 -19.368 -6.714 -3.166 1.00 0.00 N ATOM 471 CA LEU A 32 -17.951 -6.523 -3.140 1.00 0.00 C ATOM 472 C LEU A 32 -17.384 -7.596 -4.005 1.00 0.00 C ATOM 473 O LEU A 32 -16.728 -7.421 -5.031 1.00 0.00 O ATOM 474 CB LEU A 32 -17.330 -6.634 -1.738 1.00 0.00 C ATOM 475 CG LEU A 32 -17.439 -5.473 -0.735 1.00 0.00 C ATOM 476 CD1 LEU A 32 -16.718 -5.918 0.549 1.00 0.00 C ATOM 477 CD2 LEU A 32 -16.783 -4.208 -1.314 1.00 0.00 C ATOM 0 H LEU A 32 -19.734 -6.972 -2.250 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.726 -5.513 -3.482 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.769 -7.511 -1.262 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.269 -6.842 -1.873 1.00 0.00 H new ATOM 0 HG LEU A 32 -18.482 -5.234 -0.526 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -16.771 -5.121 1.291 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -17.197 -6.814 0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.674 -6.135 0.323 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -16.867 -3.393 -0.595 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.731 -4.405 -1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -17.286 -3.928 -2.239 1.00 0.00 H new ATOM 489 N GLY A 33 -17.821 -8.839 -3.737 1.00 0.00 N ATOM 490 CA GLY A 33 -17.540 -10.025 -4.484 1.00 0.00 C ATOM 491 C GLY A 33 -17.713 -9.935 -5.961 1.00 0.00 C ATOM 492 O GLY A 33 -16.807 -10.097 -6.778 1.00 0.00 O ATOM 0 H GLY A 33 -18.419 -9.028 -2.933 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.512 -10.323 -4.278 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.183 -10.823 -4.113 1.00 0.00 H new ATOM 496 N THR A 34 -18.925 -9.566 -6.412 1.00 0.00 N ATOM 497 CA THR A 34 -19.231 -9.482 -7.807 1.00 0.00 C ATOM 498 C THR A 34 -18.358 -8.536 -8.556 1.00 0.00 C ATOM 499 O THR A 34 -17.925 -8.990 -9.614 1.00 0.00 O ATOM 500 CB THR A 34 -20.623 -8.992 -8.078 1.00 0.00 C ATOM 501 OG1 THR A 34 -21.610 -9.907 -7.625 1.00 0.00 O ATOM 502 CG2 THR A 34 -20.887 -8.886 -9.589 1.00 0.00 C ATOM 0 H THR A 34 -19.704 -9.322 -5.800 1.00 0.00 H new ATOM 0 HA THR A 34 -19.086 -10.510 -8.139 1.00 0.00 H new ATOM 0 HB THR A 34 -20.688 -8.033 -7.564 1.00 0.00 H new ATOM 0 HG1 THR A 34 -21.659 -9.877 -6.647 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.903 -8.529 -9.757 1.00 0.00 H new ATOM 0 HG22 THR A 34 -20.179 -8.187 -10.034 1.00 0.00 H new ATOM 0 HG23 THR A 34 -20.767 -9.867 -10.049 1.00 0.00 H new ATOM 510 N VAL A 35 -17.987 -7.384 -7.967 1.00 0.00 N ATOM 511 CA VAL A 35 -17.045 -6.492 -8.568 1.00 0.00 C ATOM 512 C VAL A 35 -15.640 -6.987 -8.611 1.00 0.00 C ATOM 513 O VAL A 35 -15.125 -6.880 -9.722 1.00 0.00 O ATOM 514 CB VAL A 35 -17.256 -5.234 -7.780 1.00 0.00 C ATOM 515 CG1 VAL A 35 -16.178 -4.185 -8.103 1.00 0.00 C ATOM 516 CG2 VAL A 35 -18.676 -4.728 -8.083 1.00 0.00 C ATOM 0 H VAL A 35 -18.344 -7.069 -7.065 1.00 0.00 H new ATOM 0 HA VAL A 35 -17.212 -6.356 -9.636 1.00 0.00 H new ATOM 0 HB VAL A 35 -17.162 -5.431 -6.712 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -16.359 -3.285 -7.516 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -15.195 -4.587 -7.858 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -16.216 -3.940 -9.164 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -18.863 -3.811 -7.524 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -18.771 -4.528 -9.150 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -19.403 -5.486 -7.790 1.00 0.00 H new ATOM 526 N MET A 36 -15.096 -7.704 -7.611 1.00 0.00 N ATOM 527 CA MET A 36 -13.793 -8.291 -7.639 1.00 0.00 C ATOM 528 C MET A 36 -13.701 -9.413 -8.616 1.00 0.00 C ATOM 529 O MET A 36 -12.737 -9.454 -9.379 1.00 0.00 O ATOM 530 CB MET A 36 -13.344 -8.589 -6.199 1.00 0.00 C ATOM 531 CG MET A 36 -12.631 -7.456 -5.458 1.00 0.00 C ATOM 532 SD MET A 36 -10.976 -7.050 -6.092 1.00 0.00 S ATOM 533 CE MET A 36 -10.637 -6.088 -4.590 1.00 0.00 C ATOM 0 H MET A 36 -15.592 -7.883 -6.738 1.00 0.00 H new ATOM 0 HA MET A 36 -13.060 -7.587 -8.034 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.222 -8.876 -5.620 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.680 -9.453 -6.221 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.252 -6.562 -5.507 1.00 0.00 H new ATOM 0 HG3 MET A 36 -12.545 -7.727 -4.406 1.00 0.00 H new ATOM 0 HE1 MET A 36 -9.696 -5.551 -4.707 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.444 -5.374 -4.425 1.00 0.00 H new ATOM 0 HE3 MET A 36 -10.567 -6.761 -3.735 1.00 0.00 H new ATOM 543 N ARG A 37 -14.694 -10.318 -8.657 1.00 0.00 N ATOM 544 CA ARG A 37 -14.689 -11.318 -9.679 1.00 0.00 C ATOM 545 C ARG A 37 -14.719 -10.791 -11.073 1.00 0.00 C ATOM 546 O ARG A 37 -14.187 -11.289 -12.064 1.00 0.00 O ATOM 547 CB ARG A 37 -15.781 -12.388 -9.511 1.00 0.00 C ATOM 548 CG ARG A 37 -15.857 -13.106 -8.162 1.00 0.00 C ATOM 549 CD ARG A 37 -14.567 -13.661 -7.554 1.00 0.00 C ATOM 550 NE ARG A 37 -14.063 -14.712 -8.482 1.00 0.00 N ATOM 551 CZ ARG A 37 -14.509 -15.999 -8.577 1.00 0.00 C ATOM 552 NH1 ARG A 37 -15.495 -16.548 -7.808 1.00 0.00 N ATOM 553 NH2 ARG A 37 -13.849 -16.797 -9.466 1.00 0.00 N ATOM 0 H ARG A 37 -15.478 -10.360 -8.005 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.718 -11.791 -9.532 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -16.746 -11.917 -9.698 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.638 -13.141 -10.286 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -16.291 -12.412 -7.442 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -16.557 -13.935 -8.267 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.828 -12.870 -7.430 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.756 -14.079 -6.565 1.00 0.00 H new ATOM 0 HE ARG A 37 -13.307 -14.442 -9.111 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -15.959 -15.985 -7.096 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -15.767 -17.521 -7.946 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -13.073 -16.421 -10.011 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -14.132 -17.770 -9.586 1.00 0.00 H new ATOM 567 N SER A 38 -15.236 -9.565 -11.265 1.00 0.00 N ATOM 568 CA SER A 38 -15.403 -8.945 -12.543 1.00 0.00 C ATOM 569 C SER A 38 -14.192 -8.195 -12.981 1.00 0.00 C ATOM 570 O SER A 38 -14.043 -7.879 -14.160 1.00 0.00 O ATOM 571 CB SER A 38 -16.527 -7.895 -12.546 1.00 0.00 C ATOM 572 OG SER A 38 -17.788 -8.492 -12.281 1.00 0.00 O ATOM 0 H SER A 38 -15.553 -8.978 -10.493 1.00 0.00 H new ATOM 0 HA SER A 38 -15.624 -9.781 -13.207 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.318 -7.132 -11.796 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.556 -7.392 -13.513 1.00 0.00 H new ATOM 0 HG SER A 38 -17.833 -8.757 -11.339 1.00 0.00 H new ATOM 578 N LEU A 39 -13.304 -7.743 -12.078 1.00 0.00 N ATOM 579 CA LEU A 39 -11.964 -7.297 -12.302 1.00 0.00 C ATOM 580 C LEU A 39 -10.984 -8.353 -12.684 1.00 0.00 C ATOM 581 O LEU A 39 -9.917 -8.029 -13.203 1.00 0.00 O ATOM 582 CB LEU A 39 -11.412 -6.531 -11.089 1.00 0.00 C ATOM 583 CG LEU A 39 -12.154 -5.255 -10.655 1.00 0.00 C ATOM 584 CD1 LEU A 39 -11.429 -4.709 -9.414 1.00 0.00 C ATOM 585 CD2 LEU A 39 -12.176 -4.232 -11.803 1.00 0.00 C ATOM 0 H LEU A 39 -13.553 -7.685 -11.091 1.00 0.00 H new ATOM 0 HA LEU A 39 -12.064 -6.642 -13.167 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -11.394 -7.214 -10.240 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -10.378 -6.262 -11.304 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.195 -5.467 -10.410 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.925 -3.801 -9.073 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.453 -5.456 -8.620 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.393 -4.483 -9.668 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -12.704 -3.335 -11.481 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -11.154 -3.972 -12.078 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -12.685 -4.663 -12.665 1.00 0.00 H new ATOM 597 N GLY A 40 -11.312 -9.616 -12.360 1.00 0.00 N ATOM 598 CA GLY A 40 -10.353 -10.663 -12.537 1.00 0.00 C ATOM 599 C GLY A 40 -9.841 -11.352 -11.319 1.00 0.00 C ATOM 600 O GLY A 40 -9.114 -12.337 -11.433 1.00 0.00 O ATOM 0 H GLY A 40 -12.215 -9.908 -11.986 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.797 -11.417 -13.186 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.498 -10.247 -13.070 1.00 0.00 H new ATOM 604 N GLN A 41 -10.251 -10.934 -10.108 1.00 0.00 N ATOM 605 CA GLN A 41 -9.501 -11.332 -8.958 1.00 0.00 C ATOM 606 C GLN A 41 -10.257 -12.485 -8.394 1.00 0.00 C ATOM 607 O GLN A 41 -11.452 -12.665 -8.624 1.00 0.00 O ATOM 608 CB GLN A 41 -9.428 -10.134 -7.996 1.00 0.00 C ATOM 609 CG GLN A 41 -8.660 -8.958 -8.602 1.00 0.00 C ATOM 610 CD GLN A 41 -7.194 -9.177 -8.948 1.00 0.00 C ATOM 611 OE1 GLN A 41 -6.855 -9.595 -10.054 1.00 0.00 O ATOM 612 NE2 GLN A 41 -6.256 -8.819 -8.030 1.00 0.00 N ATOM 0 H GLN A 41 -11.065 -10.346 -9.928 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.473 -11.628 -9.166 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.438 -9.814 -7.739 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.946 -10.443 -7.069 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.178 -8.651 -9.511 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.719 -8.123 -7.904 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.544 -8.473 -7.115 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.265 -8.896 -8.257 1.00 0.00 H new ATOM 621 N ASN A 42 -9.613 -13.229 -7.476 1.00 0.00 N ATOM 622 CA ASN A 42 -10.241 -14.272 -6.727 1.00 0.00 C ATOM 623 C ASN A 42 -10.056 -13.981 -5.277 1.00 0.00 C ATOM 624 O ASN A 42 -9.181 -14.587 -4.662 1.00 0.00 O ATOM 625 CB ASN A 42 -9.754 -15.667 -7.152 1.00 0.00 C ATOM 626 CG ASN A 42 -9.945 -15.867 -8.649 1.00 0.00 C ATOM 627 OD1 ASN A 42 -11.119 -15.995 -8.991 1.00 0.00 O ATOM 628 ND2 ASN A 42 -8.906 -16.087 -9.499 1.00 0.00 N ATOM 0 H ASN A 42 -8.627 -13.101 -7.249 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.310 -14.293 -6.937 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.701 -15.785 -6.895 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.303 -16.433 -6.604 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -9.086 -16.370 -10.462 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.947 -15.969 -9.173 1.00 0.00 H new ATOM 635 N PRO A 43 -10.895 -13.262 -4.592 1.00 0.00 N ATOM 636 CA PRO A 43 -11.048 -13.394 -3.172 1.00 0.00 C ATOM 637 C PRO A 43 -12.117 -14.412 -2.970 1.00 0.00 C ATOM 638 O PRO A 43 -13.019 -14.544 -3.795 1.00 0.00 O ATOM 639 CB PRO A 43 -11.482 -12.009 -2.699 1.00 0.00 C ATOM 640 CG PRO A 43 -12.257 -11.497 -3.923 1.00 0.00 C ATOM 641 CD PRO A 43 -11.563 -12.099 -5.155 1.00 0.00 C ATOM 0 HA PRO A 43 -10.156 -13.709 -2.630 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -12.108 -12.057 -1.808 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -10.631 -11.373 -2.457 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.302 -11.803 -3.877 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.245 -10.408 -3.963 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.277 -12.375 -5.931 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -10.857 -11.402 -5.606 1.00 0.00 H new ATOM 649 N THR A 44 -12.112 -14.944 -1.735 1.00 0.00 N ATOM 650 CA THR A 44 -13.315 -15.504 -1.201 1.00 0.00 C ATOM 651 C THR A 44 -14.180 -14.512 -0.502 1.00 0.00 C ATOM 652 O THR A 44 -13.810 -13.459 0.016 1.00 0.00 O ATOM 653 CB THR A 44 -13.050 -16.629 -0.245 1.00 0.00 C ATOM 654 OG1 THR A 44 -12.425 -16.260 0.976 1.00 0.00 O ATOM 655 CG2 THR A 44 -12.250 -17.722 -0.974 1.00 0.00 C ATOM 0 H THR A 44 -11.299 -14.987 -1.120 1.00 0.00 H new ATOM 0 HA THR A 44 -13.840 -15.873 -2.082 1.00 0.00 H new ATOM 0 HB THR A 44 -14.025 -17.002 0.068 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.456 -16.388 0.899 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.051 -18.546 -0.288 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.825 -18.088 -1.824 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.306 -17.308 -1.327 1.00 0.00 H new ATOM 663 N GLU A 45 -15.475 -14.865 -0.420 1.00 0.00 N ATOM 664 CA GLU A 45 -16.455 -14.134 0.321 1.00 0.00 C ATOM 665 C GLU A 45 -16.105 -14.072 1.769 1.00 0.00 C ATOM 666 O GLU A 45 -16.246 -13.004 2.362 1.00 0.00 O ATOM 667 CB GLU A 45 -17.876 -14.692 0.137 1.00 0.00 C ATOM 668 CG GLU A 45 -18.447 -14.387 -1.249 1.00 0.00 C ATOM 669 CD GLU A 45 -19.711 -15.165 -1.584 1.00 0.00 C ATOM 670 OE1 GLU A 45 -20.121 -16.019 -0.753 1.00 0.00 O ATOM 671 OE2 GLU A 45 -20.344 -14.810 -2.615 1.00 0.00 O ATOM 0 H GLU A 45 -15.853 -15.689 -0.887 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.450 -13.122 -0.084 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.863 -15.771 0.292 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.531 -14.268 0.898 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -18.661 -13.320 -1.315 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.688 -14.607 -2.000 1.00 0.00 H new ATOM 678 N ALA A 46 -15.640 -15.147 2.430 1.00 0.00 N ATOM 679 CA ALA A 46 -15.127 -15.191 3.764 1.00 0.00 C ATOM 680 C ALA A 46 -13.978 -14.278 4.020 1.00 0.00 C ATOM 681 O ALA A 46 -13.857 -13.607 5.044 1.00 0.00 O ATOM 682 CB ALA A 46 -14.880 -16.654 4.168 1.00 0.00 C ATOM 0 H ALA A 46 -15.622 -16.067 1.989 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.889 -14.782 4.427 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -14.489 -16.690 5.185 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -15.818 -17.208 4.120 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -14.158 -17.103 3.486 1.00 0.00 H new ATOM 688 N GLU A 47 -12.942 -14.232 3.164 1.00 0.00 N ATOM 689 CA GLU A 47 -11.939 -13.215 3.243 1.00 0.00 C ATOM 690 C GLU A 47 -12.359 -11.788 3.155 1.00 0.00 C ATOM 691 O GLU A 47 -11.814 -10.911 3.824 1.00 0.00 O ATOM 692 CB GLU A 47 -10.861 -13.454 2.173 1.00 0.00 C ATOM 693 CG GLU A 47 -10.109 -14.737 2.531 1.00 0.00 C ATOM 694 CD GLU A 47 -9.280 -15.157 1.326 1.00 0.00 C ATOM 695 OE1 GLU A 47 -9.910 -15.672 0.364 1.00 0.00 O ATOM 696 OE2 GLU A 47 -8.060 -14.843 1.363 1.00 0.00 O ATOM 0 H GLU A 47 -12.798 -14.905 2.411 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.583 -13.330 4.267 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.317 -13.543 1.187 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.173 -12.609 2.131 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.466 -14.572 3.395 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.811 -15.525 2.802 1.00 0.00 H new ATOM 703 N LEU A 48 -13.332 -11.443 2.293 1.00 0.00 N ATOM 704 CA LEU A 48 -14.044 -10.203 2.318 1.00 0.00 C ATOM 705 C LEU A 48 -14.885 -9.930 3.517 1.00 0.00 C ATOM 706 O LEU A 48 -14.805 -8.808 4.015 1.00 0.00 O ATOM 707 CB LEU A 48 -14.818 -9.976 1.009 1.00 0.00 C ATOM 708 CG LEU A 48 -13.860 -9.711 -0.165 1.00 0.00 C ATOM 709 CD1 LEU A 48 -14.544 -9.538 -1.531 1.00 0.00 C ATOM 710 CD2 LEU A 48 -12.848 -8.586 0.110 1.00 0.00 C ATOM 0 H LEU A 48 -13.637 -12.060 1.541 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.253 -9.459 2.407 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.432 -10.850 0.790 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -15.496 -9.131 1.126 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.294 -10.639 -0.239 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -13.789 -9.356 -2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -15.099 -10.443 -1.778 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -15.230 -8.692 -1.490 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -12.205 -8.454 -0.760 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -13.382 -7.657 0.311 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.239 -8.848 0.975 1.00 0.00 H new ATOM 722 N GLN A 49 -15.758 -10.874 3.911 1.00 0.00 N ATOM 723 CA GLN A 49 -16.544 -10.755 5.100 1.00 0.00 C ATOM 724 C GLN A 49 -15.772 -10.428 6.332 1.00 0.00 C ATOM 725 O GLN A 49 -16.208 -9.592 7.122 1.00 0.00 O ATOM 726 CB GLN A 49 -17.138 -12.163 5.268 1.00 0.00 C ATOM 727 CG GLN A 49 -18.334 -12.165 6.221 1.00 0.00 C ATOM 728 CD GLN A 49 -18.670 -13.586 6.649 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.921 -14.508 5.875 1.00 0.00 O ATOM 730 NE2 GLN A 49 -18.596 -13.865 7.979 1.00 0.00 N ATOM 0 H GLN A 49 -15.921 -11.738 3.393 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.258 -9.938 4.990 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.448 -12.545 4.295 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.371 -12.838 5.646 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -18.109 -11.558 7.098 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -19.197 -11.712 5.733 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -18.389 -13.121 8.645 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -18.747 -14.818 8.309 1.00 0.00 H new ATOM 739 N ASP A 50 -14.564 -11.005 6.462 1.00 0.00 N ATOM 740 CA ASP A 50 -13.564 -10.700 7.438 1.00 0.00 C ATOM 741 C ASP A 50 -12.984 -9.331 7.339 1.00 0.00 C ATOM 742 O ASP A 50 -12.691 -8.724 8.368 1.00 0.00 O ATOM 743 CB ASP A 50 -12.504 -11.810 7.341 1.00 0.00 C ATOM 744 CG ASP A 50 -11.754 -12.071 8.640 1.00 0.00 C ATOM 745 OD1 ASP A 50 -12.449 -12.273 9.671 1.00 0.00 O ATOM 746 OD2 ASP A 50 -10.505 -11.928 8.730 1.00 0.00 O ATOM 0 H ASP A 50 -14.263 -11.747 5.830 1.00 0.00 H new ATOM 0 HA ASP A 50 -14.025 -10.680 8.425 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.989 -12.733 7.022 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.785 -11.544 6.566 1.00 0.00 H new ATOM 751 N MET A 51 -12.820 -8.728 6.148 1.00 0.00 N ATOM 752 CA MET A 51 -12.444 -7.371 5.899 1.00 0.00 C ATOM 753 C MET A 51 -13.509 -6.480 6.440 1.00 0.00 C ATOM 754 O MET A 51 -13.248 -5.603 7.262 1.00 0.00 O ATOM 755 CB MET A 51 -12.099 -7.109 4.423 1.00 0.00 C ATOM 756 CG MET A 51 -11.769 -5.637 4.169 1.00 0.00 C ATOM 757 SD MET A 51 -11.081 -5.367 2.508 1.00 0.00 S ATOM 758 CE MET A 51 -11.001 -3.565 2.718 1.00 0.00 C ATOM 0 H MET A 51 -12.965 -9.241 5.279 1.00 0.00 H new ATOM 0 HA MET A 51 -11.513 -7.148 6.421 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.249 -7.727 4.133 1.00 0.00 H new ATOM 0 HB3 MET A 51 -12.939 -7.407 3.795 1.00 0.00 H new ATOM 0 HG2 MET A 51 -12.672 -5.038 4.289 1.00 0.00 H new ATOM 0 HG3 MET A 51 -11.055 -5.292 4.917 1.00 0.00 H new ATOM 0 HE1 MET A 51 -10.351 -3.138 1.954 1.00 0.00 H new ATOM 0 HE2 MET A 51 -12.001 -3.143 2.621 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.603 -3.331 3.705 1.00 0.00 H new ATOM 768 N ILE A 52 -14.792 -6.778 6.170 1.00 0.00 N ATOM 769 CA ILE A 52 -15.845 -5.900 6.574 1.00 0.00 C ATOM 770 C ILE A 52 -16.013 -5.796 8.051 1.00 0.00 C ATOM 771 O ILE A 52 -16.071 -4.701 8.609 1.00 0.00 O ATOM 772 CB ILE A 52 -17.145 -6.379 5.999 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.018 -6.246 4.472 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.425 -5.741 6.565 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.324 -6.741 3.853 1.00 0.00 C ATOM 0 H ILE A 52 -15.098 -7.617 5.678 1.00 0.00 H new ATOM 0 HA ILE A 52 -15.568 -4.913 6.203 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.293 -7.415 6.304 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -16.831 -5.209 4.193 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.175 -6.832 4.106 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.296 -6.170 6.069 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.485 -5.935 7.636 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.403 -4.665 6.392 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.266 -6.660 2.768 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.486 -7.782 4.131 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.153 -6.135 4.219 1.00 0.00 H new ATOM 787 N ASN A 53 -15.912 -6.964 8.711 1.00 0.00 N ATOM 788 CA ASN A 53 -16.194 -7.074 10.109 1.00 0.00 C ATOM 789 C ASN A 53 -15.024 -6.611 10.908 1.00 0.00 C ATOM 790 O ASN A 53 -15.122 -6.353 12.107 1.00 0.00 O ATOM 791 CB ASN A 53 -16.677 -8.503 10.407 1.00 0.00 C ATOM 792 CG ASN A 53 -17.323 -8.657 11.777 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.465 -8.248 11.979 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.649 -9.335 12.744 1.00 0.00 N ATOM 0 H ASN A 53 -15.632 -7.841 8.271 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.007 -6.414 10.410 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -17.393 -8.802 9.642 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.830 -9.186 10.335 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.090 -9.509 13.647 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.702 -9.670 12.566 1.00 0.00 H new ATOM 801 N GLU A 54 -13.878 -6.284 10.285 1.00 0.00 N ATOM 802 CA GLU A 54 -12.845 -5.507 10.895 1.00 0.00 C ATOM 803 C GLU A 54 -13.225 -4.117 11.276 1.00 0.00 C ATOM 804 O GLU A 54 -12.995 -3.631 12.382 1.00 0.00 O ATOM 805 CB GLU A 54 -11.550 -5.561 10.067 1.00 0.00 C ATOM 806 CG GLU A 54 -10.336 -4.933 10.754 1.00 0.00 C ATOM 807 CD GLU A 54 -9.039 -5.170 9.993 1.00 0.00 C ATOM 808 OE1 GLU A 54 -9.103 -5.066 8.739 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.004 -5.317 10.696 1.00 0.00 O ATOM 0 H GLU A 54 -13.664 -6.568 9.329 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.661 -5.986 11.856 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.324 -6.602 9.836 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.718 -5.053 9.117 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.499 -3.860 10.860 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.242 -5.342 11.760 1.00 0.00 H new ATOM 816 N VAL A 55 -13.934 -3.405 10.382 1.00 0.00 N ATOM 817 CA VAL A 55 -14.288 -2.026 10.518 1.00 0.00 C ATOM 818 C VAL A 55 -15.661 -1.788 11.046 1.00 0.00 C ATOM 819 O VAL A 55 -16.141 -0.656 11.034 1.00 0.00 O ATOM 820 CB VAL A 55 -14.101 -1.245 9.251 1.00 0.00 C ATOM 821 CG1 VAL A 55 -12.607 -1.191 8.889 1.00 0.00 C ATOM 822 CG2 VAL A 55 -14.906 -1.878 8.104 1.00 0.00 C ATOM 0 H VAL A 55 -14.280 -3.816 9.515 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.585 -1.663 11.267 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.467 -0.230 9.406 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.476 -0.623 7.968 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.055 -0.708 9.695 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.230 -2.204 8.747 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.758 -1.298 7.193 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.566 -2.901 7.942 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -15.965 -1.884 8.363 1.00 0.00 H new ATOM 832 N ASP A 56 -16.358 -2.865 11.451 1.00 0.00 N ATOM 833 CA ASP A 56 -17.774 -2.931 11.635 1.00 0.00 C ATOM 834 C ASP A 56 -18.113 -2.719 13.071 1.00 0.00 C ATOM 835 O ASP A 56 -18.539 -3.619 13.793 1.00 0.00 O ATOM 836 CB ASP A 56 -18.404 -4.224 11.092 1.00 0.00 C ATOM 837 CG ASP A 56 -19.887 -4.060 10.791 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.168 -3.042 10.105 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.667 -4.957 11.209 1.00 0.00 O ATOM 0 H ASP A 56 -15.899 -3.750 11.664 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.209 -2.127 11.042 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -17.882 -4.527 10.184 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.269 -5.025 11.819 1.00 0.00 H new ATOM 844 N ALA A 57 -18.072 -1.461 13.545 1.00 0.00 N ATOM 845 CA ALA A 57 -18.523 -1.092 14.851 1.00 0.00 C ATOM 846 C ALA A 57 -19.982 -0.824 14.989 1.00 0.00 C ATOM 847 O ALA A 57 -20.540 -0.804 16.085 1.00 0.00 O ATOM 848 CB ALA A 57 -17.699 0.073 15.425 1.00 0.00 C ATOM 0 H ALA A 57 -17.714 -0.675 13.002 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.353 -1.991 15.443 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.070 0.326 16.418 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -16.652 -0.221 15.493 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.791 0.940 14.771 1.00 0.00 H new ATOM 854 N ASP A 58 -20.697 -0.642 13.864 1.00 0.00 N ATOM 855 CA ASP A 58 -22.116 -0.463 13.881 1.00 0.00 C ATOM 856 C ASP A 58 -22.916 -1.715 13.990 1.00 0.00 C ATOM 857 O ASP A 58 -24.046 -1.841 14.460 1.00 0.00 O ATOM 858 CB ASP A 58 -22.715 0.379 12.742 1.00 0.00 C ATOM 859 CG ASP A 58 -22.237 -0.247 11.440 1.00 0.00 C ATOM 860 OD1 ASP A 58 -22.930 -1.119 10.851 1.00 0.00 O ATOM 861 OD2 ASP A 58 -21.224 0.265 10.893 1.00 0.00 O ATOM 0 H ASP A 58 -20.285 -0.619 12.931 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.205 0.106 14.806 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -23.804 0.382 12.794 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -22.390 1.417 12.815 1.00 0.00 H new ATOM 866 N GLY A 59 -22.266 -2.783 13.495 1.00 0.00 N ATOM 867 CA GLY A 59 -22.822 -4.098 13.578 1.00 0.00 C ATOM 868 C GLY A 59 -23.834 -4.539 12.577 1.00 0.00 C ATOM 869 O GLY A 59 -24.532 -5.527 12.800 1.00 0.00 O ATOM 0 H GLY A 59 -21.356 -2.736 13.037 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -21.993 -4.805 13.535 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -23.275 -4.198 14.564 1.00 0.00 H new ATOM 873 N ASN A 60 -23.948 -3.874 11.413 1.00 0.00 N ATOM 874 CA ASN A 60 -24.850 -4.334 10.403 1.00 0.00 C ATOM 875 C ASN A 60 -24.401 -5.462 9.539 1.00 0.00 C ATOM 876 O ASN A 60 -25.088 -6.111 8.752 1.00 0.00 O ATOM 877 CB ASN A 60 -25.427 -3.224 9.510 1.00 0.00 C ATOM 878 CG ASN A 60 -24.412 -2.466 8.667 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.206 -2.696 8.588 1.00 0.00 O ATOM 880 ND2 ASN A 60 -24.912 -1.460 7.901 1.00 0.00 N ATOM 0 H ASN A 60 -23.425 -3.032 11.173 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.634 -4.738 11.043 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.168 -3.666 8.844 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -25.953 -2.509 10.143 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -24.292 -0.928 7.290 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -25.907 -1.237 7.937 1.00 0.00 H new ATOM 887 N GLY A 61 -23.070 -5.658 9.545 1.00 0.00 N ATOM 888 CA GLY A 61 -22.477 -6.751 8.838 1.00 0.00 C ATOM 889 C GLY A 61 -22.088 -6.464 7.429 1.00 0.00 C ATOM 890 O GLY A 61 -21.423 -7.272 6.782 1.00 0.00 O ATOM 0 H GLY A 61 -22.406 -5.061 10.038 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.591 -7.076 9.383 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -23.177 -7.586 8.841 1.00 0.00 H new ATOM 894 N THR A 62 -22.410 -5.244 6.963 1.00 0.00 N ATOM 895 CA THR A 62 -22.094 -4.808 5.638 1.00 0.00 C ATOM 896 C THR A 62 -21.387 -3.499 5.721 1.00 0.00 C ATOM 897 O THR A 62 -21.147 -2.910 6.774 1.00 0.00 O ATOM 898 CB THR A 62 -23.413 -4.520 4.986 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.298 -3.795 5.827 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.029 -5.837 4.485 1.00 0.00 C ATOM 0 H THR A 62 -22.901 -4.545 7.520 1.00 0.00 H new ATOM 0 HA THR A 62 -21.490 -5.546 5.110 1.00 0.00 H new ATOM 0 HB THR A 62 -23.238 -3.865 4.132 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.140 -3.633 5.353 1.00 0.00 H new ATOM 0 HG21 THR A 62 -24.989 -5.632 4.010 1.00 0.00 H new ATOM 0 HG22 THR A 62 -23.358 -6.301 3.762 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.178 -6.513 5.327 1.00 0.00 H new ATOM 908 N ILE A 63 -20.872 -3.092 4.547 1.00 0.00 N ATOM 909 CA ILE A 63 -20.208 -1.833 4.404 1.00 0.00 C ATOM 910 C ILE A 63 -21.232 -0.818 4.027 1.00 0.00 C ATOM 911 O ILE A 63 -22.089 -0.919 3.150 1.00 0.00 O ATOM 912 CB ILE A 63 -19.189 -1.966 3.312 1.00 0.00 C ATOM 913 CG1 ILE A 63 -17.942 -2.680 3.861 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.678 -0.621 2.769 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.347 -2.305 5.218 1.00 0.00 C ATOM 0 H ILE A 63 -20.916 -3.641 3.689 1.00 0.00 H new ATOM 0 HA ILE A 63 -19.714 -1.532 5.327 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.694 -2.510 2.514 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.176 -3.744 3.899 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -17.152 -2.554 3.121 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.945 -0.801 1.983 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.514 -0.052 2.362 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.213 -0.056 3.577 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.474 -2.926 5.417 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.051 -1.256 5.208 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -18.091 -2.465 5.998 1.00 0.00 H new ATOM 927 N ASP A 64 -21.258 0.229 4.870 1.00 0.00 N ATOM 928 CA ASP A 64 -22.106 1.359 4.650 1.00 0.00 C ATOM 929 C ASP A 64 -21.336 2.573 4.259 1.00 0.00 C ATOM 930 O ASP A 64 -20.113 2.571 4.389 1.00 0.00 O ATOM 931 CB ASP A 64 -23.092 1.529 5.818 1.00 0.00 C ATOM 932 CG ASP A 64 -22.404 1.443 7.173 1.00 0.00 C ATOM 933 OD1 ASP A 64 -21.945 2.488 7.708 1.00 0.00 O ATOM 934 OD2 ASP A 64 -22.350 0.351 7.800 1.00 0.00 O ATOM 0 H ASP A 64 -20.686 0.293 5.712 1.00 0.00 H new ATOM 0 HA ASP A 64 -22.734 1.178 3.778 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -23.595 2.492 5.729 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -23.862 0.760 5.755 1.00 0.00 H new ATOM 939 N PHE A 65 -21.918 3.732 3.903 1.00 0.00 N ATOM 940 CA PHE A 65 -21.257 4.893 3.391 1.00 0.00 C ATOM 941 C PHE A 65 -20.332 5.650 4.280 1.00 0.00 C ATOM 942 O PHE A 65 -19.291 5.928 3.686 1.00 0.00 O ATOM 943 CB PHE A 65 -22.125 5.883 2.595 1.00 0.00 C ATOM 944 CG PHE A 65 -21.396 6.874 1.755 1.00 0.00 C ATOM 945 CD1 PHE A 65 -20.527 6.426 0.788 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.441 8.226 2.002 1.00 0.00 C ATOM 947 CE1 PHE A 65 -19.770 7.298 0.041 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.696 9.121 1.272 1.00 0.00 C ATOM 949 CZ PHE A 65 -19.862 8.647 0.286 1.00 0.00 C ATOM 0 H PHE A 65 -22.926 3.867 3.979 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.614 4.353 2.697 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.791 5.311 1.949 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.754 6.428 3.298 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.437 5.364 0.611 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.079 8.595 2.791 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.111 6.927 -0.730 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -20.764 10.181 1.470 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.276 9.340 -0.299 1.00 0.00 H new ATOM 959 N PRO A 66 -20.496 5.948 5.534 1.00 0.00 N ATOM 960 CA PRO A 66 -19.613 6.835 6.233 1.00 0.00 C ATOM 961 C PRO A 66 -18.474 5.956 6.623 1.00 0.00 C ATOM 962 O PRO A 66 -17.451 6.578 6.903 1.00 0.00 O ATOM 963 CB PRO A 66 -20.393 7.287 7.466 1.00 0.00 C ATOM 964 CG PRO A 66 -21.542 6.276 7.613 1.00 0.00 C ATOM 965 CD PRO A 66 -21.819 5.931 6.141 1.00 0.00 C ATOM 0 HA PRO A 66 -19.267 7.707 5.678 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -19.759 7.293 8.352 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.774 8.300 7.340 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -21.250 5.401 8.194 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.412 6.709 8.106 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.295 4.955 6.040 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.483 6.659 5.676 1.00 0.00 H new ATOM 973 N GLU A 67 -18.738 4.638 6.663 1.00 0.00 N ATOM 974 CA GLU A 67 -17.796 3.628 7.035 1.00 0.00 C ATOM 975 C GLU A 67 -16.831 3.435 5.916 1.00 0.00 C ATOM 976 O GLU A 67 -15.613 3.465 6.086 1.00 0.00 O ATOM 977 CB GLU A 67 -18.510 2.313 7.391 1.00 0.00 C ATOM 978 CG GLU A 67 -17.638 1.238 8.044 1.00 0.00 C ATOM 979 CD GLU A 67 -18.563 0.048 8.254 1.00 0.00 C ATOM 980 OE1 GLU A 67 -19.313 -0.382 7.337 1.00 0.00 O ATOM 981 OE2 GLU A 67 -18.749 -0.373 9.427 1.00 0.00 O ATOM 0 H GLU A 67 -19.654 4.258 6.424 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.253 3.946 7.925 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -19.337 2.541 8.063 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -18.944 1.899 6.481 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -16.795 0.974 7.406 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -17.225 1.587 8.990 1.00 0.00 H new ATOM 988 N PHE A 68 -17.353 3.425 4.677 1.00 0.00 N ATOM 989 CA PHE A 68 -16.718 3.346 3.398 1.00 0.00 C ATOM 990 C PHE A 68 -15.730 4.452 3.251 1.00 0.00 C ATOM 991 O PHE A 68 -14.579 4.254 2.865 1.00 0.00 O ATOM 992 CB PHE A 68 -17.688 3.099 2.230 1.00 0.00 C ATOM 993 CG PHE A 68 -17.135 3.319 0.864 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.963 4.573 0.328 1.00 0.00 C ATOM 995 CD2 PHE A 68 -16.668 2.234 0.161 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.218 4.742 -0.815 1.00 0.00 C ATOM 997 CE2 PHE A 68 -15.905 2.405 -0.970 1.00 0.00 C ATOM 998 CZ PHE A 68 -15.657 3.665 -1.461 1.00 0.00 C ATOM 0 H PHE A 68 -18.365 3.480 4.562 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.127 2.432 3.346 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.048 2.072 2.294 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.554 3.749 2.359 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.415 5.429 0.807 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -16.903 1.236 0.501 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.071 5.736 -1.212 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -15.497 1.543 -1.477 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.036 3.806 -2.333 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.225 5.659 3.581 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.551 6.918 3.513 1.00 0.00 C ATOM 1010 C LEU A 69 -14.498 6.961 4.566 1.00 0.00 C ATOM 1011 O LEU A 69 -13.437 7.508 4.271 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.593 8.021 3.767 1.00 0.00 C ATOM 1013 CG LEU A 69 -16.464 9.304 2.930 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -17.641 10.152 3.441 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -15.159 10.113 2.824 1.00 0.00 C ATOM 0 H LEU A 69 -17.180 5.760 3.925 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.083 7.061 2.539 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.583 7.600 3.592 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -16.546 8.297 4.820 1.00 0.00 H new ATOM 0 HG LEU A 69 -16.462 8.991 1.886 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -17.658 11.106 2.914 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.576 9.622 3.262 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.524 10.330 4.510 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -15.317 10.976 2.177 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -14.860 10.453 3.816 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -14.374 9.484 2.405 1.00 0.00 H new ATOM 1027 N THR A 70 -14.686 6.398 5.774 1.00 0.00 N ATOM 1028 CA THR A 70 -13.664 6.465 6.772 1.00 0.00 C ATOM 1029 C THR A 70 -12.608 5.465 6.448 1.00 0.00 C ATOM 1030 O THR A 70 -11.423 5.731 6.642 1.00 0.00 O ATOM 1031 CB THR A 70 -14.123 6.129 8.160 1.00 0.00 C ATOM 1032 OG1 THR A 70 -15.125 7.016 8.634 1.00 0.00 O ATOM 1033 CG2 THR A 70 -12.905 6.215 9.095 1.00 0.00 C ATOM 0 H THR A 70 -15.532 5.904 6.057 1.00 0.00 H new ATOM 0 HA THR A 70 -13.321 7.500 6.761 1.00 0.00 H new ATOM 0 HB THR A 70 -14.556 5.129 8.142 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.928 6.928 8.080 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.210 5.975 10.113 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.144 5.506 8.768 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.496 7.225 9.068 1.00 0.00 H new ATOM 1041 N MET A 71 -12.989 4.335 5.825 1.00 0.00 N ATOM 1042 CA MET A 71 -12.066 3.360 5.332 1.00 0.00 C ATOM 1043 C MET A 71 -11.187 3.828 4.224 1.00 0.00 C ATOM 1044 O MET A 71 -9.962 3.733 4.276 1.00 0.00 O ATOM 1045 CB MET A 71 -12.763 2.045 4.943 1.00 0.00 C ATOM 1046 CG MET A 71 -11.816 1.053 4.265 1.00 0.00 C ATOM 1047 SD MET A 71 -12.655 -0.436 3.646 1.00 0.00 S ATOM 1048 CE MET A 71 -13.383 -0.977 5.219 1.00 0.00 C ATOM 0 H MET A 71 -13.966 4.093 5.660 1.00 0.00 H new ATOM 0 HA MET A 71 -11.405 3.177 6.179 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.186 1.585 5.836 1.00 0.00 H new ATOM 0 HB3 MET A 71 -13.594 2.264 4.273 1.00 0.00 H new ATOM 0 HG2 MET A 71 -11.314 1.550 3.435 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.043 0.757 4.974 1.00 0.00 H new ATOM 0 HE1 MET A 71 -13.815 -1.970 5.097 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.609 -1.009 5.986 1.00 0.00 H new ATOM 0 HE3 MET A 71 -14.163 -0.277 5.519 1.00 0.00 H new ATOM 1058 N MET A 72 -11.768 4.600 3.288 1.00 0.00 N ATOM 1059 CA MET A 72 -11.050 5.281 2.255 1.00 0.00 C ATOM 1060 C MET A 72 -10.162 6.390 2.705 1.00 0.00 C ATOM 1061 O MET A 72 -9.106 6.623 2.120 1.00 0.00 O ATOM 1062 CB MET A 72 -12.022 5.856 1.211 1.00 0.00 C ATOM 1063 CG MET A 72 -11.462 6.078 -0.195 1.00 0.00 C ATOM 1064 SD MET A 72 -11.275 4.526 -1.123 1.00 0.00 S ATOM 1065 CE MET A 72 -11.050 5.274 -2.763 1.00 0.00 C ATOM 0 H MET A 72 -12.775 4.756 3.249 1.00 0.00 H new ATOM 0 HA MET A 72 -10.403 4.509 1.840 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.877 5.185 1.135 1.00 0.00 H new ATOM 0 HB3 MET A 72 -12.397 6.809 1.583 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.123 6.749 -0.744 1.00 0.00 H new ATOM 0 HG3 MET A 72 -10.494 6.573 -0.123 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.914 4.488 -3.506 1.00 0.00 H new ATOM 0 HE2 MET A 72 -11.930 5.865 -3.017 1.00 0.00 H new ATOM 0 HE3 MET A 72 -10.171 5.918 -2.752 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.523 7.094 3.793 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.831 8.126 4.500 1.00 0.00 C ATOM 1077 C ALA A 73 -8.665 7.584 5.254 1.00 0.00 C ATOM 1078 O ALA A 73 -7.618 8.226 5.303 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.810 8.857 5.433 1.00 0.00 C ATOM 0 H ALA A 73 -11.425 6.909 4.232 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.435 8.839 3.777 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.281 9.643 5.971 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.614 9.298 4.844 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.230 8.148 6.147 1.00 0.00 H new ATOM 1234 N GLU A 83 -1.043 3.226 -9.608 1.00 0.00 N ATOM 1235 CA GLU A 83 -0.497 2.651 -10.798 1.00 0.00 C ATOM 1236 C GLU A 83 0.884 2.120 -10.625 1.00 0.00 C ATOM 1237 O GLU A 83 1.328 1.208 -11.322 1.00 0.00 O ATOM 1238 CB GLU A 83 -0.549 3.598 -12.009 1.00 0.00 C ATOM 1239 CG GLU A 83 0.449 4.756 -11.944 1.00 0.00 C ATOM 1240 CD GLU A 83 0.069 5.722 -13.057 1.00 0.00 C ATOM 1241 OE1 GLU A 83 -0.784 6.604 -12.771 1.00 0.00 O ATOM 1242 OE2 GLU A 83 0.590 5.688 -14.204 1.00 0.00 O ATOM 0 HA GLU A 83 -1.152 1.804 -11.004 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.361 3.022 -12.915 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.556 4.006 -12.094 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.408 5.249 -10.973 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.469 4.396 -12.075 1.00 0.00 H new ATOM 1249 N GLU A 84 1.523 2.516 -9.511 1.00 0.00 N ATOM 1250 CA GLU A 84 2.858 2.041 -9.312 1.00 0.00 C ATOM 1251 C GLU A 84 2.900 0.656 -8.764 1.00 0.00 C ATOM 1252 O GLU A 84 3.663 -0.174 -9.257 1.00 0.00 O ATOM 1253 CB GLU A 84 3.551 2.852 -8.205 1.00 0.00 C ATOM 1254 CG GLU A 84 3.978 4.193 -8.806 1.00 0.00 C ATOM 1255 CD GLU A 84 4.973 4.907 -7.904 1.00 0.00 C ATOM 1256 OE1 GLU A 84 4.460 5.673 -7.045 1.00 0.00 O ATOM 1257 OE2 GLU A 84 6.225 4.944 -8.046 1.00 0.00 O ATOM 0 H GLU A 84 1.146 3.128 -8.787 1.00 0.00 H new ATOM 0 HA GLU A 84 3.327 2.113 -10.293 1.00 0.00 H new ATOM 0 HB2 GLU A 84 2.874 3.008 -7.365 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.417 2.312 -7.821 1.00 0.00 H new ATOM 0 HG2 GLU A 84 4.424 4.029 -9.787 1.00 0.00 H new ATOM 0 HG3 GLU A 84 3.101 4.823 -8.956 1.00 0.00 H new ATOM 1264 N ILE A 85 1.912 0.357 -7.902 1.00 0.00 N ATOM 1265 CA ILE A 85 1.751 -0.962 -7.372 1.00 0.00 C ATOM 1266 C ILE A 85 1.024 -1.843 -8.328 1.00 0.00 C ATOM 1267 O ILE A 85 1.296 -3.027 -8.522 1.00 0.00 O ATOM 1268 CB ILE A 85 1.135 -0.995 -6.004 1.00 0.00 C ATOM 1269 CG1 ILE A 85 -0.401 -0.918 -6.039 1.00 0.00 C ATOM 1270 CG2 ILE A 85 1.828 0.117 -5.199 1.00 0.00 C ATOM 1271 CD1 ILE A 85 -1.043 -0.711 -4.669 1.00 0.00 C ATOM 0 H ILE A 85 1.222 1.031 -7.571 1.00 0.00 H new ATOM 0 HA ILE A 85 2.758 -1.357 -7.243 1.00 0.00 H new ATOM 0 HB ILE A 85 1.300 -1.952 -5.509 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.699 -0.101 -6.696 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.791 -1.837 -6.477 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.420 0.143 -4.189 1.00 0.00 H new ATOM 0 HG22 ILE A 85 2.899 -0.081 -5.153 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.657 1.078 -5.684 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.127 -0.667 -4.778 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -0.777 -1.540 -4.014 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.684 0.223 -4.236 1.00 0.00 H new ATOM 1283 N ARG A 86 0.114 -1.202 -9.082 1.00 0.00 N ATOM 1284 CA ARG A 86 -0.583 -1.880 -10.131 1.00 0.00 C ATOM 1285 C ARG A 86 0.346 -2.427 -11.159 1.00 0.00 C ATOM 1286 O ARG A 86 0.317 -3.594 -11.548 1.00 0.00 O ATOM 1287 CB ARG A 86 -1.599 -0.888 -10.721 1.00 0.00 C ATOM 1288 CG ARG A 86 -2.826 -1.420 -11.464 1.00 0.00 C ATOM 1289 CD ARG A 86 -3.669 -0.381 -12.205 1.00 0.00 C ATOM 1290 NE ARG A 86 -4.167 0.693 -11.301 1.00 0.00 N ATOM 1291 CZ ARG A 86 -4.642 1.870 -11.804 1.00 0.00 C ATOM 1292 NH1 ARG A 86 -4.260 2.412 -12.996 1.00 0.00 N ATOM 1293 NH2 ARG A 86 -5.249 2.757 -10.962 1.00 0.00 N ATOM 0 H ARG A 86 -0.139 -0.220 -8.967 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.105 -2.752 -9.736 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.958 -0.263 -9.903 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -1.059 -0.236 -11.407 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -2.493 -2.168 -12.184 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -3.466 -1.932 -10.746 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -3.074 0.065 -13.002 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.517 -0.876 -12.679 1.00 0.00 H new ATOM 0 HE ARG A 86 -4.153 0.547 -10.292 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.574 1.932 -13.578 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -4.661 3.298 -13.305 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -5.343 2.537 -9.971 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -5.608 3.640 -11.324 1.00 0.00 H new ATOM 1307 N GLU A 87 1.283 -1.584 -11.628 1.00 0.00 N ATOM 1308 CA GLU A 87 2.257 -2.040 -12.571 1.00 0.00 C ATOM 1309 C GLU A 87 3.293 -2.918 -11.956 1.00 0.00 C ATOM 1310 O GLU A 87 3.597 -3.957 -12.540 1.00 0.00 O ATOM 1311 CB GLU A 87 2.965 -0.935 -13.373 1.00 0.00 C ATOM 1312 CG GLU A 87 3.938 -1.467 -14.427 1.00 0.00 C ATOM 1313 CD GLU A 87 4.489 -0.352 -15.304 1.00 0.00 C ATOM 1314 OE1 GLU A 87 3.680 -0.009 -16.207 1.00 0.00 O ATOM 1315 OE2 GLU A 87 5.622 0.167 -15.115 1.00 0.00 O ATOM 0 H GLU A 87 1.367 -0.603 -11.360 1.00 0.00 H new ATOM 0 HA GLU A 87 1.651 -2.612 -13.274 1.00 0.00 H new ATOM 0 HB2 GLU A 87 2.214 -0.317 -13.864 1.00 0.00 H new ATOM 0 HB3 GLU A 87 3.508 -0.289 -12.683 1.00 0.00 H new ATOM 0 HG2 GLU A 87 4.762 -1.982 -13.933 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.431 -2.203 -15.051 1.00 0.00 H new ATOM 1322 N ALA A 88 3.713 -2.745 -10.690 1.00 0.00 N ATOM 1323 CA ALA A 88 4.500 -3.752 -10.049 1.00 0.00 C ATOM 1324 C ALA A 88 3.856 -5.095 -10.042 1.00 0.00 C ATOM 1325 O ALA A 88 4.520 -6.073 -10.381 1.00 0.00 O ATOM 1326 CB ALA A 88 4.837 -3.306 -8.616 1.00 0.00 C ATOM 0 H ALA A 88 3.513 -1.924 -10.119 1.00 0.00 H new ATOM 0 HA ALA A 88 5.414 -3.863 -10.633 1.00 0.00 H new ATOM 0 HB1 ALA A 88 5.437 -4.074 -8.128 1.00 0.00 H new ATOM 0 HB2 ALA A 88 5.399 -2.372 -8.648 1.00 0.00 H new ATOM 0 HB3 ALA A 88 3.914 -3.155 -8.055 1.00 0.00 H new ATOM 1332 N PHE A 89 2.555 -5.232 -9.727 1.00 0.00 N ATOM 1333 CA PHE A 89 1.962 -6.532 -9.789 1.00 0.00 C ATOM 1334 C PHE A 89 1.949 -7.149 -11.145 1.00 0.00 C ATOM 1335 O PHE A 89 2.125 -8.356 -11.308 1.00 0.00 O ATOM 1336 CB PHE A 89 0.524 -6.663 -9.261 1.00 0.00 C ATOM 1337 CG PHE A 89 0.223 -8.045 -8.794 1.00 0.00 C ATOM 1338 CD1 PHE A 89 -0.231 -9.043 -9.624 1.00 0.00 C ATOM 1339 CD2 PHE A 89 0.592 -8.401 -7.517 1.00 0.00 C ATOM 1340 CE1 PHE A 89 -0.559 -10.287 -9.140 1.00 0.00 C ATOM 1341 CE2 PHE A 89 0.417 -9.683 -7.052 1.00 0.00 C ATOM 1342 CZ PHE A 89 -0.073 -10.644 -7.904 1.00 0.00 C ATOM 0 H PHE A 89 1.934 -4.475 -9.440 1.00 0.00 H new ATOM 0 HA PHE A 89 2.641 -7.057 -9.118 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.375 -5.962 -8.439 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.177 -6.386 -10.048 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.332 -8.845 -10.681 1.00 0.00 H new ATOM 0 HD2 PHE A 89 1.028 -7.658 -6.866 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.178 -10.962 -9.712 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.662 -9.932 -6.030 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.076 -11.681 -7.602 1.00 0.00 H new ATOM 1352 N ARG A 90 1.815 -6.301 -12.180 1.00 0.00 N ATOM 1353 CA ARG A 90 1.813 -6.810 -13.516 1.00 0.00 C ATOM 1354 C ARG A 90 3.164 -7.208 -14.002 1.00 0.00 C ATOM 1355 O ARG A 90 3.276 -8.152 -14.783 1.00 0.00 O ATOM 1356 CB ARG A 90 1.053 -5.741 -14.319 1.00 0.00 C ATOM 1357 CG ARG A 90 1.004 -6.020 -15.823 1.00 0.00 C ATOM 1358 CD ARG A 90 0.229 -7.261 -16.270 1.00 0.00 C ATOM 1359 NE ARG A 90 1.088 -8.465 -16.452 1.00 0.00 N ATOM 1360 CZ ARG A 90 0.641 -9.668 -16.916 1.00 0.00 C ATOM 1361 NH1 ARG A 90 -0.647 -9.999 -17.227 1.00 0.00 N ATOM 1362 NH2 ARG A 90 1.589 -10.643 -17.035 1.00 0.00 N ATOM 0 H ARG A 90 1.711 -5.290 -12.098 1.00 0.00 H new ATOM 0 HA ARG A 90 1.306 -7.769 -13.621 1.00 0.00 H new ATOM 0 HB2 ARG A 90 0.034 -5.670 -13.938 1.00 0.00 H new ATOM 0 HB3 ARG A 90 1.524 -4.772 -14.153 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.567 -5.151 -16.315 1.00 0.00 H new ATOM 0 HG3 ARG A 90 2.028 -6.110 -16.185 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.542 -7.483 -15.533 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.281 -7.043 -17.209 1.00 0.00 H new ATOM 0 HE ARG A 90 2.077 -8.385 -16.214 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -1.391 -9.310 -17.119 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -0.865 -10.935 -17.568 1.00 0.00 H new ATOM 0 HH21 ARG A 90 2.558 -10.446 -16.783 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.329 -11.569 -17.376 1.00 0.00 H new ATOM 1376 N VAL A 91 4.176 -6.529 -13.432 1.00 0.00 N ATOM 1377 CA VAL A 91 5.578 -6.639 -13.689 1.00 0.00 C ATOM 1378 C VAL A 91 6.039 -7.906 -13.055 1.00 0.00 C ATOM 1379 O VAL A 91 7.022 -8.525 -13.460 1.00 0.00 O ATOM 1380 CB VAL A 91 6.349 -5.410 -13.311 1.00 0.00 C ATOM 1381 CG1 VAL A 91 7.766 -5.691 -12.782 1.00 0.00 C ATOM 1382 CG2 VAL A 91 6.406 -4.448 -14.510 1.00 0.00 C ATOM 0 H VAL A 91 3.988 -5.829 -12.715 1.00 0.00 H new ATOM 0 HA VAL A 91 5.774 -6.697 -14.760 1.00 0.00 H new ATOM 0 HB VAL A 91 5.812 -4.954 -12.479 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.254 -4.749 -12.532 1.00 0.00 H new ATOM 0 HG12 VAL A 91 7.704 -6.316 -11.891 1.00 0.00 H new ATOM 0 HG13 VAL A 91 8.345 -6.208 -13.548 1.00 0.00 H new ATOM 0 HG21 VAL A 91 6.967 -3.555 -14.234 1.00 0.00 H new ATOM 0 HG22 VAL A 91 6.898 -4.941 -15.349 1.00 0.00 H new ATOM 0 HG23 VAL A 91 5.393 -4.166 -14.798 1.00 0.00 H new ATOM 1392 N PHE A 92 5.489 -8.332 -11.903 1.00 0.00 N ATOM 1393 CA PHE A 92 5.894 -9.530 -11.237 1.00 0.00 C ATOM 1394 C PHE A 92 5.201 -10.735 -11.776 1.00 0.00 C ATOM 1395 O PHE A 92 5.785 -11.814 -11.859 1.00 0.00 O ATOM 1396 CB PHE A 92 5.682 -9.521 -9.714 1.00 0.00 C ATOM 1397 CG PHE A 92 6.777 -8.833 -8.973 1.00 0.00 C ATOM 1398 CD1 PHE A 92 7.089 -7.509 -9.175 1.00 0.00 C ATOM 1399 CD2 PHE A 92 7.436 -9.542 -7.997 1.00 0.00 C ATOM 1400 CE1 PHE A 92 7.945 -6.896 -8.291 1.00 0.00 C ATOM 1401 CE2 PHE A 92 8.356 -8.920 -7.186 1.00 0.00 C ATOM 1402 CZ PHE A 92 8.619 -7.575 -7.303 1.00 0.00 C ATOM 0 H PHE A 92 4.743 -7.829 -11.423 1.00 0.00 H new ATOM 0 HA PHE A 92 6.965 -9.573 -11.434 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.735 -9.030 -9.488 1.00 0.00 H new ATOM 0 HB3 PHE A 92 5.601 -10.548 -9.359 1.00 0.00 H new ATOM 0 HD1 PHE A 92 6.671 -6.964 -10.008 1.00 0.00 H new ATOM 0 HD2 PHE A 92 7.230 -10.594 -7.866 1.00 0.00 H new ATOM 0 HE1 PHE A 92 8.095 -5.830 -8.377 1.00 0.00 H new ATOM 0 HE2 PHE A 92 8.883 -9.499 -6.442 1.00 0.00 H new ATOM 0 HZ PHE A 92 9.321 -7.076 -6.651 1.00 0.00 H new ATOM 1412 N ASP A 93 3.895 -10.653 -12.087 1.00 0.00 N ATOM 1413 CA ASP A 93 3.179 -11.762 -12.638 1.00 0.00 C ATOM 1414 C ASP A 93 3.520 -11.983 -14.071 1.00 0.00 C ATOM 1415 O ASP A 93 3.399 -11.098 -14.917 1.00 0.00 O ATOM 1416 CB ASP A 93 1.656 -11.689 -12.435 1.00 0.00 C ATOM 1417 CG ASP A 93 0.844 -12.945 -12.720 1.00 0.00 C ATOM 1418 OD1 ASP A 93 1.528 -13.987 -12.903 1.00 0.00 O ATOM 1419 OD2 ASP A 93 -0.412 -12.900 -12.634 1.00 0.00 O ATOM 0 H ASP A 93 3.332 -9.813 -11.956 1.00 0.00 H new ATOM 0 HA ASP A 93 3.514 -12.628 -12.067 1.00 0.00 H new ATOM 0 HB2 ASP A 93 1.469 -11.396 -11.402 1.00 0.00 H new ATOM 0 HB3 ASP A 93 1.271 -10.890 -13.068 1.00 0.00 H new ATOM 1424 N LYS A 94 4.089 -13.157 -14.398 1.00 0.00 N ATOM 1425 CA LYS A 94 4.752 -13.478 -15.623 1.00 0.00 C ATOM 1426 C LYS A 94 3.770 -13.811 -16.693 1.00 0.00 C ATOM 1427 O LYS A 94 3.749 -13.241 -17.783 1.00 0.00 O ATOM 1428 CB LYS A 94 5.850 -14.552 -15.546 1.00 0.00 C ATOM 1429 CG LYS A 94 6.700 -14.843 -16.785 1.00 0.00 C ATOM 1430 CD LYS A 94 7.504 -13.628 -17.250 1.00 0.00 C ATOM 1431 CE LYS A 94 8.249 -13.821 -18.572 1.00 0.00 C ATOM 1432 NZ LYS A 94 8.942 -12.558 -18.912 1.00 0.00 N ATOM 0 H LYS A 94 4.084 -13.945 -13.751 1.00 0.00 H new ATOM 0 HA LYS A 94 5.289 -12.562 -15.871 1.00 0.00 H new ATOM 0 HB2 LYS A 94 6.529 -14.269 -14.742 1.00 0.00 H new ATOM 0 HB3 LYS A 94 5.374 -15.486 -15.248 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.384 -15.664 -16.567 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.051 -15.176 -17.595 1.00 0.00 H new ATOM 0 HD2 LYS A 94 6.828 -12.779 -17.351 1.00 0.00 H new ATOM 0 HD3 LYS A 94 8.227 -13.370 -16.476 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.968 -14.636 -18.486 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.551 -14.094 -19.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.383 -12.646 -19.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.255 -11.777 -18.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.675 -12.362 -18.201 1.00 0.00 H new ATOM 1446 N ASP A 95 2.894 -14.803 -16.451 1.00 0.00 N ATOM 1447 CA ASP A 95 1.847 -15.242 -17.320 1.00 0.00 C ATOM 1448 C ASP A 95 0.643 -14.367 -17.256 1.00 0.00 C ATOM 1449 O ASP A 95 0.480 -13.380 -17.972 1.00 0.00 O ATOM 1450 CB ASP A 95 1.710 -16.748 -17.036 1.00 0.00 C ATOM 1451 CG ASP A 95 1.496 -17.255 -15.617 1.00 0.00 C ATOM 1452 OD1 ASP A 95 1.376 -16.453 -14.652 1.00 0.00 O ATOM 1453 OD2 ASP A 95 1.444 -18.510 -15.514 1.00 0.00 O ATOM 0 H ASP A 95 2.921 -15.337 -15.582 1.00 0.00 H new ATOM 0 HA ASP A 95 2.057 -15.135 -18.384 1.00 0.00 H new ATOM 0 HB2 ASP A 95 0.876 -17.113 -17.636 1.00 0.00 H new ATOM 0 HB3 ASP A 95 2.611 -17.229 -17.416 1.00 0.00 H new ATOM 1458 N GLY A 96 -0.230 -14.646 -16.272 1.00 0.00 N ATOM 1459 CA GLY A 96 -1.417 -13.896 -16.004 1.00 0.00 C ATOM 1460 C GLY A 96 -2.430 -14.757 -15.331 1.00 0.00 C ATOM 1461 O GLY A 96 -3.483 -15.132 -15.846 1.00 0.00 O ATOM 0 H GLY A 96 -0.102 -15.431 -15.634 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -1.180 -13.040 -15.373 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.825 -13.502 -16.935 1.00 0.00 H new ATOM 1465 N ASN A 97 -2.206 -14.994 -14.027 1.00 0.00 N ATOM 1466 CA ASN A 97 -3.209 -15.588 -13.199 1.00 0.00 C ATOM 1467 C ASN A 97 -3.431 -14.845 -11.927 1.00 0.00 C ATOM 1468 O ASN A 97 -4.182 -15.290 -11.059 1.00 0.00 O ATOM 1469 CB ASN A 97 -2.812 -17.025 -12.822 1.00 0.00 C ATOM 1470 CG ASN A 97 -1.495 -17.075 -12.060 1.00 0.00 C ATOM 1471 OD1 ASN A 97 -0.741 -16.111 -11.939 1.00 0.00 O ATOM 1472 ND2 ASN A 97 -1.181 -18.270 -11.492 1.00 0.00 N ATOM 0 H ASN A 97 -1.333 -14.775 -13.547 1.00 0.00 H new ATOM 0 HA ASN A 97 -4.126 -15.565 -13.787 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -3.599 -17.470 -12.214 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -2.730 -17.627 -13.727 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -0.316 -18.371 -10.962 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -1.811 -19.065 -11.596 1.00 0.00 H new ATOM 1479 N GLY A 98 -2.872 -13.641 -11.714 1.00 0.00 N ATOM 1480 CA GLY A 98 -3.174 -12.927 -10.512 1.00 0.00 C ATOM 1481 C GLY A 98 -2.435 -13.438 -9.324 1.00 0.00 C ATOM 1482 O GLY A 98 -2.863 -13.226 -8.190 1.00 0.00 O ATOM 0 H GLY A 98 -2.229 -13.172 -12.352 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.936 -11.873 -10.654 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -4.245 -12.989 -10.320 1.00 0.00 H new ATOM 1486 N TYR A 99 -1.294 -14.122 -9.524 1.00 0.00 N ATOM 1487 CA TYR A 99 -0.470 -14.779 -8.558 1.00 0.00 C ATOM 1488 C TYR A 99 0.968 -14.759 -8.950 1.00 0.00 C ATOM 1489 O TYR A 99 1.404 -14.744 -10.099 1.00 0.00 O ATOM 1490 CB TYR A 99 -0.886 -16.233 -8.275 1.00 0.00 C ATOM 1491 CG TYR A 99 -2.268 -16.427 -7.753 1.00 0.00 C ATOM 1492 CD1 TYR A 99 -2.640 -15.810 -6.581 1.00 0.00 C ATOM 1493 CD2 TYR A 99 -3.216 -17.053 -8.527 1.00 0.00 C ATOM 1494 CE1 TYR A 99 -3.887 -16.082 -6.069 1.00 0.00 C ATOM 1495 CE2 TYR A 99 -4.489 -17.298 -8.067 1.00 0.00 C ATOM 1496 CZ TYR A 99 -4.776 -16.826 -6.808 1.00 0.00 C ATOM 1497 OH TYR A 99 -6.076 -17.102 -6.334 1.00 0.00 O ATOM 0 H TYR A 99 -0.911 -14.223 -10.464 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.613 -14.206 -7.642 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -0.783 -16.805 -9.197 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.185 -16.657 -7.557 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -1.970 -15.130 -6.076 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -2.953 -17.362 -9.528 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -4.166 -15.714 -5.093 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -5.219 -17.829 -8.659 1.00 0.00 H new ATOM 0 HH TYR A 99 -6.558 -17.640 -6.996 1.00 0.00 H new ATOM 1507 N ILE A 100 1.818 -14.794 -7.908 1.00 0.00 N ATOM 1508 CA ILE A 100 3.243 -14.778 -8.030 1.00 0.00 C ATOM 1509 C ILE A 100 3.804 -15.967 -7.329 1.00 0.00 C ATOM 1510 O ILE A 100 3.446 -16.176 -6.171 1.00 0.00 O ATOM 1511 CB ILE A 100 3.904 -13.520 -7.551 1.00 0.00 C ATOM 1512 CG1 ILE A 100 3.209 -12.185 -7.869 1.00 0.00 C ATOM 1513 CG2 ILE A 100 5.375 -13.439 -7.995 1.00 0.00 C ATOM 1514 CD1 ILE A 100 3.634 -11.061 -6.925 1.00 0.00 C ATOM 0 H ILE A 100 1.499 -14.835 -6.940 1.00 0.00 H new ATOM 0 HA ILE A 100 3.461 -14.814 -9.097 1.00 0.00 H new ATOM 0 HB ILE A 100 3.820 -13.628 -6.470 1.00 0.00 H new ATOM 0 HG12 ILE A 100 3.436 -11.897 -8.896 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.129 -12.318 -7.806 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.816 -12.512 -7.627 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.925 -14.288 -7.590 1.00 0.00 H new ATOM 0 HG23 ILE A 100 5.428 -13.459 -9.084 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.113 -10.142 -7.195 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.383 -11.333 -5.900 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.710 -10.905 -7.006 1.00 0.00 H new ATOM 1526 N SER A 101 4.674 -16.783 -7.949 1.00 0.00 N ATOM 1527 CA SER A 101 5.416 -17.845 -7.344 1.00 0.00 C ATOM 1528 C SER A 101 6.826 -17.393 -7.177 1.00 0.00 C ATOM 1529 O SER A 101 7.242 -16.520 -7.938 1.00 0.00 O ATOM 1530 CB SER A 101 5.447 -19.091 -8.245 1.00 0.00 C ATOM 1531 OG SER A 101 6.173 -18.923 -9.454 1.00 0.00 O ATOM 0 H SER A 101 4.873 -16.693 -8.945 1.00 0.00 H new ATOM 0 HA SER A 101 4.942 -18.095 -6.395 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.883 -19.918 -7.685 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.423 -19.375 -8.487 1.00 0.00 H new ATOM 0 HG SER A 101 6.148 -19.756 -9.969 1.00 0.00 H new ATOM 1537 N ALA A 102 7.597 -17.994 -6.253 1.00 0.00 N ATOM 1538 CA ALA A 102 8.996 -17.708 -6.186 1.00 0.00 C ATOM 1539 C ALA A 102 9.660 -17.701 -7.520 1.00 0.00 C ATOM 1540 O ALA A 102 10.537 -16.859 -7.706 1.00 0.00 O ATOM 1541 CB ALA A 102 9.736 -18.687 -5.259 1.00 0.00 C ATOM 0 H ALA A 102 7.260 -18.666 -5.564 1.00 0.00 H new ATOM 0 HA ALA A 102 9.059 -16.700 -5.775 1.00 0.00 H new ATOM 0 HB1 ALA A 102 10.796 -18.435 -5.236 1.00 0.00 H new ATOM 0 HB2 ALA A 102 9.324 -18.617 -4.252 1.00 0.00 H new ATOM 0 HB3 ALA A 102 9.613 -19.704 -5.631 1.00 0.00 H new ATOM 1547 N ALA A 103 9.439 -18.580 -8.514 1.00 0.00 N ATOM 1548 CA ALA A 103 9.982 -18.545 -9.836 1.00 0.00 C ATOM 1549 C ALA A 103 9.812 -17.276 -10.598 1.00 0.00 C ATOM 1550 O ALA A 103 10.708 -16.715 -11.227 1.00 0.00 O ATOM 1551 CB ALA A 103 9.399 -19.688 -10.684 1.00 0.00 C ATOM 0 H ALA A 103 8.827 -19.384 -8.378 1.00 0.00 H new ATOM 0 HA ALA A 103 11.054 -18.648 -9.666 1.00 0.00 H new ATOM 0 HB1 ALA A 103 9.822 -19.648 -11.688 1.00 0.00 H new ATOM 0 HB2 ALA A 103 9.646 -20.645 -10.224 1.00 0.00 H new ATOM 0 HB3 ALA A 103 8.316 -19.582 -10.742 1.00 0.00 H new ATOM 1557 N GLU A 104 8.622 -16.663 -10.465 1.00 0.00 N ATOM 1558 CA GLU A 104 8.371 -15.352 -10.978 1.00 0.00 C ATOM 1559 C GLU A 104 9.071 -14.258 -10.247 1.00 0.00 C ATOM 1560 O GLU A 104 9.587 -13.390 -10.949 1.00 0.00 O ATOM 1561 CB GLU A 104 6.859 -15.085 -11.066 1.00 0.00 C ATOM 1562 CG GLU A 104 6.105 -16.293 -11.626 1.00 0.00 C ATOM 1563 CD GLU A 104 4.604 -16.332 -11.873 1.00 0.00 C ATOM 1564 OE1 GLU A 104 3.894 -16.535 -10.852 1.00 0.00 O ATOM 1565 OE2 GLU A 104 4.152 -16.137 -13.033 1.00 0.00 O ATOM 0 H GLU A 104 7.821 -17.084 -9.994 1.00 0.00 H new ATOM 0 HA GLU A 104 8.799 -15.340 -11.980 1.00 0.00 H new ATOM 0 HB2 GLU A 104 6.474 -14.842 -10.076 1.00 0.00 H new ATOM 0 HB3 GLU A 104 6.679 -14.217 -11.700 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.575 -16.526 -12.582 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.322 -17.123 -10.954 1.00 0.00 H new ATOM 1572 N LEU A 105 9.036 -14.140 -8.908 1.00 0.00 N ATOM 1573 CA LEU A 105 9.725 -13.127 -8.170 1.00 0.00 C ATOM 1574 C LEU A 105 11.203 -13.120 -8.361 1.00 0.00 C ATOM 1575 O LEU A 105 11.825 -12.059 -8.323 1.00 0.00 O ATOM 1576 CB LEU A 105 9.386 -13.180 -6.671 1.00 0.00 C ATOM 1577 CG LEU A 105 9.991 -12.040 -5.835 1.00 0.00 C ATOM 1578 CD1 LEU A 105 8.936 -11.751 -4.753 1.00 0.00 C ATOM 1579 CD2 LEU A 105 11.247 -12.451 -5.048 1.00 0.00 C ATOM 0 H LEU A 105 8.505 -14.777 -8.314 1.00 0.00 H new ATOM 0 HA LEU A 105 9.358 -12.190 -8.590 1.00 0.00 H new ATOM 0 HB2 LEU A 105 8.302 -13.161 -6.557 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.732 -14.132 -6.267 1.00 0.00 H new ATOM 0 HG LEU A 105 10.253 -11.221 -6.505 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.288 -10.946 -4.108 1.00 0.00 H new ATOM 0 HD12 LEU A 105 8.001 -11.454 -5.227 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.771 -12.648 -4.156 1.00 0.00 H new ATOM 0 HD21 LEU A 105 11.618 -11.596 -4.482 1.00 0.00 H new ATOM 0 HD22 LEU A 105 10.998 -13.260 -4.361 1.00 0.00 H new ATOM 0 HD23 LEU A 105 12.017 -12.788 -5.742 1.00 0.00 H new ATOM 1591 N ARG A 106 11.794 -14.310 -8.568 1.00 0.00 N ATOM 1592 CA ARG A 106 13.204 -14.484 -8.727 1.00 0.00 C ATOM 1593 C ARG A 106 13.610 -13.900 -10.036 1.00 0.00 C ATOM 1594 O ARG A 106 14.587 -13.161 -10.149 1.00 0.00 O ATOM 1595 CB ARG A 106 13.632 -15.960 -8.661 1.00 0.00 C ATOM 1596 CG ARG A 106 15.138 -16.100 -8.896 1.00 0.00 C ATOM 1597 CD ARG A 106 15.636 -17.522 -8.631 1.00 0.00 C ATOM 1598 NE ARG A 106 17.107 -17.502 -8.870 1.00 0.00 N ATOM 1599 CZ ARG A 106 17.803 -18.675 -8.936 1.00 0.00 C ATOM 1600 NH1 ARG A 106 17.209 -19.857 -8.600 1.00 0.00 N ATOM 1601 NH2 ARG A 106 19.047 -18.706 -9.497 1.00 0.00 N ATOM 0 H ARG A 106 11.270 -15.183 -8.627 1.00 0.00 H new ATOM 0 HA ARG A 106 13.701 -13.976 -7.901 1.00 0.00 H new ATOM 0 HB2 ARG A 106 13.371 -16.376 -7.688 1.00 0.00 H new ATOM 0 HB3 ARG A 106 13.087 -16.535 -9.410 1.00 0.00 H new ATOM 0 HG2 ARG A 106 15.371 -15.821 -9.924 1.00 0.00 H new ATOM 0 HG3 ARG A 106 15.671 -15.404 -8.248 1.00 0.00 H new ATOM 0 HD2 ARG A 106 15.412 -17.828 -7.609 1.00 0.00 H new ATOM 0 HD3 ARG A 106 15.144 -18.236 -9.292 1.00 0.00 H new ATOM 0 HE ARG A 106 17.593 -16.613 -8.984 1.00 0.00 H new ATOM 0 HH11 ARG A 106 16.235 -19.870 -8.296 1.00 0.00 H new ATOM 0 HH12 ARG A 106 17.739 -20.727 -8.653 1.00 0.00 H new ATOM 0 HH21 ARG A 106 19.460 -17.851 -9.869 1.00 0.00 H new ATOM 0 HH22 ARG A 106 19.563 -19.584 -9.544 1.00 0.00 H new ATOM 1615 N HIS A 107 12.808 -14.122 -11.093 1.00 0.00 N ATOM 1616 CA HIS A 107 13.037 -13.629 -12.416 1.00 0.00 C ATOM 1617 C HIS A 107 12.992 -12.140 -12.435 1.00 0.00 C ATOM 1618 O HIS A 107 13.647 -11.556 -13.298 1.00 0.00 O ATOM 1619 CB HIS A 107 11.939 -14.210 -13.322 1.00 0.00 C ATOM 1620 CG HIS A 107 11.726 -13.661 -14.702 1.00 0.00 C ATOM 1621 ND1 HIS A 107 12.546 -13.955 -15.772 1.00 0.00 N ATOM 1622 CD2 HIS A 107 10.727 -12.861 -15.162 1.00 0.00 C ATOM 1623 CE1 HIS A 107 11.988 -13.307 -16.830 1.00 0.00 C ATOM 1624 NE2 HIS A 107 10.885 -12.653 -16.517 1.00 0.00 N ATOM 0 H HIS A 107 11.954 -14.675 -11.020 1.00 0.00 H new ATOM 0 HA HIS A 107 14.023 -13.931 -12.768 1.00 0.00 H new ATOM 0 HB2 HIS A 107 12.138 -15.277 -13.426 1.00 0.00 H new ATOM 0 HB3 HIS A 107 10.994 -14.113 -12.787 1.00 0.00 H new ATOM 0 HD1 HIS A 107 13.387 -14.532 -15.770 1.00 0.00 H new ATOM 0 HD2 HIS A 107 9.931 -12.451 -14.558 1.00 0.00 H new ATOM 0 HE1 HIS A 107 12.405 -13.326 -17.826 1.00 0.00 H new ATOM 1632 N VAL A 108 12.282 -11.555 -11.454 1.00 0.00 N ATOM 1633 CA VAL A 108 12.284 -10.135 -11.284 1.00 0.00 C ATOM 1634 C VAL A 108 13.572 -9.717 -10.661 1.00 0.00 C ATOM 1635 O VAL A 108 14.213 -8.733 -11.024 1.00 0.00 O ATOM 1636 CB VAL A 108 11.210 -9.669 -10.347 1.00 0.00 C ATOM 1637 CG1 VAL A 108 11.099 -8.136 -10.282 1.00 0.00 C ATOM 1638 CG2 VAL A 108 9.814 -10.131 -10.799 1.00 0.00 C ATOM 0 H VAL A 108 11.708 -12.063 -10.781 1.00 0.00 H new ATOM 0 HA VAL A 108 12.127 -9.705 -12.273 1.00 0.00 H new ATOM 0 HB VAL A 108 11.499 -10.092 -9.385 1.00 0.00 H new ATOM 0 HG11 VAL A 108 10.306 -7.858 -9.588 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.045 -7.717 -9.938 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.868 -7.746 -11.273 1.00 0.00 H new ATOM 0 HG21 VAL A 108 9.066 -9.772 -10.093 1.00 0.00 H new ATOM 0 HG22 VAL A 108 9.601 -9.729 -11.789 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.785 -11.220 -10.836 1.00 0.00 H new ATOM 1648 N MET A 109 14.107 -10.461 -9.677 1.00 0.00 N ATOM 1649 CA MET A 109 15.402 -10.151 -9.154 1.00 0.00 C ATOM 1650 C MET A 109 16.522 -10.343 -10.117 1.00 0.00 C ATOM 1651 O MET A 109 17.369 -9.452 -10.084 1.00 0.00 O ATOM 1652 CB MET A 109 15.777 -10.883 -7.854 1.00 0.00 C ATOM 1653 CG MET A 109 14.653 -11.037 -6.827 1.00 0.00 C ATOM 1654 SD MET A 109 13.435 -9.708 -6.595 1.00 0.00 S ATOM 1655 CE MET A 109 14.526 -8.471 -5.836 1.00 0.00 C ATOM 0 H MET A 109 13.651 -11.266 -9.248 1.00 0.00 H new ATOM 0 HA MET A 109 15.285 -9.089 -8.938 1.00 0.00 H new ATOM 0 HB2 MET A 109 16.146 -11.876 -8.112 1.00 0.00 H new ATOM 0 HB3 MET A 109 16.602 -10.348 -7.384 1.00 0.00 H new ATOM 0 HG2 MET A 109 14.100 -11.940 -7.087 1.00 0.00 H new ATOM 0 HG3 MET A 109 15.122 -11.217 -5.860 1.00 0.00 H new ATOM 0 HE1 MET A 109 13.955 -7.569 -5.616 1.00 0.00 H new ATOM 0 HE2 MET A 109 14.943 -8.871 -4.912 1.00 0.00 H new ATOM 0 HE3 MET A 109 15.336 -8.229 -6.524 1.00 0.00 H new ATOM 1665 N THR A 110 16.445 -11.394 -10.953 1.00 0.00 N ATOM 1666 CA THR A 110 17.339 -11.548 -12.058 1.00 0.00 C ATOM 1667 C THR A 110 17.239 -10.456 -13.068 1.00 0.00 C ATOM 1668 O THR A 110 18.259 -9.994 -13.578 1.00 0.00 O ATOM 1669 CB THR A 110 17.141 -12.827 -12.816 1.00 0.00 C ATOM 1670 OG1 THR A 110 16.963 -13.885 -11.886 1.00 0.00 O ATOM 1671 CG2 THR A 110 18.346 -13.162 -13.712 1.00 0.00 C ATOM 0 H THR A 110 15.758 -12.142 -10.862 1.00 0.00 H new ATOM 0 HA THR A 110 18.315 -11.533 -11.573 1.00 0.00 H new ATOM 0 HB THR A 110 16.267 -12.705 -13.456 1.00 0.00 H new ATOM 0 HG1 THR A 110 16.831 -14.727 -12.370 1.00 0.00 H new ATOM 0 HG21 THR A 110 18.157 -14.096 -14.241 1.00 0.00 H new ATOM 0 HG22 THR A 110 18.496 -12.360 -14.434 1.00 0.00 H new ATOM 0 HG23 THR A 110 19.239 -13.268 -13.096 1.00 0.00 H new ATOM 1679 N ASN A 111 16.037 -9.977 -13.433 1.00 0.00 N ATOM 1680 CA ASN A 111 15.787 -8.950 -14.397 1.00 0.00 C ATOM 1681 C ASN A 111 16.449 -7.647 -14.105 1.00 0.00 C ATOM 1682 O ASN A 111 17.073 -6.957 -14.908 1.00 0.00 O ATOM 1683 CB ASN A 111 14.327 -8.680 -14.798 1.00 0.00 C ATOM 1684 CG ASN A 111 13.777 -9.792 -15.680 1.00 0.00 C ATOM 1685 OD1 ASN A 111 14.411 -10.377 -16.557 1.00 0.00 O ATOM 1686 ND2 ASN A 111 12.477 -10.112 -15.443 1.00 0.00 N ATOM 0 H ASN A 111 15.175 -10.335 -13.022 1.00 0.00 H new ATOM 0 HA ASN A 111 16.256 -9.421 -15.261 1.00 0.00 H new ATOM 0 HB2 ASN A 111 13.713 -8.588 -13.902 1.00 0.00 H new ATOM 0 HB3 ASN A 111 14.264 -7.729 -15.327 1.00 0.00 H new ATOM 0 HD21 ASN A 111 12.023 -10.840 -15.994 1.00 0.00 H new ATOM 0 HD22 ASN A 111 11.956 -9.624 -14.715 1.00 0.00 H new ATOM 1693 N LEU A 112 16.270 -7.245 -12.834 1.00 0.00 N ATOM 1694 CA LEU A 112 16.932 -6.123 -12.244 1.00 0.00 C ATOM 1695 C LEU A 112 18.382 -6.382 -12.022 1.00 0.00 C ATOM 1696 O LEU A 112 19.191 -5.484 -12.249 1.00 0.00 O ATOM 1697 CB LEU A 112 16.308 -5.775 -10.881 1.00 0.00 C ATOM 1698 CG LEU A 112 14.795 -5.532 -11.006 1.00 0.00 C ATOM 1699 CD1 LEU A 112 14.153 -5.194 -9.650 1.00 0.00 C ATOM 1700 CD2 LEU A 112 14.444 -4.412 -12.000 1.00 0.00 C ATOM 0 H LEU A 112 15.638 -7.722 -12.191 1.00 0.00 H new ATOM 0 HA LEU A 112 16.814 -5.297 -12.946 1.00 0.00 H new ATOM 0 HB2 LEU A 112 16.491 -6.586 -10.177 1.00 0.00 H new ATOM 0 HB3 LEU A 112 16.789 -4.885 -10.475 1.00 0.00 H new ATOM 0 HG LEU A 112 14.392 -6.472 -11.383 1.00 0.00 H new ATOM 0 HD11 LEU A 112 13.084 -5.030 -9.784 1.00 0.00 H new ATOM 0 HD12 LEU A 112 14.309 -6.021 -8.957 1.00 0.00 H new ATOM 0 HD13 LEU A 112 14.611 -4.291 -9.246 1.00 0.00 H new ATOM 0 HD21 LEU A 112 13.362 -4.290 -12.043 1.00 0.00 H new ATOM 0 HD22 LEU A 112 14.902 -3.479 -11.673 1.00 0.00 H new ATOM 0 HD23 LEU A 112 14.819 -4.673 -12.990 1.00 0.00 H new ATOM 1712 N GLY A 113 18.833 -7.601 -11.676 1.00 0.00 N ATOM 1713 CA GLY A 113 20.224 -7.915 -11.565 1.00 0.00 C ATOM 1714 C GLY A 113 20.648 -8.007 -10.139 1.00 0.00 C ATOM 1715 O GLY A 113 21.820 -8.218 -9.835 1.00 0.00 O ATOM 0 H GLY A 113 18.217 -8.387 -11.469 1.00 0.00 H new ATOM 0 HA2 GLY A 113 20.427 -8.860 -12.068 1.00 0.00 H new ATOM 0 HA3 GLY A 113 20.813 -7.151 -12.073 1.00 0.00 H new ATOM 1719 N GLU A 114 19.677 -7.799 -9.232 1.00 0.00 N ATOM 1720 CA GLU A 114 19.788 -7.950 -7.814 1.00 0.00 C ATOM 1721 C GLU A 114 20.201 -9.347 -7.500 1.00 0.00 C ATOM 1722 O GLU A 114 19.485 -10.265 -7.894 1.00 0.00 O ATOM 1723 CB GLU A 114 18.407 -7.739 -7.171 1.00 0.00 C ATOM 1724 CG GLU A 114 17.894 -6.299 -7.239 1.00 0.00 C ATOM 1725 CD GLU A 114 18.919 -5.363 -6.614 1.00 0.00 C ATOM 1726 OE1 GLU A 114 19.499 -5.672 -5.539 1.00 0.00 O ATOM 1727 OE2 GLU A 114 19.088 -4.235 -7.149 1.00 0.00 O ATOM 0 H GLU A 114 18.742 -7.502 -9.513 1.00 0.00 H new ATOM 0 HA GLU A 114 20.513 -7.229 -7.438 1.00 0.00 H new ATOM 0 HB2 GLU A 114 17.687 -8.393 -7.663 1.00 0.00 H new ATOM 0 HB3 GLU A 114 18.455 -8.046 -6.126 1.00 0.00 H new ATOM 0 HG2 GLU A 114 17.712 -6.016 -8.276 1.00 0.00 H new ATOM 0 HG3 GLU A 114 16.942 -6.216 -6.714 1.00 0.00 H new ATOM 1734 N LYS A 115 21.296 -9.621 -6.767 1.00 0.00 N ATOM 1735 CA LYS A 115 21.854 -10.935 -6.673 1.00 0.00 C ATOM 1736 C LYS A 115 21.301 -11.745 -5.552 1.00 0.00 C ATOM 1737 O LYS A 115 21.620 -11.613 -4.371 1.00 0.00 O ATOM 1738 CB LYS A 115 23.391 -10.982 -6.670 1.00 0.00 C ATOM 1739 CG LYS A 115 24.126 -10.327 -7.841 1.00 0.00 C ATOM 1740 CD LYS A 115 24.426 -8.840 -7.642 1.00 0.00 C ATOM 1741 CE LYS A 115 25.281 -8.193 -8.734 1.00 0.00 C ATOM 1742 NZ LYS A 115 24.420 -7.926 -9.908 1.00 0.00 N ATOM 0 H LYS A 115 21.803 -8.917 -6.230 1.00 0.00 H new ATOM 0 HA LYS A 115 21.532 -11.400 -7.605 1.00 0.00 H new ATOM 0 HB2 LYS A 115 23.739 -10.511 -5.751 1.00 0.00 H new ATOM 0 HB3 LYS A 115 23.694 -12.028 -6.627 1.00 0.00 H new ATOM 0 HG2 LYS A 115 25.064 -10.856 -8.008 1.00 0.00 H new ATOM 0 HG3 LYS A 115 23.527 -10.447 -8.744 1.00 0.00 H new ATOM 0 HD2 LYS A 115 23.481 -8.301 -7.577 1.00 0.00 H new ATOM 0 HD3 LYS A 115 24.932 -8.713 -6.685 1.00 0.00 H new ATOM 0 HE2 LYS A 115 25.723 -7.266 -8.369 1.00 0.00 H new ATOM 0 HE3 LYS A 115 26.105 -8.851 -9.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 24.647 -8.601 -10.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 23.421 -8.032 -9.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 24.586 -6.957 -10.247 1.00 0.00 H new ATOM 1756 N LEU A 116 20.351 -12.630 -5.903 1.00 0.00 N ATOM 1757 CA LEU A 116 19.719 -13.483 -4.945 1.00 0.00 C ATOM 1758 C LEU A 116 19.742 -14.905 -5.388 1.00 0.00 C ATOM 1759 O LEU A 116 19.863 -15.137 -6.590 1.00 0.00 O ATOM 1760 CB LEU A 116 18.258 -13.098 -4.657 1.00 0.00 C ATOM 1761 CG LEU A 116 17.968 -11.966 -3.658 1.00 0.00 C ATOM 1762 CD1 LEU A 116 18.292 -10.535 -4.119 1.00 0.00 C ATOM 1763 CD2 LEU A 116 16.494 -11.938 -3.220 1.00 0.00 C ATOM 0 H LEU A 116 20.018 -12.755 -6.859 1.00 0.00 H new ATOM 0 HA LEU A 116 20.297 -13.356 -4.030 1.00 0.00 H new ATOM 0 HB2 LEU A 116 17.796 -12.825 -5.606 1.00 0.00 H new ATOM 0 HB3 LEU A 116 17.747 -13.992 -4.299 1.00 0.00 H new ATOM 0 HG LEU A 116 18.650 -12.225 -2.848 1.00 0.00 H new ATOM 0 HD11 LEU A 116 18.042 -9.832 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU A 116 19.354 -10.459 -4.350 1.00 0.00 H new ATOM 0 HD13 LEU A 116 17.709 -10.299 -5.009 1.00 0.00 H new ATOM 0 HD21 LEU A 116 16.339 -11.121 -2.515 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.858 -11.789 -4.093 1.00 0.00 H new ATOM 0 HD23 LEU A 116 16.238 -12.884 -2.742 1.00 0.00 H new ATOM 1775 N THR A 117 19.795 -15.881 -4.464 1.00 0.00 N ATOM 1776 CA THR A 117 19.543 -17.281 -4.614 1.00 0.00 C ATOM 1777 C THR A 117 18.094 -17.481 -4.326 1.00 0.00 C ATOM 1778 O THR A 117 17.390 -16.626 -3.793 1.00 0.00 O ATOM 1779 CB THR A 117 20.341 -18.070 -3.619 1.00 0.00 C ATOM 1780 OG1 THR A 117 20.199 -17.550 -2.305 1.00 0.00 O ATOM 1781 CG2 THR A 117 21.852 -17.976 -3.894 1.00 0.00 C ATOM 0 H THR A 117 20.044 -15.659 -3.500 1.00 0.00 H new ATOM 0 HA THR A 117 19.818 -17.613 -5.615 1.00 0.00 H new ATOM 0 HB THR A 117 19.967 -19.090 -3.708 1.00 0.00 H new ATOM 0 HG1 THR A 117 20.730 -18.088 -1.681 1.00 0.00 H new ATOM 0 HG21 THR A 117 22.394 -18.561 -3.151 1.00 0.00 H new ATOM 0 HG22 THR A 117 22.066 -18.366 -4.889 1.00 0.00 H new ATOM 0 HG23 THR A 117 22.168 -16.934 -3.837 1.00 0.00 H new ATOM 1789 N ASP A 118 17.570 -18.692 -4.588 1.00 0.00 N ATOM 1790 CA ASP A 118 16.311 -19.236 -4.183 1.00 0.00 C ATOM 1791 C ASP A 118 16.063 -19.026 -2.728 1.00 0.00 C ATOM 1792 O ASP A 118 14.946 -18.780 -2.276 1.00 0.00 O ATOM 1793 CB ASP A 118 16.236 -20.758 -4.386 1.00 0.00 C ATOM 1794 CG ASP A 118 16.238 -21.158 -5.855 1.00 0.00 C ATOM 1795 OD1 ASP A 118 15.590 -20.416 -6.641 1.00 0.00 O ATOM 1796 OD2 ASP A 118 16.903 -22.131 -6.300 1.00 0.00 O ATOM 0 H ASP A 118 18.093 -19.365 -5.149 1.00 0.00 H new ATOM 0 HA ASP A 118 15.577 -18.719 -4.801 1.00 0.00 H new ATOM 0 HB2 ASP A 118 17.082 -21.229 -3.885 1.00 0.00 H new ATOM 0 HB3 ASP A 118 15.332 -21.139 -3.912 1.00 0.00 H new ATOM 1801 N GLU A 119 17.094 -19.124 -1.870 1.00 0.00 N ATOM 1802 CA GLU A 119 16.992 -18.963 -0.453 1.00 0.00 C ATOM 1803 C GLU A 119 16.527 -17.625 0.007 1.00 0.00 C ATOM 1804 O GLU A 119 15.675 -17.438 0.874 1.00 0.00 O ATOM 1805 CB GLU A 119 18.307 -19.338 0.253 1.00 0.00 C ATOM 1806 CG GLU A 119 17.979 -19.618 1.721 1.00 0.00 C ATOM 1807 CD GLU A 119 19.185 -20.237 2.413 1.00 0.00 C ATOM 1808 OE1 GLU A 119 19.464 -21.451 2.218 1.00 0.00 O ATOM 1809 OE2 GLU A 119 19.808 -19.507 3.229 1.00 0.00 O ATOM 0 H GLU A 119 18.045 -19.325 -2.180 1.00 0.00 H new ATOM 0 HA GLU A 119 16.204 -19.659 -0.166 1.00 0.00 H new ATOM 0 HB2 GLU A 119 18.756 -20.215 -0.213 1.00 0.00 H new ATOM 0 HB3 GLU A 119 19.031 -18.527 0.170 1.00 0.00 H new ATOM 0 HG2 GLU A 119 17.697 -18.692 2.222 1.00 0.00 H new ATOM 0 HG3 GLU A 119 17.124 -20.291 1.790 1.00 0.00 H new ATOM 1816 N GLU A 120 17.056 -16.567 -0.632 1.00 0.00 N ATOM 1817 CA GLU A 120 16.746 -15.201 -0.344 1.00 0.00 C ATOM 1818 C GLU A 120 15.438 -14.769 -0.912 1.00 0.00 C ATOM 1819 O GLU A 120 14.711 -14.014 -0.267 1.00 0.00 O ATOM 1820 CB GLU A 120 17.893 -14.384 -0.962 1.00 0.00 C ATOM 1821 CG GLU A 120 19.258 -14.681 -0.337 1.00 0.00 C ATOM 1822 CD GLU A 120 20.350 -13.845 -0.989 1.00 0.00 C ATOM 1823 OE1 GLU A 120 20.566 -12.696 -0.518 1.00 0.00 O ATOM 1824 OE2 GLU A 120 21.036 -14.373 -1.904 1.00 0.00 O ATOM 0 H GLU A 120 17.734 -16.669 -1.387 1.00 0.00 H new ATOM 0 HA GLU A 120 16.653 -15.054 0.732 1.00 0.00 H new ATOM 0 HB2 GLU A 120 17.939 -14.589 -2.032 1.00 0.00 H new ATOM 0 HB3 GLU A 120 17.674 -13.322 -0.850 1.00 0.00 H new ATOM 0 HG2 GLU A 120 19.225 -14.473 0.732 1.00 0.00 H new ATOM 0 HG3 GLU A 120 19.490 -15.740 -0.449 1.00 0.00 H new ATOM 1831 N VAL A 121 15.056 -15.412 -2.030 1.00 0.00 N ATOM 1832 CA VAL A 121 13.771 -15.290 -2.646 1.00 0.00 C ATOM 1833 C VAL A 121 12.686 -15.885 -1.816 1.00 0.00 C ATOM 1834 O VAL A 121 11.655 -15.255 -1.581 1.00 0.00 O ATOM 1835 CB VAL A 121 13.806 -15.976 -3.979 1.00 0.00 C ATOM 1836 CG1 VAL A 121 12.372 -16.104 -4.521 1.00 0.00 C ATOM 1837 CG2 VAL A 121 14.667 -15.141 -4.942 1.00 0.00 C ATOM 0 H VAL A 121 15.676 -16.050 -2.530 1.00 0.00 H new ATOM 0 HA VAL A 121 13.553 -14.228 -2.757 1.00 0.00 H new ATOM 0 HB VAL A 121 14.236 -16.973 -3.882 1.00 0.00 H new ATOM 0 HG11 VAL A 121 12.392 -16.602 -5.490 1.00 0.00 H new ATOM 0 HG12 VAL A 121 11.771 -16.689 -3.825 1.00 0.00 H new ATOM 0 HG13 VAL A 121 11.935 -15.112 -4.632 1.00 0.00 H new ATOM 0 HG21 VAL A 121 14.701 -15.629 -5.916 1.00 0.00 H new ATOM 0 HG22 VAL A 121 14.233 -14.147 -5.049 1.00 0.00 H new ATOM 0 HG23 VAL A 121 15.678 -15.055 -4.544 1.00 0.00 H new ATOM 1847 N ASP A 122 13.013 -17.055 -1.240 1.00 0.00 N ATOM 1848 CA ASP A 122 12.168 -17.867 -0.420 1.00 0.00 C ATOM 1849 C ASP A 122 11.927 -17.074 0.818 1.00 0.00 C ATOM 1850 O ASP A 122 10.763 -17.099 1.215 1.00 0.00 O ATOM 1851 CB ASP A 122 12.828 -19.218 -0.097 1.00 0.00 C ATOM 1852 CG ASP A 122 11.900 -20.282 0.473 1.00 0.00 C ATOM 1853 OD1 ASP A 122 10.795 -20.516 -0.084 1.00 0.00 O ATOM 1854 OD2 ASP A 122 12.378 -21.047 1.353 1.00 0.00 O ATOM 0 H ASP A 122 13.940 -17.464 -1.357 1.00 0.00 H new ATOM 0 HA ASP A 122 11.235 -18.108 -0.929 1.00 0.00 H new ATOM 0 HB2 ASP A 122 13.282 -19.607 -1.008 1.00 0.00 H new ATOM 0 HB3 ASP A 122 13.636 -19.047 0.614 1.00 0.00 H new ATOM 1859 N GLU A 123 12.879 -16.279 1.340 1.00 0.00 N ATOM 1860 CA GLU A 123 12.755 -15.366 2.434 1.00 0.00 C ATOM 1861 C GLU A 123 11.809 -14.244 2.176 1.00 0.00 C ATOM 1862 O GLU A 123 10.938 -13.931 2.986 1.00 0.00 O ATOM 1863 CB GLU A 123 14.097 -14.759 2.876 1.00 0.00 C ATOM 1864 CG GLU A 123 14.110 -13.995 4.201 1.00 0.00 C ATOM 1865 CD GLU A 123 15.541 -13.576 4.508 1.00 0.00 C ATOM 1866 OE1 GLU A 123 16.343 -14.516 4.755 1.00 0.00 O ATOM 1867 OE2 GLU A 123 15.859 -12.357 4.523 1.00 0.00 O ATOM 0 H GLU A 123 13.825 -16.277 0.958 1.00 0.00 H new ATOM 0 HA GLU A 123 12.357 -15.991 3.233 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.828 -15.565 2.942 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.438 -14.083 2.092 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.465 -13.119 4.138 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.719 -14.622 5.003 1.00 0.00 H new ATOM 1874 N MET A 124 11.786 -13.728 0.934 1.00 0.00 N ATOM 1875 CA MET A 124 10.823 -12.800 0.430 1.00 0.00 C ATOM 1876 C MET A 124 9.386 -13.160 0.275 1.00 0.00 C ATOM 1877 O MET A 124 8.456 -12.546 0.796 1.00 0.00 O ATOM 1878 CB MET A 124 11.304 -12.090 -0.847 1.00 0.00 C ATOM 1879 CG MET A 124 12.607 -11.349 -0.539 1.00 0.00 C ATOM 1880 SD MET A 124 13.426 -10.805 -2.068 1.00 0.00 S ATOM 1881 CE MET A 124 14.652 -9.786 -1.199 1.00 0.00 C ATOM 0 H MET A 124 12.488 -13.977 0.237 1.00 0.00 H new ATOM 0 HA MET A 124 10.790 -12.153 1.306 1.00 0.00 H new ATOM 0 HB2 MET A 124 11.462 -12.815 -1.645 1.00 0.00 H new ATOM 0 HB3 MET A 124 10.546 -11.390 -1.198 1.00 0.00 H new ATOM 0 HG2 MET A 124 12.398 -10.485 0.092 1.00 0.00 H new ATOM 0 HG3 MET A 124 13.276 -12.001 0.024 1.00 0.00 H new ATOM 0 HE1 MET A 124 15.233 -9.217 -1.925 1.00 0.00 H new ATOM 0 HE2 MET A 124 14.141 -9.099 -0.524 1.00 0.00 H new ATOM 0 HE3 MET A 124 15.319 -10.429 -0.625 1.00 0.00 H new ATOM 1891 N ILE A 125 9.224 -14.358 -0.314 1.00 0.00 N ATOM 1892 CA ILE A 125 7.984 -15.044 -0.508 1.00 0.00 C ATOM 1893 C ILE A 125 7.418 -15.420 0.818 1.00 0.00 C ATOM 1894 O ILE A 125 6.251 -15.222 1.153 1.00 0.00 O ATOM 1895 CB ILE A 125 8.114 -16.195 -1.460 1.00 0.00 C ATOM 1896 CG1 ILE A 125 8.447 -15.940 -2.940 1.00 0.00 C ATOM 1897 CG2 ILE A 125 6.769 -16.941 -1.488 1.00 0.00 C ATOM 1898 CD1 ILE A 125 7.352 -15.165 -3.672 1.00 0.00 C ATOM 0 H ILE A 125 10.017 -14.884 -0.681 1.00 0.00 H new ATOM 0 HA ILE A 125 7.273 -14.374 -0.992 1.00 0.00 H new ATOM 0 HB ILE A 125 8.982 -16.718 -1.058 1.00 0.00 H new ATOM 0 HG12 ILE A 125 9.383 -15.386 -3.006 1.00 0.00 H new ATOM 0 HG13 ILE A 125 8.606 -16.895 -3.441 1.00 0.00 H new ATOM 0 HG21 ILE A 125 6.835 -17.785 -2.174 1.00 0.00 H new ATOM 0 HG22 ILE A 125 6.534 -17.304 -0.488 1.00 0.00 H new ATOM 0 HG23 ILE A 125 5.984 -16.263 -1.822 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.644 -15.016 -4.711 1.00 0.00 H new ATOM 0 HD12 ILE A 125 6.420 -15.729 -3.635 1.00 0.00 H new ATOM 0 HD13 ILE A 125 7.209 -14.196 -3.193 1.00 0.00 H new ATOM 1910 N ARG A 126 8.164 -16.005 1.773 1.00 0.00 N ATOM 1911 CA ARG A 126 7.768 -16.298 3.115 1.00 0.00 C ATOM 1912 C ARG A 126 7.282 -15.147 3.927 1.00 0.00 C ATOM 1913 O ARG A 126 6.406 -15.271 4.781 1.00 0.00 O ATOM 1914 CB ARG A 126 8.918 -16.903 3.939 1.00 0.00 C ATOM 1915 CG ARG A 126 8.572 -17.652 5.227 1.00 0.00 C ATOM 1916 CD ARG A 126 9.592 -18.689 5.702 1.00 0.00 C ATOM 1917 NE ARG A 126 10.820 -17.995 6.184 1.00 0.00 N ATOM 1918 CZ ARG A 126 12.048 -17.943 5.591 1.00 0.00 C ATOM 1919 NH1 ARG A 126 12.270 -18.515 4.371 1.00 0.00 N ATOM 1920 NH2 ARG A 126 13.071 -17.349 6.272 1.00 0.00 N ATOM 0 H ARG A 126 9.124 -16.296 1.588 1.00 0.00 H new ATOM 0 HA ARG A 126 6.942 -16.989 2.947 1.00 0.00 H new ATOM 0 HB2 ARG A 126 9.465 -17.589 3.292 1.00 0.00 H new ATOM 0 HB3 ARG A 126 9.602 -16.095 4.198 1.00 0.00 H new ATOM 0 HG2 ARG A 126 8.433 -16.919 6.022 1.00 0.00 H new ATOM 0 HG3 ARG A 126 7.615 -18.154 5.085 1.00 0.00 H new ATOM 0 HD2 ARG A 126 9.166 -19.294 6.502 1.00 0.00 H new ATOM 0 HD3 ARG A 126 9.842 -19.369 4.887 1.00 0.00 H new ATOM 0 HE ARG A 126 10.731 -17.496 7.069 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.510 -18.992 3.886 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.195 -18.465 3.945 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.907 -16.958 7.200 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.999 -17.296 5.853 1.00 0.00 H new ATOM 1934 N GLU A 127 7.790 -13.936 3.638 1.00 0.00 N ATOM 1935 CA GLU A 127 7.410 -12.772 4.376 1.00 0.00 C ATOM 1936 C GLU A 127 6.140 -12.190 3.857 1.00 0.00 C ATOM 1937 O GLU A 127 5.366 -11.601 4.609 1.00 0.00 O ATOM 1938 CB GLU A 127 8.602 -11.804 4.446 1.00 0.00 C ATOM 1939 CG GLU A 127 8.336 -10.409 5.015 1.00 0.00 C ATOM 1940 CD GLU A 127 9.500 -9.488 4.680 1.00 0.00 C ATOM 1941 OE1 GLU A 127 10.550 -9.569 5.372 1.00 0.00 O ATOM 1942 OE2 GLU A 127 9.387 -8.643 3.752 1.00 0.00 O ATOM 0 H GLU A 127 8.464 -13.763 2.893 1.00 0.00 H new ATOM 0 HA GLU A 127 7.172 -13.032 5.407 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.382 -12.271 5.047 1.00 0.00 H new ATOM 0 HB3 GLU A 127 9.003 -11.688 3.439 1.00 0.00 H new ATOM 0 HG2 GLU A 127 7.411 -10.007 4.601 1.00 0.00 H new ATOM 0 HG3 GLU A 127 8.204 -10.466 6.095 1.00 0.00 H new ATOM 1949 N ALA A 128 6.096 -12.308 2.518 1.00 0.00 N ATOM 1950 CA ALA A 128 4.991 -11.872 1.722 1.00 0.00 C ATOM 1951 C ALA A 128 3.706 -12.617 1.839 1.00 0.00 C ATOM 1952 O ALA A 128 2.640 -12.005 1.856 1.00 0.00 O ATOM 1953 CB ALA A 128 5.373 -12.142 0.257 1.00 0.00 C ATOM 0 H ALA A 128 6.853 -12.720 1.972 1.00 0.00 H new ATOM 0 HA ALA A 128 4.825 -10.847 2.054 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.559 -11.825 -0.395 1.00 0.00 H new ATOM 0 HB2 ALA A 128 6.276 -11.584 0.008 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.555 -13.208 0.119 1.00 0.00 H new ATOM 1959 N ASP A 129 3.793 -13.943 2.050 1.00 0.00 N ATOM 1960 CA ASP A 129 2.585 -14.705 1.983 1.00 0.00 C ATOM 1961 C ASP A 129 1.907 -14.770 3.309 1.00 0.00 C ATOM 1962 O ASP A 129 2.488 -15.248 4.282 1.00 0.00 O ATOM 1963 CB ASP A 129 2.881 -16.128 1.482 1.00 0.00 C ATOM 1964 CG ASP A 129 1.620 -16.571 0.753 1.00 0.00 C ATOM 1965 OD1 ASP A 129 1.529 -16.314 -0.477 1.00 0.00 O ATOM 1966 OD2 ASP A 129 0.718 -17.174 1.393 1.00 0.00 O ATOM 0 H ASP A 129 4.646 -14.463 2.255 1.00 0.00 H new ATOM 0 HA ASP A 129 1.917 -14.204 1.283 1.00 0.00 H new ATOM 0 HB2 ASP A 129 3.744 -16.138 0.816 1.00 0.00 H new ATOM 0 HB3 ASP A 129 3.111 -16.797 2.312 1.00 0.00 H new ATOM 1971 N ILE A 130 0.648 -14.301 3.366 1.00 0.00 N ATOM 1972 CA ILE A 130 -0.037 -14.090 4.603 1.00 0.00 C ATOM 1973 C ILE A 130 -0.826 -15.278 5.036 1.00 0.00 C ATOM 1974 O ILE A 130 -0.650 -15.777 6.146 1.00 0.00 O ATOM 1975 CB ILE A 130 -0.878 -12.850 4.545 1.00 0.00 C ATOM 1976 CG1 ILE A 130 0.109 -11.671 4.581 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -1.766 -12.782 5.799 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -0.588 -10.412 4.070 1.00 0.00 C ATOM 0 H ILE A 130 0.097 -14.065 2.541 1.00 0.00 H new ATOM 0 HA ILE A 130 0.725 -13.943 5.368 1.00 0.00 H new ATOM 0 HB ILE A 130 -1.511 -12.834 3.657 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.468 -11.514 5.598 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.981 -11.893 3.965 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -2.380 -11.882 5.762 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -2.411 -13.660 5.836 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -1.137 -12.756 6.689 1.00 0.00 H new ATOM 0 HD11 ILE A 130 0.109 -9.575 4.094 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -0.926 -10.573 3.046 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -1.446 -10.188 4.704 1.00 0.00 H new ATOM 1990 N ASP A 131 -1.674 -15.825 4.147 1.00 0.00 N ATOM 1991 CA ASP A 131 -2.438 -17.023 4.313 1.00 0.00 C ATOM 1992 C ASP A 131 -1.769 -18.318 4.005 1.00 0.00 C ATOM 1993 O ASP A 131 -2.406 -19.360 3.863 1.00 0.00 O ATOM 1994 CB ASP A 131 -3.721 -16.874 3.478 1.00 0.00 C ATOM 1995 CG ASP A 131 -3.539 -16.788 1.970 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -2.380 -16.731 1.477 1.00 0.00 O ATOM 1997 OD2 ASP A 131 -4.531 -16.721 1.196 1.00 0.00 O ATOM 0 H ASP A 131 -1.838 -15.393 3.238 1.00 0.00 H new ATOM 0 HA ASP A 131 -2.622 -17.104 5.384 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -4.371 -17.721 3.696 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -4.243 -15.977 3.811 1.00 0.00 H new ATOM 2002 N GLY A 132 -0.431 -18.305 3.867 1.00 0.00 N ATOM 2003 CA GLY A 132 0.469 -19.413 3.954 1.00 0.00 C ATOM 2004 C GLY A 132 0.320 -20.388 2.838 1.00 0.00 C ATOM 2005 O GLY A 132 0.775 -21.530 2.853 1.00 0.00 O ATOM 0 H GLY A 132 0.066 -17.435 3.676 1.00 0.00 H new ATOM 0 HA2 GLY A 132 1.493 -19.039 3.965 1.00 0.00 H new ATOM 0 HA3 GLY A 132 0.307 -19.929 4.901 1.00 0.00 H new ATOM 2009 N ASP A 133 -0.324 -19.969 1.734 1.00 0.00 N ATOM 2010 CA ASP A 133 -0.612 -20.855 0.649 1.00 0.00 C ATOM 2011 C ASP A 133 0.516 -21.049 -0.304 1.00 0.00 C ATOM 2012 O ASP A 133 0.729 -22.066 -0.962 1.00 0.00 O ATOM 2013 CB ASP A 133 -1.989 -20.509 0.058 1.00 0.00 C ATOM 2014 CG ASP A 133 -2.144 -19.173 -0.654 1.00 0.00 C ATOM 2015 OD1 ASP A 133 -1.118 -18.446 -0.744 1.00 0.00 O ATOM 2016 OD2 ASP A 133 -3.272 -18.999 -1.187 1.00 0.00 O ATOM 0 H ASP A 133 -0.647 -19.012 1.593 1.00 0.00 H new ATOM 0 HA ASP A 133 -0.702 -21.873 1.027 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -2.258 -21.296 -0.646 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -2.718 -20.543 0.867 1.00 0.00 H new ATOM 2021 N GLY A 134 1.353 -19.997 -0.363 1.00 0.00 N ATOM 2022 CA GLY A 134 2.613 -20.027 -1.039 1.00 0.00 C ATOM 2023 C GLY A 134 2.680 -19.270 -2.320 1.00 0.00 C ATOM 2024 O GLY A 134 3.661 -19.303 -3.061 1.00 0.00 O ATOM 0 H GLY A 134 1.147 -19.098 0.073 1.00 0.00 H new ATOM 0 HA2 GLY A 134 3.374 -19.633 -0.366 1.00 0.00 H new ATOM 0 HA3 GLY A 134 2.872 -21.067 -1.239 1.00 0.00 H new ATOM 2028 N GLN A 135 1.565 -18.616 -2.694 1.00 0.00 N ATOM 2029 CA GLN A 135 1.556 -17.916 -3.940 1.00 0.00 C ATOM 2030 C GLN A 135 0.991 -16.601 -3.522 1.00 0.00 C ATOM 2031 O GLN A 135 -0.032 -16.498 -2.848 1.00 0.00 O ATOM 2032 CB GLN A 135 0.573 -18.392 -5.023 1.00 0.00 C ATOM 2033 CG GLN A 135 -0.864 -18.736 -4.625 1.00 0.00 C ATOM 2034 CD GLN A 135 -1.633 -19.224 -5.844 1.00 0.00 C ATOM 2035 OE1 GLN A 135 -1.122 -19.603 -6.897 1.00 0.00 O ATOM 2036 NE2 GLN A 135 -2.935 -19.519 -5.585 1.00 0.00 N ATOM 0 H GLN A 135 0.700 -18.571 -2.156 1.00 0.00 H new ATOM 0 HA GLN A 135 2.550 -17.997 -4.380 1.00 0.00 H new ATOM 0 HB2 GLN A 135 0.525 -17.616 -5.787 1.00 0.00 H new ATOM 0 HB3 GLN A 135 1.004 -19.276 -5.493 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -0.863 -19.505 -3.852 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -1.354 -17.859 -4.202 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -3.365 -19.208 -4.714 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -3.482 -20.051 -6.262 1.00 0.00 H new ATOM 2045 N VAL A 136 1.645 -15.490 -3.904 1.00 0.00 N ATOM 2046 CA VAL A 136 1.457 -14.173 -3.378 1.00 0.00 C ATOM 2047 C VAL A 136 0.459 -13.515 -4.267 1.00 0.00 C ATOM 2048 O VAL A 136 0.610 -13.298 -5.469 1.00 0.00 O ATOM 2049 CB VAL A 136 2.779 -13.480 -3.229 1.00 0.00 C ATOM 2050 CG1 VAL A 136 2.733 -12.050 -2.664 1.00 0.00 C ATOM 2051 CG2 VAL A 136 3.648 -14.412 -2.367 1.00 0.00 C ATOM 0 H VAL A 136 2.357 -15.515 -4.634 1.00 0.00 H new ATOM 0 HA VAL A 136 1.056 -14.153 -2.365 1.00 0.00 H new ATOM 0 HB VAL A 136 3.195 -13.314 -4.223 1.00 0.00 H new ATOM 0 HG11 VAL A 136 3.745 -11.651 -2.601 1.00 0.00 H new ATOM 0 HG12 VAL A 136 2.134 -11.419 -3.320 1.00 0.00 H new ATOM 0 HG13 VAL A 136 2.287 -12.066 -1.669 1.00 0.00 H new ATOM 0 HG21 VAL A 136 4.630 -13.962 -2.221 1.00 0.00 H new ATOM 0 HG22 VAL A 136 3.170 -14.563 -1.399 1.00 0.00 H new ATOM 0 HG23 VAL A 136 3.760 -15.373 -2.870 1.00 0.00 H new ATOM 2061 N ASN A 137 -0.720 -13.174 -3.718 1.00 0.00 N ATOM 2062 CA ASN A 137 -1.781 -12.534 -4.432 1.00 0.00 C ATOM 2063 C ASN A 137 -1.582 -11.069 -4.247 1.00 0.00 C ATOM 2064 O ASN A 137 -0.701 -10.509 -3.597 1.00 0.00 O ATOM 2065 CB ASN A 137 -3.115 -13.093 -3.910 1.00 0.00 C ATOM 2066 CG ASN A 137 -3.656 -12.638 -2.562 1.00 0.00 C ATOM 2067 OD1 ASN A 137 -3.619 -11.478 -2.154 1.00 0.00 O ATOM 2068 ND2 ASN A 137 -4.421 -13.572 -1.935 1.00 0.00 N ATOM 0 H ASN A 137 -0.943 -13.351 -2.739 1.00 0.00 H new ATOM 0 HA ASN A 137 -1.790 -12.726 -5.505 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -3.876 -12.867 -4.657 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -3.019 -14.178 -3.871 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -4.973 -13.314 -1.117 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -4.443 -14.530 -2.283 1.00 0.00 H new ATOM 2075 N TYR A 138 -2.426 -10.249 -4.900 1.00 0.00 N ATOM 2076 CA TYR A 138 -2.228 -8.837 -5.006 1.00 0.00 C ATOM 2077 C TYR A 138 -2.180 -8.115 -3.704 1.00 0.00 C ATOM 2078 O TYR A 138 -1.327 -7.251 -3.505 1.00 0.00 O ATOM 2079 CB TYR A 138 -3.413 -8.389 -5.878 1.00 0.00 C ATOM 2080 CG TYR A 138 -3.368 -6.971 -6.335 1.00 0.00 C ATOM 2081 CD1 TYR A 138 -2.589 -6.694 -7.433 1.00 0.00 C ATOM 2082 CD2 TYR A 138 -3.960 -5.880 -5.744 1.00 0.00 C ATOM 2083 CE1 TYR A 138 -2.367 -5.427 -7.918 1.00 0.00 C ATOM 2084 CE2 TYR A 138 -3.856 -4.597 -6.228 1.00 0.00 C ATOM 2085 CZ TYR A 138 -3.016 -4.386 -7.296 1.00 0.00 C ATOM 2086 OH TYR A 138 -2.854 -3.071 -7.782 1.00 0.00 O ATOM 0 H TYR A 138 -3.271 -10.578 -5.368 1.00 0.00 H new ATOM 0 HA TYR A 138 -1.252 -8.601 -5.430 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -3.462 -9.035 -6.755 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -4.335 -8.543 -5.317 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -2.123 -7.522 -7.946 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -4.541 -6.040 -4.847 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -1.708 -5.255 -8.756 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -4.414 -3.785 -5.785 1.00 0.00 H new ATOM 0 HH TYR A 138 -3.380 -2.452 -7.233 1.00 0.00 H new ATOM 2096 N GLU A 139 -3.051 -8.422 -2.727 1.00 0.00 N ATOM 2097 CA GLU A 139 -3.054 -7.745 -1.468 1.00 0.00 C ATOM 2098 C GLU A 139 -1.792 -7.998 -0.716 1.00 0.00 C ATOM 2099 O GLU A 139 -1.216 -7.077 -0.139 1.00 0.00 O ATOM 2100 CB GLU A 139 -4.305 -8.027 -0.619 1.00 0.00 C ATOM 2101 CG GLU A 139 -4.359 -7.217 0.679 1.00 0.00 C ATOM 2102 CD GLU A 139 -5.769 -7.111 1.241 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -6.592 -8.053 1.086 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -6.088 -6.098 1.918 1.00 0.00 O ATOM 0 H GLU A 139 -3.762 -9.149 -2.811 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.099 -6.680 -1.694 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -5.193 -7.808 -1.212 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -4.338 -9.089 -0.376 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.710 -7.682 1.421 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -3.968 -6.216 0.496 1.00 0.00 H new ATOM 2111 N GLU A 140 -1.270 -9.236 -0.753 1.00 0.00 N ATOM 2112 CA GLU A 140 -0.081 -9.617 -0.055 1.00 0.00 C ATOM 2113 C GLU A 140 1.107 -8.907 -0.608 1.00 0.00 C ATOM 2114 O GLU A 140 2.077 -8.554 0.061 1.00 0.00 O ATOM 2115 CB GLU A 140 0.049 -11.141 -0.224 1.00 0.00 C ATOM 2116 CG GLU A 140 -1.210 -11.857 0.268 1.00 0.00 C ATOM 2117 CD GLU A 140 -1.019 -13.342 -0.007 1.00 0.00 C ATOM 2118 OE1 GLU A 140 -0.718 -13.790 -1.146 1.00 0.00 O ATOM 2119 OE2 GLU A 140 -1.233 -14.156 0.931 1.00 0.00 O ATOM 0 H GLU A 140 -1.689 -9.998 -1.286 1.00 0.00 H new ATOM 0 HA GLU A 140 -0.136 -9.347 1.000 1.00 0.00 H new ATOM 0 HB2 GLU A 140 0.221 -11.381 -1.273 1.00 0.00 H new ATOM 0 HB3 GLU A 140 0.916 -11.499 0.331 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -1.363 -11.679 1.333 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -2.093 -11.481 -0.248 1.00 0.00 H new ATOM 2126 N PHE A 141 1.080 -8.717 -1.939 1.00 0.00 N ATOM 2127 CA PHE A 141 2.044 -7.933 -2.647 1.00 0.00 C ATOM 2128 C PHE A 141 2.124 -6.506 -2.226 1.00 0.00 C ATOM 2129 O PHE A 141 3.209 -6.004 -1.935 1.00 0.00 O ATOM 2130 CB PHE A 141 1.834 -8.097 -4.162 1.00 0.00 C ATOM 2131 CG PHE A 141 2.946 -7.416 -4.884 1.00 0.00 C ATOM 2132 CD1 PHE A 141 4.220 -7.932 -4.914 1.00 0.00 C ATOM 2133 CD2 PHE A 141 2.657 -6.204 -5.465 1.00 0.00 C ATOM 2134 CE1 PHE A 141 5.220 -7.235 -5.550 1.00 0.00 C ATOM 2135 CE2 PHE A 141 3.688 -5.456 -5.983 1.00 0.00 C ATOM 2136 CZ PHE A 141 4.962 -5.971 -6.027 1.00 0.00 C ATOM 0 H PHE A 141 0.364 -9.122 -2.542 1.00 0.00 H new ATOM 0 HA PHE A 141 3.025 -8.326 -2.378 1.00 0.00 H new ATOM 0 HB2 PHE A 141 1.806 -9.154 -4.426 1.00 0.00 H new ATOM 0 HB3 PHE A 141 0.876 -7.669 -4.458 1.00 0.00 H new ATOM 0 HD1 PHE A 141 4.434 -8.879 -4.441 1.00 0.00 H new ATOM 0 HD2 PHE A 141 1.639 -5.846 -5.514 1.00 0.00 H new ATOM 0 HE1 PHE A 141 6.198 -7.676 -5.674 1.00 0.00 H new ATOM 0 HE2 PHE A 141 3.496 -4.461 -6.356 1.00 0.00 H new ATOM 0 HZ PHE A 141 5.766 -5.379 -6.439 1.00 0.00 H new ATOM 2146 N VAL A 142 0.939 -5.871 -2.241 1.00 0.00 N ATOM 2147 CA VAL A 142 0.685 -4.531 -1.811 1.00 0.00 C ATOM 2148 C VAL A 142 1.074 -4.257 -0.399 1.00 0.00 C ATOM 2149 O VAL A 142 1.547 -3.210 0.042 1.00 0.00 O ATOM 2150 CB VAL A 142 -0.754 -4.291 -2.159 1.00 0.00 C ATOM 2151 CG1 VAL A 142 -1.312 -3.052 -1.439 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -0.879 -4.196 -3.689 1.00 0.00 C ATOM 0 H VAL A 142 0.094 -6.331 -2.580 1.00 0.00 H new ATOM 0 HA VAL A 142 1.322 -3.806 -2.318 1.00 0.00 H new ATOM 0 HB VAL A 142 -1.362 -5.126 -1.811 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -2.357 -2.910 -1.716 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -1.238 -3.194 -0.361 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -0.737 -2.173 -1.729 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -1.921 -4.021 -3.959 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -0.267 -3.371 -4.054 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -0.539 -5.128 -4.140 1.00 0.00 H new ATOM 2162 N GLN A 143 0.889 -5.233 0.508 1.00 0.00 N ATOM 2163 CA GLN A 143 1.321 -5.127 1.867 1.00 0.00 C ATOM 2164 C GLN A 143 2.794 -5.246 2.057 1.00 0.00 C ATOM 2165 O GLN A 143 3.390 -4.481 2.814 1.00 0.00 O ATOM 2166 CB GLN A 143 0.631 -6.135 2.801 1.00 0.00 C ATOM 2167 CG GLN A 143 1.025 -5.973 4.270 1.00 0.00 C ATOM 2168 CD GLN A 143 0.400 -6.985 5.220 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -0.742 -7.320 4.909 1.00 0.00 O ATOM 2170 NE2 GLN A 143 1.089 -7.274 6.357 1.00 0.00 N ATOM 0 H GLN A 143 0.428 -6.117 0.292 1.00 0.00 H new ATOM 0 HA GLN A 143 1.023 -4.114 2.137 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -0.449 -6.024 2.708 1.00 0.00 H new ATOM 0 HB3 GLN A 143 0.876 -7.146 2.476 1.00 0.00 H new ATOM 0 HG2 GLN A 143 2.110 -6.045 4.349 1.00 0.00 H new ATOM 0 HG3 GLN A 143 0.747 -4.971 4.597 1.00 0.00 H new ATOM 0 HE21 GLN A 143 2.039 -6.925 6.480 1.00 0.00 H new ATOM 0 HE22 GLN A 143 0.655 -7.840 7.086 1.00 0.00 H new ATOM 2179 N MET A 144 3.363 -6.159 1.249 1.00 0.00 N ATOM 2180 CA MET A 144 4.788 -6.242 1.168 1.00 0.00 C ATOM 2181 C MET A 144 5.480 -4.994 0.738 1.00 0.00 C ATOM 2182 O MET A 144 6.638 -4.727 1.056 1.00 0.00 O ATOM 2183 CB MET A 144 5.170 -7.468 0.323 1.00 0.00 C ATOM 2184 CG MET A 144 6.648 -7.624 -0.040 1.00 0.00 C ATOM 2185 SD MET A 144 7.094 -9.252 -0.717 1.00 0.00 S ATOM 2186 CE MET A 144 6.521 -8.880 -2.399 1.00 0.00 C ATOM 0 H MET A 144 2.853 -6.823 0.666 1.00 0.00 H new ATOM 0 HA MET A 144 5.158 -6.369 2.185 1.00 0.00 H new ATOM 0 HB2 MET A 144 4.857 -8.362 0.861 1.00 0.00 H new ATOM 0 HB3 MET A 144 4.595 -7.435 -0.602 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.912 -6.857 -0.768 1.00 0.00 H new ATOM 0 HG3 MET A 144 7.249 -7.438 0.850 1.00 0.00 H new ATOM 0 HE1 MET A 144 6.719 -9.733 -3.048 1.00 0.00 H new ATOM 0 HE2 MET A 144 5.450 -8.678 -2.382 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.050 -8.006 -2.778 1.00 0.00 H new ATOM 2196 N MET A 145 4.845 -4.200 -0.142 1.00 0.00 N ATOM 2197 CA MET A 145 5.315 -2.902 -0.516 1.00 0.00 C ATOM 2198 C MET A 145 5.328 -1.895 0.581 1.00 0.00 C ATOM 2199 O MET A 145 6.121 -0.958 0.670 1.00 0.00 O ATOM 2200 CB MET A 145 4.623 -2.472 -1.820 1.00 0.00 C ATOM 2201 CG MET A 145 5.178 -3.256 -3.011 1.00 0.00 C ATOM 2202 SD MET A 145 4.707 -2.564 -4.625 1.00 0.00 S ATOM 2203 CE MET A 145 5.503 -0.932 -4.609 1.00 0.00 C ATOM 0 H MET A 145 3.978 -4.469 -0.608 1.00 0.00 H new ATOM 0 HA MET A 145 6.383 -2.969 -0.724 1.00 0.00 H new ATOM 0 HB2 MET A 145 3.549 -2.637 -1.739 1.00 0.00 H new ATOM 0 HB3 MET A 145 4.770 -1.404 -1.981 1.00 0.00 H new ATOM 0 HG2 MET A 145 6.265 -3.284 -2.941 1.00 0.00 H new ATOM 0 HG3 MET A 145 4.828 -4.286 -2.951 1.00 0.00 H new ATOM 0 HE1 MET A 145 5.567 -0.548 -5.627 1.00 0.00 H new ATOM 0 HE2 MET A 145 4.915 -0.246 -3.999 1.00 0.00 H new ATOM 0 HE3 MET A 145 6.506 -1.020 -4.191 1.00 0.00 H new