USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 928 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 68 MET CE :methyl 173:sc= -2.72! (180deg=-2.03!) USER MOD Set 1.2: A 144 MET CE :methyl -160:sc= -1.49 (180deg=-1.02) USER MOD Set 2.1: A 109 SER OG : rot -102:sc= 0.2 USER MOD Set 2.2: A 114 GLN : amide:sc= -7.2! C(o=-7!,f=-9.3!) USER MOD Single : A 12 HIS : no HE2:sc= -11.7! C(o=-12!,f=-13!) USER MOD Single : A 13 GLN : amide:sc= -0.417 X(o=-0.42,f=-0.065) USER MOD Single : A 16 SER OG : rot 180:sc= 0.171 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= -0.0167 X(o=-0.017,f=-0.5) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0.908 USER MOD Single : A 39 MET CE :methyl 137:sc= -9.38! (180deg=-11.3!) USER MOD Single : A 41 SER OG : rot -54:sc= 0.14 USER MOD Single : A 44 SER OG : rot -170:sc= 0.73 USER MOD Single : A 48 THR OG1 : rot 109:sc= 1.12 USER MOD Single : A 50 GLN : amide:sc= -0.216 K(o=-0.22,f=-2.5!) USER MOD Single : A 53 ASN : amide:sc=-0.00565 K(o=-0.0056,f=-1.2) USER MOD Single : A 54 THR OG1 : rot 94:sc= 0.246 USER MOD Single : A 55 MET CE :methyl -132:sc= -8.01! (180deg=-16.1!) USER MOD Single : A 57 ASN : amide:sc=-0.00568 X(o=-0.0057,f=-0.014) USER MOD Single : A 58 THR OG1 : rot -126:sc= -0.733 USER MOD Single : A 62 HIS : no HD1:sc= -0.232 X(o=-0.23,f=-0.0076) USER MOD Single : A 63 GLN : amide:sc= -0.0109 X(o=-0.011,f=0) USER MOD Single : A 66 MET CE :methyl -168:sc= -0.0137 (180deg=-0.334) USER MOD Single : A 67 GLN : amide:sc= -0.307 K(o=-0.31,f=-2.4!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot -140:sc=-0.00803 USER MOD Single : A 74 ASN : amide:sc= -0.0649 K(o=-0.065,f=-1.8!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -86:sc= 0.167 USER MOD Single : A 112 GLN : amide:sc= -0.392 K(o=-0.39,f=-2.6!) USER MOD Single : A 118 MET CE :methyl 170:sc= -0.457 (180deg=-0.797) USER MOD Single : A 119 THR OG1 : rot 84:sc= 0.385 USER MOD Single : A 120 HIS : no HD1:sc= 0.00466 X(o=0.0047,f=-0.3) USER MOD Single : A 121 ASN : amide:sc= -0.0077 X(o=-0.0077,f=0) USER MOD Single : A 130 TYR OH : rot 46:sc= 0.0786 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.0254 X(o=-0.025,f=-0.25) USER MOD Single : A 140 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000401) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 1.692 -0.274 0.365 1.00 0.00 N ATOM 2 CA PRO A 1 0.987 -0.098 -0.893 1.00 0.00 C ATOM 3 C PRO A 1 1.124 -1.339 -1.778 1.00 0.00 C ATOM 4 O PRO A 1 1.879 -2.254 -1.456 1.00 0.00 O ATOM 5 CB PRO A 1 1.599 1.147 -1.516 1.00 0.00 C ATOM 6 CG PRO A 1 2.931 1.352 -0.814 1.00 0.00 C ATOM 7 CD PRO A 1 2.944 0.473 0.426 1.00 0.00 C ATOM 0 H2 PRO A 1 1.887 -1.266 0.504 1.00 0.00 H new ATOM 0 H3 PRO A 1 1.088 0.022 1.132 1.00 0.00 H new ATOM 0 HA PRO A 1 -0.088 0.027 -0.759 1.00 0.00 H new ATOM 0 HB2 PRO A 1 1.739 1.018 -2.589 1.00 0.00 H new ATOM 0 HB3 PRO A 1 0.949 2.011 -1.381 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.756 1.090 -1.476 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.062 2.399 -0.541 1.00 0.00 H new ATOM 0 HD2 PRO A 1 3.804 -0.196 0.428 1.00 0.00 H new ATOM 0 HD3 PRO A 1 3.004 1.072 1.335 1.00 0.00 H new ATOM 15 N ILE A 2 0.382 -1.329 -2.875 1.00 0.00 N ATOM 16 CA ILE A 2 0.411 -2.443 -3.808 1.00 0.00 C ATOM 17 C ILE A 2 1.485 -2.186 -4.867 1.00 0.00 C ATOM 18 O ILE A 2 1.814 -1.037 -5.158 1.00 0.00 O ATOM 19 CB ILE A 2 -0.981 -2.690 -4.392 1.00 0.00 C ATOM 20 CG1 ILE A 2 -1.763 -3.691 -3.539 1.00 0.00 C ATOM 21 CG2 ILE A 2 -0.893 -3.128 -5.855 1.00 0.00 C ATOM 22 CD1 ILE A 2 -3.231 -3.748 -3.966 1.00 0.00 C ATOM 0 H ILE A 2 -0.243 -0.567 -3.139 1.00 0.00 H new ATOM 0 HA ILE A 2 0.683 -3.364 -3.293 1.00 0.00 H new ATOM 0 HB ILE A 2 -1.532 -1.750 -4.371 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.315 -4.680 -3.631 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.697 -3.408 -2.488 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -1.897 -3.297 -6.245 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -0.403 -2.349 -6.439 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -0.317 -4.051 -5.925 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -3.763 -4.467 -3.343 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -3.682 -2.763 -3.849 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -3.295 -4.055 -5.010 1.00 0.00 H new ATOM 158 N VAL A 11 1.135 -8.004 -6.091 1.00 0.00 N ATOM 159 CA VAL A 11 1.321 -8.185 -4.661 1.00 0.00 C ATOM 160 C VAL A 11 1.682 -6.843 -4.024 1.00 0.00 C ATOM 161 O VAL A 11 2.213 -5.956 -4.693 1.00 0.00 O ATOM 162 CB VAL A 11 2.368 -9.270 -4.403 1.00 0.00 C ATOM 163 CG1 VAL A 11 2.026 -10.554 -5.163 1.00 0.00 C ATOM 164 CG2 VAL A 11 3.770 -8.777 -4.765 1.00 0.00 C ATOM 0 HA VAL A 11 0.396 -8.527 -4.196 1.00 0.00 H new ATOM 0 HB VAL A 11 2.358 -9.498 -3.337 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.786 -11.309 -4.962 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.054 -10.922 -4.836 1.00 0.00 H new ATOM 0 HG13 VAL A 11 1.995 -10.346 -6.233 1.00 0.00 H new ATOM 0 HG21 VAL A 11 4.495 -9.568 -4.572 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.800 -8.507 -5.821 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.016 -7.904 -4.161 1.00 0.00 H new ATOM 174 N HIS A 12 1.380 -6.734 -2.739 1.00 0.00 N ATOM 175 CA HIS A 12 1.666 -5.514 -2.003 1.00 0.00 C ATOM 176 C HIS A 12 2.900 -5.723 -1.122 1.00 0.00 C ATOM 177 O HIS A 12 3.227 -6.853 -0.765 1.00 0.00 O ATOM 178 CB HIS A 12 0.440 -5.058 -1.208 1.00 0.00 C ATOM 179 CG HIS A 12 -0.122 -6.115 -0.289 1.00 0.00 C ATOM 180 ND1 HIS A 12 0.563 -6.591 0.816 1.00 0.00 N ATOM 181 CD2 HIS A 12 -1.312 -6.783 -0.320 1.00 0.00 C ATOM 182 CE1 HIS A 12 -0.189 -7.504 1.414 1.00 0.00 C ATOM 183 NE2 HIS A 12 -1.350 -7.621 0.708 1.00 0.00 N ATOM 0 H HIS A 12 0.940 -7.471 -2.188 1.00 0.00 H new ATOM 0 HA HIS A 12 1.893 -4.709 -2.702 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.708 -4.182 -0.617 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -0.338 -4.746 -1.905 1.00 0.00 H new ATOM 0 HD1 HIS A 12 1.489 -6.290 1.119 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -2.091 -6.652 -1.057 1.00 0.00 H new ATOM 0 HE1 HIS A 12 0.072 -8.058 2.304 1.00 0.00 H new ATOM 192 N GLN A 13 3.551 -4.615 -0.798 1.00 0.00 N ATOM 193 CA GLN A 13 4.741 -4.662 0.034 1.00 0.00 C ATOM 194 C GLN A 13 4.473 -3.990 1.382 1.00 0.00 C ATOM 195 O GLN A 13 5.317 -3.254 1.890 1.00 0.00 O ATOM 196 CB GLN A 13 5.931 -4.014 -0.675 1.00 0.00 C ATOM 197 CG GLN A 13 6.550 -4.972 -1.695 1.00 0.00 C ATOM 198 CD GLN A 13 7.417 -4.215 -2.703 1.00 0.00 C ATOM 199 OE1 GLN A 13 8.585 -4.509 -2.900 1.00 0.00 O ATOM 200 NE2 GLN A 13 6.783 -3.227 -3.328 1.00 0.00 N ATOM 0 H GLN A 13 3.276 -3.679 -1.097 1.00 0.00 H new ATOM 0 HA GLN A 13 4.993 -5.707 0.215 1.00 0.00 H new ATOM 0 HB2 GLN A 13 5.607 -3.102 -1.177 1.00 0.00 H new ATOM 0 HB3 GLN A 13 6.682 -3.724 0.059 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.154 -5.718 -1.179 1.00 0.00 H new ATOM 0 HG3 GLN A 13 5.760 -5.509 -2.220 1.00 0.00 H new ATOM 0 HE21 GLN A 13 5.804 -3.034 -3.116 1.00 0.00 H new ATOM 0 HE22 GLN A 13 7.276 -2.662 -4.020 1.00 0.00 H new ATOM 209 N ALA A 14 3.296 -4.269 1.923 1.00 0.00 N ATOM 210 CA ALA A 14 2.908 -3.701 3.202 1.00 0.00 C ATOM 211 C ALA A 14 3.210 -2.201 3.202 1.00 0.00 C ATOM 212 O ALA A 14 3.596 -1.642 2.176 1.00 0.00 O ATOM 213 CB ALA A 14 3.629 -4.441 4.330 1.00 0.00 C ATOM 0 H ALA A 14 2.599 -4.881 1.499 1.00 0.00 H new ATOM 0 HA ALA A 14 1.837 -3.822 3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.337 -4.014 5.290 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.357 -5.496 4.305 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.707 -4.340 4.201 1.00 0.00 H new ATOM 219 N ILE A 15 3.021 -1.592 4.364 1.00 0.00 N ATOM 220 CA ILE A 15 3.270 -0.167 4.510 1.00 0.00 C ATOM 221 C ILE A 15 4.773 0.072 4.660 1.00 0.00 C ATOM 222 O ILE A 15 5.570 -0.855 4.521 1.00 0.00 O ATOM 223 CB ILE A 15 2.438 0.405 5.660 1.00 0.00 C ATOM 224 CG1 ILE A 15 2.125 1.885 5.427 1.00 0.00 C ATOM 225 CG2 ILE A 15 3.128 0.170 7.005 1.00 0.00 C ATOM 226 CD1 ILE A 15 0.665 2.195 5.761 1.00 0.00 C ATOM 0 H ILE A 15 2.699 -2.058 5.212 1.00 0.00 H new ATOM 0 HA ILE A 15 2.951 0.370 3.617 1.00 0.00 H new ATOM 0 HB ILE A 15 1.486 -0.125 5.690 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.781 2.501 6.042 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.327 2.144 4.388 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.516 0.586 7.805 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.257 -0.900 7.166 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.103 0.657 7.004 1.00 0.00 H new ATOM 0 HD11 ILE A 15 0.469 3.253 5.587 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.012 1.596 5.127 1.00 0.00 H new ATOM 0 HD13 ILE A 15 0.473 1.958 6.807 1.00 0.00 H new ATOM 238 N SER A 16 5.117 1.320 4.942 1.00 0.00 N ATOM 239 CA SER A 16 6.511 1.692 5.112 1.00 0.00 C ATOM 240 C SER A 16 6.701 2.410 6.450 1.00 0.00 C ATOM 241 O SER A 16 5.805 3.112 6.915 1.00 0.00 O ATOM 242 CB SER A 16 6.988 2.580 3.961 1.00 0.00 C ATOM 243 OG SER A 16 7.999 3.495 4.376 1.00 0.00 O ATOM 0 H SER A 16 4.454 2.087 5.057 1.00 0.00 H new ATOM 0 HA SER A 16 7.111 0.782 5.106 1.00 0.00 H new ATOM 0 HB2 SER A 16 7.374 1.954 3.156 1.00 0.00 H new ATOM 0 HB3 SER A 16 6.141 3.134 3.556 1.00 0.00 H new ATOM 0 HG SER A 16 8.278 4.043 3.613 1.00 0.00 H new ATOM 249 N PRO A 17 7.906 2.204 7.047 1.00 0.00 N ATOM 250 CA PRO A 17 8.224 2.823 8.322 1.00 0.00 C ATOM 251 C PRO A 17 8.527 4.313 8.147 1.00 0.00 C ATOM 252 O PRO A 17 8.110 5.134 8.963 1.00 0.00 O ATOM 253 CB PRO A 17 9.410 2.035 8.856 1.00 0.00 C ATOM 254 CG PRO A 17 10.001 1.308 7.658 1.00 0.00 C ATOM 255 CD PRO A 17 8.992 1.379 6.525 1.00 0.00 C ATOM 0 HA PRO A 17 7.392 2.791 9.025 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.145 2.697 9.313 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.096 1.329 9.625 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.943 1.768 7.359 1.00 0.00 H new ATOM 0 HG3 PRO A 17 10.219 0.270 7.911 1.00 0.00 H new ATOM 0 HD2 PRO A 17 9.431 1.822 5.631 1.00 0.00 H new ATOM 0 HD3 PRO A 17 8.637 0.386 6.248 1.00 0.00 H new ATOM 263 N ARG A 18 9.252 4.616 7.079 1.00 0.00 N ATOM 264 CA ARG A 18 9.615 5.991 6.788 1.00 0.00 C ATOM 265 C ARG A 18 8.365 6.814 6.467 1.00 0.00 C ATOM 266 O ARG A 18 8.316 8.010 6.750 1.00 0.00 O ATOM 267 CB ARG A 18 10.584 6.067 5.606 1.00 0.00 C ATOM 268 CG ARG A 18 12.016 6.312 6.085 1.00 0.00 C ATOM 269 CD ARG A 18 13.030 5.892 5.019 1.00 0.00 C ATOM 270 NE ARG A 18 14.278 6.672 5.172 1.00 0.00 N ATOM 271 CZ ARG A 18 15.466 6.292 4.686 1.00 0.00 C ATOM 272 NH1 ARG A 18 15.576 5.139 4.011 1.00 0.00 N ATOM 273 NH2 ARG A 18 16.546 7.064 4.873 1.00 0.00 N ATOM 0 H ARG A 18 9.597 3.932 6.406 1.00 0.00 H new ATOM 0 HA ARG A 18 10.105 6.398 7.672 1.00 0.00 H new ATOM 0 HB2 ARG A 18 10.541 5.139 5.036 1.00 0.00 H new ATOM 0 HB3 ARG A 18 10.280 6.869 4.933 1.00 0.00 H new ATOM 0 HG2 ARG A 18 12.148 7.368 6.322 1.00 0.00 H new ATOM 0 HG3 ARG A 18 12.197 5.754 7.004 1.00 0.00 H new ATOM 0 HD2 ARG A 18 13.244 4.827 5.108 1.00 0.00 H new ATOM 0 HD3 ARG A 18 12.612 6.051 4.025 1.00 0.00 H new ATOM 0 HE ARG A 18 14.230 7.555 5.680 1.00 0.00 H new ATOM 0 HH11 ARG A 18 14.755 4.552 3.868 1.00 0.00 H new ATOM 0 HH12 ARG A 18 16.481 4.849 3.641 1.00 0.00 H new ATOM 0 HH21 ARG A 18 16.463 7.942 5.386 1.00 0.00 H new ATOM 0 HH22 ARG A 18 17.451 6.774 4.502 1.00 0.00 H new ATOM 287 N THR A 19 7.386 6.140 5.883 1.00 0.00 N ATOM 288 CA THR A 19 6.139 6.794 5.521 1.00 0.00 C ATOM 289 C THR A 19 5.288 7.045 6.768 1.00 0.00 C ATOM 290 O THR A 19 4.794 8.153 6.973 1.00 0.00 O ATOM 291 CB THR A 19 5.439 5.929 4.471 1.00 0.00 C ATOM 292 OG1 THR A 19 5.516 6.703 3.277 1.00 0.00 O ATOM 293 CG2 THR A 19 3.938 5.793 4.732 1.00 0.00 C ATOM 0 H THR A 19 7.430 5.148 5.651 1.00 0.00 H new ATOM 0 HA THR A 19 6.319 7.777 5.085 1.00 0.00 H new ATOM 0 HB THR A 19 5.895 4.939 4.453 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.087 6.216 2.543 1.00 0.00 H new ATOM 0 HG21 THR A 19 3.489 5.170 3.958 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.778 5.332 5.707 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.475 6.780 4.717 1.00 0.00 H new ATOM 301 N LEU A 20 5.142 5.998 7.566 1.00 0.00 N ATOM 302 CA LEU A 20 4.360 6.092 8.787 1.00 0.00 C ATOM 303 C LEU A 20 5.011 7.106 9.729 1.00 0.00 C ATOM 304 O LEU A 20 4.318 7.890 10.376 1.00 0.00 O ATOM 305 CB LEU A 20 4.170 4.707 9.410 1.00 0.00 C ATOM 306 CG LEU A 20 3.047 3.853 8.817 1.00 0.00 C ATOM 307 CD1 LEU A 20 3.177 2.394 9.258 1.00 0.00 C ATOM 308 CD2 LEU A 20 1.676 4.436 9.164 1.00 0.00 C ATOM 0 H LEU A 20 5.552 5.080 7.391 1.00 0.00 H new ATOM 0 HA LEU A 20 3.357 6.458 8.569 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.106 4.157 9.316 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.980 4.833 10.476 1.00 0.00 H new ATOM 0 HG LEU A 20 3.140 3.871 7.731 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.367 1.809 8.823 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.134 1.996 8.921 1.00 0.00 H new ATOM 0 HD13 LEU A 20 3.123 2.336 10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.895 3.811 8.731 1.00 0.00 H new ATOM 0 HD22 LEU A 20 1.557 4.467 10.247 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.598 5.446 8.761 1.00 0.00 H new ATOM 320 N ASN A 21 6.333 7.058 9.776 1.00 0.00 N ATOM 321 CA ASN A 21 7.086 7.962 10.629 1.00 0.00 C ATOM 322 C ASN A 21 6.815 9.405 10.197 1.00 0.00 C ATOM 323 O ASN A 21 6.306 10.206 10.980 1.00 0.00 O ATOM 324 CB ASN A 21 8.590 7.708 10.511 1.00 0.00 C ATOM 325 CG ASN A 21 9.336 8.259 11.728 1.00 0.00 C ATOM 326 OD1 ASN A 21 9.366 9.452 11.982 1.00 0.00 O ATOM 327 ND2 ASN A 21 9.935 7.326 12.463 1.00 0.00 N ATOM 0 H ASN A 21 6.903 6.407 9.237 1.00 0.00 H new ATOM 0 HA ASN A 21 6.773 7.794 11.659 1.00 0.00 H new ATOM 0 HB2 ASN A 21 8.776 6.638 10.420 1.00 0.00 H new ATOM 0 HB3 ASN A 21 8.971 8.176 9.604 1.00 0.00 H new ATOM 0 HD21 ASN A 21 10.459 7.592 13.296 1.00 0.00 H new ATOM 0 HD22 ASN A 21 9.870 6.344 12.193 1.00 0.00 H new ATOM 334 N ALA A 22 7.169 9.693 8.954 1.00 0.00 N ATOM 335 CA ALA A 22 6.971 11.026 8.409 1.00 0.00 C ATOM 336 C ALA A 22 5.517 11.449 8.624 1.00 0.00 C ATOM 337 O ALA A 22 5.249 12.573 9.047 1.00 0.00 O ATOM 338 CB ALA A 22 7.369 11.038 6.931 1.00 0.00 C ATOM 0 H ALA A 22 7.592 9.027 8.308 1.00 0.00 H new ATOM 0 HA ALA A 22 7.604 11.749 8.923 1.00 0.00 H new ATOM 0 HB1 ALA A 22 7.221 12.038 6.522 1.00 0.00 H new ATOM 0 HB2 ALA A 22 8.418 10.759 6.834 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.752 10.326 6.382 1.00 0.00 H new ATOM 344 N TRP A 23 4.615 10.526 8.324 1.00 0.00 N ATOM 345 CA TRP A 23 3.194 10.789 8.480 1.00 0.00 C ATOM 346 C TRP A 23 2.957 11.276 9.910 1.00 0.00 C ATOM 347 O TRP A 23 2.509 12.403 10.120 1.00 0.00 O ATOM 348 CB TRP A 23 2.365 9.553 8.124 1.00 0.00 C ATOM 349 CG TRP A 23 0.877 9.685 8.457 1.00 0.00 C ATOM 350 CD1 TRP A 23 0.173 9.002 9.370 1.00 0.00 C ATOM 351 CD2 TRP A 23 -0.065 10.586 7.840 1.00 0.00 C ATOM 352 NE1 TRP A 23 -1.150 9.395 9.385 1.00 0.00 N ATOM 353 CE2 TRP A 23 -1.300 10.389 8.425 1.00 0.00 C ATOM 354 CE3 TRP A 23 0.118 11.535 6.819 1.00 0.00 C ATOM 355 CZ2 TRP A 23 -2.445 11.105 8.058 1.00 0.00 C ATOM 356 CZ3 TRP A 23 -1.036 12.242 6.464 1.00 0.00 C ATOM 357 CH2 TRP A 23 -2.286 12.057 7.043 1.00 0.00 C ATOM 0 H TRP A 23 4.840 9.595 7.974 1.00 0.00 H new ATOM 0 HA TRP A 23 2.868 11.567 7.789 1.00 0.00 H new ATOM 0 HB2 TRP A 23 2.472 9.351 7.058 1.00 0.00 H new ATOM 0 HB3 TRP A 23 2.770 8.691 8.654 1.00 0.00 H new ATOM 0 HD1 TRP A 23 0.588 8.240 10.013 1.00 0.00 H new ATOM 0 HE1 TRP A 23 -1.883 9.024 9.990 1.00 0.00 H new ATOM 0 HE3 TRP A 23 1.074 11.705 6.346 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 -3.400 10.933 8.532 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 -0.949 12.984 5.684 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -3.130 12.644 6.712 1.00 0.00 H new ATOM 368 N VAL A 24 3.268 10.404 10.858 1.00 0.00 N ATOM 369 CA VAL A 24 3.094 10.732 12.263 1.00 0.00 C ATOM 370 C VAL A 24 3.588 12.158 12.515 1.00 0.00 C ATOM 371 O VAL A 24 2.951 12.920 13.240 1.00 0.00 O ATOM 372 CB VAL A 24 3.802 9.692 13.134 1.00 0.00 C ATOM 373 CG1 VAL A 24 3.739 10.081 14.612 1.00 0.00 C ATOM 374 CG2 VAL A 24 3.216 8.297 12.909 1.00 0.00 C ATOM 0 H VAL A 24 3.639 9.471 10.681 1.00 0.00 H new ATOM 0 HA VAL A 24 2.039 10.701 12.534 1.00 0.00 H new ATOM 0 HB VAL A 24 4.851 9.666 12.838 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.249 9.325 15.209 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.225 11.046 14.755 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.698 10.149 14.926 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.737 7.577 13.540 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.156 8.302 13.164 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.336 8.016 11.863 1.00 0.00 H new ATOM 384 N LYS A 25 4.718 12.477 11.900 1.00 0.00 N ATOM 385 CA LYS A 25 5.303 13.797 12.048 1.00 0.00 C ATOM 386 C LYS A 25 4.363 14.839 11.440 1.00 0.00 C ATOM 387 O LYS A 25 4.149 15.903 12.021 1.00 0.00 O ATOM 388 CB LYS A 25 6.716 13.826 11.459 1.00 0.00 C ATOM 389 CG LYS A 25 7.754 13.414 12.504 1.00 0.00 C ATOM 390 CD LYS A 25 9.101 14.085 12.233 1.00 0.00 C ATOM 391 CE LYS A 25 9.323 15.269 13.177 1.00 0.00 C ATOM 392 NZ LYS A 25 10.324 14.926 14.212 1.00 0.00 N ATOM 0 H LYS A 25 5.243 11.843 11.298 1.00 0.00 H new ATOM 0 HA LYS A 25 5.416 14.047 13.103 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.771 13.154 10.602 1.00 0.00 H new ATOM 0 HB3 LYS A 25 6.941 14.828 11.093 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.402 13.687 13.499 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.875 12.331 12.494 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.905 13.359 12.359 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.139 14.427 11.199 1.00 0.00 H new ATOM 0 HE2 LYS A 25 9.661 16.136 12.609 1.00 0.00 H new ATOM 0 HE3 LYS A 25 8.381 15.545 13.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 10.463 15.740 14.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 9.987 14.112 14.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 11.227 14.684 13.755 1.00 0.00 H new ATOM 406 N VAL A 26 3.824 14.497 10.279 1.00 0.00 N ATOM 407 CA VAL A 26 2.911 15.390 9.586 1.00 0.00 C ATOM 408 C VAL A 26 1.668 15.613 10.451 1.00 0.00 C ATOM 409 O VAL A 26 1.390 16.738 10.865 1.00 0.00 O ATOM 410 CB VAL A 26 2.581 14.829 8.201 1.00 0.00 C ATOM 411 CG1 VAL A 26 1.477 15.646 7.527 1.00 0.00 C ATOM 412 CG2 VAL A 26 3.833 14.769 7.323 1.00 0.00 C ATOM 0 H VAL A 26 4.002 13.614 9.801 1.00 0.00 H new ATOM 0 HA VAL A 26 3.376 16.363 9.426 1.00 0.00 H new ATOM 0 HB VAL A 26 2.212 13.811 8.330 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.262 15.226 6.544 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.576 15.615 8.140 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.805 16.679 7.416 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.572 14.367 6.344 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.243 15.772 7.206 1.00 0.00 H new ATOM 0 HG23 VAL A 26 4.577 14.125 7.793 1.00 0.00 H new ATOM 422 N VAL A 27 0.955 14.525 10.699 1.00 0.00 N ATOM 423 CA VAL A 27 -0.251 14.587 11.507 1.00 0.00 C ATOM 424 C VAL A 27 0.040 15.369 12.790 1.00 0.00 C ATOM 425 O VAL A 27 -0.780 16.173 13.230 1.00 0.00 O ATOM 426 CB VAL A 27 -0.777 13.175 11.773 1.00 0.00 C ATOM 427 CG1 VAL A 27 -1.979 13.208 12.719 1.00 0.00 C ATOM 428 CG2 VAL A 27 -1.127 12.465 10.465 1.00 0.00 C ATOM 0 H VAL A 27 1.189 13.594 10.354 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.040 15.118 10.975 1.00 0.00 H new ATOM 0 HB VAL A 27 0.016 12.607 12.259 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.334 12.192 12.892 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.683 13.655 13.668 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.778 13.800 12.272 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.498 11.464 10.683 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.896 13.031 9.938 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.237 12.394 9.840 1.00 0.00 H new ATOM 438 N GLU A 28 1.210 15.105 13.352 1.00 0.00 N ATOM 439 CA GLU A 28 1.620 15.774 14.575 1.00 0.00 C ATOM 440 C GLU A 28 1.615 17.291 14.378 1.00 0.00 C ATOM 441 O GLU A 28 1.094 18.027 15.214 1.00 0.00 O ATOM 442 CB GLU A 28 2.996 15.285 15.033 1.00 0.00 C ATOM 443 CG GLU A 28 2.864 14.161 16.063 1.00 0.00 C ATOM 444 CD GLU A 28 3.755 14.423 17.278 1.00 0.00 C ATOM 445 OE1 GLU A 28 4.815 15.055 17.079 1.00 0.00 O ATOM 446 OE2 GLU A 28 3.355 13.987 18.380 1.00 0.00 O ATOM 0 H GLU A 28 1.887 14.437 12.983 1.00 0.00 H new ATOM 0 HA GLU A 28 0.904 15.527 15.358 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.564 14.930 14.173 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.556 16.115 15.465 1.00 0.00 H new ATOM 0 HG2 GLU A 28 1.825 14.075 16.381 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.137 13.210 15.606 1.00 0.00 H new ATOM 453 N GLU A 29 2.201 17.713 13.268 1.00 0.00 N ATOM 454 CA GLU A 29 2.270 19.130 12.951 1.00 0.00 C ATOM 455 C GLU A 29 1.042 19.553 12.142 1.00 0.00 C ATOM 456 O GLU A 29 0.925 20.711 11.745 1.00 0.00 O ATOM 457 CB GLU A 29 3.561 19.461 12.200 1.00 0.00 C ATOM 458 CG GLU A 29 4.369 20.528 12.942 1.00 0.00 C ATOM 459 CD GLU A 29 4.008 21.931 12.447 1.00 0.00 C ATOM 460 OE1 GLU A 29 3.042 22.497 13.002 1.00 0.00 O ATOM 461 OE2 GLU A 29 4.708 22.405 11.526 1.00 0.00 O ATOM 0 H GLU A 29 2.632 17.099 12.577 1.00 0.00 H new ATOM 0 HA GLU A 29 2.277 19.692 13.885 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.162 18.558 12.087 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.322 19.813 11.196 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.177 20.456 14.013 1.00 0.00 H new ATOM 0 HG3 GLU A 29 5.434 20.350 12.796 1.00 0.00 H new ATOM 468 N LYS A 30 0.158 18.592 11.922 1.00 0.00 N ATOM 469 CA LYS A 30 -1.058 18.850 11.169 1.00 0.00 C ATOM 470 C LYS A 30 -2.273 18.568 12.055 1.00 0.00 C ATOM 471 O LYS A 30 -2.808 19.476 12.688 1.00 0.00 O ATOM 472 CB LYS A 30 -1.054 18.059 9.859 1.00 0.00 C ATOM 473 CG LYS A 30 -0.109 18.695 8.837 1.00 0.00 C ATOM 474 CD LYS A 30 -0.610 20.077 8.413 1.00 0.00 C ATOM 475 CE LYS A 30 0.353 21.173 8.872 1.00 0.00 C ATOM 476 NZ LYS A 30 1.014 21.805 7.708 1.00 0.00 N ATOM 0 H LYS A 30 0.259 17.632 12.252 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.112 19.900 10.881 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -0.748 17.031 10.052 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.064 18.020 9.451 1.00 0.00 H new ATOM 0 HG2 LYS A 30 0.890 18.782 9.265 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -0.026 18.050 7.962 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -0.717 20.112 7.329 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.598 20.255 8.837 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -0.190 21.927 9.442 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.104 20.749 9.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.664 22.547 8.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 1.549 21.086 7.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 0.294 22.227 7.087 1.00 0.00 H new ATOM 490 N ALA A 31 -2.671 17.305 12.072 1.00 0.00 N ATOM 491 CA ALA A 31 -3.814 16.891 12.870 1.00 0.00 C ATOM 492 C ALA A 31 -5.100 17.148 12.083 1.00 0.00 C ATOM 493 O ALA A 31 -5.877 18.037 12.428 1.00 0.00 O ATOM 494 CB ALA A 31 -3.793 17.628 14.210 1.00 0.00 C ATOM 0 H ALA A 31 -2.223 16.554 11.546 1.00 0.00 H new ATOM 0 HA ALA A 31 -3.767 15.823 13.084 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.649 17.318 14.809 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -2.872 17.389 14.742 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.842 18.703 14.035 1.00 0.00 H new ATOM 500 N PHE A 32 -5.286 16.353 11.038 1.00 0.00 N ATOM 501 CA PHE A 32 -6.466 16.483 10.200 1.00 0.00 C ATOM 502 C PHE A 32 -6.631 17.922 9.706 1.00 0.00 C ATOM 503 O PHE A 32 -7.117 18.781 10.439 1.00 0.00 O ATOM 504 CB PHE A 32 -7.672 16.111 11.063 1.00 0.00 C ATOM 505 CG PHE A 32 -7.787 14.614 11.360 1.00 0.00 C ATOM 506 CD1 PHE A 32 -6.796 13.976 12.036 1.00 0.00 C ATOM 507 CD2 PHE A 32 -8.883 13.922 10.946 1.00 0.00 C ATOM 508 CE1 PHE A 32 -6.902 12.587 12.311 1.00 0.00 C ATOM 509 CE2 PHE A 32 -8.990 12.533 11.221 1.00 0.00 C ATOM 510 CZ PHE A 32 -7.998 11.895 11.898 1.00 0.00 C ATOM 0 H PHE A 32 -4.639 15.617 10.753 1.00 0.00 H new ATOM 0 HA PHE A 32 -6.376 15.835 9.328 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -7.612 16.654 12.006 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -8.581 16.442 10.561 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.927 14.526 12.365 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.671 14.429 10.409 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -6.113 12.080 12.847 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -9.859 11.983 10.892 1.00 0.00 H new ATOM 0 HZ PHE A 32 -8.080 10.839 12.108 1.00 0.00 H new ATOM 520 N SER A 33 -6.216 18.140 8.467 1.00 0.00 N ATOM 521 CA SER A 33 -6.313 19.459 7.866 1.00 0.00 C ATOM 522 C SER A 33 -6.357 19.339 6.341 1.00 0.00 C ATOM 523 O SER A 33 -6.178 18.251 5.796 1.00 0.00 O ATOM 524 CB SER A 33 -5.143 20.346 8.295 1.00 0.00 C ATOM 525 OG SER A 33 -4.176 20.492 7.257 1.00 0.00 O ATOM 0 H SER A 33 -5.812 17.425 7.863 1.00 0.00 H new ATOM 0 HA SER A 33 -7.235 19.926 8.213 1.00 0.00 H new ATOM 0 HB2 SER A 33 -5.519 21.328 8.582 1.00 0.00 H new ATOM 0 HB3 SER A 33 -4.667 19.917 9.177 1.00 0.00 H new ATOM 0 HG SER A 33 -3.446 21.066 7.569 1.00 0.00 H new ATOM 531 N PRO A 34 -6.605 20.501 5.680 1.00 0.00 N ATOM 532 CA PRO A 34 -6.675 20.535 4.230 1.00 0.00 C ATOM 533 C PRO A 34 -5.279 20.440 3.611 1.00 0.00 C ATOM 534 O PRO A 34 -5.137 20.428 2.389 1.00 0.00 O ATOM 535 CB PRO A 34 -7.382 21.841 3.902 1.00 0.00 C ATOM 536 CG PRO A 34 -7.266 22.703 5.148 1.00 0.00 C ATOM 537 CD PRO A 34 -6.822 21.808 6.294 1.00 0.00 C ATOM 0 HA PRO A 34 -7.219 19.687 3.815 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.920 22.330 3.044 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.427 21.666 3.645 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.547 23.507 4.991 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -8.223 23.172 5.378 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.911 22.183 6.759 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -7.581 21.758 7.075 1.00 0.00 H new ATOM 545 N GLU A 35 -4.283 20.374 4.482 1.00 0.00 N ATOM 546 CA GLU A 35 -2.904 20.279 4.036 1.00 0.00 C ATOM 547 C GLU A 35 -2.383 18.852 4.221 1.00 0.00 C ATOM 548 O GLU A 35 -1.292 18.521 3.758 1.00 0.00 O ATOM 549 CB GLU A 35 -2.019 21.286 4.774 1.00 0.00 C ATOM 550 CG GLU A 35 -0.952 21.864 3.842 1.00 0.00 C ATOM 551 CD GLU A 35 -1.009 23.393 3.825 1.00 0.00 C ATOM 552 OE1 GLU A 35 -1.126 23.968 4.929 1.00 0.00 O ATOM 553 OE2 GLU A 35 -0.935 23.952 2.710 1.00 0.00 O ATOM 0 H GLU A 35 -4.404 20.384 5.495 1.00 0.00 H new ATOM 0 HA GLU A 35 -2.868 20.523 2.974 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.634 22.093 5.173 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.540 20.800 5.624 1.00 0.00 H new ATOM 0 HG2 GLU A 35 0.036 21.537 4.167 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.099 21.480 2.833 1.00 0.00 H new ATOM 560 N VAL A 36 -3.187 18.046 4.897 1.00 0.00 N ATOM 561 CA VAL A 36 -2.821 16.663 5.148 1.00 0.00 C ATOM 562 C VAL A 36 -3.689 15.745 4.286 1.00 0.00 C ATOM 563 O VAL A 36 -3.314 14.606 4.012 1.00 0.00 O ATOM 564 CB VAL A 36 -2.930 16.356 6.644 1.00 0.00 C ATOM 565 CG1 VAL A 36 -4.318 15.818 6.993 1.00 0.00 C ATOM 566 CG2 VAL A 36 -1.837 15.380 7.084 1.00 0.00 C ATOM 0 H VAL A 36 -4.091 18.324 5.279 1.00 0.00 H new ATOM 0 HA VAL A 36 -1.783 16.486 4.867 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.786 17.289 7.189 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -4.369 15.608 8.061 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -5.072 16.561 6.733 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -4.504 14.901 6.434 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -1.937 15.179 8.151 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.936 14.448 6.528 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -0.858 15.817 6.887 1.00 0.00 H new ATOM 576 N ILE A 37 -4.834 16.276 3.880 1.00 0.00 N ATOM 577 CA ILE A 37 -5.759 15.518 3.054 1.00 0.00 C ATOM 578 C ILE A 37 -5.077 15.158 1.732 1.00 0.00 C ATOM 579 O ILE A 37 -5.209 14.035 1.247 1.00 0.00 O ATOM 580 CB ILE A 37 -7.072 16.284 2.879 1.00 0.00 C ATOM 581 CG1 ILE A 37 -8.060 15.939 3.996 1.00 0.00 C ATOM 582 CG2 ILE A 37 -7.669 16.040 1.492 1.00 0.00 C ATOM 583 CD1 ILE A 37 -8.949 17.138 4.330 1.00 0.00 C ATOM 0 H ILE A 37 -5.142 17.221 4.108 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.026 14.581 3.542 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.858 17.350 2.954 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -8.680 15.096 3.691 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -7.514 15.627 4.886 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -8.601 16.596 1.394 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -6.966 16.374 0.729 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -7.866 14.976 1.363 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -9.642 16.867 5.126 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -8.328 17.971 4.658 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -9.512 17.432 3.444 1.00 0.00 H new ATOM 595 N PRO A 38 -4.343 16.156 1.172 1.00 0.00 N ATOM 596 CA PRO A 38 -3.640 15.956 -0.083 1.00 0.00 C ATOM 597 C PRO A 38 -2.387 15.102 0.120 1.00 0.00 C ATOM 598 O PRO A 38 -2.032 14.299 -0.741 1.00 0.00 O ATOM 599 CB PRO A 38 -3.330 17.356 -0.588 1.00 0.00 C ATOM 600 CG PRO A 38 -3.455 18.272 0.619 1.00 0.00 C ATOM 601 CD PRO A 38 -4.164 17.499 1.719 1.00 0.00 C ATOM 0 HA PRO A 38 -4.233 15.406 -0.814 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -2.327 17.405 -1.013 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -4.025 17.650 -1.375 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -2.470 18.597 0.955 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -4.016 19.170 0.360 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -3.571 17.478 2.634 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -5.122 17.955 1.970 1.00 0.00 H new ATOM 609 N MET A 39 -1.751 15.306 1.264 1.00 0.00 N ATOM 610 CA MET A 39 -0.545 14.565 1.592 1.00 0.00 C ATOM 611 C MET A 39 -0.857 13.087 1.831 1.00 0.00 C ATOM 612 O MET A 39 -0.052 12.217 1.501 1.00 0.00 O ATOM 613 CB MET A 39 0.096 15.161 2.847 1.00 0.00 C ATOM 614 CG MET A 39 1.416 15.859 2.511 1.00 0.00 C ATOM 615 SD MET A 39 2.387 16.076 3.992 1.00 0.00 S ATOM 616 CE MET A 39 2.619 14.369 4.463 1.00 0.00 C ATOM 0 H MET A 39 -2.048 15.974 1.975 1.00 0.00 H new ATOM 0 HA MET A 39 0.144 14.640 0.751 1.00 0.00 H new ATOM 0 HB2 MET A 39 -0.589 15.873 3.306 1.00 0.00 H new ATOM 0 HB3 MET A 39 0.273 14.372 3.578 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.974 15.269 1.784 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.218 16.827 2.051 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.652 14.215 4.776 1.00 0.00 H new ATOM 0 HE2 MET A 39 1.950 14.125 5.288 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.398 13.724 3.613 1.00 0.00 H new ATOM 626 N PHE A 40 -2.028 12.848 2.404 1.00 0.00 N ATOM 627 CA PHE A 40 -2.456 11.489 2.691 1.00 0.00 C ATOM 628 C PHE A 40 -2.901 10.773 1.414 1.00 0.00 C ATOM 629 O PHE A 40 -2.541 9.619 1.188 1.00 0.00 O ATOM 630 CB PHE A 40 -3.647 11.588 3.646 1.00 0.00 C ATOM 631 CG PHE A 40 -3.856 10.344 4.512 1.00 0.00 C ATOM 632 CD1 PHE A 40 -2.845 9.884 5.297 1.00 0.00 C ATOM 633 CD2 PHE A 40 -5.053 9.699 4.498 1.00 0.00 C ATOM 634 CE1 PHE A 40 -3.038 8.729 6.100 1.00 0.00 C ATOM 635 CE2 PHE A 40 -5.247 8.545 5.301 1.00 0.00 C ATOM 636 CZ PHE A 40 -4.235 8.084 6.085 1.00 0.00 C ATOM 0 H PHE A 40 -2.693 13.572 2.677 1.00 0.00 H new ATOM 0 HA PHE A 40 -1.632 10.923 3.125 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.507 12.451 4.296 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -4.551 11.770 3.065 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.895 10.398 5.310 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -5.856 10.065 3.876 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -2.235 8.363 6.722 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -6.198 8.033 5.290 1.00 0.00 H new ATOM 0 HZ PHE A 40 -4.382 7.205 6.696 1.00 0.00 H new ATOM 646 N SER A 41 -3.677 11.487 0.612 1.00 0.00 N ATOM 647 CA SER A 41 -4.174 10.934 -0.636 1.00 0.00 C ATOM 648 C SER A 41 -3.005 10.606 -1.565 1.00 0.00 C ATOM 649 O SER A 41 -3.032 9.598 -2.271 1.00 0.00 O ATOM 650 CB SER A 41 -5.141 11.903 -1.321 1.00 0.00 C ATOM 651 OG SER A 41 -4.457 12.852 -2.135 1.00 0.00 O ATOM 0 H SER A 41 -3.974 12.444 0.802 1.00 0.00 H new ATOM 0 HA SER A 41 -4.719 10.017 -0.411 1.00 0.00 H new ATOM 0 HB2 SER A 41 -5.845 11.340 -1.934 1.00 0.00 H new ATOM 0 HB3 SER A 41 -5.725 12.428 -0.565 1.00 0.00 H new ATOM 0 HG SER A 41 -3.775 13.310 -1.601 1.00 0.00 H new ATOM 657 N ALA A 42 -2.005 11.475 -1.536 1.00 0.00 N ATOM 658 CA ALA A 42 -0.828 11.290 -2.368 1.00 0.00 C ATOM 659 C ALA A 42 0.034 10.170 -1.781 1.00 0.00 C ATOM 660 O ALA A 42 0.612 9.374 -2.520 1.00 0.00 O ATOM 661 CB ALA A 42 -0.068 12.612 -2.480 1.00 0.00 C ATOM 0 H ALA A 42 -1.986 12.309 -0.949 1.00 0.00 H new ATOM 0 HA ALA A 42 -1.114 10.993 -3.377 1.00 0.00 H new ATOM 0 HB1 ALA A 42 0.815 12.473 -3.104 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.714 13.366 -2.929 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.238 12.941 -1.487 1.00 0.00 H new ATOM 667 N LEU A 43 0.094 10.144 -0.458 1.00 0.00 N ATOM 668 CA LEU A 43 0.877 9.136 0.237 1.00 0.00 C ATOM 669 C LEU A 43 0.347 7.747 -0.126 1.00 0.00 C ATOM 670 O LEU A 43 1.124 6.836 -0.409 1.00 0.00 O ATOM 671 CB LEU A 43 0.895 9.413 1.741 1.00 0.00 C ATOM 672 CG LEU A 43 2.181 10.031 2.294 1.00 0.00 C ATOM 673 CD1 LEU A 43 1.878 11.285 3.116 1.00 0.00 C ATOM 674 CD2 LEU A 43 2.984 9.003 3.092 1.00 0.00 C ATOM 0 H LEU A 43 -0.387 10.805 0.152 1.00 0.00 H new ATOM 0 HA LEU A 43 1.918 9.175 -0.083 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.065 10.078 1.978 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.711 8.475 2.265 1.00 0.00 H new ATOM 0 HG LEU A 43 2.800 10.340 1.452 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.809 11.704 3.497 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.380 12.022 2.486 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.229 11.024 3.952 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.893 9.468 3.474 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.384 8.641 3.927 1.00 0.00 H new ATOM 0 HD23 LEU A 43 3.249 8.166 2.445 1.00 0.00 H new ATOM 686 N SER A 44 -0.973 7.628 -0.106 1.00 0.00 N ATOM 687 CA SER A 44 -1.616 6.366 -0.430 1.00 0.00 C ATOM 688 C SER A 44 -1.784 6.237 -1.945 1.00 0.00 C ATOM 689 O SER A 44 -0.975 5.593 -2.610 1.00 0.00 O ATOM 690 CB SER A 44 -2.972 6.243 0.268 1.00 0.00 C ATOM 691 OG SER A 44 -3.800 5.259 -0.344 1.00 0.00 O ATOM 0 H SER A 44 -1.614 8.385 0.130 1.00 0.00 H new ATOM 0 HA SER A 44 -0.980 5.557 -0.072 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.818 5.986 1.316 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.479 7.208 0.247 1.00 0.00 H new ATOM 0 HG SER A 44 -4.706 5.319 0.024 1.00 0.00 H new ATOM 697 N GLU A 45 -2.841 6.860 -2.445 1.00 0.00 N ATOM 698 CA GLU A 45 -3.125 6.823 -3.870 1.00 0.00 C ATOM 699 C GLU A 45 -3.756 5.483 -4.251 1.00 0.00 C ATOM 700 O GLU A 45 -4.356 5.355 -5.317 1.00 0.00 O ATOM 701 CB GLU A 45 -1.861 7.087 -4.689 1.00 0.00 C ATOM 702 CG GLU A 45 -2.052 8.280 -5.626 1.00 0.00 C ATOM 703 CD GLU A 45 -0.753 8.615 -6.362 1.00 0.00 C ATOM 704 OE1 GLU A 45 -0.287 7.735 -7.119 1.00 0.00 O ATOM 705 OE2 GLU A 45 -0.255 9.741 -6.150 1.00 0.00 O ATOM 0 H GLU A 45 -3.511 7.393 -1.890 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.837 7.616 -4.099 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -1.023 7.277 -4.019 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -1.609 6.200 -5.271 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.836 8.057 -6.349 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.383 9.147 -5.054 1.00 0.00 H new ATOM 712 N GLY A 46 -3.601 4.517 -3.357 1.00 0.00 N ATOM 713 CA GLY A 46 -4.148 3.190 -3.586 1.00 0.00 C ATOM 714 C GLY A 46 -3.524 2.168 -2.633 1.00 0.00 C ATOM 715 O GLY A 46 -3.251 1.035 -3.026 1.00 0.00 O ATOM 0 H GLY A 46 -3.104 4.627 -2.473 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -5.229 3.209 -3.447 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.964 2.890 -4.618 1.00 0.00 H new ATOM 719 N ALA A 47 -3.319 2.606 -1.400 1.00 0.00 N ATOM 720 CA ALA A 47 -2.733 1.743 -0.388 1.00 0.00 C ATOM 721 C ALA A 47 -3.724 0.633 -0.032 1.00 0.00 C ATOM 722 O ALA A 47 -4.925 0.881 0.070 1.00 0.00 O ATOM 723 CB ALA A 47 -2.333 2.581 0.829 1.00 0.00 C ATOM 0 H ALA A 47 -3.548 3.547 -1.078 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.829 1.267 -0.767 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.894 1.934 1.588 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.605 3.334 0.529 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.216 3.073 1.238 1.00 0.00 H new ATOM 729 N THR A 48 -3.186 -0.564 0.145 1.00 0.00 N ATOM 730 CA THR A 48 -4.009 -1.711 0.486 1.00 0.00 C ATOM 731 C THR A 48 -4.929 -1.376 1.662 1.00 0.00 C ATOM 732 O THR A 48 -4.923 -0.252 2.160 1.00 0.00 O ATOM 733 CB THR A 48 -3.079 -2.895 0.762 1.00 0.00 C ATOM 734 OG1 THR A 48 -1.790 -2.416 0.391 1.00 0.00 O ATOM 735 CG2 THR A 48 -3.328 -4.067 -0.190 1.00 0.00 C ATOM 0 H THR A 48 -2.190 -0.765 0.059 1.00 0.00 H new ATOM 0 HA THR A 48 -4.670 -1.982 -0.337 1.00 0.00 H new ATOM 0 HB THR A 48 -3.210 -3.228 1.792 1.00 0.00 H new ATOM 0 HG1 THR A 48 -1.249 -2.275 1.196 1.00 0.00 H new ATOM 0 HG21 THR A 48 -2.643 -4.881 0.048 1.00 0.00 H new ATOM 0 HG22 THR A 48 -4.355 -4.414 -0.079 1.00 0.00 H new ATOM 0 HG23 THR A 48 -3.163 -3.743 -1.217 1.00 0.00 H new ATOM 743 N PRO A 49 -5.719 -2.400 2.084 1.00 0.00 N ATOM 744 CA PRO A 49 -6.643 -2.226 3.192 1.00 0.00 C ATOM 745 C PRO A 49 -5.899 -2.204 4.529 1.00 0.00 C ATOM 746 O PRO A 49 -6.274 -1.468 5.440 1.00 0.00 O ATOM 747 CB PRO A 49 -7.621 -3.384 3.074 1.00 0.00 C ATOM 748 CG PRO A 49 -6.939 -4.418 2.193 1.00 0.00 C ATOM 749 CD PRO A 49 -5.753 -3.746 1.519 1.00 0.00 C ATOM 0 HA PRO A 49 -7.170 -1.272 3.155 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.855 -3.799 4.054 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -8.563 -3.056 2.634 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -6.608 -5.269 2.789 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.635 -4.803 1.447 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -4.826 -4.283 1.720 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.876 -3.718 0.436 1.00 0.00 H new ATOM 757 N GLN A 50 -4.858 -3.020 4.603 1.00 0.00 N ATOM 758 CA GLN A 50 -4.058 -3.103 5.813 1.00 0.00 C ATOM 759 C GLN A 50 -3.160 -1.872 5.942 1.00 0.00 C ATOM 760 O GLN A 50 -2.910 -1.394 7.047 1.00 0.00 O ATOM 761 CB GLN A 50 -3.229 -4.390 5.834 1.00 0.00 C ATOM 762 CG GLN A 50 -4.103 -5.600 6.173 1.00 0.00 C ATOM 763 CD GLN A 50 -3.256 -6.758 6.702 1.00 0.00 C ATOM 764 OE1 GLN A 50 -3.050 -7.763 6.043 1.00 0.00 O ATOM 765 NE2 GLN A 50 -2.776 -6.561 7.927 1.00 0.00 N ATOM 0 H GLN A 50 -4.550 -3.629 3.845 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.732 -3.128 6.669 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -2.757 -4.539 4.863 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -2.428 -4.299 6.567 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -4.846 -5.318 6.919 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -4.648 -5.920 5.285 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -2.987 -5.696 8.424 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -2.197 -7.275 8.369 1.00 0.00 H new ATOM 774 N ASP A 51 -2.700 -1.391 4.795 1.00 0.00 N ATOM 775 CA ASP A 51 -1.835 -0.224 4.766 1.00 0.00 C ATOM 776 C ASP A 51 -2.639 1.011 5.177 1.00 0.00 C ATOM 777 O ASP A 51 -2.252 1.731 6.097 1.00 0.00 O ATOM 778 CB ASP A 51 -1.282 0.018 3.361 1.00 0.00 C ATOM 779 CG ASP A 51 -0.197 -0.965 2.913 1.00 0.00 C ATOM 780 OD1 ASP A 51 0.569 -1.404 3.798 1.00 0.00 O ATOM 781 OD2 ASP A 51 -0.160 -1.255 1.698 1.00 0.00 O ATOM 0 H ASP A 51 -2.910 -1.789 3.880 1.00 0.00 H new ATOM 0 HA ASP A 51 -1.007 -0.401 5.453 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -2.107 -0.026 2.650 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -0.876 1.029 3.316 1.00 0.00 H new ATOM 786 N LEU A 52 -3.743 1.219 4.475 1.00 0.00 N ATOM 787 CA LEU A 52 -4.605 2.355 4.755 1.00 0.00 C ATOM 788 C LEU A 52 -5.043 2.308 6.221 1.00 0.00 C ATOM 789 O LEU A 52 -4.881 3.284 6.952 1.00 0.00 O ATOM 790 CB LEU A 52 -5.772 2.399 3.767 1.00 0.00 C ATOM 791 CG LEU A 52 -5.598 3.330 2.565 1.00 0.00 C ATOM 792 CD1 LEU A 52 -6.717 3.121 1.542 1.00 0.00 C ATOM 793 CD2 LEU A 52 -5.495 4.790 3.013 1.00 0.00 C ATOM 0 H LEU A 52 -4.061 0.620 3.713 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.062 3.289 4.613 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.947 1.389 3.397 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.669 2.700 4.308 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.660 3.078 2.071 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -6.569 3.795 0.698 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.700 2.090 1.190 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.680 3.329 2.008 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.372 5.431 2.140 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.403 5.072 3.545 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.636 4.908 3.674 1.00 0.00 H new ATOM 805 N ASN A 53 -5.589 1.164 6.606 1.00 0.00 N ATOM 806 CA ASN A 53 -6.051 0.978 7.971 1.00 0.00 C ATOM 807 C ASN A 53 -4.917 1.316 8.940 1.00 0.00 C ATOM 808 O ASN A 53 -5.144 1.947 9.972 1.00 0.00 O ATOM 809 CB ASN A 53 -6.466 -0.475 8.218 1.00 0.00 C ATOM 810 CG ASN A 53 -7.275 -0.601 9.511 1.00 0.00 C ATOM 811 OD1 ASN A 53 -7.516 0.363 10.220 1.00 0.00 O ATOM 812 ND2 ASN A 53 -7.678 -1.840 9.777 1.00 0.00 N ATOM 0 H ASN A 53 -5.722 0.357 5.997 1.00 0.00 H new ATOM 0 HA ASN A 53 -6.909 1.631 8.128 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.058 -0.836 7.377 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -5.579 -1.106 8.277 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -8.224 -2.029 10.618 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -7.441 -2.601 9.140 1.00 0.00 H new ATOM 819 N THR A 54 -3.720 0.883 8.573 1.00 0.00 N ATOM 820 CA THR A 54 -2.549 1.134 9.397 1.00 0.00 C ATOM 821 C THR A 54 -2.316 2.638 9.551 1.00 0.00 C ATOM 822 O THR A 54 -2.287 3.154 10.668 1.00 0.00 O ATOM 823 CB THR A 54 -1.363 0.397 8.770 1.00 0.00 C ATOM 824 OG1 THR A 54 -1.354 -0.868 9.426 1.00 0.00 O ATOM 825 CG2 THR A 54 -0.019 1.022 9.148 1.00 0.00 C ATOM 0 H THR A 54 -3.535 0.360 7.717 1.00 0.00 H new ATOM 0 HA THR A 54 -2.690 0.754 10.409 1.00 0.00 H new ATOM 0 HB THR A 54 -1.470 0.395 7.685 1.00 0.00 H new ATOM 0 HG1 THR A 54 -1.862 -1.516 8.894 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.788 0.461 8.677 1.00 0.00 H new ATOM 0 HG22 THR A 54 0.010 2.057 8.806 1.00 0.00 H new ATOM 0 HG23 THR A 54 0.103 0.994 10.231 1.00 0.00 H new ATOM 833 N MET A 55 -2.156 3.299 8.414 1.00 0.00 N ATOM 834 CA MET A 55 -1.927 4.734 8.409 1.00 0.00 C ATOM 835 C MET A 55 -2.957 5.456 9.280 1.00 0.00 C ATOM 836 O MET A 55 -2.626 6.420 9.968 1.00 0.00 O ATOM 837 CB MET A 55 -2.013 5.260 6.975 1.00 0.00 C ATOM 838 CG MET A 55 -0.756 6.049 6.604 1.00 0.00 C ATOM 839 SD MET A 55 -0.656 6.240 4.832 1.00 0.00 S ATOM 840 CE MET A 55 -0.523 8.016 4.718 1.00 0.00 C ATOM 0 H MET A 55 -2.180 2.868 7.490 1.00 0.00 H new ATOM 0 HA MET A 55 -0.935 4.926 8.817 1.00 0.00 H new ATOM 0 HB2 MET A 55 -2.140 4.426 6.285 1.00 0.00 H new ATOM 0 HB3 MET A 55 -2.891 5.897 6.870 1.00 0.00 H new ATOM 0 HG2 MET A 55 -0.777 7.028 7.083 1.00 0.00 H new ATOM 0 HG3 MET A 55 0.130 5.532 6.973 1.00 0.00 H new ATOM 0 HE1 MET A 55 -1.227 8.386 3.972 1.00 0.00 H new ATOM 0 HE2 MET A 55 -0.752 8.461 5.686 1.00 0.00 H new ATOM 0 HE3 MET A 55 0.491 8.287 4.426 1.00 0.00 H new ATOM 850 N LEU A 56 -4.185 4.964 9.221 1.00 0.00 N ATOM 851 CA LEU A 56 -5.265 5.550 9.996 1.00 0.00 C ATOM 852 C LEU A 56 -5.025 5.281 11.484 1.00 0.00 C ATOM 853 O LEU A 56 -5.158 6.182 12.310 1.00 0.00 O ATOM 854 CB LEU A 56 -6.620 5.048 9.492 1.00 0.00 C ATOM 855 CG LEU A 56 -6.944 5.350 8.027 1.00 0.00 C ATOM 856 CD1 LEU A 56 -8.156 4.544 7.556 1.00 0.00 C ATOM 857 CD2 LEU A 56 -7.132 6.851 7.805 1.00 0.00 C ATOM 0 H LEU A 56 -4.457 4.165 8.648 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.283 6.632 9.866 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.663 3.969 9.638 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.401 5.485 10.114 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.095 5.039 7.418 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.365 4.777 6.512 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.945 3.479 7.655 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -9.023 4.800 8.165 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.361 7.038 6.756 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.953 7.211 8.425 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.216 7.376 8.075 1.00 0.00 H new ATOM 869 N ASN A 57 -4.676 4.037 11.778 1.00 0.00 N ATOM 870 CA ASN A 57 -4.416 3.638 13.151 1.00 0.00 C ATOM 871 C ASN A 57 -3.244 4.454 13.701 1.00 0.00 C ATOM 872 O ASN A 57 -3.215 4.784 14.885 1.00 0.00 O ATOM 873 CB ASN A 57 -4.041 2.157 13.233 1.00 0.00 C ATOM 874 CG ASN A 57 -5.263 1.300 13.566 1.00 0.00 C ATOM 875 OD1 ASN A 57 -6.336 1.458 13.007 1.00 0.00 O ATOM 876 ND2 ASN A 57 -5.041 0.385 14.507 1.00 0.00 N ATOM 0 H ASN A 57 -4.567 3.292 11.089 1.00 0.00 H new ATOM 0 HA ASN A 57 -5.323 3.813 13.730 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -3.613 1.833 12.284 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -3.274 2.014 13.994 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -5.794 -0.237 14.801 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -4.118 0.306 14.934 1.00 0.00 H new ATOM 883 N THR A 58 -2.307 4.756 12.815 1.00 0.00 N ATOM 884 CA THR A 58 -1.136 5.525 13.196 1.00 0.00 C ATOM 885 C THR A 58 -1.543 6.937 13.626 1.00 0.00 C ATOM 886 O THR A 58 -0.991 7.482 14.581 1.00 0.00 O ATOM 887 CB THR A 58 -0.154 5.507 12.024 1.00 0.00 C ATOM 888 OG1 THR A 58 0.788 4.497 12.376 1.00 0.00 O ATOM 889 CG2 THR A 58 0.684 6.785 11.940 1.00 0.00 C ATOM 0 H THR A 58 -2.335 4.481 11.833 1.00 0.00 H new ATOM 0 HA THR A 58 -0.639 5.085 14.060 1.00 0.00 H new ATOM 0 HB THR A 58 -0.704 5.373 11.093 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.695 4.867 12.337 1.00 0.00 H new ATOM 0 HG21 THR A 58 1.364 6.719 11.091 1.00 0.00 H new ATOM 0 HG22 THR A 58 0.026 7.644 11.812 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.260 6.903 12.858 1.00 0.00 H new ATOM 897 N VAL A 59 -2.504 7.488 12.900 1.00 0.00 N ATOM 898 CA VAL A 59 -2.991 8.825 13.193 1.00 0.00 C ATOM 899 C VAL A 59 -3.165 8.979 14.705 1.00 0.00 C ATOM 900 O VAL A 59 -3.144 7.993 15.440 1.00 0.00 O ATOM 901 CB VAL A 59 -4.279 9.096 12.412 1.00 0.00 C ATOM 902 CG1 VAL A 59 -5.484 9.167 13.352 1.00 0.00 C ATOM 903 CG2 VAL A 59 -4.157 10.372 11.578 1.00 0.00 C ATOM 0 H VAL A 59 -2.959 7.033 12.109 1.00 0.00 H new ATOM 0 HA VAL A 59 -2.268 9.574 12.871 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.437 8.263 11.727 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.387 9.360 12.772 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -5.589 8.220 13.881 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.336 9.971 14.073 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -5.086 10.541 11.033 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -3.963 11.219 12.236 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.335 10.267 10.870 1.00 0.00 H new ATOM 913 N GLY A 60 -3.331 10.224 15.125 1.00 0.00 N ATOM 914 CA GLY A 60 -3.508 10.521 16.537 1.00 0.00 C ATOM 915 C GLY A 60 -4.410 9.483 17.207 1.00 0.00 C ATOM 916 O GLY A 60 -3.968 8.744 18.084 1.00 0.00 O ATOM 0 H GLY A 60 -3.347 11.040 14.513 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.538 10.539 17.033 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -3.943 11.514 16.652 1.00 0.00 H new ATOM 920 N GLY A 61 -5.659 9.459 16.765 1.00 0.00 N ATOM 921 CA GLY A 61 -6.629 8.524 17.310 1.00 0.00 C ATOM 922 C GLY A 61 -7.818 9.264 17.926 1.00 0.00 C ATOM 923 O GLY A 61 -8.145 9.057 19.095 1.00 0.00 O ATOM 0 H GLY A 61 -6.022 10.072 16.035 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.980 7.858 16.522 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -6.153 7.900 18.066 1.00 0.00 H new ATOM 927 N HIS A 62 -8.433 10.111 17.114 1.00 0.00 N ATOM 928 CA HIS A 62 -9.579 10.882 17.565 1.00 0.00 C ATOM 929 C HIS A 62 -10.868 10.121 17.246 1.00 0.00 C ATOM 930 O HIS A 62 -11.084 9.708 16.108 1.00 0.00 O ATOM 931 CB HIS A 62 -9.557 12.289 16.963 1.00 0.00 C ATOM 932 CG HIS A 62 -8.170 12.855 16.774 1.00 0.00 C ATOM 933 ND1 HIS A 62 -7.809 13.598 15.663 1.00 0.00 N ATOM 934 CD2 HIS A 62 -7.061 12.779 17.563 1.00 0.00 C ATOM 935 CE1 HIS A 62 -6.538 13.947 15.789 1.00 0.00 C ATOM 936 NE2 HIS A 62 -6.075 13.438 16.967 1.00 0.00 N ATOM 0 H HIS A 62 -8.159 10.280 16.146 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.533 11.011 18.646 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -10.064 12.268 15.998 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.126 12.958 17.608 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -6.996 12.269 18.513 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -5.968 14.532 15.083 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -5.128 13.546 17.330 1.00 0.00 H new ATOM 945 N GLN A 63 -11.690 9.958 18.273 1.00 0.00 N ATOM 946 CA GLN A 63 -12.950 9.254 18.117 1.00 0.00 C ATOM 947 C GLN A 63 -13.912 10.071 17.250 1.00 0.00 C ATOM 948 O GLN A 63 -14.685 9.510 16.476 1.00 0.00 O ATOM 949 CB GLN A 63 -13.573 8.937 19.477 1.00 0.00 C ATOM 950 CG GLN A 63 -13.926 10.220 20.231 1.00 0.00 C ATOM 951 CD GLN A 63 -13.931 9.985 21.743 1.00 0.00 C ATOM 952 OE1 GLN A 63 -14.643 9.144 22.265 1.00 0.00 O ATOM 953 NE2 GLN A 63 -13.096 10.774 22.415 1.00 0.00 N ATOM 0 H GLN A 63 -11.507 10.302 19.216 1.00 0.00 H new ATOM 0 HA GLN A 63 -12.754 8.307 17.614 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -14.470 8.334 19.338 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -12.878 8.342 20.070 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -13.207 11.001 19.983 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -14.906 10.576 19.912 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -12.528 11.458 21.916 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.024 10.695 23.429 1.00 0.00 H new ATOM 962 N ALA A 64 -13.831 11.385 17.411 1.00 0.00 N ATOM 963 CA ALA A 64 -14.683 12.284 16.653 1.00 0.00 C ATOM 964 C ALA A 64 -14.248 12.279 15.186 1.00 0.00 C ATOM 965 O ALA A 64 -15.074 12.112 14.291 1.00 0.00 O ATOM 966 CB ALA A 64 -14.629 13.682 17.273 1.00 0.00 C ATOM 0 H ALA A 64 -13.189 11.847 18.055 1.00 0.00 H new ATOM 0 HA ALA A 64 -15.720 11.951 16.689 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.268 14.357 16.704 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -14.977 13.636 18.305 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -13.603 14.050 17.252 1.00 0.00 H new ATOM 972 N ALA A 65 -12.951 12.465 14.987 1.00 0.00 N ATOM 973 CA ALA A 65 -12.396 12.484 13.644 1.00 0.00 C ATOM 974 C ALA A 65 -12.680 11.145 12.961 1.00 0.00 C ATOM 975 O ALA A 65 -13.237 11.109 11.865 1.00 0.00 O ATOM 976 CB ALA A 65 -10.900 12.797 13.715 1.00 0.00 C ATOM 0 H ALA A 65 -12.269 12.604 15.733 1.00 0.00 H new ATOM 0 HA ALA A 65 -12.865 13.265 13.045 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -10.483 12.811 12.708 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -10.754 13.771 14.182 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -10.396 12.032 14.305 1.00 0.00 H new ATOM 982 N MET A 66 -12.283 10.076 13.637 1.00 0.00 N ATOM 983 CA MET A 66 -12.488 8.738 13.108 1.00 0.00 C ATOM 984 C MET A 66 -13.977 8.450 12.907 1.00 0.00 C ATOM 985 O MET A 66 -14.361 7.802 11.935 1.00 0.00 O ATOM 986 CB MET A 66 -11.895 7.711 14.075 1.00 0.00 C ATOM 987 CG MET A 66 -10.392 7.541 13.840 1.00 0.00 C ATOM 988 SD MET A 66 -10.105 6.748 12.266 1.00 0.00 S ATOM 989 CE MET A 66 -8.674 7.661 11.716 1.00 0.00 C ATOM 0 H MET A 66 -11.821 10.109 14.546 1.00 0.00 H new ATOM 0 HA MET A 66 -11.990 8.669 12.141 1.00 0.00 H new ATOM 0 HB2 MET A 66 -12.072 8.029 15.102 1.00 0.00 H new ATOM 0 HB3 MET A 66 -12.398 6.752 13.946 1.00 0.00 H new ATOM 0 HG2 MET A 66 -9.900 8.513 13.861 1.00 0.00 H new ATOM 0 HG3 MET A 66 -9.955 6.945 14.642 1.00 0.00 H new ATOM 0 HE1 MET A 66 -8.488 7.446 10.664 1.00 0.00 H new ATOM 0 HE2 MET A 66 -8.853 8.729 11.842 1.00 0.00 H new ATOM 0 HE3 MET A 66 -7.806 7.367 12.306 1.00 0.00 H new ATOM 999 N GLN A 67 -14.774 8.946 13.842 1.00 0.00 N ATOM 1000 CA GLN A 67 -16.213 8.749 13.780 1.00 0.00 C ATOM 1001 C GLN A 67 -16.761 9.266 12.449 1.00 0.00 C ATOM 1002 O GLN A 67 -17.449 8.539 11.733 1.00 0.00 O ATOM 1003 CB GLN A 67 -16.910 9.427 14.960 1.00 0.00 C ATOM 1004 CG GLN A 67 -18.423 9.490 14.742 1.00 0.00 C ATOM 1005 CD GLN A 67 -19.175 8.886 15.929 1.00 0.00 C ATOM 1006 OE1 GLN A 67 -18.616 8.619 16.981 1.00 0.00 O ATOM 1007 NE2 GLN A 67 -20.471 8.686 15.705 1.00 0.00 N ATOM 0 H GLN A 67 -14.451 9.484 14.646 1.00 0.00 H new ATOM 0 HA GLN A 67 -16.418 7.680 13.845 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -16.694 8.880 15.878 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.516 10.435 15.089 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -18.731 10.526 14.602 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -18.685 8.953 13.830 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -20.876 8.932 14.802 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -21.059 8.287 16.437 1.00 0.00 H new ATOM 1016 N MET A 68 -16.438 10.518 12.157 1.00 0.00 N ATOM 1017 CA MET A 68 -16.890 11.140 10.924 1.00 0.00 C ATOM 1018 C MET A 68 -16.358 10.388 9.703 1.00 0.00 C ATOM 1019 O MET A 68 -17.097 10.142 8.750 1.00 0.00 O ATOM 1020 CB MET A 68 -16.410 12.592 10.879 1.00 0.00 C ATOM 1021 CG MET A 68 -17.505 13.547 11.353 1.00 0.00 C ATOM 1022 SD MET A 68 -17.111 14.170 12.980 1.00 0.00 S ATOM 1023 CE MET A 68 -15.523 14.914 12.650 1.00 0.00 C ATOM 0 H MET A 68 -15.869 11.118 12.753 1.00 0.00 H new ATOM 0 HA MET A 68 -17.979 11.107 10.901 1.00 0.00 H new ATOM 0 HB2 MET A 68 -15.526 12.706 11.507 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.114 12.849 9.862 1.00 0.00 H new ATOM 0 HG2 MET A 68 -17.605 14.376 10.652 1.00 0.00 H new ATOM 0 HG3 MET A 68 -18.465 13.031 11.375 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.187 15.460 13.531 1.00 0.00 H new ATOM 0 HE2 MET A 68 -14.800 14.135 12.408 1.00 0.00 H new ATOM 0 HE3 MET A 68 -15.611 15.601 11.809 1.00 0.00 H new ATOM 1033 N LEU A 69 -15.081 10.043 9.770 1.00 0.00 N ATOM 1034 CA LEU A 69 -14.441 9.324 8.682 1.00 0.00 C ATOM 1035 C LEU A 69 -15.192 8.014 8.430 1.00 0.00 C ATOM 1036 O LEU A 69 -15.369 7.605 7.284 1.00 0.00 O ATOM 1037 CB LEU A 69 -12.950 9.133 8.968 1.00 0.00 C ATOM 1038 CG LEU A 69 -12.105 8.608 7.805 1.00 0.00 C ATOM 1039 CD1 LEU A 69 -11.026 9.618 7.412 1.00 0.00 C ATOM 1040 CD2 LEU A 69 -11.514 7.235 8.133 1.00 0.00 C ATOM 0 H LEU A 69 -14.472 10.248 10.562 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.493 9.904 7.761 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.537 10.089 9.289 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -12.847 8.444 9.806 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.756 8.480 6.940 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -10.440 9.220 6.584 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.496 10.553 7.108 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -10.372 9.801 8.264 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.918 6.885 7.290 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.881 7.313 9.017 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.321 6.528 8.325 1.00 0.00 H new ATOM 1052 N LYS A 70 -15.613 7.392 9.523 1.00 0.00 N ATOM 1053 CA LYS A 70 -16.340 6.137 9.435 1.00 0.00 C ATOM 1054 C LYS A 70 -17.673 6.374 8.721 1.00 0.00 C ATOM 1055 O LYS A 70 -18.029 5.637 7.804 1.00 0.00 O ATOM 1056 CB LYS A 70 -16.489 5.507 10.821 1.00 0.00 C ATOM 1057 CG LYS A 70 -17.310 4.218 10.752 1.00 0.00 C ATOM 1058 CD LYS A 70 -18.638 4.373 11.499 1.00 0.00 C ATOM 1059 CE LYS A 70 -19.702 3.438 10.924 1.00 0.00 C ATOM 1060 NZ LYS A 70 -21.000 3.650 11.602 1.00 0.00 N ATOM 0 H LYS A 70 -15.464 7.734 10.472 1.00 0.00 H new ATOM 0 HA LYS A 70 -15.783 5.414 8.839 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -15.504 5.293 11.235 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -16.972 6.214 11.496 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -17.502 3.960 9.710 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -16.740 3.396 11.184 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -18.492 4.156 12.557 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -18.980 5.406 11.430 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -19.811 3.616 9.854 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -19.387 2.401 11.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -21.711 3.007 11.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -20.896 3.458 12.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -21.306 4.634 11.465 1.00 0.00 H new ATOM 1074 N GLU A 71 -18.374 7.406 9.170 1.00 0.00 N ATOM 1075 CA GLU A 71 -19.658 7.748 8.586 1.00 0.00 C ATOM 1076 C GLU A 71 -19.518 7.949 7.076 1.00 0.00 C ATOM 1077 O GLU A 71 -20.340 7.460 6.303 1.00 0.00 O ATOM 1078 CB GLU A 71 -20.249 8.993 9.253 1.00 0.00 C ATOM 1079 CG GLU A 71 -21.676 9.251 8.765 1.00 0.00 C ATOM 1080 CD GLU A 71 -22.663 8.282 9.419 1.00 0.00 C ATOM 1081 OE1 GLU A 71 -22.458 7.986 10.617 1.00 0.00 O ATOM 1082 OE2 GLU A 71 -23.598 7.858 8.707 1.00 0.00 O ATOM 0 H GLU A 71 -18.076 8.016 9.932 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.346 6.921 8.760 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -20.249 8.865 10.335 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -19.624 9.859 9.034 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -21.963 10.277 8.994 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -21.719 9.143 7.681 1.00 0.00 H new ATOM 1089 N THR A 72 -18.472 8.670 6.702 1.00 0.00 N ATOM 1090 CA THR A 72 -18.214 8.942 5.298 1.00 0.00 C ATOM 1091 C THR A 72 -18.022 7.634 4.528 1.00 0.00 C ATOM 1092 O THR A 72 -18.777 7.336 3.605 1.00 0.00 O ATOM 1093 CB THR A 72 -17.009 9.882 5.212 1.00 0.00 C ATOM 1094 OG1 THR A 72 -17.586 11.171 5.022 1.00 0.00 O ATOM 1095 CG2 THR A 72 -16.179 9.655 3.946 1.00 0.00 C ATOM 0 H THR A 72 -17.793 9.074 7.347 1.00 0.00 H new ATOM 0 HA THR A 72 -19.064 9.437 4.828 1.00 0.00 H new ATOM 0 HB THR A 72 -16.378 9.744 6.090 1.00 0.00 H new ATOM 0 HG1 THR A 72 -17.052 11.676 4.374 1.00 0.00 H new ATOM 0 HG21 THR A 72 -15.337 10.347 3.934 1.00 0.00 H new ATOM 0 HG22 THR A 72 -15.807 8.630 3.934 1.00 0.00 H new ATOM 0 HG23 THR A 72 -16.801 9.826 3.068 1.00 0.00 H new ATOM 1103 N ILE A 73 -17.004 6.889 4.936 1.00 0.00 N ATOM 1104 CA ILE A 73 -16.702 5.620 4.297 1.00 0.00 C ATOM 1105 C ILE A 73 -17.989 4.803 4.161 1.00 0.00 C ATOM 1106 O ILE A 73 -18.299 4.301 3.082 1.00 0.00 O ATOM 1107 CB ILE A 73 -15.588 4.891 5.051 1.00 0.00 C ATOM 1108 CG1 ILE A 73 -14.230 5.544 4.787 1.00 0.00 C ATOM 1109 CG2 ILE A 73 -15.582 3.400 4.713 1.00 0.00 C ATOM 1110 CD1 ILE A 73 -13.090 4.549 5.012 1.00 0.00 C ATOM 0 H ILE A 73 -16.378 7.141 5.701 1.00 0.00 H new ATOM 0 HA ILE A 73 -16.319 5.783 3.290 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.785 4.978 6.120 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -14.195 5.917 3.764 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -14.102 6.404 5.445 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -14.781 2.906 5.262 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -16.539 2.960 4.993 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -15.422 3.270 3.643 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -12.136 5.039 4.818 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -13.113 4.196 6.043 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -13.208 3.702 4.336 1.00 0.00 H new ATOM 1122 N ASN A 74 -18.703 4.695 5.272 1.00 0.00 N ATOM 1123 CA ASN A 74 -19.949 3.948 5.291 1.00 0.00 C ATOM 1124 C ASN A 74 -20.901 4.526 4.242 1.00 0.00 C ATOM 1125 O ASN A 74 -21.684 3.794 3.638 1.00 0.00 O ATOM 1126 CB ASN A 74 -20.632 4.050 6.657 1.00 0.00 C ATOM 1127 CG ASN A 74 -21.609 2.892 6.868 1.00 0.00 C ATOM 1128 OD1 ASN A 74 -21.665 1.943 6.102 1.00 0.00 O ATOM 1129 ND2 ASN A 74 -22.374 3.020 7.948 1.00 0.00 N ATOM 0 H ASN A 74 -18.442 5.112 6.165 1.00 0.00 H new ATOM 0 HA ASN A 74 -19.719 2.904 5.080 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -19.879 4.044 7.445 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -21.164 4.998 6.732 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -23.058 2.299 8.177 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -22.277 3.839 8.548 1.00 0.00 H new ATOM 1136 N GLU A 75 -20.804 5.834 4.058 1.00 0.00 N ATOM 1137 CA GLU A 75 -21.646 6.519 3.093 1.00 0.00 C ATOM 1138 C GLU A 75 -21.332 6.034 1.676 1.00 0.00 C ATOM 1139 O GLU A 75 -22.174 5.416 1.027 1.00 0.00 O ATOM 1140 CB GLU A 75 -21.484 8.037 3.202 1.00 0.00 C ATOM 1141 CG GLU A 75 -22.659 8.763 2.541 1.00 0.00 C ATOM 1142 CD GLU A 75 -22.321 10.234 2.290 1.00 0.00 C ATOM 1143 OE1 GLU A 75 -22.288 10.987 3.287 1.00 0.00 O ATOM 1144 OE2 GLU A 75 -22.105 10.572 1.105 1.00 0.00 O ATOM 0 H GLU A 75 -20.154 6.438 4.561 1.00 0.00 H new ATOM 0 HA GLU A 75 -22.686 6.282 3.315 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -21.418 8.325 4.251 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -20.551 8.342 2.728 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -22.908 8.277 1.598 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -23.540 8.692 3.178 1.00 0.00 H new ATOM 1151 N GLU A 76 -20.119 6.335 1.237 1.00 0.00 N ATOM 1152 CA GLU A 76 -19.683 5.938 -0.090 1.00 0.00 C ATOM 1153 C GLU A 76 -20.036 4.472 -0.349 1.00 0.00 C ATOM 1154 O GLU A 76 -20.407 4.107 -1.463 1.00 0.00 O ATOM 1155 CB GLU A 76 -18.183 6.181 -0.271 1.00 0.00 C ATOM 1156 CG GLU A 76 -17.904 7.638 -0.646 1.00 0.00 C ATOM 1157 CD GLU A 76 -18.149 7.877 -2.138 1.00 0.00 C ATOM 1158 OE1 GLU A 76 -19.319 7.729 -2.552 1.00 0.00 O ATOM 1159 OE2 GLU A 76 -17.160 8.202 -2.829 1.00 0.00 O ATOM 0 H GLU A 76 -19.424 6.850 1.778 1.00 0.00 H new ATOM 0 HA GLU A 76 -20.208 6.552 -0.822 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -17.657 5.932 0.651 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -17.795 5.521 -1.047 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -18.543 8.297 -0.059 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -16.873 7.890 -0.398 1.00 0.00 H new ATOM 1166 N ALA A 77 -19.908 3.672 0.699 1.00 0.00 N ATOM 1167 CA ALA A 77 -20.209 2.255 0.600 1.00 0.00 C ATOM 1168 C ALA A 77 -21.681 2.075 0.225 1.00 0.00 C ATOM 1169 O ALA A 77 -22.001 1.351 -0.718 1.00 0.00 O ATOM 1170 CB ALA A 77 -19.855 1.563 1.918 1.00 0.00 C ATOM 0 H ALA A 77 -19.600 3.979 1.622 1.00 0.00 H new ATOM 0 HA ALA A 77 -19.610 1.790 -0.183 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -20.081 0.499 1.843 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -18.793 1.694 2.124 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -20.438 2.002 2.727 1.00 0.00 H new ATOM 1176 N ALA A 78 -22.537 2.746 0.980 1.00 0.00 N ATOM 1177 CA ALA A 78 -23.968 2.670 0.738 1.00 0.00 C ATOM 1178 C ALA A 78 -24.257 3.066 -0.711 1.00 0.00 C ATOM 1179 O ALA A 78 -24.975 2.361 -1.420 1.00 0.00 O ATOM 1180 CB ALA A 78 -24.704 3.558 1.743 1.00 0.00 C ATOM 0 H ALA A 78 -22.268 3.345 1.760 1.00 0.00 H new ATOM 0 HA ALA A 78 -24.328 1.651 0.879 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -25.777 3.501 1.561 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -24.489 3.217 2.756 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -24.371 4.590 1.629 1.00 0.00 H new ATOM 1186 N GLU A 79 -23.685 4.192 -1.110 1.00 0.00 N ATOM 1187 CA GLU A 79 -23.872 4.690 -2.461 1.00 0.00 C ATOM 1188 C GLU A 79 -23.319 3.689 -3.478 1.00 0.00 C ATOM 1189 O GLU A 79 -23.866 3.541 -4.569 1.00 0.00 O ATOM 1190 CB GLU A 79 -23.222 6.064 -2.635 1.00 0.00 C ATOM 1191 CG GLU A 79 -24.206 7.063 -3.246 1.00 0.00 C ATOM 1192 CD GLU A 79 -23.484 8.333 -3.705 1.00 0.00 C ATOM 1193 OE1 GLU A 79 -22.420 8.181 -4.342 1.00 0.00 O ATOM 1194 OE2 GLU A 79 -24.014 9.425 -3.407 1.00 0.00 O ATOM 0 H GLU A 79 -23.091 4.774 -0.520 1.00 0.00 H new ATOM 0 HA GLU A 79 -24.941 4.806 -2.639 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -22.878 6.432 -1.669 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -22.343 5.976 -3.274 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -24.717 6.604 -4.093 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -24.971 7.320 -2.513 1.00 0.00 H new ATOM 1201 N TRP A 80 -22.242 3.027 -3.082 1.00 0.00 N ATOM 1202 CA TRP A 80 -21.608 2.045 -3.945 1.00 0.00 C ATOM 1203 C TRP A 80 -22.627 0.940 -4.231 1.00 0.00 C ATOM 1204 O TRP A 80 -22.779 0.512 -5.375 1.00 0.00 O ATOM 1205 CB TRP A 80 -20.316 1.516 -3.317 1.00 0.00 C ATOM 1206 CG TRP A 80 -19.081 1.677 -4.207 1.00 0.00 C ATOM 1207 CD1 TRP A 80 -18.416 0.725 -4.875 1.00 0.00 C ATOM 1208 CD2 TRP A 80 -18.388 2.908 -4.502 1.00 0.00 C ATOM 1209 NE1 TRP A 80 -17.349 1.249 -5.574 1.00 0.00 N ATOM 1210 CE2 TRP A 80 -17.331 2.619 -5.340 1.00 0.00 C ATOM 1211 CE3 TRP A 80 -18.645 4.222 -4.073 1.00 0.00 C ATOM 1212 CZ2 TRP A 80 -16.447 3.591 -5.823 1.00 0.00 C ATOM 1213 CZ3 TRP A 80 -17.753 5.182 -4.564 1.00 0.00 C ATOM 1214 CH2 TRP A 80 -16.684 4.908 -5.409 1.00 0.00 C ATOM 0 H TRP A 80 -21.792 3.151 -2.175 1.00 0.00 H new ATOM 0 HA TRP A 80 -21.309 2.498 -4.890 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -20.143 2.036 -2.375 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -20.445 0.460 -3.080 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -18.682 -0.322 -4.867 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -16.694 0.727 -6.156 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -19.466 4.471 -3.417 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.627 3.339 -6.479 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -17.906 6.208 -4.265 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -16.039 5.707 -5.745 1.00 0.00 H new ATOM 1225 N ASP A 81 -23.302 0.512 -3.174 1.00 0.00 N ATOM 1226 CA ASP A 81 -24.303 -0.534 -3.299 1.00 0.00 C ATOM 1227 C ASP A 81 -25.424 -0.053 -4.223 1.00 0.00 C ATOM 1228 O ASP A 81 -25.857 -0.785 -5.111 1.00 0.00 O ATOM 1229 CB ASP A 81 -24.920 -0.869 -1.940 1.00 0.00 C ATOM 1230 CG ASP A 81 -25.721 -2.173 -1.897 1.00 0.00 C ATOM 1231 OD1 ASP A 81 -25.077 -3.228 -1.716 1.00 0.00 O ATOM 1232 OD2 ASP A 81 -26.959 -2.084 -2.045 1.00 0.00 O ATOM 0 H ASP A 81 -23.175 0.870 -2.228 1.00 0.00 H new ATOM 0 HA ASP A 81 -23.816 -1.422 -3.703 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -24.122 -0.926 -1.200 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -25.573 -0.049 -1.642 1.00 0.00 H new ATOM 1237 N ARG A 82 -25.862 1.174 -3.981 1.00 0.00 N ATOM 1238 CA ARG A 82 -26.923 1.760 -4.780 1.00 0.00 C ATOM 1239 C ARG A 82 -26.512 1.814 -6.253 1.00 0.00 C ATOM 1240 O ARG A 82 -27.312 1.510 -7.137 1.00 0.00 O ATOM 1241 CB ARG A 82 -27.258 3.173 -4.299 1.00 0.00 C ATOM 1242 CG ARG A 82 -28.450 3.747 -5.070 1.00 0.00 C ATOM 1243 CD ARG A 82 -28.877 5.098 -4.493 1.00 0.00 C ATOM 1244 NE ARG A 82 -29.436 5.952 -5.564 1.00 0.00 N ATOM 1245 CZ ARG A 82 -28.693 6.641 -6.441 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -27.356 6.582 -6.378 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -29.287 7.390 -7.380 1.00 0.00 N ATOM 0 H ARG A 82 -25.501 1.778 -3.243 1.00 0.00 H new ATOM 0 HA ARG A 82 -27.807 1.131 -4.669 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -27.485 3.154 -3.233 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -26.391 3.820 -4.429 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -28.186 3.864 -6.121 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -29.286 3.049 -5.027 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -29.620 4.950 -3.710 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -28.022 5.592 -4.032 1.00 0.00 H new ATOM 0 HE ARG A 82 -30.451 6.021 -5.640 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -26.904 6.013 -5.663 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -26.790 7.106 -7.045 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -30.305 7.436 -7.427 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -28.721 7.914 -8.047 1.00 0.00 H new ATOM 1545 N SER A 102 -19.098 -2.163 1.076 1.00 0.00 N ATOM 1546 CA SER A 102 -18.775 -2.777 2.352 1.00 0.00 C ATOM 1547 C SER A 102 -17.526 -3.651 2.211 1.00 0.00 C ATOM 1548 O SER A 102 -16.645 -3.625 3.069 1.00 0.00 O ATOM 1549 CB SER A 102 -19.948 -3.608 2.877 1.00 0.00 C ATOM 1550 OG SER A 102 -20.901 -2.808 3.571 1.00 0.00 O ATOM 0 HA SER A 102 -18.576 -1.984 3.072 1.00 0.00 H new ATOM 0 HB2 SER A 102 -20.437 -4.112 2.043 1.00 0.00 H new ATOM 0 HB3 SER A 102 -19.573 -4.384 3.544 1.00 0.00 H new ATOM 0 HG SER A 102 -21.635 -3.375 3.889 1.00 0.00 H new ATOM 1556 N ASP A 103 -17.490 -4.404 1.121 1.00 0.00 N ATOM 1557 CA ASP A 103 -16.365 -5.284 0.857 1.00 0.00 C ATOM 1558 C ASP A 103 -15.079 -4.457 0.799 1.00 0.00 C ATOM 1559 O ASP A 103 -14.079 -4.813 1.420 1.00 0.00 O ATOM 1560 CB ASP A 103 -16.529 -5.998 -0.486 1.00 0.00 C ATOM 1561 CG ASP A 103 -16.819 -5.080 -1.676 1.00 0.00 C ATOM 1562 OD1 ASP A 103 -17.826 -4.344 -1.591 1.00 0.00 O ATOM 1563 OD2 ASP A 103 -16.030 -5.136 -2.642 1.00 0.00 O ATOM 0 H ASP A 103 -18.222 -4.422 0.411 1.00 0.00 H new ATOM 0 HA ASP A 103 -16.320 -6.024 1.656 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -15.619 -6.561 -0.694 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -17.339 -6.722 -0.399 1.00 0.00 H new ATOM 1568 N ILE A 104 -15.148 -3.367 0.048 1.00 0.00 N ATOM 1569 CA ILE A 104 -14.000 -2.487 -0.098 1.00 0.00 C ATOM 1570 C ILE A 104 -13.668 -1.861 1.258 1.00 0.00 C ATOM 1571 O ILE A 104 -12.550 -1.393 1.472 1.00 0.00 O ATOM 1572 CB ILE A 104 -14.251 -1.461 -1.205 1.00 0.00 C ATOM 1573 CG1 ILE A 104 -14.679 -2.148 -2.503 1.00 0.00 C ATOM 1574 CG2 ILE A 104 -13.029 -0.563 -1.408 1.00 0.00 C ATOM 1575 CD1 ILE A 104 -15.370 -1.159 -3.444 1.00 0.00 C ATOM 0 H ILE A 104 -15.979 -3.074 -0.465 1.00 0.00 H new ATOM 0 HA ILE A 104 -13.122 -3.052 -0.412 1.00 0.00 H new ATOM 0 HB ILE A 104 -15.075 -0.818 -0.894 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -13.807 -2.577 -2.997 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -15.355 -2.973 -2.277 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -13.234 0.157 -2.200 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -12.810 -0.031 -0.482 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -12.171 -1.174 -1.687 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -15.664 -1.673 -4.359 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -16.255 -0.751 -2.956 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -14.683 -0.348 -3.688 1.00 0.00 H new ATOM 1587 N ALA A 105 -14.659 -1.871 2.137 1.00 0.00 N ATOM 1588 CA ALA A 105 -14.485 -1.309 3.467 1.00 0.00 C ATOM 1589 C ALA A 105 -13.581 -2.228 4.290 1.00 0.00 C ATOM 1590 O ALA A 105 -12.952 -1.788 5.251 1.00 0.00 O ATOM 1591 CB ALA A 105 -15.854 -1.103 4.117 1.00 0.00 C ATOM 0 H ALA A 105 -15.585 -2.259 1.955 1.00 0.00 H new ATOM 0 HA ALA A 105 -14.001 -0.334 3.411 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -15.724 -0.682 5.114 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -16.446 -0.419 3.509 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -16.369 -2.061 4.192 1.00 0.00 H new ATOM 1597 N GLY A 106 -13.545 -3.489 3.883 1.00 0.00 N ATOM 1598 CA GLY A 106 -12.728 -4.474 4.571 1.00 0.00 C ATOM 1599 C GLY A 106 -13.341 -4.845 5.923 1.00 0.00 C ATOM 1600 O GLY A 106 -12.641 -5.324 6.815 1.00 0.00 O ATOM 0 H GLY A 106 -14.068 -3.851 3.086 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -12.632 -5.367 3.954 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.723 -4.079 4.719 1.00 0.00 H new ATOM 1604 N THR A 107 -14.639 -4.610 6.034 1.00 0.00 N ATOM 1605 CA THR A 107 -15.354 -4.913 7.262 1.00 0.00 C ATOM 1606 C THR A 107 -15.879 -6.350 7.232 1.00 0.00 C ATOM 1607 O THR A 107 -15.906 -7.025 8.260 1.00 0.00 O ATOM 1608 CB THR A 107 -16.455 -3.867 7.440 1.00 0.00 C ATOM 1609 OG1 THR A 107 -15.767 -2.718 7.926 1.00 0.00 O ATOM 1610 CG2 THR A 107 -17.427 -4.224 8.566 1.00 0.00 C ATOM 0 H THR A 107 -15.216 -4.213 5.292 1.00 0.00 H new ATOM 0 HA THR A 107 -14.694 -4.859 8.127 1.00 0.00 H new ATOM 0 HB THR A 107 -17.007 -3.759 6.506 1.00 0.00 H new ATOM 0 HG1 THR A 107 -16.407 -1.989 8.068 1.00 0.00 H new ATOM 0 HG21 THR A 107 -18.188 -3.448 8.649 1.00 0.00 H new ATOM 0 HG22 THR A 107 -17.905 -5.179 8.345 1.00 0.00 H new ATOM 0 HG23 THR A 107 -16.882 -4.300 9.507 1.00 0.00 H new ATOM 1618 N THR A 108 -16.282 -6.774 6.044 1.00 0.00 N ATOM 1619 CA THR A 108 -16.806 -8.119 5.868 1.00 0.00 C ATOM 1620 C THR A 108 -15.799 -8.988 5.112 1.00 0.00 C ATOM 1621 O THR A 108 -15.853 -10.214 5.185 1.00 0.00 O ATOM 1622 CB THR A 108 -18.162 -8.010 5.168 1.00 0.00 C ATOM 1623 OG1 THR A 108 -19.058 -7.623 6.205 1.00 0.00 O ATOM 1624 CG2 THR A 108 -18.692 -9.368 4.704 1.00 0.00 C ATOM 0 H THR A 108 -16.257 -6.211 5.194 1.00 0.00 H new ATOM 0 HA THR A 108 -16.959 -8.614 6.827 1.00 0.00 H new ATOM 0 HB THR A 108 -18.075 -7.342 4.311 1.00 0.00 H new ATOM 0 HG1 THR A 108 -19.962 -7.528 5.838 1.00 0.00 H new ATOM 0 HG21 THR A 108 -19.656 -9.234 4.214 1.00 0.00 H new ATOM 0 HG22 THR A 108 -17.987 -9.813 4.002 1.00 0.00 H new ATOM 0 HG23 THR A 108 -18.811 -10.026 5.565 1.00 0.00 H new ATOM 1632 N SER A 109 -14.903 -8.317 4.401 1.00 0.00 N ATOM 1633 CA SER A 109 -13.886 -9.013 3.632 1.00 0.00 C ATOM 1634 C SER A 109 -12.499 -8.706 4.199 1.00 0.00 C ATOM 1635 O SER A 109 -12.316 -7.708 4.897 1.00 0.00 O ATOM 1636 CB SER A 109 -13.952 -8.624 2.154 1.00 0.00 C ATOM 1637 OG SER A 109 -13.544 -7.276 1.937 1.00 0.00 O ATOM 0 H SER A 109 -14.861 -7.300 4.342 1.00 0.00 H new ATOM 0 HA SER A 109 -14.074 -10.084 3.708 1.00 0.00 H new ATOM 0 HB2 SER A 109 -13.316 -9.293 1.575 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.970 -8.757 1.789 1.00 0.00 H new ATOM 0 HG SER A 109 -14.335 -6.712 1.804 1.00 0.00 H new ATOM 1643 N THR A 110 -11.556 -9.580 3.880 1.00 0.00 N ATOM 1644 CA THR A 110 -10.191 -9.415 4.351 1.00 0.00 C ATOM 1645 C THR A 110 -9.279 -8.988 3.199 1.00 0.00 C ATOM 1646 O THR A 110 -9.742 -8.783 2.079 1.00 0.00 O ATOM 1647 CB THR A 110 -9.759 -10.723 5.016 1.00 0.00 C ATOM 1648 OG1 THR A 110 -9.831 -11.686 3.968 1.00 0.00 O ATOM 1649 CG2 THR A 110 -10.775 -11.219 6.047 1.00 0.00 C ATOM 0 H THR A 110 -11.710 -10.405 3.301 1.00 0.00 H new ATOM 0 HA THR A 110 -10.121 -8.619 5.092 1.00 0.00 H new ATOM 0 HB THR A 110 -8.791 -10.582 5.498 1.00 0.00 H new ATOM 0 HG1 THR A 110 -10.742 -12.042 3.913 1.00 0.00 H new ATOM 0 HG21 THR A 110 -10.420 -12.150 6.489 1.00 0.00 H new ATOM 0 HG22 THR A 110 -10.896 -10.469 6.829 1.00 0.00 H new ATOM 0 HG23 THR A 110 -11.734 -11.392 5.559 1.00 0.00 H new ATOM 1657 N LEU A 111 -7.998 -8.868 3.516 1.00 0.00 N ATOM 1658 CA LEU A 111 -7.016 -8.469 2.522 1.00 0.00 C ATOM 1659 C LEU A 111 -7.070 -9.439 1.340 1.00 0.00 C ATOM 1660 O LEU A 111 -7.334 -9.032 0.209 1.00 0.00 O ATOM 1661 CB LEU A 111 -5.629 -8.350 3.156 1.00 0.00 C ATOM 1662 CG LEU A 111 -4.445 -8.352 2.186 1.00 0.00 C ATOM 1663 CD1 LEU A 111 -4.161 -6.942 1.666 1.00 0.00 C ATOM 1664 CD2 LEU A 111 -3.211 -8.986 2.830 1.00 0.00 C ATOM 0 H LEU A 111 -7.618 -9.040 4.447 1.00 0.00 H new ATOM 0 HA LEU A 111 -7.249 -7.478 2.133 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.595 -7.429 3.738 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -5.500 -9.174 3.857 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.709 -8.965 1.324 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.315 -6.971 0.979 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.040 -6.563 1.144 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -3.925 -6.286 2.504 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.384 -8.975 2.120 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -2.933 -8.420 3.719 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.435 -10.015 3.110 1.00 0.00 H new ATOM 1676 N GLN A 112 -6.817 -10.704 1.641 1.00 0.00 N ATOM 1677 CA GLN A 112 -6.834 -11.736 0.618 1.00 0.00 C ATOM 1678 C GLN A 112 -8.027 -11.535 -0.318 1.00 0.00 C ATOM 1679 O GLN A 112 -7.886 -11.628 -1.537 1.00 0.00 O ATOM 1680 CB GLN A 112 -6.858 -13.131 1.246 1.00 0.00 C ATOM 1681 CG GLN A 112 -5.481 -13.793 1.166 1.00 0.00 C ATOM 1682 CD GLN A 112 -5.053 -14.335 2.531 1.00 0.00 C ATOM 1683 OE1 GLN A 112 -5.582 -13.967 3.567 1.00 0.00 O ATOM 1684 NE2 GLN A 112 -4.067 -15.225 2.474 1.00 0.00 N ATOM 0 H GLN A 112 -6.599 -11.038 2.580 1.00 0.00 H new ATOM 0 HA GLN A 112 -5.919 -11.654 0.031 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -7.171 -13.059 2.288 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -7.594 -13.751 0.734 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -5.506 -14.605 0.440 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -4.746 -13.070 0.811 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -3.669 -15.488 1.572 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -3.708 -15.644 3.332 1.00 0.00 H new ATOM 1693 N GLU A 113 -9.174 -11.263 0.286 1.00 0.00 N ATOM 1694 CA GLU A 113 -10.391 -11.048 -0.478 1.00 0.00 C ATOM 1695 C GLU A 113 -10.227 -9.845 -1.409 1.00 0.00 C ATOM 1696 O GLU A 113 -10.619 -9.899 -2.574 1.00 0.00 O ATOM 1697 CB GLU A 113 -11.595 -10.866 0.447 1.00 0.00 C ATOM 1698 CG GLU A 113 -12.339 -12.188 0.646 1.00 0.00 C ATOM 1699 CD GLU A 113 -11.580 -13.106 1.606 1.00 0.00 C ATOM 1700 OE1 GLU A 113 -10.521 -13.619 1.181 1.00 0.00 O ATOM 1701 OE2 GLU A 113 -12.073 -13.273 2.742 1.00 0.00 O ATOM 0 H GLU A 113 -9.286 -11.186 1.297 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.575 -11.932 -1.088 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -11.262 -10.483 1.412 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -12.273 -10.123 0.026 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -13.337 -11.992 1.038 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -12.466 -12.686 -0.315 1.00 0.00 H new ATOM 1708 N GLN A 114 -9.647 -8.787 -0.861 1.00 0.00 N ATOM 1709 CA GLN A 114 -9.427 -7.573 -1.628 1.00 0.00 C ATOM 1710 C GLN A 114 -8.438 -7.835 -2.765 1.00 0.00 C ATOM 1711 O GLN A 114 -8.586 -7.294 -3.859 1.00 0.00 O ATOM 1712 CB GLN A 114 -8.939 -6.437 -0.727 1.00 0.00 C ATOM 1713 CG GLN A 114 -9.839 -6.284 0.501 1.00 0.00 C ATOM 1714 CD GLN A 114 -10.817 -5.120 0.322 1.00 0.00 C ATOM 1715 OE1 GLN A 114 -11.936 -5.280 -0.138 1.00 0.00 O ATOM 1716 NE2 GLN A 114 -10.333 -3.944 0.711 1.00 0.00 N ATOM 0 H GLN A 114 -9.323 -8.746 0.105 1.00 0.00 H new ATOM 0 HA GLN A 114 -10.377 -7.264 -2.064 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -7.915 -6.635 -0.409 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -8.924 -5.503 -1.289 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -10.394 -7.207 0.667 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -9.226 -6.116 1.387 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -9.387 -3.881 1.087 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -10.908 -3.105 0.633 1.00 0.00 H new ATOM 1725 N ILE A 115 -7.449 -8.665 -2.466 1.00 0.00 N ATOM 1726 CA ILE A 115 -6.435 -9.005 -3.449 1.00 0.00 C ATOM 1727 C ILE A 115 -7.101 -9.686 -4.647 1.00 0.00 C ATOM 1728 O ILE A 115 -6.798 -9.365 -5.796 1.00 0.00 O ATOM 1729 CB ILE A 115 -5.325 -9.840 -2.807 1.00 0.00 C ATOM 1730 CG1 ILE A 115 -4.720 -9.114 -1.604 1.00 0.00 C ATOM 1731 CG2 ILE A 115 -4.262 -10.224 -3.838 1.00 0.00 C ATOM 1732 CD1 ILE A 115 -3.874 -7.920 -2.051 1.00 0.00 C ATOM 0 H ILE A 115 -7.329 -9.112 -1.557 1.00 0.00 H new ATOM 0 HA ILE A 115 -5.949 -8.104 -3.823 1.00 0.00 H new ATOM 0 HB ILE A 115 -5.764 -10.766 -2.437 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -5.517 -8.772 -0.943 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -4.104 -9.806 -1.030 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -3.485 -10.817 -3.356 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -4.722 -10.808 -4.635 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -3.820 -9.321 -4.259 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -3.456 -7.422 -1.176 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -3.064 -8.268 -2.692 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -4.498 -7.218 -2.604 1.00 0.00 H new ATOM 1744 N GLY A 116 -7.996 -10.613 -4.338 1.00 0.00 N ATOM 1745 CA GLY A 116 -8.707 -11.341 -5.375 1.00 0.00 C ATOM 1746 C GLY A 116 -9.555 -10.395 -6.227 1.00 0.00 C ATOM 1747 O GLY A 116 -9.518 -10.455 -7.455 1.00 0.00 O ATOM 0 H GLY A 116 -8.245 -10.876 -3.385 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.993 -11.866 -6.010 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.346 -12.098 -4.920 1.00 0.00 H new ATOM 1751 N TRP A 117 -10.302 -9.542 -5.540 1.00 0.00 N ATOM 1752 CA TRP A 117 -11.159 -8.583 -6.219 1.00 0.00 C ATOM 1753 C TRP A 117 -10.270 -7.675 -7.072 1.00 0.00 C ATOM 1754 O TRP A 117 -10.640 -7.309 -8.185 1.00 0.00 O ATOM 1755 CB TRP A 117 -12.016 -7.809 -5.216 1.00 0.00 C ATOM 1756 CG TRP A 117 -13.273 -8.556 -4.763 1.00 0.00 C ATOM 1757 CD1 TRP A 117 -14.132 -9.257 -5.516 1.00 0.00 C ATOM 1758 CD2 TRP A 117 -13.777 -8.651 -3.415 1.00 0.00 C ATOM 1759 NE1 TRP A 117 -15.151 -9.793 -4.754 1.00 0.00 N ATOM 1760 CE2 TRP A 117 -14.928 -9.413 -3.436 1.00 0.00 C ATOM 1761 CE3 TRP A 117 -13.279 -8.110 -2.216 1.00 0.00 C ATOM 1762 CZ2 TRP A 117 -15.677 -9.704 -2.289 1.00 0.00 C ATOM 1763 CZ3 TRP A 117 -14.039 -8.409 -1.079 1.00 0.00 C ATOM 1764 CH2 TRP A 117 -15.198 -9.174 -1.084 1.00 0.00 C ATOM 0 H TRP A 117 -10.332 -9.495 -4.522 1.00 0.00 H new ATOM 0 HA TRP A 117 -11.866 -9.093 -6.874 1.00 0.00 H new ATOM 0 HB2 TRP A 117 -11.410 -7.575 -4.341 1.00 0.00 H new ATOM 0 HB3 TRP A 117 -12.311 -6.860 -5.663 1.00 0.00 H new ATOM 0 HD1 TRP A 117 -14.039 -9.386 -6.584 1.00 0.00 H new ATOM 0 HE1 TRP A 117 -15.925 -10.363 -5.096 1.00 0.00 H new ATOM 0 HE3 TRP A 117 -12.381 -7.511 -2.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -16.574 -10.304 -2.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 -13.700 -8.017 -0.131 1.00 0.00 H new ATOM 0 HH2 TRP A 117 -15.728 -9.360 -0.162 1.00 0.00 H new ATOM 1775 N MET A 118 -9.116 -7.339 -6.515 1.00 0.00 N ATOM 1776 CA MET A 118 -8.172 -6.481 -7.211 1.00 0.00 C ATOM 1777 C MET A 118 -7.577 -7.193 -8.428 1.00 0.00 C ATOM 1778 O MET A 118 -7.384 -6.581 -9.477 1.00 0.00 O ATOM 1779 CB MET A 118 -7.047 -6.079 -6.255 1.00 0.00 C ATOM 1780 CG MET A 118 -7.101 -4.581 -5.944 1.00 0.00 C ATOM 1781 SD MET A 118 -5.601 -3.788 -6.499 1.00 0.00 S ATOM 1782 CE MET A 118 -5.690 -2.270 -5.563 1.00 0.00 C ATOM 0 H MET A 118 -8.813 -7.645 -5.590 1.00 0.00 H new ATOM 0 HA MET A 118 -8.703 -5.594 -7.556 1.00 0.00 H new ATOM 0 HB2 MET A 118 -7.130 -6.649 -5.330 1.00 0.00 H new ATOM 0 HB3 MET A 118 -6.082 -6.328 -6.698 1.00 0.00 H new ATOM 0 HG2 MET A 118 -7.964 -4.130 -6.435 1.00 0.00 H new ATOM 0 HG3 MET A 118 -7.228 -4.428 -4.872 1.00 0.00 H new ATOM 0 HE1 MET A 118 -4.746 -1.732 -5.651 1.00 0.00 H new ATOM 0 HE2 MET A 118 -6.498 -1.650 -5.951 1.00 0.00 H new ATOM 0 HE3 MET A 118 -5.880 -2.500 -4.515 1.00 0.00 H new ATOM 1792 N THR A 119 -7.303 -8.477 -8.246 1.00 0.00 N ATOM 1793 CA THR A 119 -6.734 -9.280 -9.316 1.00 0.00 C ATOM 1794 C THR A 119 -7.841 -10.003 -10.085 1.00 0.00 C ATOM 1795 O THR A 119 -7.587 -11.013 -10.742 1.00 0.00 O ATOM 1796 CB THR A 119 -5.703 -10.226 -8.700 1.00 0.00 C ATOM 1797 OG1 THR A 119 -4.829 -9.365 -7.975 1.00 0.00 O ATOM 1798 CG2 THR A 119 -4.799 -10.873 -9.752 1.00 0.00 C ATOM 0 H THR A 119 -7.464 -8.981 -7.374 1.00 0.00 H new ATOM 0 HA THR A 119 -6.225 -8.657 -10.051 1.00 0.00 H new ATOM 0 HB THR A 119 -6.217 -11.003 -8.135 1.00 0.00 H new ATOM 0 HG1 THR A 119 -5.207 -9.186 -7.089 1.00 0.00 H new ATOM 0 HG21 THR A 119 -4.086 -11.535 -9.261 1.00 0.00 H new ATOM 0 HG22 THR A 119 -5.407 -11.448 -10.450 1.00 0.00 H new ATOM 0 HG23 THR A 119 -4.260 -10.097 -10.295 1.00 0.00 H new ATOM 1806 N HIS A 120 -9.044 -9.460 -9.979 1.00 0.00 N ATOM 1807 CA HIS A 120 -10.190 -10.042 -10.657 1.00 0.00 C ATOM 1808 C HIS A 120 -10.364 -9.385 -12.028 1.00 0.00 C ATOM 1809 O HIS A 120 -9.749 -8.359 -12.311 1.00 0.00 O ATOM 1810 CB HIS A 120 -11.445 -9.941 -9.788 1.00 0.00 C ATOM 1811 CG HIS A 120 -12.326 -11.166 -9.834 1.00 0.00 C ATOM 1812 ND1 HIS A 120 -13.349 -11.320 -10.752 1.00 0.00 N ATOM 1813 CD2 HIS A 120 -12.324 -12.294 -9.066 1.00 0.00 C ATOM 1814 CE1 HIS A 120 -13.931 -12.492 -10.538 1.00 0.00 C ATOM 1815 NE2 HIS A 120 -13.295 -13.093 -9.492 1.00 0.00 N ATOM 0 H HIS A 120 -9.251 -8.623 -9.434 1.00 0.00 H new ATOM 0 HA HIS A 120 -10.017 -11.106 -10.822 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -11.146 -9.760 -8.756 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -12.026 -9.076 -10.107 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -11.647 -12.502 -8.250 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -14.762 -12.899 -11.094 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -13.527 -14.006 -9.101 1.00 0.00 H new ATOM 1824 N ASN A 121 -11.205 -10.005 -12.844 1.00 0.00 N ATOM 1825 CA ASN A 121 -11.469 -9.493 -14.177 1.00 0.00 C ATOM 1826 C ASN A 121 -12.954 -9.157 -14.306 1.00 0.00 C ATOM 1827 O ASN A 121 -13.796 -10.053 -14.348 1.00 0.00 O ATOM 1828 CB ASN A 121 -11.124 -10.535 -15.245 1.00 0.00 C ATOM 1829 CG ASN A 121 -9.641 -10.469 -15.616 1.00 0.00 C ATOM 1830 OD1 ASN A 121 -8.768 -10.870 -14.864 1.00 0.00 O ATOM 1831 ND2 ASN A 121 -9.407 -9.945 -16.816 1.00 0.00 N ATOM 0 H ASN A 121 -11.712 -10.858 -12.607 1.00 0.00 H new ATOM 0 HA ASN A 121 -10.853 -8.606 -14.326 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -11.367 -11.532 -14.877 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -11.733 -10.366 -16.133 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -8.450 -9.859 -17.157 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -10.185 -9.629 -17.395 1.00 0.00 H new ATOM 1838 N PRO A 122 -13.241 -7.828 -14.368 1.00 0.00 N ATOM 1839 CA PRO A 122 -12.184 -6.832 -14.312 1.00 0.00 C ATOM 1840 C PRO A 122 -11.644 -6.686 -12.888 1.00 0.00 C ATOM 1841 O PRO A 122 -12.262 -7.156 -11.935 1.00 0.00 O ATOM 1842 CB PRO A 122 -12.819 -5.557 -14.841 1.00 0.00 C ATOM 1843 CG PRO A 122 -14.321 -5.763 -14.736 1.00 0.00 C ATOM 1844 CD PRO A 122 -14.572 -7.242 -14.492 1.00 0.00 C ATOM 0 HA PRO A 122 -11.314 -7.106 -14.909 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -12.502 -4.692 -14.258 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.522 -5.372 -15.873 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -14.732 -5.166 -13.922 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -14.816 -5.438 -15.651 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -15.160 -7.400 -13.588 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -15.127 -7.691 -15.316 1.00 0.00 H new ATOM 1852 N PRO A 123 -10.465 -6.014 -12.786 1.00 0.00 N ATOM 1853 CA PRO A 123 -9.835 -5.800 -11.495 1.00 0.00 C ATOM 1854 C PRO A 123 -10.564 -4.712 -10.704 1.00 0.00 C ATOM 1855 O PRO A 123 -10.625 -3.561 -11.135 1.00 0.00 O ATOM 1856 CB PRO A 123 -8.394 -5.437 -11.816 1.00 0.00 C ATOM 1857 CG PRO A 123 -8.387 -5.009 -13.275 1.00 0.00 C ATOM 1858 CD PRO A 123 -9.705 -5.444 -13.895 1.00 0.00 C ATOM 0 HA PRO A 123 -9.876 -6.681 -10.855 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -8.041 -4.632 -11.171 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -7.732 -6.288 -11.655 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -8.266 -3.929 -13.355 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -7.549 -5.464 -13.802 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -10.230 -4.600 -14.343 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -9.548 -6.177 -14.686 1.00 0.00 H new ATOM 1866 N ILE A 124 -11.096 -5.114 -9.559 1.00 0.00 N ATOM 1867 CA ILE A 124 -11.818 -4.187 -8.703 1.00 0.00 C ATOM 1868 C ILE A 124 -10.822 -3.237 -8.033 1.00 0.00 C ATOM 1869 O ILE A 124 -9.903 -3.681 -7.345 1.00 0.00 O ATOM 1870 CB ILE A 124 -12.701 -4.949 -7.714 1.00 0.00 C ATOM 1871 CG1 ILE A 124 -13.851 -5.653 -8.437 1.00 0.00 C ATOM 1872 CG2 ILE A 124 -13.204 -4.024 -6.604 1.00 0.00 C ATOM 1873 CD1 ILE A 124 -13.859 -7.152 -8.124 1.00 0.00 C ATOM 0 H ILE A 124 -11.042 -6.069 -9.204 1.00 0.00 H new ATOM 0 HA ILE A 124 -12.497 -3.573 -9.294 1.00 0.00 H new ATOM 0 HB ILE A 124 -12.096 -5.722 -7.240 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -14.800 -5.210 -8.136 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -13.756 -5.503 -9.512 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -13.830 -4.590 -5.914 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.354 -3.607 -6.064 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -13.788 -3.214 -7.042 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -14.686 -7.629 -8.650 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -12.918 -7.596 -8.448 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -13.979 -7.299 -7.051 1.00 0.00 H new ATOM 1885 N PRO A 125 -11.044 -1.916 -8.264 1.00 0.00 N ATOM 1886 CA PRO A 125 -10.177 -0.900 -7.690 1.00 0.00 C ATOM 1887 C PRO A 125 -10.455 -0.722 -6.196 1.00 0.00 C ATOM 1888 O PRO A 125 -10.611 0.401 -5.720 1.00 0.00 O ATOM 1889 CB PRO A 125 -10.454 0.357 -8.499 1.00 0.00 C ATOM 1890 CG PRO A 125 -11.791 0.124 -9.185 1.00 0.00 C ATOM 1891 CD PRO A 125 -12.122 -1.356 -9.073 1.00 0.00 C ATOM 0 HA PRO A 125 -9.122 -1.168 -7.744 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -10.493 1.235 -7.855 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -9.665 0.533 -9.230 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -12.570 0.726 -8.717 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -11.741 0.426 -10.231 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.092 -1.510 -8.601 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.166 -1.827 -10.055 1.00 0.00 H new ATOM 1899 N VAL A 126 -10.508 -1.847 -5.498 1.00 0.00 N ATOM 1900 CA VAL A 126 -10.764 -1.830 -4.069 1.00 0.00 C ATOM 1901 C VAL A 126 -9.787 -0.868 -3.391 1.00 0.00 C ATOM 1902 O VAL A 126 -10.120 -0.243 -2.385 1.00 0.00 O ATOM 1903 CB VAL A 126 -10.691 -3.250 -3.505 1.00 0.00 C ATOM 1904 CG1 VAL A 126 -9.428 -3.968 -3.989 1.00 0.00 C ATOM 1905 CG2 VAL A 126 -10.765 -3.240 -1.978 1.00 0.00 C ATOM 0 H VAL A 126 -10.378 -2.777 -5.897 1.00 0.00 H new ATOM 0 HA VAL A 126 -11.772 -1.467 -3.868 1.00 0.00 H new ATOM 0 HB VAL A 126 -11.554 -3.802 -3.877 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -9.400 -4.975 -3.574 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -9.436 -4.024 -5.078 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -8.547 -3.416 -3.661 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -10.711 -4.263 -1.604 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -9.932 -2.663 -1.577 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -11.705 -2.788 -1.662 1.00 0.00 H new ATOM 1915 N GLY A 127 -8.597 -0.778 -3.970 1.00 0.00 N ATOM 1916 CA GLY A 127 -7.568 0.097 -3.434 1.00 0.00 C ATOM 1917 C GLY A 127 -7.922 1.567 -3.671 1.00 0.00 C ATOM 1918 O GLY A 127 -8.267 2.285 -2.734 1.00 0.00 O ATOM 0 H GLY A 127 -8.323 -1.297 -4.805 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.451 -0.085 -2.366 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -6.611 -0.131 -3.903 1.00 0.00 H new ATOM 1922 N GLU A 128 -7.825 1.971 -4.929 1.00 0.00 N ATOM 1923 CA GLU A 128 -8.129 3.342 -5.300 1.00 0.00 C ATOM 1924 C GLU A 128 -9.449 3.784 -4.664 1.00 0.00 C ATOM 1925 O GLU A 128 -9.595 4.940 -4.271 1.00 0.00 O ATOM 1926 CB GLU A 128 -8.175 3.500 -6.822 1.00 0.00 C ATOM 1927 CG GLU A 128 -7.669 4.881 -7.245 1.00 0.00 C ATOM 1928 CD GLU A 128 -7.810 5.077 -8.756 1.00 0.00 C ATOM 1929 OE1 GLU A 128 -7.053 4.404 -9.487 1.00 0.00 O ATOM 1930 OE2 GLU A 128 -8.670 5.897 -9.144 1.00 0.00 O ATOM 0 H GLU A 128 -7.540 1.373 -5.704 1.00 0.00 H new ATOM 0 HA GLU A 128 -7.333 3.985 -4.924 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.566 2.726 -7.290 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -9.196 3.359 -7.175 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -8.230 5.654 -6.720 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -6.624 4.994 -6.956 1.00 0.00 H new ATOM 1937 N ILE A 129 -10.374 2.840 -4.581 1.00 0.00 N ATOM 1938 CA ILE A 129 -11.676 3.117 -3.998 1.00 0.00 C ATOM 1939 C ILE A 129 -11.500 3.506 -2.529 1.00 0.00 C ATOM 1940 O ILE A 129 -11.888 4.600 -2.122 1.00 0.00 O ATOM 1941 CB ILE A 129 -12.622 1.934 -4.212 1.00 0.00 C ATOM 1942 CG1 ILE A 129 -12.894 1.710 -5.701 1.00 0.00 C ATOM 1943 CG2 ILE A 129 -13.914 2.114 -3.413 1.00 0.00 C ATOM 1944 CD1 ILE A 129 -13.175 0.236 -5.992 1.00 0.00 C ATOM 0 H ILE A 129 -10.248 1.882 -4.908 1.00 0.00 H new ATOM 0 HA ILE A 129 -12.145 3.964 -4.498 1.00 0.00 H new ATOM 0 HB ILE A 129 -12.134 1.035 -3.836 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -13.745 2.315 -6.014 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -12.036 2.042 -6.285 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -14.569 1.259 -3.583 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -13.678 2.185 -2.351 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -14.417 3.026 -3.735 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -13.365 0.105 -7.057 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -12.312 -0.363 -5.701 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -14.049 -0.087 -5.425 1.00 0.00 H new ATOM 1956 N TYR A 130 -10.914 2.589 -1.773 1.00 0.00 N ATOM 1957 CA TYR A 130 -10.682 2.823 -0.358 1.00 0.00 C ATOM 1958 C TYR A 130 -9.898 4.118 -0.137 1.00 0.00 C ATOM 1959 O TYR A 130 -10.173 4.862 0.803 1.00 0.00 O ATOM 1960 CB TYR A 130 -9.841 1.642 0.132 1.00 0.00 C ATOM 1961 CG TYR A 130 -10.051 1.299 1.608 1.00 0.00 C ATOM 1962 CD1 TYR A 130 -11.328 1.240 2.128 1.00 0.00 C ATOM 1963 CD2 TYR A 130 -8.963 1.048 2.420 1.00 0.00 C ATOM 1964 CE1 TYR A 130 -11.525 0.918 3.518 1.00 0.00 C ATOM 1965 CE2 TYR A 130 -9.159 0.725 3.808 1.00 0.00 C ATOM 1966 CZ TYR A 130 -10.432 0.675 4.290 1.00 0.00 C ATOM 1967 OH TYR A 130 -10.618 0.371 5.601 1.00 0.00 O ATOM 0 H TYR A 130 -10.593 1.683 -2.114 1.00 0.00 H new ATOM 0 HA TYR A 130 -11.628 2.913 0.176 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -10.078 0.766 -0.471 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -8.787 1.867 -0.032 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -12.179 1.435 1.493 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -7.964 1.094 2.013 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -12.519 0.871 3.938 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -8.316 0.527 4.453 1.00 0.00 H new ATOM 0 HH TYR A 130 -11.337 -0.289 5.685 1.00 0.00 H new ATOM 1977 N LYS A 131 -8.937 4.348 -1.021 1.00 0.00 N ATOM 1978 CA LYS A 131 -8.112 5.540 -0.934 1.00 0.00 C ATOM 1979 C LYS A 131 -9.006 6.780 -0.996 1.00 0.00 C ATOM 1980 O LYS A 131 -8.859 7.696 -0.188 1.00 0.00 O ATOM 1981 CB LYS A 131 -7.020 5.515 -2.006 1.00 0.00 C ATOM 1982 CG LYS A 131 -6.233 6.828 -2.019 1.00 0.00 C ATOM 1983 CD LYS A 131 -6.985 7.910 -2.796 1.00 0.00 C ATOM 1984 CE LYS A 131 -6.251 8.264 -4.091 1.00 0.00 C ATOM 1985 NZ LYS A 131 -7.166 8.944 -5.036 1.00 0.00 N ATOM 0 H LYS A 131 -8.712 3.729 -1.800 1.00 0.00 H new ATOM 0 HA LYS A 131 -7.588 5.572 0.021 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.342 4.682 -1.820 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -7.470 5.347 -2.984 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -6.061 7.163 -0.996 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -5.254 6.665 -2.470 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -7.992 7.563 -3.028 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -7.089 8.801 -2.177 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -5.401 8.910 -3.870 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -5.852 7.359 -4.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -6.652 9.177 -5.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.963 8.315 -5.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -7.526 9.818 -4.602 1.00 0.00 H new ATOM 1999 N ARG A 132 -9.912 6.770 -1.962 1.00 0.00 N ATOM 2000 CA ARG A 132 -10.830 7.882 -2.139 1.00 0.00 C ATOM 2001 C ARG A 132 -11.817 7.947 -0.973 1.00 0.00 C ATOM 2002 O ARG A 132 -12.246 9.030 -0.578 1.00 0.00 O ATOM 2003 CB ARG A 132 -11.608 7.750 -3.451 1.00 0.00 C ATOM 2004 CG ARG A 132 -11.767 9.110 -4.133 1.00 0.00 C ATOM 2005 CD ARG A 132 -11.896 8.951 -5.649 1.00 0.00 C ATOM 2006 NE ARG A 132 -12.507 10.165 -6.236 1.00 0.00 N ATOM 2007 CZ ARG A 132 -13.826 10.405 -6.261 1.00 0.00 C ATOM 2008 NH1 ARG A 132 -14.678 9.518 -5.733 1.00 0.00 N ATOM 2009 NH2 ARG A 132 -14.289 11.535 -6.813 1.00 0.00 N ATOM 0 H ARG A 132 -10.030 6.009 -2.631 1.00 0.00 H new ATOM 0 HA ARG A 132 -10.240 8.798 -2.170 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -11.088 7.063 -4.119 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -12.590 7.321 -3.254 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -12.649 9.617 -3.741 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -10.908 9.740 -3.902 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -10.914 8.779 -6.090 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -12.507 8.078 -5.881 1.00 0.00 H new ATOM 0 HE ARG A 132 -11.886 10.862 -6.647 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -14.324 8.659 -5.311 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -15.681 9.701 -5.752 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -13.638 12.211 -7.213 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -15.292 11.719 -6.833 1.00 0.00 H new ATOM 2023 N TRP A 133 -12.149 6.774 -0.455 1.00 0.00 N ATOM 2024 CA TRP A 133 -13.078 6.684 0.658 1.00 0.00 C ATOM 2025 C TRP A 133 -12.459 7.415 1.852 1.00 0.00 C ATOM 2026 O TRP A 133 -12.940 8.474 2.253 1.00 0.00 O ATOM 2027 CB TRP A 133 -13.426 5.226 0.966 1.00 0.00 C ATOM 2028 CG TRP A 133 -14.535 4.651 0.083 1.00 0.00 C ATOM 2029 CD1 TRP A 133 -14.903 5.048 -1.142 1.00 0.00 C ATOM 2030 CD2 TRP A 133 -15.411 3.551 0.410 1.00 0.00 C ATOM 2031 NE1 TRP A 133 -15.948 4.288 -1.627 1.00 0.00 N ATOM 2032 CE2 TRP A 133 -16.266 3.348 -0.654 1.00 0.00 C ATOM 2033 CE3 TRP A 133 -15.478 2.753 1.565 1.00 0.00 C ATOM 2034 CZ2 TRP A 133 -17.251 2.353 -0.667 1.00 0.00 C ATOM 2035 CZ3 TRP A 133 -16.467 1.763 1.536 1.00 0.00 C ATOM 2036 CH2 TRP A 133 -17.336 1.546 0.474 1.00 0.00 C ATOM 0 H TRP A 133 -11.791 5.878 -0.786 1.00 0.00 H new ATOM 0 HA TRP A 133 -14.025 7.163 0.409 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -12.530 4.617 0.849 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -13.730 5.148 2.010 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -14.440 5.861 -1.682 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -16.403 4.396 -2.533 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -14.818 2.893 2.409 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -17.910 2.215 -1.512 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -16.561 1.122 2.400 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -18.073 0.759 0.528 1.00 0.00 H new ATOM 2047 N ILE A 134 -11.401 6.822 2.385 1.00 0.00 N ATOM 2048 CA ILE A 134 -10.711 7.404 3.523 1.00 0.00 C ATOM 2049 C ILE A 134 -10.532 8.906 3.293 1.00 0.00 C ATOM 2050 O ILE A 134 -10.843 9.713 4.166 1.00 0.00 O ATOM 2051 CB ILE A 134 -9.401 6.662 3.792 1.00 0.00 C ATOM 2052 CG1 ILE A 134 -9.659 5.327 4.493 1.00 0.00 C ATOM 2053 CG2 ILE A 134 -8.423 7.541 4.575 1.00 0.00 C ATOM 2054 CD1 ILE A 134 -8.375 4.503 4.596 1.00 0.00 C ATOM 0 H ILE A 134 -11.005 5.944 2.049 1.00 0.00 H new ATOM 0 HA ILE A 134 -11.307 7.289 4.429 1.00 0.00 H new ATOM 0 HB ILE A 134 -8.935 6.436 2.833 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -10.060 5.508 5.490 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -10.413 4.764 3.943 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -7.500 6.989 4.753 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.203 8.441 4.001 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -8.869 7.820 5.530 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.588 3.559 5.098 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -7.990 4.303 3.596 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -7.631 5.058 5.167 1.00 0.00 H new ATOM 2066 N ILE A 135 -10.031 9.234 2.110 1.00 0.00 N ATOM 2067 CA ILE A 135 -9.807 10.625 1.754 1.00 0.00 C ATOM 2068 C ILE A 135 -11.127 11.392 1.853 1.00 0.00 C ATOM 2069 O ILE A 135 -11.144 12.557 2.248 1.00 0.00 O ATOM 2070 CB ILE A 135 -9.139 10.725 0.380 1.00 0.00 C ATOM 2071 CG1 ILE A 135 -7.616 10.773 0.514 1.00 0.00 C ATOM 2072 CG2 ILE A 135 -9.684 11.917 -0.408 1.00 0.00 C ATOM 2073 CD1 ILE A 135 -7.066 9.436 1.017 1.00 0.00 C ATOM 0 H ILE A 135 -9.774 8.561 1.387 1.00 0.00 H new ATOM 0 HA ILE A 135 -9.114 11.091 2.455 1.00 0.00 H new ATOM 0 HB ILE A 135 -9.384 9.826 -0.186 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -7.170 11.014 -0.451 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -7.333 11.569 1.203 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -9.193 11.966 -1.380 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -10.758 11.799 -0.549 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -9.489 12.837 0.143 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -5.981 9.498 1.103 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -7.495 9.210 1.993 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -7.330 8.646 0.313 1.00 0.00 H new ATOM 2085 N LEU A 136 -12.201 10.708 1.487 1.00 0.00 N ATOM 2086 CA LEU A 136 -13.523 11.310 1.530 1.00 0.00 C ATOM 2087 C LEU A 136 -13.826 11.761 2.960 1.00 0.00 C ATOM 2088 O LEU A 136 -14.288 12.880 3.177 1.00 0.00 O ATOM 2089 CB LEU A 136 -14.567 10.353 0.952 1.00 0.00 C ATOM 2090 CG LEU A 136 -15.463 10.924 -0.148 1.00 0.00 C ATOM 2091 CD1 LEU A 136 -15.774 9.864 -1.207 1.00 0.00 C ATOM 2092 CD2 LEU A 136 -16.737 11.533 0.443 1.00 0.00 C ATOM 0 H LEU A 136 -12.183 9.742 1.159 1.00 0.00 H new ATOM 0 HA LEU A 136 -13.558 12.199 0.901 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -14.050 9.479 0.555 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -15.202 10.005 1.766 1.00 0.00 H new ATOM 0 HG LEU A 136 -14.922 11.729 -0.646 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -16.413 10.296 -1.978 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -14.845 9.517 -1.658 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -16.287 9.023 -0.740 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -17.356 11.932 -0.360 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -17.292 10.765 0.981 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -16.471 12.337 1.129 1.00 0.00 H new ATOM 2104 N GLY A 137 -13.555 10.866 3.899 1.00 0.00 N ATOM 2105 CA GLY A 137 -13.793 11.158 5.302 1.00 0.00 C ATOM 2106 C GLY A 137 -12.951 12.348 5.766 1.00 0.00 C ATOM 2107 O GLY A 137 -13.470 13.281 6.377 1.00 0.00 O ATOM 0 H GLY A 137 -13.173 9.938 3.715 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -14.850 11.373 5.458 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -13.554 10.282 5.905 1.00 0.00 H new ATOM 2111 N LEU A 138 -11.665 12.276 5.459 1.00 0.00 N ATOM 2112 CA LEU A 138 -10.744 13.336 5.836 1.00 0.00 C ATOM 2113 C LEU A 138 -11.320 14.684 5.399 1.00 0.00 C ATOM 2114 O LEU A 138 -11.336 15.637 6.176 1.00 0.00 O ATOM 2115 CB LEU A 138 -9.346 13.054 5.282 1.00 0.00 C ATOM 2116 CG LEU A 138 -8.562 11.938 5.974 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -7.452 11.404 5.066 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -8.021 12.406 7.327 1.00 0.00 C ATOM 0 H LEU A 138 -11.238 11.500 4.953 1.00 0.00 H new ATOM 0 HA LEU A 138 -10.629 13.374 6.919 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -9.440 12.804 4.225 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -8.761 13.972 5.341 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.244 11.111 6.169 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.910 10.612 5.582 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.890 11.007 4.150 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.764 12.212 4.818 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.468 11.594 7.798 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.358 13.259 7.179 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -8.851 12.700 7.969 1.00 0.00 H new ATOM 2130 N ASN A 139 -11.777 14.722 4.156 1.00 0.00 N ATOM 2131 CA ASN A 139 -12.352 15.938 3.606 1.00 0.00 C ATOM 2132 C ASN A 139 -13.560 16.352 4.448 1.00 0.00 C ATOM 2133 O ASN A 139 -13.705 17.520 4.800 1.00 0.00 O ATOM 2134 CB ASN A 139 -12.828 15.720 2.169 1.00 0.00 C ATOM 2135 CG ASN A 139 -11.928 16.458 1.175 1.00 0.00 C ATOM 2136 OD1 ASN A 139 -11.620 17.628 1.328 1.00 0.00 O ATOM 2137 ND2 ASN A 139 -11.527 15.711 0.151 1.00 0.00 N ATOM 0 H ASN A 139 -11.761 13.930 3.514 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.583 16.711 3.618 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -12.831 14.654 1.941 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -13.855 16.071 2.065 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -10.924 16.112 -0.567 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -11.822 14.737 0.084 1.00 0.00 H new ATOM 2144 N LYS A 140 -14.398 15.369 4.745 1.00 0.00 N ATOM 2145 CA LYS A 140 -15.590 15.616 5.539 1.00 0.00 C ATOM 2146 C LYS A 140 -15.182 16.179 6.901 1.00 0.00 C ATOM 2147 O LYS A 140 -15.870 17.035 7.455 1.00 0.00 O ATOM 2148 CB LYS A 140 -16.447 14.351 5.626 1.00 0.00 C ATOM 2149 CG LYS A 140 -17.868 14.616 5.123 1.00 0.00 C ATOM 2150 CD LYS A 140 -18.902 13.918 6.009 1.00 0.00 C ATOM 2151 CE LYS A 140 -20.114 13.472 5.188 1.00 0.00 C ATOM 2152 NZ LYS A 140 -20.889 14.646 4.729 1.00 0.00 N ATOM 0 H LYS A 140 -14.275 14.400 4.450 1.00 0.00 H new ATOM 0 HA LYS A 140 -16.219 16.366 5.060 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -15.990 13.557 5.035 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -16.482 14.001 6.658 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -18.059 15.689 5.111 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -17.966 14.263 4.096 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -18.448 13.053 6.493 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -19.223 14.594 6.801 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -19.784 12.888 4.329 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -20.749 12.822 5.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -21.717 14.325 4.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -21.206 15.197 5.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -20.290 15.242 4.123 1.00 0.00 H new ATOM 2166 N ILE A 141 -14.065 15.674 7.405 1.00 0.00 N ATOM 2167 CA ILE A 141 -13.557 16.115 8.693 1.00 0.00 C ATOM 2168 C ILE A 141 -13.140 17.584 8.595 1.00 0.00 C ATOM 2169 O ILE A 141 -13.519 18.397 9.437 1.00 0.00 O ATOM 2170 CB ILE A 141 -12.439 15.189 9.173 1.00 0.00 C ATOM 2171 CG1 ILE A 141 -12.982 13.795 9.494 1.00 0.00 C ATOM 2172 CG2 ILE A 141 -11.693 15.800 10.362 1.00 0.00 C ATOM 2173 CD1 ILE A 141 -11.847 12.771 9.580 1.00 0.00 C ATOM 0 H ILE A 141 -13.497 14.963 6.944 1.00 0.00 H new ATOM 0 HA ILE A 141 -14.337 16.054 9.452 1.00 0.00 H new ATOM 0 HB ILE A 141 -11.718 15.076 8.363 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -13.526 13.821 10.438 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -13.693 13.492 8.725 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -10.903 15.121 10.684 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -11.254 16.753 10.066 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -12.390 15.962 11.184 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -12.260 11.789 9.809 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -11.321 12.730 8.626 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -11.151 13.064 10.366 1.00 0.00 H new ATOM 2185 N VAL A 142 -12.367 17.879 7.561 1.00 0.00 N ATOM 2186 CA VAL A 142 -11.895 19.236 7.342 1.00 0.00 C ATOM 2187 C VAL A 142 -13.093 20.156 7.099 1.00 0.00 C ATOM 2188 O VAL A 142 -13.075 21.321 7.491 1.00 0.00 O ATOM 2189 CB VAL A 142 -10.881 19.259 6.197 1.00 0.00 C ATOM 2190 CG1 VAL A 142 -10.959 20.576 5.422 1.00 0.00 C ATOM 2191 CG2 VAL A 142 -9.463 19.010 6.714 1.00 0.00 C ATOM 0 H VAL A 142 -12.055 17.202 6.865 1.00 0.00 H new ATOM 0 HA VAL A 142 -11.375 19.607 8.226 1.00 0.00 H new ATOM 0 HB VAL A 142 -11.133 18.451 5.511 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -10.228 20.566 4.614 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -11.959 20.694 5.005 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -10.746 21.407 6.094 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -8.762 19.032 5.879 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -9.196 19.785 7.432 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -9.419 18.035 7.200 1.00 0.00 H new ATOM 2201 N ARG A 143 -14.106 19.596 6.454 1.00 0.00 N ATOM 2202 CA ARG A 143 -15.311 20.352 6.155 1.00 0.00 C ATOM 2203 C ARG A 143 -16.021 20.754 7.449 1.00 0.00 C ATOM 2204 O ARG A 143 -16.387 21.915 7.625 1.00 0.00 O ATOM 2205 CB ARG A 143 -16.271 19.535 5.286 1.00 0.00 C ATOM 2206 CG ARG A 143 -17.153 20.451 4.436 1.00 0.00 C ATOM 2207 CD ARG A 143 -18.616 20.008 4.490 1.00 0.00 C ATOM 2208 NE ARG A 143 -19.405 20.738 3.473 1.00 0.00 N ATOM 2209 CZ ARG A 143 -20.698 20.502 3.213 1.00 0.00 C ATOM 2210 NH1 ARG A 143 -21.356 19.554 3.893 1.00 0.00 N ATOM 2211 NH2 ARG A 143 -21.333 21.214 2.272 1.00 0.00 N ATOM 0 H ARG A 143 -14.117 18.629 6.130 1.00 0.00 H new ATOM 0 HA ARG A 143 -15.014 21.247 5.607 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -15.703 18.868 4.638 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -16.897 18.907 5.920 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -17.067 21.478 4.792 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -16.804 20.442 3.403 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -18.686 18.935 4.314 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -19.025 20.196 5.483 1.00 0.00 H new ATOM 0 HE ARG A 143 -18.935 21.467 2.936 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -20.873 19.012 4.609 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -22.340 19.375 3.695 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -20.832 21.936 1.754 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -22.317 21.034 2.074 1.00 0.00 H new ATOM 2225 N MET A 144 -16.195 19.772 8.320 1.00 0.00 N ATOM 2226 CA MET A 144 -16.856 20.009 9.593 1.00 0.00 C ATOM 2227 C MET A 144 -16.014 20.922 10.486 1.00 0.00 C ATOM 2228 O MET A 144 -16.534 21.864 11.081 1.00 0.00 O ATOM 2229 CB MET A 144 -17.089 18.674 10.304 1.00 0.00 C ATOM 2230 CG MET A 144 -18.167 18.808 11.381 1.00 0.00 C ATOM 2231 SD MET A 144 -17.430 19.329 12.921 1.00 0.00 S ATOM 2232 CE MET A 144 -16.539 17.844 13.356 1.00 0.00 C ATOM 0 H MET A 144 -15.890 18.810 8.170 1.00 0.00 H new ATOM 0 HA MET A 144 -17.810 20.500 9.400 1.00 0.00 H new ATOM 0 HB2 MET A 144 -17.387 17.918 9.578 1.00 0.00 H new ATOM 0 HB3 MET A 144 -16.158 18.331 10.756 1.00 0.00 H new ATOM 0 HG2 MET A 144 -18.920 19.531 11.066 1.00 0.00 H new ATOM 0 HG3 MET A 144 -18.678 17.855 11.517 1.00 0.00 H new ATOM 0 HE1 MET A 144 -16.319 17.851 14.424 1.00 0.00 H new ATOM 0 HE2 MET A 144 -17.147 16.972 13.117 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.606 17.801 12.794 1.00 0.00 H new ATOM 2242 N TYR A 145 -14.728 20.612 10.550 1.00 0.00 N ATOM 2243 CA TYR A 145 -13.809 21.394 11.359 1.00 0.00 C ATOM 2244 C TYR A 145 -13.881 22.878 10.993 1.00 0.00 C ATOM 2245 O TYR A 145 -14.059 23.728 11.864 1.00 0.00 O ATOM 2246 CB TYR A 145 -12.409 20.868 11.034 1.00 0.00 C ATOM 2247 CG TYR A 145 -11.861 19.878 12.065 1.00 0.00 C ATOM 2248 CD1 TYR A 145 -12.646 18.827 12.496 1.00 0.00 C ATOM 2249 CD2 TYR A 145 -10.584 20.036 12.564 1.00 0.00 C ATOM 2250 CE1 TYR A 145 -12.130 17.895 13.465 1.00 0.00 C ATOM 2251 CE2 TYR A 145 -10.069 19.104 13.533 1.00 0.00 C ATOM 2252 CZ TYR A 145 -10.868 18.080 13.936 1.00 0.00 C ATOM 2253 OH TYR A 145 -10.381 17.199 14.852 1.00 0.00 O ATOM 0 H TYR A 145 -14.300 19.830 10.055 1.00 0.00 H new ATOM 0 HA TYR A 145 -14.056 21.302 12.417 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -12.431 20.385 10.057 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -11.724 21.712 10.956 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -13.646 18.704 12.107 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -9.971 20.859 12.228 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -12.732 17.067 13.810 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -9.071 19.216 13.931 1.00 0.00 H new ATOM 0 HH TYR A 145 -9.467 17.454 15.098 1.00 0.00 H new