USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 968 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 58 THR OG1 : rot 160:sc= 0.103 USER MOD Set 1.2: B 55 LYS NZ :NH3+ -152:sc= 0.226 (180deg=0) USER MOD Set 2.1: A 60 SER OG : rot 180:sc= 0.188 USER MOD Set 2.2: A 61 ASN : amide:sc= -0.183 X(o=0.005,f=-0.37) USER MOD Single : A 8 THR OG1 : rot 25:sc= 0.144 USER MOD Single : A 14 HIS : no HE2:sc= 0.997 K(o=1,f=-6.6!) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 1:sc= 0.398 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -151:sc= 1.35 (180deg=0.699) USER MOD Single : A 30 ASN : amide:sc= 0.328 K(o=0.33,f=-4.9!) USER MOD Single : A 33 SER OG : rot 24:sc= 0.86 USER MOD Single : A 35 ASN : amide:sc= -0.131 K(o=-0.13,f=-1.5!) USER MOD Single : A 40 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0163) USER MOD Single : A 47 SER OG : rot 180:sc= 0.00765 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -2.81! K(o=-2.8!,f=-0.17) USER MOD Single : A 66 THR OG1 : rot 98:sc= 1.23 USER MOD Single : A 67 MET CE :methyl -174:sc= -0.0295 (180deg=-0.155) USER MOD Single : A 72 LYS NZ :NH3+ 170:sc= -3.82! (180deg=-4.34!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : B 8 THR OG1 : rot 180:sc= -0.008 USER MOD Single : B 14 HIS : no HD1:sc= -0.085 X(o=-0.085,f=-0.31) USER MOD Single : B 17 THR OG1 : rot -70:sc= 1.22 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= -0.0981 X(o=-0.098,f=-0.59) USER MOD Single : B 23 LYS NZ :NH3+ 163:sc= -0.0849 (180deg=-0.401) USER MOD Single : B 26 THR OG1 : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ 169:sc= 1.72 (180deg=1.47) USER MOD Single : B 30 ASN : amide:sc= 0.478 K(o=0.48,f=-2.1!) USER MOD Single : B 33 SER OG : rot 83:sc= 0.371 USER MOD Single : B 35 ASN : amide:sc= -0.531 K(o=-0.53,f=0) USER MOD Single : B 40 LYS NZ :NH3+ 168:sc= -0.0376 (180deg=-0.256) USER MOD Single : B 47 SER OG : rot -66:sc= 0.504 USER MOD Single : B 58 THR OG1 : rot 49:sc= 0.0392 USER MOD Single : B 60 SER OG : rot 80:sc= 0.897 USER MOD Single : B 61 ASN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : B 65 GLN : amide:sc= 0.889 K(o=0.89,f=-0.14) USER MOD Single : B 66 THR OG1 : rot 94:sc= 1.25 USER MOD Single : B 67 MET CE :methyl -178:sc=-0.000418 (180deg=-0.0192) USER MOD Single : B 72 LYS NZ :NH3+ -152:sc= 0.634 (180deg=0.0667) USER MOD Single : B 74 ASN : amide:sc= -1.98 K(o=-2,f=-12!) USER MOD ----------------------------------------------------------------- ATOM 126 N THR A 8 13.293 8.086 -16.726 1.00 0.00 N ATOM 127 CA THR A 8 14.178 7.424 -15.793 1.00 0.00 C ATOM 128 C THR A 8 13.576 7.412 -14.394 1.00 0.00 C ATOM 129 O THR A 8 13.348 8.460 -13.799 1.00 0.00 O ATOM 130 CB THR A 8 15.553 8.120 -15.756 1.00 0.00 C ATOM 131 OG1 THR A 8 16.084 8.201 -17.087 1.00 0.00 O ATOM 132 CG2 THR A 8 16.524 7.368 -14.857 1.00 0.00 C ATOM 0 HA THR A 8 14.309 6.396 -16.132 1.00 0.00 H new ATOM 0 HB THR A 8 15.422 9.123 -15.349 1.00 0.00 H new ATOM 0 HG1 THR A 8 15.348 8.188 -17.734 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.485 7.881 -14.850 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.126 7.329 -13.843 1.00 0.00 H new ATOM 0 HG23 THR A 8 16.657 6.354 -15.233 1.00 0.00 H new ATOM 140 N PHE A 9 13.315 6.219 -13.884 1.00 0.00 N ATOM 141 CA PHE A 9 12.836 6.062 -12.524 1.00 0.00 C ATOM 142 C PHE A 9 13.973 5.544 -11.656 1.00 0.00 C ATOM 143 O PHE A 9 14.545 4.485 -11.924 1.00 0.00 O ATOM 144 CB PHE A 9 11.611 5.129 -12.470 1.00 0.00 C ATOM 145 CG PHE A 9 11.844 3.746 -13.024 1.00 0.00 C ATOM 146 CD1 PHE A 9 11.850 3.517 -14.392 1.00 0.00 C ATOM 147 CD2 PHE A 9 12.045 2.673 -12.170 1.00 0.00 C ATOM 148 CE1 PHE A 9 12.054 2.246 -14.896 1.00 0.00 C ATOM 149 CE2 PHE A 9 12.250 1.400 -12.668 1.00 0.00 C ATOM 150 CZ PHE A 9 12.256 1.186 -14.032 1.00 0.00 C ATOM 0 H PHE A 9 13.428 5.344 -14.395 1.00 0.00 H new ATOM 0 HA PHE A 9 12.510 7.029 -12.141 1.00 0.00 H new ATOM 0 HB2 PHE A 9 11.285 5.040 -11.434 1.00 0.00 H new ATOM 0 HB3 PHE A 9 10.794 5.593 -13.022 1.00 0.00 H new ATOM 0 HD1 PHE A 9 11.693 4.342 -15.072 1.00 0.00 H new ATOM 0 HD2 PHE A 9 12.041 2.834 -11.102 1.00 0.00 H new ATOM 0 HE1 PHE A 9 12.056 2.081 -15.963 1.00 0.00 H new ATOM 0 HE2 PHE A 9 12.405 0.573 -11.991 1.00 0.00 H new ATOM 0 HZ PHE A 9 12.418 0.192 -14.423 1.00 0.00 H new ATOM 160 N GLU A 10 14.327 6.312 -10.647 1.00 0.00 N ATOM 161 CA GLU A 10 15.464 5.981 -9.812 1.00 0.00 C ATOM 162 C GLU A 10 15.023 5.509 -8.432 1.00 0.00 C ATOM 163 O GLU A 10 14.344 6.230 -7.694 1.00 0.00 O ATOM 164 CB GLU A 10 16.406 7.184 -9.716 1.00 0.00 C ATOM 165 CG GLU A 10 15.712 8.484 -9.339 1.00 0.00 C ATOM 166 CD GLU A 10 16.631 9.682 -9.450 1.00 0.00 C ATOM 167 OE1 GLU A 10 16.719 10.270 -10.546 1.00 0.00 O ATOM 168 OE2 GLU A 10 17.281 10.035 -8.447 1.00 0.00 O ATOM 0 H GLU A 10 13.844 7.171 -10.384 1.00 0.00 H new ATOM 0 HA GLU A 10 16.003 5.153 -10.273 1.00 0.00 H new ATOM 0 HB2 GLU A 10 17.179 6.969 -8.978 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.908 7.317 -10.674 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.847 8.632 -9.986 1.00 0.00 H new ATOM 0 HG3 GLU A 10 15.338 8.410 -8.318 1.00 0.00 H new ATOM 175 N ILE A 11 15.400 4.280 -8.104 1.00 0.00 N ATOM 176 CA ILE A 11 15.089 3.712 -6.808 1.00 0.00 C ATOM 177 C ILE A 11 16.168 4.133 -5.824 1.00 0.00 C ATOM 178 O ILE A 11 17.208 3.483 -5.701 1.00 0.00 O ATOM 179 CB ILE A 11 14.978 2.163 -6.838 1.00 0.00 C ATOM 180 CG1 ILE A 11 13.920 1.693 -7.848 1.00 0.00 C ATOM 181 CG2 ILE A 11 14.640 1.631 -5.453 1.00 0.00 C ATOM 182 CD1 ILE A 11 14.385 1.691 -9.289 1.00 0.00 C ATOM 0 H ILE A 11 15.923 3.660 -8.722 1.00 0.00 H new ATOM 0 HA ILE A 11 14.112 4.088 -6.503 1.00 0.00 H new ATOM 0 HB ILE A 11 15.945 1.769 -7.151 1.00 0.00 H new ATOM 0 HG12 ILE A 11 13.603 0.685 -7.580 1.00 0.00 H new ATOM 0 HG13 ILE A 11 13.044 2.336 -7.763 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.565 0.544 -5.489 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.424 1.918 -4.752 1.00 0.00 H new ATOM 0 HG23 ILE A 11 13.689 2.049 -5.125 1.00 0.00 H new ATOM 0 HD11 ILE A 11 13.575 1.346 -9.932 1.00 0.00 H new ATOM 0 HD12 ILE A 11 14.674 2.701 -9.580 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.241 1.025 -9.394 1.00 0.00 H new ATOM 194 N GLU A 12 15.926 5.251 -5.159 1.00 0.00 N ATOM 195 CA GLU A 12 16.916 5.853 -4.282 1.00 0.00 C ATOM 196 C GLU A 12 16.793 5.335 -2.857 1.00 0.00 C ATOM 197 O GLU A 12 17.784 5.250 -2.126 1.00 0.00 O ATOM 198 CB GLU A 12 16.754 7.370 -4.286 1.00 0.00 C ATOM 199 CG GLU A 12 16.944 7.992 -5.654 1.00 0.00 C ATOM 200 CD GLU A 12 18.343 7.761 -6.194 1.00 0.00 C ATOM 201 OE1 GLU A 12 19.304 8.341 -5.650 1.00 0.00 O ATOM 202 OE2 GLU A 12 18.498 6.977 -7.152 1.00 0.00 O ATOM 0 H GLU A 12 15.045 5.763 -5.211 1.00 0.00 H new ATOM 0 HA GLU A 12 17.902 5.581 -4.658 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.761 7.623 -3.915 1.00 0.00 H new ATOM 0 HB3 GLU A 12 17.474 7.807 -3.593 1.00 0.00 H new ATOM 0 HG2 GLU A 12 16.214 7.574 -6.347 1.00 0.00 H new ATOM 0 HG3 GLU A 12 16.750 9.063 -5.595 1.00 0.00 H new ATOM 209 N GLU A 13 15.580 4.990 -2.462 1.00 0.00 N ATOM 210 CA GLU A 13 15.324 4.593 -1.091 1.00 0.00 C ATOM 211 C GLU A 13 14.300 3.470 -1.023 1.00 0.00 C ATOM 212 O GLU A 13 13.224 3.556 -1.618 1.00 0.00 O ATOM 213 CB GLU A 13 14.840 5.807 -0.299 1.00 0.00 C ATOM 214 CG GLU A 13 14.642 5.546 1.183 1.00 0.00 C ATOM 215 CD GLU A 13 14.271 6.805 1.928 1.00 0.00 C ATOM 216 OE1 GLU A 13 15.183 7.571 2.304 1.00 0.00 O ATOM 217 OE2 GLU A 13 13.067 7.054 2.116 1.00 0.00 O ATOM 0 H GLU A 13 14.761 4.977 -3.069 1.00 0.00 H new ATOM 0 HA GLU A 13 16.250 4.217 -0.656 1.00 0.00 H new ATOM 0 HB2 GLU A 13 15.560 6.616 -0.421 1.00 0.00 H new ATOM 0 HB3 GLU A 13 13.898 6.152 -0.725 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.860 4.799 1.319 1.00 0.00 H new ATOM 0 HG3 GLU A 13 15.557 5.130 1.605 1.00 0.00 H new ATOM 224 N HIS A 14 14.654 2.410 -0.318 1.00 0.00 N ATOM 225 CA HIS A 14 13.728 1.322 -0.054 1.00 0.00 C ATOM 226 C HIS A 14 13.036 1.583 1.278 1.00 0.00 C ATOM 227 O HIS A 14 13.624 1.373 2.336 1.00 0.00 O ATOM 228 CB HIS A 14 14.456 -0.030 -0.021 1.00 0.00 C ATOM 229 CG HIS A 14 15.164 -0.378 -1.297 1.00 0.00 C ATOM 230 ND1 HIS A 14 14.559 -1.051 -2.331 1.00 0.00 N ATOM 231 CD2 HIS A 14 16.438 -0.146 -1.704 1.00 0.00 C ATOM 232 CE1 HIS A 14 15.419 -1.217 -3.315 1.00 0.00 C ATOM 233 NE2 HIS A 14 16.569 -0.679 -2.965 1.00 0.00 N ATOM 0 H HIS A 14 15.582 2.279 0.084 1.00 0.00 H new ATOM 0 HA HIS A 14 12.991 1.277 -0.855 1.00 0.00 H new ATOM 0 HB2 HIS A 14 15.181 -0.020 0.793 1.00 0.00 H new ATOM 0 HB3 HIS A 14 13.733 -0.814 0.206 1.00 0.00 H new ATOM 0 HD1 HIS A 14 13.591 -1.373 -2.336 1.00 0.00 H new ATOM 0 HD2 HIS A 14 17.207 0.363 -1.142 1.00 0.00 H new ATOM 0 HE1 HIS A 14 15.215 -1.712 -4.253 1.00 0.00 H new ATOM 242 N LEU A 15 11.801 2.064 1.214 1.00 0.00 N ATOM 243 CA LEU A 15 11.065 2.482 2.407 1.00 0.00 C ATOM 244 C LEU A 15 10.840 1.329 3.373 1.00 0.00 C ATOM 245 O LEU A 15 11.190 1.410 4.550 1.00 0.00 O ATOM 246 CB LEU A 15 9.708 3.072 2.012 1.00 0.00 C ATOM 247 CG LEU A 15 9.748 4.453 1.365 1.00 0.00 C ATOM 248 CD1 LEU A 15 8.388 4.795 0.780 1.00 0.00 C ATOM 249 CD2 LEU A 15 10.152 5.503 2.386 1.00 0.00 C ATOM 0 H LEU A 15 11.282 2.176 0.343 1.00 0.00 H new ATOM 0 HA LEU A 15 11.672 3.236 2.909 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.220 2.383 1.323 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.083 3.127 2.904 1.00 0.00 H new ATOM 0 HG LEU A 15 10.487 4.441 0.564 1.00 0.00 H new ATOM 0 HD11 LEU A 15 8.427 5.783 0.321 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.120 4.055 0.026 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.640 4.793 1.573 1.00 0.00 H new ATOM 0 HD21 LEU A 15 10.176 6.483 1.910 1.00 0.00 H new ATOM 0 HD22 LEU A 15 9.430 5.514 3.202 1.00 0.00 H new ATOM 0 HD23 LEU A 15 11.141 5.266 2.780 1.00 0.00 H new ATOM 261 N LEU A 16 10.247 0.258 2.877 1.00 0.00 N ATOM 262 CA LEU A 16 9.831 -0.827 3.743 1.00 0.00 C ATOM 263 C LEU A 16 9.886 -2.160 3.014 1.00 0.00 C ATOM 264 O LEU A 16 9.136 -2.392 2.069 1.00 0.00 O ATOM 265 CB LEU A 16 8.406 -0.563 4.228 1.00 0.00 C ATOM 266 CG LEU A 16 8.097 -0.986 5.660 1.00 0.00 C ATOM 267 CD1 LEU A 16 6.642 -0.706 5.957 1.00 0.00 C ATOM 268 CD2 LEU A 16 8.413 -2.457 5.898 1.00 0.00 C ATOM 0 H LEU A 16 10.044 0.118 1.887 1.00 0.00 H new ATOM 0 HA LEU A 16 10.512 -0.877 4.592 1.00 0.00 H new ATOM 0 HB2 LEU A 16 8.203 0.504 4.134 1.00 0.00 H new ATOM 0 HB3 LEU A 16 7.715 -1.079 3.561 1.00 0.00 H new ATOM 0 HG LEU A 16 8.731 -0.409 6.333 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.415 -1.007 6.980 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.445 0.360 5.840 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.015 -1.269 5.266 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.179 -2.717 6.930 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.815 -3.071 5.224 1.00 0.00 H new ATOM 0 HD23 LEU A 16 9.472 -2.637 5.710 1.00 0.00 H new ATOM 280 N THR A 17 10.766 -3.034 3.465 1.00 0.00 N ATOM 281 CA THR A 17 10.861 -4.372 2.908 1.00 0.00 C ATOM 282 C THR A 17 9.914 -5.304 3.656 1.00 0.00 C ATOM 283 O THR A 17 10.196 -5.715 4.780 1.00 0.00 O ATOM 284 CB THR A 17 12.302 -4.907 3.003 1.00 0.00 C ATOM 285 OG1 THR A 17 13.224 -3.897 2.561 1.00 0.00 O ATOM 286 CG2 THR A 17 12.475 -6.158 2.154 1.00 0.00 C ATOM 0 H THR A 17 11.427 -2.842 4.217 1.00 0.00 H new ATOM 0 HA THR A 17 10.581 -4.330 1.855 1.00 0.00 H new ATOM 0 HB THR A 17 12.504 -5.163 4.043 1.00 0.00 H new ATOM 0 HG1 THR A 17 14.140 -4.240 2.624 1.00 0.00 H new ATOM 0 HG21 THR A 17 13.501 -6.516 2.238 1.00 0.00 H new ATOM 0 HG22 THR A 17 11.791 -6.932 2.503 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.257 -5.924 1.112 1.00 0.00 H new ATOM 294 N LEU A 18 8.777 -5.606 3.040 1.00 0.00 N ATOM 295 CA LEU A 18 7.750 -6.405 3.692 1.00 0.00 C ATOM 296 C LEU A 18 8.150 -7.874 3.764 1.00 0.00 C ATOM 297 O LEU A 18 8.527 -8.369 4.826 1.00 0.00 O ATOM 298 CB LEU A 18 6.407 -6.253 2.972 1.00 0.00 C ATOM 299 CG LEU A 18 5.817 -4.842 2.982 1.00 0.00 C ATOM 300 CD1 LEU A 18 4.501 -4.816 2.225 1.00 0.00 C ATOM 301 CD2 LEU A 18 5.621 -4.357 4.412 1.00 0.00 C ATOM 0 H LEU A 18 8.545 -5.310 2.092 1.00 0.00 H new ATOM 0 HA LEU A 18 7.643 -6.035 4.712 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.530 -6.570 1.937 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.689 -6.933 3.430 1.00 0.00 H new ATOM 0 HG LEU A 18 6.516 -4.169 2.485 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.092 -3.806 2.240 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.669 -5.124 1.193 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.796 -5.500 2.698 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.200 -3.351 4.401 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.940 -5.029 4.934 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.582 -4.343 4.926 1.00 0.00 H new ATOM 313 N SER A 19 8.078 -8.568 2.636 1.00 0.00 N ATOM 314 CA SER A 19 8.376 -9.993 2.601 1.00 0.00 C ATOM 315 C SER A 19 8.760 -10.452 1.202 1.00 0.00 C ATOM 316 O SER A 19 8.355 -9.858 0.201 1.00 0.00 O ATOM 317 CB SER A 19 7.172 -10.806 3.087 1.00 0.00 C ATOM 318 OG SER A 19 6.879 -10.539 4.445 1.00 0.00 O ATOM 0 H SER A 19 7.816 -8.168 1.735 1.00 0.00 H new ATOM 0 HA SER A 19 9.224 -10.161 3.265 1.00 0.00 H new ATOM 0 HB2 SER A 19 6.302 -10.572 2.473 1.00 0.00 H new ATOM 0 HB3 SER A 19 7.375 -11.869 2.960 1.00 0.00 H new ATOM 0 HG SER A 19 7.503 -9.866 4.788 1.00 0.00 H new ATOM 324 N GLU A 20 9.572 -11.491 1.155 1.00 0.00 N ATOM 325 CA GLU A 20 9.884 -12.188 -0.080 1.00 0.00 C ATOM 326 C GLU A 20 8.857 -13.299 -0.301 1.00 0.00 C ATOM 327 O GLU A 20 8.762 -14.234 0.493 1.00 0.00 O ATOM 328 CB GLU A 20 11.301 -12.762 0.005 1.00 0.00 C ATOM 329 CG GLU A 20 11.676 -13.684 -1.140 1.00 0.00 C ATOM 330 CD GLU A 20 12.190 -15.014 -0.635 1.00 0.00 C ATOM 331 OE1 GLU A 20 11.370 -15.930 -0.446 1.00 0.00 O ATOM 332 OE2 GLU A 20 13.411 -15.144 -0.400 1.00 0.00 O ATOM 0 H GLU A 20 10.037 -11.878 1.976 1.00 0.00 H new ATOM 0 HA GLU A 20 9.841 -11.499 -0.924 1.00 0.00 H new ATOM 0 HB2 GLU A 20 12.012 -11.937 0.038 1.00 0.00 H new ATOM 0 HB3 GLU A 20 11.403 -13.308 0.943 1.00 0.00 H new ATOM 0 HG2 GLU A 20 10.807 -13.847 -1.777 1.00 0.00 H new ATOM 0 HG3 GLU A 20 12.439 -13.208 -1.757 1.00 0.00 H new ATOM 339 N ASN A 21 8.082 -13.181 -1.365 1.00 0.00 N ATOM 340 CA ASN A 21 6.987 -14.106 -1.630 1.00 0.00 C ATOM 341 C ASN A 21 7.282 -14.989 -2.834 1.00 0.00 C ATOM 342 O ASN A 21 8.190 -14.700 -3.625 1.00 0.00 O ATOM 343 CB ASN A 21 5.676 -13.343 -1.871 1.00 0.00 C ATOM 344 CG ASN A 21 5.094 -12.743 -0.603 1.00 0.00 C ATOM 345 OD1 ASN A 21 5.404 -11.608 -0.240 1.00 0.00 O ATOM 346 ND2 ASN A 21 4.229 -13.492 0.063 1.00 0.00 N ATOM 0 H ASN A 21 8.190 -12.448 -2.066 1.00 0.00 H new ATOM 0 HA ASN A 21 6.882 -14.740 -0.749 1.00 0.00 H new ATOM 0 HB2 ASN A 21 5.854 -12.547 -2.594 1.00 0.00 H new ATOM 0 HB3 ASN A 21 4.945 -14.019 -2.314 1.00 0.00 H new ATOM 0 HD21 ASN A 21 3.791 -13.133 0.912 1.00 0.00 H new ATOM 0 HD22 ASN A 21 4.000 -14.428 -0.273 1.00 0.00 H new ATOM 353 N GLU A 22 6.492 -16.060 -2.959 1.00 0.00 N ATOM 354 CA GLU A 22 6.589 -17.019 -4.057 1.00 0.00 C ATOM 355 C GLU A 22 7.913 -17.777 -4.036 1.00 0.00 C ATOM 356 O GLU A 22 7.951 -18.968 -3.713 1.00 0.00 O ATOM 357 CB GLU A 22 6.390 -16.324 -5.411 1.00 0.00 C ATOM 358 CG GLU A 22 5.013 -15.691 -5.574 1.00 0.00 C ATOM 359 CD GLU A 22 3.896 -16.713 -5.483 1.00 0.00 C ATOM 360 OE1 GLU A 22 3.479 -17.049 -4.355 1.00 0.00 O ATOM 361 OE2 GLU A 22 3.437 -17.189 -6.542 1.00 0.00 O ATOM 0 H GLU A 22 5.757 -16.286 -2.289 1.00 0.00 H new ATOM 0 HA GLU A 22 5.790 -17.747 -3.918 1.00 0.00 H new ATOM 0 HB2 GLU A 22 7.152 -15.553 -5.530 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.544 -17.050 -6.209 1.00 0.00 H new ATOM 0 HG2 GLU A 22 4.871 -14.932 -4.805 1.00 0.00 H new ATOM 0 HG3 GLU A 22 4.961 -15.183 -6.537 1.00 0.00 H new ATOM 368 N LYS A 23 8.987 -17.088 -4.367 1.00 0.00 N ATOM 369 CA LYS A 23 10.298 -17.702 -4.469 1.00 0.00 C ATOM 370 C LYS A 23 11.365 -16.623 -4.596 1.00 0.00 C ATOM 371 O LYS A 23 12.250 -16.508 -3.751 1.00 0.00 O ATOM 372 CB LYS A 23 10.343 -18.636 -5.679 1.00 0.00 C ATOM 373 CG LYS A 23 11.594 -19.497 -5.758 1.00 0.00 C ATOM 374 CD LYS A 23 11.510 -20.470 -6.922 1.00 0.00 C ATOM 375 CE LYS A 23 10.277 -21.357 -6.812 1.00 0.00 C ATOM 376 NZ LYS A 23 10.091 -22.211 -8.012 1.00 0.00 N ATOM 0 H LYS A 23 8.977 -16.089 -4.573 1.00 0.00 H new ATOM 0 HA LYS A 23 10.492 -18.285 -3.569 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.469 -19.287 -5.654 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.269 -18.038 -6.588 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.471 -18.861 -5.873 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.720 -20.048 -4.826 1.00 0.00 H new ATOM 0 HD2 LYS A 23 11.480 -19.916 -7.860 1.00 0.00 H new ATOM 0 HD3 LYS A 23 12.406 -21.090 -6.946 1.00 0.00 H new ATOM 0 HE2 LYS A 23 10.364 -21.989 -5.928 1.00 0.00 H new ATOM 0 HE3 LYS A 23 9.394 -20.733 -6.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 9.240 -22.797 -7.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 9.981 -21.609 -8.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 10.921 -22.826 -8.132 1.00 0.00 H new ATOM 390 N GLY A 24 11.272 -15.837 -5.659 1.00 0.00 N ATOM 391 CA GLY A 24 12.181 -14.724 -5.839 1.00 0.00 C ATOM 392 C GLY A 24 11.442 -13.417 -6.034 1.00 0.00 C ATOM 393 O GLY A 24 12.016 -12.430 -6.497 1.00 0.00 O ATOM 0 H GLY A 24 10.582 -15.951 -6.401 1.00 0.00 H new ATOM 0 HA2 GLY A 24 12.835 -14.645 -4.970 1.00 0.00 H new ATOM 0 HA3 GLY A 24 12.819 -14.912 -6.702 1.00 0.00 H new ATOM 397 N TRP A 25 10.168 -13.404 -5.667 1.00 0.00 N ATOM 398 CA TRP A 25 9.339 -12.220 -5.831 1.00 0.00 C ATOM 399 C TRP A 25 9.260 -11.444 -4.531 1.00 0.00 C ATOM 400 O TRP A 25 8.527 -11.814 -3.622 1.00 0.00 O ATOM 401 CB TRP A 25 7.934 -12.599 -6.305 1.00 0.00 C ATOM 402 CG TRP A 25 7.872 -12.984 -7.749 1.00 0.00 C ATOM 403 CD1 TRP A 25 8.173 -14.199 -8.294 1.00 0.00 C ATOM 404 CD2 TRP A 25 7.478 -12.141 -8.836 1.00 0.00 C ATOM 405 NE1 TRP A 25 7.989 -14.161 -9.656 1.00 0.00 N ATOM 406 CE2 TRP A 25 7.561 -12.910 -10.011 1.00 0.00 C ATOM 407 CE3 TRP A 25 7.058 -10.811 -8.926 1.00 0.00 C ATOM 408 CZ2 TRP A 25 7.243 -12.390 -11.262 1.00 0.00 C ATOM 409 CZ3 TRP A 25 6.743 -10.296 -10.169 1.00 0.00 C ATOM 410 CH2 TRP A 25 6.837 -11.083 -11.322 1.00 0.00 C ATOM 0 H TRP A 25 9.686 -14.202 -5.253 1.00 0.00 H new ATOM 0 HA TRP A 25 9.799 -11.588 -6.590 1.00 0.00 H new ATOM 0 HB2 TRP A 25 7.567 -13.429 -5.701 1.00 0.00 H new ATOM 0 HB3 TRP A 25 7.262 -11.758 -6.133 1.00 0.00 H new ATOM 0 HD1 TRP A 25 8.506 -15.062 -7.737 1.00 0.00 H new ATOM 0 HE1 TRP A 25 8.146 -14.938 -10.298 1.00 0.00 H new ATOM 0 HE3 TRP A 25 6.981 -10.197 -8.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 7.314 -12.995 -12.154 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 6.419 -9.269 -10.252 1.00 0.00 H new ATOM 0 HH2 TRP A 25 6.584 -10.651 -12.279 1.00 0.00 H new ATOM 421 N THR A 26 10.020 -10.374 -4.439 1.00 0.00 N ATOM 422 CA THR A 26 10.032 -9.581 -3.229 1.00 0.00 C ATOM 423 C THR A 26 8.914 -8.547 -3.271 1.00 0.00 C ATOM 424 O THR A 26 8.670 -7.931 -4.306 1.00 0.00 O ATOM 425 CB THR A 26 11.391 -8.873 -3.054 1.00 0.00 C ATOM 426 OG1 THR A 26 12.446 -9.830 -3.201 1.00 0.00 O ATOM 427 CG2 THR A 26 11.493 -8.201 -1.687 1.00 0.00 C ATOM 0 H THR A 26 10.633 -10.035 -5.181 1.00 0.00 H new ATOM 0 HA THR A 26 9.875 -10.247 -2.381 1.00 0.00 H new ATOM 0 HB THR A 26 11.478 -8.100 -3.818 1.00 0.00 H new ATOM 0 HG1 THR A 26 13.311 -9.383 -3.092 1.00 0.00 H new ATOM 0 HG21 THR A 26 12.462 -7.711 -1.594 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.700 -7.460 -1.586 1.00 0.00 H new ATOM 0 HG23 THR A 26 11.390 -8.952 -0.904 1.00 0.00 H new ATOM 435 N LYS A 27 8.229 -8.371 -2.157 1.00 0.00 N ATOM 436 CA LYS A 27 7.188 -7.366 -2.066 1.00 0.00 C ATOM 437 C LYS A 27 7.609 -6.303 -1.070 1.00 0.00 C ATOM 438 O LYS A 27 7.774 -6.581 0.123 1.00 0.00 O ATOM 439 CB LYS A 27 5.863 -8.008 -1.655 1.00 0.00 C ATOM 440 CG LYS A 27 4.656 -7.098 -1.827 1.00 0.00 C ATOM 441 CD LYS A 27 3.356 -7.890 -1.791 1.00 0.00 C ATOM 442 CE LYS A 27 3.196 -8.647 -0.483 1.00 0.00 C ATOM 443 NZ LYS A 27 1.966 -9.487 -0.467 1.00 0.00 N ATOM 0 H LYS A 27 8.375 -8.910 -1.304 1.00 0.00 H new ATOM 0 HA LYS A 27 7.042 -6.900 -3.041 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.711 -8.912 -2.244 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.928 -8.315 -0.611 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.649 -6.347 -1.037 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.733 -6.564 -2.774 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.513 -7.212 -1.925 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.335 -8.593 -2.624 1.00 0.00 H new ATOM 0 HE2 LYS A 27 4.069 -9.280 -0.322 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.160 -7.937 0.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.624 -9.583 0.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.231 -9.037 -1.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 2.184 -10.429 -0.851 1.00 0.00 H new ATOM 457 N GLU A 28 7.792 -5.091 -1.558 1.00 0.00 N ATOM 458 CA GLU A 28 8.362 -4.032 -0.750 1.00 0.00 C ATOM 459 C GLU A 28 7.807 -2.672 -1.157 1.00 0.00 C ATOM 460 O GLU A 28 7.337 -2.488 -2.282 1.00 0.00 O ATOM 461 CB GLU A 28 9.898 -4.095 -0.856 1.00 0.00 C ATOM 462 CG GLU A 28 10.614 -2.756 -0.754 1.00 0.00 C ATOM 463 CD GLU A 28 11.073 -2.250 -2.106 1.00 0.00 C ATOM 464 OE1 GLU A 28 10.218 -1.910 -2.944 1.00 0.00 O ATOM 465 OE2 GLU A 28 12.297 -2.199 -2.333 1.00 0.00 O ATOM 0 H GLU A 28 7.554 -4.816 -2.511 1.00 0.00 H new ATOM 0 HA GLU A 28 8.082 -4.173 0.294 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.273 -4.749 -0.069 1.00 0.00 H new ATOM 0 HB3 GLU A 28 10.161 -4.557 -1.807 1.00 0.00 H new ATOM 0 HG2 GLU A 28 9.947 -2.023 -0.300 1.00 0.00 H new ATOM 0 HG3 GLU A 28 11.475 -2.855 -0.093 1.00 0.00 H new ATOM 472 N ILE A 29 7.823 -1.748 -0.211 1.00 0.00 N ATOM 473 CA ILE A 29 7.402 -0.387 -0.451 1.00 0.00 C ATOM 474 C ILE A 29 8.633 0.482 -0.655 1.00 0.00 C ATOM 475 O ILE A 29 9.518 0.523 0.200 1.00 0.00 O ATOM 476 CB ILE A 29 6.573 0.146 0.736 1.00 0.00 C ATOM 477 CG1 ILE A 29 5.402 -0.799 1.014 1.00 0.00 C ATOM 478 CG2 ILE A 29 6.073 1.556 0.449 1.00 0.00 C ATOM 479 CD1 ILE A 29 4.602 -0.445 2.246 1.00 0.00 C ATOM 0 H ILE A 29 8.130 -1.926 0.745 1.00 0.00 H new ATOM 0 HA ILE A 29 6.775 -0.359 -1.342 1.00 0.00 H new ATOM 0 HB ILE A 29 7.207 0.189 1.621 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.737 -0.800 0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.786 -1.813 1.122 1.00 0.00 H new ATOM 0 HG21 ILE A 29 5.490 1.915 1.297 1.00 0.00 H new ATOM 0 HG22 ILE A 29 6.924 2.218 0.287 1.00 0.00 H new ATOM 0 HG23 ILE A 29 5.446 1.545 -0.443 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.791 -1.163 2.372 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.251 -0.473 3.121 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.186 0.556 2.134 1.00 0.00 H new ATOM 491 N ASN A 30 8.697 1.157 -1.785 1.00 0.00 N ATOM 492 CA ASN A 30 9.876 1.924 -2.148 1.00 0.00 C ATOM 493 C ASN A 30 9.531 3.383 -2.412 1.00 0.00 C ATOM 494 O ASN A 30 8.360 3.752 -2.530 1.00 0.00 O ATOM 495 CB ASN A 30 10.553 1.318 -3.383 1.00 0.00 C ATOM 496 CG ASN A 30 9.588 1.120 -4.537 1.00 0.00 C ATOM 497 OD1 ASN A 30 9.353 2.028 -5.327 1.00 0.00 O ATOM 498 ND2 ASN A 30 9.040 -0.078 -4.651 1.00 0.00 N ATOM 0 H ASN A 30 7.944 1.191 -2.472 1.00 0.00 H new ATOM 0 HA ASN A 30 10.566 1.883 -1.305 1.00 0.00 H new ATOM 0 HB2 ASN A 30 11.368 1.968 -3.702 1.00 0.00 H new ATOM 0 HB3 ASN A 30 10.997 0.359 -3.116 1.00 0.00 H new ATOM 0 HD21 ASN A 30 8.396 -0.273 -5.417 1.00 0.00 H new ATOM 0 HD22 ASN A 30 9.262 -0.807 -3.973 1.00 0.00 H new ATOM 505 N ARG A 31 10.563 4.210 -2.481 1.00 0.00 N ATOM 506 CA ARG A 31 10.406 5.617 -2.783 1.00 0.00 C ATOM 507 C ARG A 31 11.239 5.959 -4.014 1.00 0.00 C ATOM 508 O ARG A 31 12.473 5.998 -3.955 1.00 0.00 O ATOM 509 CB ARG A 31 10.819 6.468 -1.575 1.00 0.00 C ATOM 510 CG ARG A 31 10.482 7.940 -1.724 1.00 0.00 C ATOM 511 CD ARG A 31 10.608 8.697 -0.408 1.00 0.00 C ATOM 512 NE ARG A 31 11.967 8.674 0.134 1.00 0.00 N ATOM 513 CZ ARG A 31 12.848 9.660 -0.028 1.00 0.00 C ATOM 514 NH1 ARG A 31 12.531 10.731 -0.750 1.00 0.00 N ATOM 515 NH2 ARG A 31 14.045 9.580 0.543 1.00 0.00 N ATOM 0 H ARG A 31 11.529 3.922 -2.329 1.00 0.00 H new ATOM 0 HA ARG A 31 9.360 5.836 -2.997 1.00 0.00 H new ATOM 0 HB2 ARG A 31 10.327 6.080 -0.683 1.00 0.00 H new ATOM 0 HB3 ARG A 31 11.893 6.364 -1.418 1.00 0.00 H new ATOM 0 HG2 ARG A 31 11.144 8.389 -2.464 1.00 0.00 H new ATOM 0 HG3 ARG A 31 9.465 8.041 -2.103 1.00 0.00 H new ATOM 0 HD2 ARG A 31 10.300 9.732 -0.559 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.924 8.264 0.322 1.00 0.00 H new ATOM 0 HE ARG A 31 12.257 7.854 0.667 1.00 0.00 H new ATOM 0 HH11 ARG A 31 11.610 10.800 -1.183 1.00 0.00 H new ATOM 0 HH12 ARG A 31 13.209 11.483 -0.871 1.00 0.00 H new ATOM 0 HH21 ARG A 31 14.289 8.764 1.105 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.720 10.334 0.420 1.00 0.00 H new ATOM 529 N VAL A 32 10.561 6.181 -5.132 1.00 0.00 N ATOM 530 CA VAL A 32 11.225 6.327 -6.424 1.00 0.00 C ATOM 531 C VAL A 32 10.895 7.661 -7.083 1.00 0.00 C ATOM 532 O VAL A 32 9.747 8.110 -7.075 1.00 0.00 O ATOM 533 CB VAL A 32 10.824 5.177 -7.379 1.00 0.00 C ATOM 534 CG1 VAL A 32 11.379 5.392 -8.780 1.00 0.00 C ATOM 535 CG2 VAL A 32 11.294 3.843 -6.833 1.00 0.00 C ATOM 0 H VAL A 32 9.545 6.265 -5.172 1.00 0.00 H new ATOM 0 HA VAL A 32 12.298 6.290 -6.234 1.00 0.00 H new ATOM 0 HB VAL A 32 9.736 5.172 -7.445 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.077 4.565 -9.422 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.991 6.326 -9.186 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.467 5.439 -8.737 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.003 3.047 -7.518 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.379 3.854 -6.730 1.00 0.00 H new ATOM 0 HG23 VAL A 32 10.838 3.668 -5.858 1.00 0.00 H new ATOM 545 N SER A 33 11.913 8.296 -7.644 1.00 0.00 N ATOM 546 CA SER A 33 11.726 9.507 -8.424 1.00 0.00 C ATOM 547 C SER A 33 11.450 9.126 -9.875 1.00 0.00 C ATOM 548 O SER A 33 12.280 8.487 -10.525 1.00 0.00 O ATOM 549 CB SER A 33 12.967 10.402 -8.328 1.00 0.00 C ATOM 550 OG SER A 33 12.816 11.589 -9.090 1.00 0.00 O ATOM 0 H SER A 33 12.883 7.989 -7.572 1.00 0.00 H new ATOM 0 HA SER A 33 10.878 10.067 -8.030 1.00 0.00 H new ATOM 0 HB2 SER A 33 13.150 10.660 -7.285 1.00 0.00 H new ATOM 0 HB3 SER A 33 13.840 9.852 -8.679 1.00 0.00 H new ATOM 0 HG SER A 33 11.863 11.783 -9.208 1.00 0.00 H new ATOM 556 N PHE A 34 10.280 9.496 -10.373 1.00 0.00 N ATOM 557 CA PHE A 34 9.891 9.146 -11.730 1.00 0.00 C ATOM 558 C PHE A 34 10.227 10.285 -12.681 1.00 0.00 C ATOM 559 O PHE A 34 9.369 11.105 -13.010 1.00 0.00 O ATOM 560 CB PHE A 34 8.393 8.825 -11.795 1.00 0.00 C ATOM 561 CG PHE A 34 7.976 7.709 -10.877 1.00 0.00 C ATOM 562 CD1 PHE A 34 8.114 6.384 -11.265 1.00 0.00 C ATOM 563 CD2 PHE A 34 7.451 7.982 -9.624 1.00 0.00 C ATOM 564 CE1 PHE A 34 7.734 5.358 -10.422 1.00 0.00 C ATOM 565 CE2 PHE A 34 7.070 6.961 -8.776 1.00 0.00 C ATOM 566 CZ PHE A 34 7.211 5.646 -9.176 1.00 0.00 C ATOM 0 H PHE A 34 9.585 10.037 -9.859 1.00 0.00 H new ATOM 0 HA PHE A 34 10.447 8.258 -12.032 1.00 0.00 H new ATOM 0 HB2 PHE A 34 7.827 9.722 -11.544 1.00 0.00 H new ATOM 0 HB3 PHE A 34 8.131 8.559 -12.819 1.00 0.00 H new ATOM 0 HD1 PHE A 34 8.523 6.152 -12.237 1.00 0.00 H new ATOM 0 HD2 PHE A 34 7.338 9.008 -9.306 1.00 0.00 H new ATOM 0 HE1 PHE A 34 7.846 4.331 -10.737 1.00 0.00 H new ATOM 0 HE2 PHE A 34 6.663 7.190 -7.802 1.00 0.00 H new ATOM 0 HZ PHE A 34 6.913 4.845 -8.516 1.00 0.00 H new ATOM 576 N ASN A 35 11.491 10.323 -13.102 1.00 0.00 N ATOM 577 CA ASN A 35 12.023 11.381 -13.966 1.00 0.00 C ATOM 578 C ASN A 35 11.750 12.766 -13.379 1.00 0.00 C ATOM 579 O ASN A 35 11.686 13.760 -14.104 1.00 0.00 O ATOM 580 CB ASN A 35 11.432 11.272 -15.375 1.00 0.00 C ATOM 581 CG ASN A 35 12.365 11.835 -16.431 1.00 0.00 C ATOM 582 OD1 ASN A 35 13.587 11.758 -16.297 1.00 0.00 O ATOM 583 ND2 ASN A 35 11.804 12.403 -17.484 1.00 0.00 N ATOM 0 H ASN A 35 12.182 9.615 -12.852 1.00 0.00 H new ATOM 0 HA ASN A 35 13.103 11.249 -14.028 1.00 0.00 H new ATOM 0 HB2 ASN A 35 11.221 10.226 -15.599 1.00 0.00 H new ATOM 0 HB3 ASN A 35 10.481 11.804 -15.411 1.00 0.00 H new ATOM 0 HD21 ASN A 35 12.387 12.797 -18.222 1.00 0.00 H new ATOM 0 HD22 ASN A 35 10.788 12.447 -17.559 1.00 0.00 H new ATOM 590 N GLY A 36 11.610 12.826 -12.061 1.00 0.00 N ATOM 591 CA GLY A 36 11.310 14.078 -11.399 1.00 0.00 C ATOM 592 C GLY A 36 10.633 13.865 -10.059 1.00 0.00 C ATOM 593 O GLY A 36 10.312 12.727 -9.701 1.00 0.00 O ATOM 0 H GLY A 36 11.700 12.024 -11.437 1.00 0.00 H new ATOM 0 HA2 GLY A 36 12.232 14.641 -11.254 1.00 0.00 H new ATOM 0 HA3 GLY A 36 10.666 14.681 -12.039 1.00 0.00 H new ATOM 597 N ALA A 37 10.421 14.963 -9.323 1.00 0.00 N ATOM 598 CA ALA A 37 9.814 14.931 -7.988 1.00 0.00 C ATOM 599 C ALA A 37 10.774 14.322 -6.959 1.00 0.00 C ATOM 600 O ALA A 37 11.641 13.515 -7.306 1.00 0.00 O ATOM 601 CB ALA A 37 8.483 14.186 -8.005 1.00 0.00 C ATOM 0 H ALA A 37 10.667 15.901 -9.638 1.00 0.00 H new ATOM 0 HA ALA A 37 9.615 15.960 -7.690 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.057 14.179 -7.002 1.00 0.00 H new ATOM 0 HB2 ALA A 37 7.795 14.685 -8.688 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.644 13.161 -8.338 1.00 0.00 H new ATOM 607 N PRO A 38 10.632 14.706 -5.674 1.00 0.00 N ATOM 608 CA PRO A 38 11.512 14.231 -4.589 1.00 0.00 C ATOM 609 C PRO A 38 11.270 12.765 -4.209 1.00 0.00 C ATOM 610 O PRO A 38 11.320 12.409 -3.028 1.00 0.00 O ATOM 611 CB PRO A 38 11.146 15.153 -3.420 1.00 0.00 C ATOM 612 CG PRO A 38 9.737 15.549 -3.683 1.00 0.00 C ATOM 613 CD PRO A 38 9.619 15.659 -5.178 1.00 0.00 C ATOM 0 HA PRO A 38 12.562 14.265 -4.880 1.00 0.00 H new ATOM 0 HB2 PRO A 38 11.241 14.638 -2.464 1.00 0.00 H new ATOM 0 HB3 PRO A 38 11.802 16.023 -3.381 1.00 0.00 H new ATOM 0 HG2 PRO A 38 9.042 14.808 -3.289 1.00 0.00 H new ATOM 0 HG3 PRO A 38 9.500 16.497 -3.200 1.00 0.00 H new ATOM 0 HD2 PRO A 38 8.619 15.397 -5.522 1.00 0.00 H new ATOM 0 HD3 PRO A 38 9.819 16.673 -5.523 1.00 0.00 H new ATOM 621 N ALA A 39 11.044 11.929 -5.225 1.00 0.00 N ATOM 622 CA ALA A 39 10.790 10.501 -5.052 1.00 0.00 C ATOM 623 C ALA A 39 9.446 10.249 -4.363 1.00 0.00 C ATOM 624 O ALA A 39 9.246 10.604 -3.201 1.00 0.00 O ATOM 625 CB ALA A 39 11.939 9.829 -4.302 1.00 0.00 C ATOM 0 H ALA A 39 11.033 12.230 -6.200 1.00 0.00 H new ATOM 0 HA ALA A 39 10.732 10.051 -6.043 1.00 0.00 H new ATOM 0 HB1 ALA A 39 11.726 8.766 -4.186 1.00 0.00 H new ATOM 0 HB2 ALA A 39 12.864 9.954 -4.865 1.00 0.00 H new ATOM 0 HB3 ALA A 39 12.049 10.286 -3.319 1.00 0.00 H new ATOM 631 N LYS A 40 8.526 9.638 -5.094 1.00 0.00 N ATOM 632 CA LYS A 40 7.196 9.353 -4.574 1.00 0.00 C ATOM 633 C LYS A 40 7.134 7.936 -4.017 1.00 0.00 C ATOM 634 O LYS A 40 8.112 7.196 -4.076 1.00 0.00 O ATOM 635 CB LYS A 40 6.142 9.540 -5.669 1.00 0.00 C ATOM 636 CG LYS A 40 5.903 10.994 -6.043 1.00 0.00 C ATOM 637 CD LYS A 40 5.283 11.771 -4.891 1.00 0.00 C ATOM 638 CE LYS A 40 5.145 13.254 -5.214 1.00 0.00 C ATOM 639 NZ LYS A 40 4.203 13.513 -6.339 1.00 0.00 N ATOM 0 H LYS A 40 8.677 9.328 -6.054 1.00 0.00 H new ATOM 0 HA LYS A 40 6.985 10.053 -3.766 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.453 8.991 -6.558 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.202 9.100 -5.336 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.847 11.457 -6.329 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.247 11.044 -6.912 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.301 11.357 -4.661 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.898 11.650 -3.999 1.00 0.00 H new ATOM 0 HE2 LYS A 40 4.799 13.784 -4.327 1.00 0.00 H new ATOM 0 HE3 LYS A 40 6.125 13.659 -5.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.095 14.539 -6.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.579 13.088 -7.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 3.277 13.093 -6.120 1.00 0.00 H new ATOM 653 N PHE A 41 5.980 7.565 -3.489 1.00 0.00 N ATOM 654 CA PHE A 41 5.828 6.284 -2.816 1.00 0.00 C ATOM 655 C PHE A 41 5.190 5.258 -3.747 1.00 0.00 C ATOM 656 O PHE A 41 4.152 5.523 -4.352 1.00 0.00 O ATOM 657 CB PHE A 41 4.954 6.454 -1.572 1.00 0.00 C ATOM 658 CG PHE A 41 5.300 7.663 -0.737 1.00 0.00 C ATOM 659 CD1 PHE A 41 6.342 7.623 0.174 1.00 0.00 C ATOM 660 CD2 PHE A 41 4.580 8.842 -0.867 1.00 0.00 C ATOM 661 CE1 PHE A 41 6.662 8.728 0.938 1.00 0.00 C ATOM 662 CE2 PHE A 41 4.896 9.954 -0.107 1.00 0.00 C ATOM 663 CZ PHE A 41 5.938 9.897 0.796 1.00 0.00 C ATOM 0 H PHE A 41 5.133 8.133 -3.513 1.00 0.00 H new ATOM 0 HA PHE A 41 6.816 5.928 -2.526 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.911 6.525 -1.881 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.043 5.561 -0.954 1.00 0.00 H new ATOM 0 HD1 PHE A 41 6.913 6.714 0.289 1.00 0.00 H new ATOM 0 HD2 PHE A 41 3.762 8.892 -1.571 1.00 0.00 H new ATOM 0 HE1 PHE A 41 7.477 8.679 1.645 1.00 0.00 H new ATOM 0 HE2 PHE A 41 4.328 10.866 -0.220 1.00 0.00 H new ATOM 0 HZ PHE A 41 6.187 10.764 1.390 1.00 0.00 H new ATOM 673 N ASP A 42 5.805 4.088 -3.854 1.00 0.00 N ATOM 674 CA ASP A 42 5.251 3.005 -4.663 1.00 0.00 C ATOM 675 C ASP A 42 5.329 1.685 -3.908 1.00 0.00 C ATOM 676 O ASP A 42 6.368 1.337 -3.344 1.00 0.00 O ATOM 677 CB ASP A 42 5.983 2.892 -6.008 1.00 0.00 C ATOM 678 CG ASP A 42 5.398 1.810 -6.907 1.00 0.00 C ATOM 679 OD1 ASP A 42 4.298 2.020 -7.467 1.00 0.00 O ATOM 680 OD2 ASP A 42 6.044 0.759 -7.077 1.00 0.00 O ATOM 0 H ASP A 42 6.686 3.862 -3.393 1.00 0.00 H new ATOM 0 HA ASP A 42 4.204 3.235 -4.863 1.00 0.00 H new ATOM 0 HB2 ASP A 42 5.937 3.851 -6.524 1.00 0.00 H new ATOM 0 HB3 ASP A 42 7.036 2.678 -5.827 1.00 0.00 H new ATOM 685 N ILE A 43 4.216 0.978 -3.862 1.00 0.00 N ATOM 686 CA ILE A 43 4.163 -0.334 -3.238 1.00 0.00 C ATOM 687 C ILE A 43 4.035 -1.383 -4.324 1.00 0.00 C ATOM 688 O ILE A 43 2.963 -1.545 -4.902 1.00 0.00 O ATOM 689 CB ILE A 43 2.965 -0.463 -2.270 1.00 0.00 C ATOM 690 CG1 ILE A 43 2.973 0.680 -1.252 1.00 0.00 C ATOM 691 CG2 ILE A 43 3.001 -1.811 -1.561 1.00 0.00 C ATOM 692 CD1 ILE A 43 1.783 0.673 -0.313 1.00 0.00 C ATOM 0 H ILE A 43 3.328 1.292 -4.253 1.00 0.00 H new ATOM 0 HA ILE A 43 5.077 -0.475 -2.661 1.00 0.00 H new ATOM 0 HB ILE A 43 2.043 -0.400 -2.848 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.889 0.623 -0.663 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.996 1.630 -1.786 1.00 0.00 H new ATOM 0 HG21 ILE A 43 2.151 -1.888 -0.882 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.950 -2.612 -2.299 1.00 0.00 H new ATOM 0 HG23 ILE A 43 3.928 -1.899 -0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.860 1.512 0.378 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.863 0.762 -0.891 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.769 -0.260 0.250 1.00 0.00 H new ATOM 704 N ARG A 44 5.115 -2.089 -4.612 1.00 0.00 N ATOM 705 CA ARG A 44 5.134 -2.964 -5.773 1.00 0.00 C ATOM 706 C ARG A 44 5.770 -4.310 -5.461 1.00 0.00 C ATOM 707 O ARG A 44 6.355 -4.514 -4.394 1.00 0.00 O ATOM 708 CB ARG A 44 5.906 -2.299 -6.913 1.00 0.00 C ATOM 709 CG ARG A 44 5.311 -2.546 -8.288 1.00 0.00 C ATOM 710 CD ARG A 44 6.307 -2.229 -9.389 1.00 0.00 C ATOM 711 NE ARG A 44 7.373 -3.230 -9.449 1.00 0.00 N ATOM 712 CZ ARG A 44 8.351 -3.234 -10.350 1.00 0.00 C ATOM 713 NH1 ARG A 44 8.452 -2.263 -11.249 1.00 0.00 N ATOM 714 NH2 ARG A 44 9.248 -4.209 -10.342 1.00 0.00 N ATOM 0 H ARG A 44 5.978 -2.075 -4.068 1.00 0.00 H new ATOM 0 HA ARG A 44 4.099 -3.137 -6.067 1.00 0.00 H new ATOM 0 HB2 ARG A 44 5.946 -1.225 -6.733 1.00 0.00 H new ATOM 0 HB3 ARG A 44 6.934 -2.662 -6.902 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.997 -3.587 -8.368 1.00 0.00 H new ATOM 0 HG3 ARG A 44 4.419 -1.933 -8.415 1.00 0.00 H new ATOM 0 HD2 ARG A 44 5.791 -2.187 -10.348 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.740 -1.244 -9.217 1.00 0.00 H new ATOM 0 HE ARG A 44 7.365 -3.975 -8.752 1.00 0.00 H new ATOM 0 HH11 ARG A 44 7.774 -1.501 -11.255 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.207 -2.279 -11.934 1.00 0.00 H new ATOM 0 HH21 ARG A 44 9.187 -4.953 -9.647 1.00 0.00 H new ATOM 0 HH22 ARG A 44 10.000 -4.216 -11.031 1.00 0.00 H new ATOM 728 N ALA A 45 5.632 -5.231 -6.404 1.00 0.00 N ATOM 729 CA ALA A 45 6.324 -6.505 -6.345 1.00 0.00 C ATOM 730 C ALA A 45 7.530 -6.489 -7.279 1.00 0.00 C ATOM 731 O ALA A 45 7.506 -5.838 -8.328 1.00 0.00 O ATOM 732 CB ALA A 45 5.381 -7.641 -6.716 1.00 0.00 C ATOM 0 H ALA A 45 5.040 -5.115 -7.226 1.00 0.00 H new ATOM 0 HA ALA A 45 6.672 -6.667 -5.325 1.00 0.00 H new ATOM 0 HB1 ALA A 45 5.916 -8.589 -6.667 1.00 0.00 H new ATOM 0 HB2 ALA A 45 4.543 -7.661 -6.019 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.007 -7.488 -7.728 1.00 0.00 H new ATOM 738 N TRP A 46 8.583 -7.186 -6.887 1.00 0.00 N ATOM 739 CA TRP A 46 9.795 -7.266 -7.688 1.00 0.00 C ATOM 740 C TRP A 46 10.032 -8.700 -8.148 1.00 0.00 C ATOM 741 O TRP A 46 9.929 -9.634 -7.356 1.00 0.00 O ATOM 742 CB TRP A 46 11.002 -6.776 -6.882 1.00 0.00 C ATOM 743 CG TRP A 46 10.889 -5.351 -6.420 1.00 0.00 C ATOM 744 CD1 TRP A 46 10.349 -4.909 -5.245 1.00 0.00 C ATOM 745 CD2 TRP A 46 11.329 -4.182 -7.123 1.00 0.00 C ATOM 746 NE1 TRP A 46 10.433 -3.539 -5.172 1.00 0.00 N ATOM 747 CE2 TRP A 46 11.026 -3.070 -6.313 1.00 0.00 C ATOM 748 CE3 TRP A 46 11.952 -3.965 -8.357 1.00 0.00 C ATOM 749 CZ2 TRP A 46 11.323 -1.765 -6.698 1.00 0.00 C ATOM 750 CZ3 TRP A 46 12.246 -2.669 -8.737 1.00 0.00 C ATOM 751 CH2 TRP A 46 11.932 -1.585 -7.910 1.00 0.00 C ATOM 0 H TRP A 46 8.624 -7.709 -6.012 1.00 0.00 H new ATOM 0 HA TRP A 46 9.670 -6.627 -8.563 1.00 0.00 H new ATOM 0 HB2 TRP A 46 11.131 -7.420 -6.012 1.00 0.00 H new ATOM 0 HB3 TRP A 46 11.900 -6.880 -7.492 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.919 -5.544 -4.484 1.00 0.00 H new ATOM 0 HE1 TRP A 46 10.107 -2.965 -4.394 1.00 0.00 H new ATOM 0 HE3 TRP A 46 12.199 -4.796 -9.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 11.081 -0.925 -6.063 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 12.726 -2.490 -9.688 1.00 0.00 H new ATOM 0 HH2 TRP A 46 12.176 -0.584 -8.235 1.00 0.00 H new ATOM 762 N SER A 47 10.345 -8.865 -9.423 1.00 0.00 N ATOM 763 CA SER A 47 10.617 -10.179 -9.982 1.00 0.00 C ATOM 764 C SER A 47 12.056 -10.603 -9.678 1.00 0.00 C ATOM 765 O SER A 47 12.861 -9.781 -9.229 1.00 0.00 O ATOM 766 CB SER A 47 10.376 -10.152 -11.497 1.00 0.00 C ATOM 767 OG SER A 47 11.085 -9.086 -12.112 1.00 0.00 O ATOM 0 H SER A 47 10.417 -8.100 -10.094 1.00 0.00 H new ATOM 0 HA SER A 47 9.945 -10.906 -9.526 1.00 0.00 H new ATOM 0 HB2 SER A 47 10.689 -11.100 -11.934 1.00 0.00 H new ATOM 0 HB3 SER A 47 9.310 -10.045 -11.696 1.00 0.00 H new ATOM 0 HG SER A 47 10.915 -9.094 -13.077 1.00 0.00 H new ATOM 877 N LYS A 55 1.582 -6.437 -9.789 1.00 0.00 N ATOM 878 CA LYS A 55 0.914 -5.931 -8.602 1.00 0.00 C ATOM 879 C LYS A 55 1.732 -4.813 -7.969 1.00 0.00 C ATOM 880 O LYS A 55 2.888 -5.007 -7.588 1.00 0.00 O ATOM 881 CB LYS A 55 0.669 -7.074 -7.612 1.00 0.00 C ATOM 882 CG LYS A 55 -0.356 -8.074 -8.126 1.00 0.00 C ATOM 883 CD LYS A 55 -0.331 -9.383 -7.351 1.00 0.00 C ATOM 884 CE LYS A 55 -1.382 -10.349 -7.882 1.00 0.00 C ATOM 885 NZ LYS A 55 -1.162 -11.743 -7.415 1.00 0.00 N ATOM 0 HA LYS A 55 -0.053 -5.515 -8.885 1.00 0.00 H new ATOM 0 HB2 LYS A 55 1.609 -7.589 -7.416 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.327 -6.662 -6.663 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -1.352 -7.635 -8.060 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.165 -8.276 -9.180 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.657 -9.837 -7.427 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.512 -9.188 -6.294 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -2.370 -10.015 -7.566 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -1.372 -10.329 -8.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -1.903 -12.360 -7.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -0.231 -12.074 -7.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -1.198 -11.771 -6.376 1.00 0.00 H new ATOM 899 N GLY A 56 1.124 -3.638 -7.887 1.00 0.00 N ATOM 900 CA GLY A 56 1.809 -2.465 -7.384 1.00 0.00 C ATOM 901 C GLY A 56 0.967 -1.218 -7.543 1.00 0.00 C ATOM 902 O GLY A 56 0.076 -1.177 -8.394 1.00 0.00 O ATOM 0 H GLY A 56 0.156 -3.476 -8.164 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.053 -2.609 -6.331 1.00 0.00 H new ATOM 0 HA3 GLY A 56 2.752 -2.338 -7.915 1.00 0.00 H new ATOM 906 N ILE A 57 1.240 -0.203 -6.732 1.00 0.00 N ATOM 907 CA ILE A 57 0.458 1.027 -6.755 1.00 0.00 C ATOM 908 C ILE A 57 1.257 2.214 -6.212 1.00 0.00 C ATOM 909 O ILE A 57 1.988 2.087 -5.225 1.00 0.00 O ATOM 910 CB ILE A 57 -0.855 0.873 -5.945 1.00 0.00 C ATOM 911 CG1 ILE A 57 -1.681 2.162 -6.010 1.00 0.00 C ATOM 912 CG2 ILE A 57 -0.558 0.494 -4.496 1.00 0.00 C ATOM 913 CD1 ILE A 57 -2.988 2.090 -5.250 1.00 0.00 C ATOM 0 H ILE A 57 1.998 -0.208 -6.049 1.00 0.00 H new ATOM 0 HA ILE A 57 0.211 1.223 -7.798 1.00 0.00 H new ATOM 0 HB ILE A 57 -1.439 0.068 -6.392 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.086 2.984 -5.613 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -1.891 2.395 -7.054 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.494 0.392 -3.947 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -0.017 -0.452 -4.471 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.050 1.272 -4.034 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.516 3.039 -5.343 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.604 1.290 -5.661 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.786 1.888 -4.198 1.00 0.00 H new ATOM 925 N THR A 58 1.112 3.360 -6.865 1.00 0.00 N ATOM 926 CA THR A 58 1.766 4.584 -6.435 1.00 0.00 C ATOM 927 C THR A 58 0.862 5.399 -5.510 1.00 0.00 C ATOM 928 O THR A 58 -0.329 5.592 -5.782 1.00 0.00 O ATOM 929 CB THR A 58 2.175 5.445 -7.646 1.00 0.00 C ATOM 930 OG1 THR A 58 1.215 5.294 -8.704 1.00 0.00 O ATOM 931 CG2 THR A 58 3.557 5.059 -8.146 1.00 0.00 C ATOM 0 H THR A 58 0.540 3.465 -7.703 1.00 0.00 H new ATOM 0 HA THR A 58 2.662 4.296 -5.885 1.00 0.00 H new ATOM 0 HB THR A 58 2.202 6.487 -7.328 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.286 6.052 -9.321 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.822 5.681 -9.001 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.286 5.207 -7.350 1.00 0.00 H new ATOM 0 HG23 THR A 58 3.556 4.011 -8.447 1.00 0.00 H new ATOM 939 N LEU A 59 1.435 5.867 -4.411 1.00 0.00 N ATOM 940 CA LEU A 59 0.704 6.667 -3.440 1.00 0.00 C ATOM 941 C LEU A 59 1.343 8.042 -3.311 1.00 0.00 C ATOM 942 O LEU A 59 2.563 8.176 -3.399 1.00 0.00 O ATOM 943 CB LEU A 59 0.692 5.976 -2.071 1.00 0.00 C ATOM 944 CG LEU A 59 0.051 4.586 -2.045 1.00 0.00 C ATOM 945 CD1 LEU A 59 0.154 3.982 -0.655 1.00 0.00 C ATOM 946 CD2 LEU A 59 -1.403 4.653 -2.489 1.00 0.00 C ATOM 0 H LEU A 59 2.412 5.705 -4.168 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.323 6.776 -3.788 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.719 5.891 -1.716 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.163 6.615 -1.364 1.00 0.00 H new ATOM 0 HG LEU A 59 0.591 3.947 -2.744 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -0.306 2.994 -0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.203 3.894 -0.373 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.361 4.624 0.060 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.838 3.654 -2.463 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.958 5.308 -1.818 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.456 5.045 -3.505 1.00 0.00 H new ATOM 958 N SER A 60 0.521 9.063 -3.130 1.00 0.00 N ATOM 959 CA SER A 60 1.029 10.403 -2.916 1.00 0.00 C ATOM 960 C SER A 60 1.149 10.684 -1.419 1.00 0.00 C ATOM 961 O SER A 60 0.947 9.790 -0.590 1.00 0.00 O ATOM 962 CB SER A 60 0.113 11.432 -3.588 1.00 0.00 C ATOM 963 OG SER A 60 0.725 12.711 -3.631 1.00 0.00 O ATOM 0 H SER A 60 -0.496 8.988 -3.127 1.00 0.00 H new ATOM 0 HA SER A 60 2.019 10.482 -3.364 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.125 11.105 -4.600 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.829 11.495 -3.044 1.00 0.00 H new ATOM 0 HG SER A 60 0.121 13.348 -4.066 1.00 0.00 H new ATOM 969 N ASN A 61 1.471 11.923 -1.076 1.00 0.00 N ATOM 970 CA ASN A 61 1.697 12.311 0.312 1.00 0.00 C ATOM 971 C ASN A 61 0.438 12.150 1.159 1.00 0.00 C ATOM 972 O ASN A 61 0.516 11.762 2.326 1.00 0.00 O ATOM 973 CB ASN A 61 2.212 13.757 0.392 1.00 0.00 C ATOM 974 CG ASN A 61 1.377 14.738 -0.421 1.00 0.00 C ATOM 975 OD1 ASN A 61 1.644 14.962 -1.603 1.00 0.00 O ATOM 976 ND2 ASN A 61 0.371 15.335 0.197 1.00 0.00 N ATOM 0 H ASN A 61 1.583 12.684 -1.746 1.00 0.00 H new ATOM 0 HA ASN A 61 2.456 11.641 0.717 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.222 14.075 1.434 1.00 0.00 H new ATOM 0 HB3 ASN A 61 3.243 13.789 0.040 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.212 16.004 -0.306 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.178 15.126 1.177 1.00 0.00 H new ATOM 983 N GLU A 62 -0.717 12.418 0.567 1.00 0.00 N ATOM 984 CA GLU A 62 -1.973 12.363 1.297 1.00 0.00 C ATOM 985 C GLU A 62 -2.328 10.934 1.676 1.00 0.00 C ATOM 986 O GLU A 62 -2.482 10.624 2.857 1.00 0.00 O ATOM 987 CB GLU A 62 -3.102 12.995 0.482 1.00 0.00 C ATOM 988 CG GLU A 62 -2.919 14.487 0.264 1.00 0.00 C ATOM 989 CD GLU A 62 -2.789 15.244 1.570 1.00 0.00 C ATOM 990 OE1 GLU A 62 -1.678 15.277 2.136 1.00 0.00 O ATOM 991 OE2 GLU A 62 -3.801 15.806 2.040 1.00 0.00 O ATOM 0 H GLU A 62 -0.809 12.675 -0.416 1.00 0.00 H new ATOM 0 HA GLU A 62 -1.847 12.935 2.216 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.165 12.498 -0.486 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.050 12.822 0.991 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.030 14.657 -0.343 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -3.768 14.877 -0.297 1.00 0.00 H new ATOM 998 N GLU A 63 -2.440 10.064 0.679 1.00 0.00 N ATOM 999 CA GLU A 63 -2.813 8.671 0.911 1.00 0.00 C ATOM 1000 C GLU A 63 -1.856 8.004 1.891 1.00 0.00 C ATOM 1001 O GLU A 63 -2.282 7.305 2.815 1.00 0.00 O ATOM 1002 CB GLU A 63 -2.820 7.873 -0.397 1.00 0.00 C ATOM 1003 CG GLU A 63 -3.606 8.525 -1.521 1.00 0.00 C ATOM 1004 CD GLU A 63 -2.748 9.429 -2.374 1.00 0.00 C ATOM 1005 OE1 GLU A 63 -2.596 10.615 -2.025 1.00 0.00 O ATOM 1006 OE2 GLU A 63 -2.207 8.941 -3.390 1.00 0.00 O ATOM 0 H GLU A 63 -2.278 10.298 -0.300 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.818 8.677 1.333 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.791 7.727 -0.726 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.236 6.884 -0.204 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -4.049 7.751 -2.148 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.429 9.102 -1.098 1.00 0.00 H new ATOM 1013 N PHE A 64 -0.566 8.245 1.692 1.00 0.00 N ATOM 1014 CA PHE A 64 0.470 7.605 2.490 1.00 0.00 C ATOM 1015 C PHE A 64 0.332 7.987 3.961 1.00 0.00 C ATOM 1016 O PHE A 64 0.247 7.123 4.830 1.00 0.00 O ATOM 1017 CB PHE A 64 1.848 8.006 1.968 1.00 0.00 C ATOM 1018 CG PHE A 64 2.878 6.923 2.102 1.00 0.00 C ATOM 1019 CD1 PHE A 64 2.888 5.856 1.218 1.00 0.00 C ATOM 1020 CD2 PHE A 64 3.835 6.968 3.099 1.00 0.00 C ATOM 1021 CE1 PHE A 64 3.833 4.855 1.326 1.00 0.00 C ATOM 1022 CE2 PHE A 64 4.784 5.971 3.214 1.00 0.00 C ATOM 1023 CZ PHE A 64 4.783 4.913 2.325 1.00 0.00 C ATOM 0 H PHE A 64 -0.212 8.883 0.980 1.00 0.00 H new ATOM 0 HA PHE A 64 0.356 6.524 2.406 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.762 8.287 0.918 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.189 8.889 2.508 1.00 0.00 H new ATOM 0 HD1 PHE A 64 2.147 5.807 0.434 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.841 7.793 3.796 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.829 4.029 0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.526 6.018 3.998 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.525 4.133 2.412 1.00 0.00 H new ATOM 1033 N GLN A 65 0.287 9.286 4.238 1.00 0.00 N ATOM 1034 CA GLN A 65 0.167 9.762 5.613 1.00 0.00 C ATOM 1035 C GLN A 65 -1.164 9.340 6.235 1.00 0.00 C ATOM 1036 O GLN A 65 -1.218 8.994 7.418 1.00 0.00 O ATOM 1037 CB GLN A 65 0.311 11.283 5.675 1.00 0.00 C ATOM 1038 CG GLN A 65 1.705 11.752 6.080 1.00 0.00 C ATOM 1039 CD GLN A 65 1.974 11.625 7.576 1.00 0.00 C ATOM 1040 OE1 GLN A 65 2.772 12.377 8.138 1.00 0.00 O ATOM 1041 NE2 GLN A 65 1.302 10.694 8.243 1.00 0.00 N ATOM 0 H GLN A 65 0.331 10.024 3.535 1.00 0.00 H new ATOM 0 HA GLN A 65 0.974 9.306 6.187 1.00 0.00 H new ATOM 0 HB2 GLN A 65 0.066 11.702 4.699 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -0.416 11.679 6.384 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.449 11.172 5.534 1.00 0.00 H new ATOM 0 HG3 GLN A 65 1.831 12.793 5.782 1.00 0.00 H new ATOM 0 HE21 GLN A 65 0.648 10.086 7.750 1.00 0.00 H new ATOM 0 HE22 GLN A 65 1.440 10.587 9.248 1.00 0.00 H new ATOM 1050 N THR A 66 -2.224 9.363 5.428 1.00 0.00 N ATOM 1051 CA THR A 66 -3.559 9.009 5.899 1.00 0.00 C ATOM 1052 C THR A 66 -3.606 7.564 6.398 1.00 0.00 C ATOM 1053 O THR A 66 -4.076 7.301 7.506 1.00 0.00 O ATOM 1054 CB THR A 66 -4.614 9.205 4.785 1.00 0.00 C ATOM 1055 OG1 THR A 66 -4.619 10.571 4.350 1.00 0.00 O ATOM 1056 CG2 THR A 66 -6.006 8.827 5.269 1.00 0.00 C ATOM 0 H THR A 66 -2.182 9.624 4.443 1.00 0.00 H new ATOM 0 HA THR A 66 -3.793 9.676 6.729 1.00 0.00 H new ATOM 0 HB THR A 66 -4.347 8.552 3.954 1.00 0.00 H new ATOM 0 HG1 THR A 66 -4.080 10.657 3.536 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.724 8.976 4.463 1.00 0.00 H new ATOM 0 HG22 THR A 66 -6.014 7.780 5.573 1.00 0.00 H new ATOM 0 HG23 THR A 66 -6.279 9.454 6.118 1.00 0.00 H new ATOM 1064 N MET A 67 -3.093 6.634 5.592 1.00 0.00 N ATOM 1065 CA MET A 67 -3.136 5.219 5.947 1.00 0.00 C ATOM 1066 C MET A 67 -2.351 4.967 7.232 1.00 0.00 C ATOM 1067 O MET A 67 -2.799 4.225 8.104 1.00 0.00 O ATOM 1068 CB MET A 67 -2.595 4.335 4.812 1.00 0.00 C ATOM 1069 CG MET A 67 -1.094 4.434 4.606 1.00 0.00 C ATOM 1070 SD MET A 67 -0.481 3.319 3.336 1.00 0.00 S ATOM 1071 CE MET A 67 1.282 3.579 3.509 1.00 0.00 C ATOM 0 H MET A 67 -2.647 6.834 4.697 1.00 0.00 H new ATOM 0 HA MET A 67 -4.180 4.952 6.110 1.00 0.00 H new ATOM 0 HB2 MET A 67 -2.854 3.297 5.021 1.00 0.00 H new ATOM 0 HB3 MET A 67 -3.096 4.608 3.884 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.837 5.458 4.336 1.00 0.00 H new ATOM 0 HG3 MET A 67 -0.589 4.216 5.547 1.00 0.00 H new ATOM 0 HE1 MET A 67 1.808 3.041 2.721 1.00 0.00 H new ATOM 0 HE2 MET A 67 1.502 4.644 3.431 1.00 0.00 H new ATOM 0 HE3 MET A 67 1.610 3.211 4.481 1.00 0.00 H new ATOM 1081 N VAL A 68 -1.196 5.616 7.353 1.00 0.00 N ATOM 1082 CA VAL A 68 -0.334 5.448 8.516 1.00 0.00 C ATOM 1083 C VAL A 68 -1.100 5.724 9.811 1.00 0.00 C ATOM 1084 O VAL A 68 -1.133 4.884 10.714 1.00 0.00 O ATOM 1085 CB VAL A 68 0.905 6.369 8.430 1.00 0.00 C ATOM 1086 CG1 VAL A 68 1.746 6.283 9.690 1.00 0.00 C ATOM 1087 CG2 VAL A 68 1.752 6.008 7.224 1.00 0.00 C ATOM 0 H VAL A 68 -0.835 6.266 6.655 1.00 0.00 H new ATOM 0 HA VAL A 68 0.004 4.412 8.524 1.00 0.00 H new ATOM 0 HB VAL A 68 0.547 7.393 8.325 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.609 6.942 9.597 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.147 6.588 10.548 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.087 5.257 9.831 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.620 6.666 7.179 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.085 4.974 7.310 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.161 6.125 6.316 1.00 0.00 H new ATOM 1097 N ASP A 69 -1.739 6.886 9.880 1.00 0.00 N ATOM 1098 CA ASP A 69 -2.484 7.289 11.074 1.00 0.00 C ATOM 1099 C ASP A 69 -3.651 6.336 11.350 1.00 0.00 C ATOM 1100 O ASP A 69 -3.816 5.836 12.471 1.00 0.00 O ATOM 1101 CB ASP A 69 -3.002 8.722 10.904 1.00 0.00 C ATOM 1102 CG ASP A 69 -3.829 9.198 12.084 1.00 0.00 C ATOM 1103 OD1 ASP A 69 -5.051 8.951 12.099 1.00 0.00 O ATOM 1104 OD2 ASP A 69 -3.266 9.841 12.996 1.00 0.00 O ATOM 0 H ASP A 69 -1.758 7.569 9.123 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.808 7.246 11.928 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -2.155 9.394 10.766 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -3.605 8.779 9.998 1.00 0.00 H new ATOM 1109 N ALA A 70 -4.433 6.060 10.314 1.00 0.00 N ATOM 1110 CA ALA A 70 -5.626 5.236 10.457 1.00 0.00 C ATOM 1111 C ALA A 70 -5.287 3.816 10.900 1.00 0.00 C ATOM 1112 O ALA A 70 -6.023 3.218 11.680 1.00 0.00 O ATOM 1113 CB ALA A 70 -6.409 5.214 9.157 1.00 0.00 C ATOM 0 H ALA A 70 -4.262 6.395 9.366 1.00 0.00 H new ATOM 0 HA ALA A 70 -6.243 5.682 11.237 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.298 4.595 9.278 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -6.707 6.229 8.895 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.785 4.802 8.364 1.00 0.00 H new ATOM 1119 N PHE A 71 -4.172 3.277 10.420 1.00 0.00 N ATOM 1120 CA PHE A 71 -3.776 1.924 10.788 1.00 0.00 C ATOM 1121 C PHE A 71 -3.275 1.864 12.227 1.00 0.00 C ATOM 1122 O PHE A 71 -3.349 0.813 12.869 1.00 0.00 O ATOM 1123 CB PHE A 71 -2.743 1.363 9.809 1.00 0.00 C ATOM 1124 CG PHE A 71 -3.343 1.030 8.471 1.00 0.00 C ATOM 1125 CD1 PHE A 71 -4.537 0.329 8.394 1.00 0.00 C ATOM 1126 CD2 PHE A 71 -2.725 1.419 7.297 1.00 0.00 C ATOM 1127 CE1 PHE A 71 -5.101 0.027 7.173 1.00 0.00 C ATOM 1128 CE2 PHE A 71 -3.286 1.118 6.070 1.00 0.00 C ATOM 1129 CZ PHE A 71 -4.476 0.422 6.009 1.00 0.00 C ATOM 0 H PHE A 71 -3.533 3.751 9.782 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.662 1.292 10.726 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -1.942 2.090 9.674 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.292 0.467 10.235 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -5.031 0.016 9.302 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -1.794 1.964 7.339 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.032 -0.519 7.128 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.793 1.427 5.160 1.00 0.00 H new ATOM 0 HZ PHE A 71 -4.917 0.187 5.052 1.00 0.00 H new ATOM 1139 N LYS A 72 -2.792 2.991 12.744 1.00 0.00 N ATOM 1140 CA LYS A 72 -2.458 3.079 14.167 1.00 0.00 C ATOM 1141 C LYS A 72 -3.732 2.981 14.993 1.00 0.00 C ATOM 1142 O LYS A 72 -3.740 2.449 16.101 1.00 0.00 O ATOM 1143 CB LYS A 72 -1.748 4.394 14.487 1.00 0.00 C ATOM 1144 CG LYS A 72 -0.568 4.680 13.587 1.00 0.00 C ATOM 1145 CD LYS A 72 0.441 3.552 13.616 1.00 0.00 C ATOM 1146 CE LYS A 72 1.450 3.701 12.497 1.00 0.00 C ATOM 1147 NZ LYS A 72 2.018 5.071 12.448 1.00 0.00 N ATOM 0 H LYS A 72 -2.624 3.844 12.211 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.786 2.256 14.412 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.463 5.212 14.405 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.407 4.371 15.522 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.917 4.831 12.565 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.087 5.607 13.900 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.956 3.544 14.577 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.074 2.596 13.522 1.00 0.00 H new ATOM 0 HE2 LYS A 72 2.254 2.978 12.634 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.973 3.471 11.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.821 5.091 11.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 1.288 5.738 12.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 2.344 5.346 13.397 1.00 0.00 H new ATOM 1161 N GLY A 73 -4.813 3.492 14.428 1.00 0.00 N ATOM 1162 CA GLY A 73 -6.095 3.435 15.103 1.00 0.00 C ATOM 1163 C GLY A 73 -6.977 2.312 14.588 1.00 0.00 C ATOM 1164 O GLY A 73 -8.205 2.390 14.671 1.00 0.00 O ATOM 0 H GLY A 73 -4.828 3.946 13.514 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -5.933 3.303 16.173 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.612 4.386 14.974 1.00 0.00 H new ATOM 1168 N ASN A 74 -6.359 1.263 14.056 1.00 0.00 N ATOM 1169 CA ASN A 74 -7.115 0.146 13.500 1.00 0.00 C ATOM 1170 C ASN A 74 -6.391 -1.184 13.686 1.00 0.00 C ATOM 1171 O ASN A 74 -6.844 -2.048 14.434 1.00 0.00 O ATOM 1172 CB ASN A 74 -7.399 0.385 12.016 1.00 0.00 C ATOM 1173 CG ASN A 74 -8.186 -0.746 11.380 1.00 0.00 C ATOM 1174 OD1 ASN A 74 -7.613 -1.676 10.816 1.00 0.00 O ATOM 1175 ND2 ASN A 74 -9.505 -0.677 11.476 1.00 0.00 N ATOM 0 H ASN A 74 -5.346 1.162 13.998 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.057 0.087 14.045 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -7.953 1.317 11.902 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.455 0.509 11.485 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -10.085 -1.413 11.073 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -9.941 0.112 11.953 1.00 0.00 H new ATOM 1182 N LEU A 75 -5.261 -1.350 13.014 1.00 0.00 N ATOM 1183 CA LEU A 75 -4.558 -2.626 13.030 1.00 0.00 C ATOM 1184 C LEU A 75 -3.580 -2.695 14.199 1.00 0.00 C ATOM 1185 O LEU A 75 -3.122 -3.775 14.583 1.00 0.00 O ATOM 1186 CB LEU A 75 -3.841 -2.857 11.691 1.00 0.00 C ATOM 1187 CG LEU A 75 -3.159 -4.223 11.533 1.00 0.00 C ATOM 1188 CD1 LEU A 75 -4.064 -5.341 12.015 1.00 0.00 C ATOM 1189 CD2 LEU A 75 -2.782 -4.460 10.081 1.00 0.00 C ATOM 0 H LEU A 75 -4.813 -0.624 12.455 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.290 -3.422 13.166 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.566 -2.737 10.886 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.089 -2.078 11.562 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.256 -4.219 12.143 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.557 -6.298 11.892 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.301 -5.189 13.068 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -4.985 -5.341 11.432 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.299 -5.433 9.984 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.680 -4.438 9.464 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.096 -3.680 9.751 1.00 0.00 H new ATOM 1201 N GLU A 76 -3.265 -1.543 14.767 1.00 0.00 N ATOM 1202 CA GLU A 76 -2.412 -1.484 15.945 1.00 0.00 C ATOM 1203 C GLU A 76 -3.139 -2.061 17.158 1.00 0.00 C ATOM 1204 O GLU A 76 -4.043 -1.440 17.716 1.00 0.00 O ATOM 1205 CB GLU A 76 -1.962 -0.039 16.199 1.00 0.00 C ATOM 1206 CG GLU A 76 -1.360 0.213 17.576 1.00 0.00 C ATOM 1207 CD GLU A 76 -0.206 -0.710 17.908 1.00 0.00 C ATOM 1208 OE1 GLU A 76 0.837 -0.637 17.226 1.00 0.00 O ATOM 1209 OE2 GLU A 76 -0.332 -1.494 18.869 1.00 0.00 O ATOM 0 H GLU A 76 -3.587 -0.635 14.432 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.523 -2.089 15.771 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.228 0.236 15.442 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -2.819 0.622 16.067 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -1.016 1.246 17.630 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -2.138 0.096 18.331 1.00 0.00 H new ATOM 1451 N THR B 8 -15.874 -13.774 -9.134 1.00 0.00 N ATOM 1452 CA THR B 8 -16.187 -12.424 -8.699 1.00 0.00 C ATOM 1453 C THR B 8 -15.464 -12.087 -7.396 1.00 0.00 C ATOM 1454 O THR B 8 -15.005 -12.977 -6.676 1.00 0.00 O ATOM 1455 CB THR B 8 -17.712 -12.230 -8.528 1.00 0.00 C ATOM 1456 OG1 THR B 8 -18.018 -10.846 -8.313 1.00 0.00 O ATOM 1457 CG2 THR B 8 -18.252 -13.056 -7.366 1.00 0.00 C ATOM 0 HA THR B 8 -15.840 -11.742 -9.475 1.00 0.00 H new ATOM 0 HB THR B 8 -18.191 -12.571 -9.446 1.00 0.00 H new ATOM 0 HG1 THR B 8 -18.986 -10.738 -8.208 1.00 0.00 H new ATOM 0 HG21 THR B 8 -19.326 -12.896 -7.274 1.00 0.00 H new ATOM 0 HG22 THR B 8 -18.057 -14.113 -7.549 1.00 0.00 H new ATOM 0 HG23 THR B 8 -17.760 -12.751 -6.443 1.00 0.00 H new ATOM 1465 N PHE B 9 -15.357 -10.801 -7.108 1.00 0.00 N ATOM 1466 CA PHE B 9 -14.702 -10.345 -5.895 1.00 0.00 C ATOM 1467 C PHE B 9 -15.696 -9.595 -5.017 1.00 0.00 C ATOM 1468 O PHE B 9 -16.529 -8.832 -5.511 1.00 0.00 O ATOM 1469 CB PHE B 9 -13.497 -9.453 -6.232 1.00 0.00 C ATOM 1470 CG PHE B 9 -13.837 -8.221 -7.031 1.00 0.00 C ATOM 1471 CD1 PHE B 9 -13.969 -8.287 -8.409 1.00 0.00 C ATOM 1472 CD2 PHE B 9 -14.018 -6.996 -6.404 1.00 0.00 C ATOM 1473 CE1 PHE B 9 -14.278 -7.159 -9.146 1.00 0.00 C ATOM 1474 CE2 PHE B 9 -14.326 -5.865 -7.134 1.00 0.00 C ATOM 1475 CZ PHE B 9 -14.455 -5.946 -8.508 1.00 0.00 C ATOM 0 H PHE B 9 -15.717 -10.052 -7.700 1.00 0.00 H new ATOM 0 HA PHE B 9 -14.336 -11.214 -5.347 1.00 0.00 H new ATOM 0 HB2 PHE B 9 -13.016 -9.147 -5.303 1.00 0.00 H new ATOM 0 HB3 PHE B 9 -12.769 -10.043 -6.789 1.00 0.00 H new ATOM 0 HD1 PHE B 9 -13.829 -9.232 -8.913 1.00 0.00 H new ATOM 0 HD2 PHE B 9 -13.917 -6.926 -5.331 1.00 0.00 H new ATOM 0 HE1 PHE B 9 -14.381 -7.226 -10.219 1.00 0.00 H new ATOM 0 HE2 PHE B 9 -14.466 -4.919 -6.632 1.00 0.00 H new ATOM 0 HZ PHE B 9 -14.694 -5.063 -9.082 1.00 0.00 H new ATOM 1485 N GLU B 10 -15.625 -9.824 -3.718 1.00 0.00 N ATOM 1486 CA GLU B 10 -16.531 -9.172 -2.792 1.00 0.00 C ATOM 1487 C GLU B 10 -15.756 -8.334 -1.783 1.00 0.00 C ATOM 1488 O GLU B 10 -14.951 -8.860 -1.013 1.00 0.00 O ATOM 1489 CB GLU B 10 -17.390 -10.207 -2.065 1.00 0.00 C ATOM 1490 CG GLU B 10 -18.530 -9.594 -1.269 1.00 0.00 C ATOM 1491 CD GLU B 10 -19.603 -8.989 -2.155 1.00 0.00 C ATOM 1492 OE1 GLU B 10 -19.303 -8.031 -2.901 1.00 0.00 O ATOM 1493 OE2 GLU B 10 -20.752 -9.475 -2.120 1.00 0.00 O ATOM 0 H GLU B 10 -14.952 -10.454 -3.282 1.00 0.00 H new ATOM 0 HA GLU B 10 -17.185 -8.513 -3.363 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -17.801 -10.905 -2.795 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -16.757 -10.785 -1.392 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -18.977 -10.359 -0.634 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -18.133 -8.823 -0.608 1.00 0.00 H new ATOM 1500 N ILE B 11 -15.984 -7.029 -1.813 1.00 0.00 N ATOM 1501 CA ILE B 11 -15.396 -6.130 -0.832 1.00 0.00 C ATOM 1502 C ILE B 11 -16.256 -6.128 0.428 1.00 0.00 C ATOM 1503 O ILE B 11 -17.229 -5.377 0.523 1.00 0.00 O ATOM 1504 CB ILE B 11 -15.282 -4.688 -1.371 1.00 0.00 C ATOM 1505 CG1 ILE B 11 -14.616 -4.683 -2.749 1.00 0.00 C ATOM 1506 CG2 ILE B 11 -14.493 -3.821 -0.395 1.00 0.00 C ATOM 1507 CD1 ILE B 11 -14.529 -3.311 -3.382 1.00 0.00 C ATOM 0 H ILE B 11 -16.573 -6.569 -2.507 1.00 0.00 H new ATOM 0 HA ILE B 11 -14.390 -6.487 -0.610 1.00 0.00 H new ATOM 0 HB ILE B 11 -16.285 -4.274 -1.472 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -13.611 -5.095 -2.658 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -15.172 -5.344 -3.413 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -14.420 -2.806 -0.787 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -15.002 -3.802 0.569 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -13.492 -4.234 -0.268 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -14.045 -3.390 -4.356 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -15.532 -2.904 -3.507 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -13.947 -2.650 -2.740 1.00 0.00 H new ATOM 1519 N GLU B 12 -15.912 -6.980 1.379 1.00 0.00 N ATOM 1520 CA GLU B 12 -16.742 -7.160 2.563 1.00 0.00 C ATOM 1521 C GLU B 12 -16.416 -6.138 3.651 1.00 0.00 C ATOM 1522 O GLU B 12 -17.282 -5.784 4.450 1.00 0.00 O ATOM 1523 CB GLU B 12 -16.646 -8.605 3.084 1.00 0.00 C ATOM 1524 CG GLU B 12 -15.240 -9.193 3.125 1.00 0.00 C ATOM 1525 CD GLU B 12 -14.423 -8.716 4.306 1.00 0.00 C ATOM 1526 OE1 GLU B 12 -14.734 -9.114 5.449 1.00 0.00 O ATOM 1527 OE2 GLU B 12 -13.455 -7.962 4.097 1.00 0.00 O ATOM 0 H GLU B 12 -15.070 -7.555 1.357 1.00 0.00 H new ATOM 0 HA GLU B 12 -17.777 -6.981 2.272 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -17.065 -8.639 4.090 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -17.270 -9.242 2.457 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -15.310 -10.280 3.156 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -14.719 -8.934 2.204 1.00 0.00 H new ATOM 1534 N GLU B 13 -15.184 -5.650 3.664 1.00 0.00 N ATOM 1535 CA GLU B 13 -14.781 -4.605 4.599 1.00 0.00 C ATOM 1536 C GLU B 13 -13.983 -3.519 3.893 1.00 0.00 C ATOM 1537 O GLU B 13 -13.213 -3.791 2.974 1.00 0.00 O ATOM 1538 CB GLU B 13 -13.955 -5.189 5.748 1.00 0.00 C ATOM 1539 CG GLU B 13 -14.793 -5.695 6.911 1.00 0.00 C ATOM 1540 CD GLU B 13 -15.473 -4.572 7.668 1.00 0.00 C ATOM 1541 OE1 GLU B 13 -16.536 -4.097 7.220 1.00 0.00 O ATOM 1542 OE2 GLU B 13 -14.956 -4.155 8.724 1.00 0.00 O ATOM 0 H GLU B 13 -14.443 -5.961 3.036 1.00 0.00 H new ATOM 0 HA GLU B 13 -15.689 -4.162 5.008 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -13.348 -6.010 5.366 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -13.267 -4.426 6.113 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -15.548 -6.386 6.537 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -14.157 -6.257 7.595 1.00 0.00 H new ATOM 1549 N HIS B 14 -14.180 -2.285 4.321 1.00 0.00 N ATOM 1550 CA HIS B 14 -13.399 -1.172 3.816 1.00 0.00 C ATOM 1551 C HIS B 14 -12.612 -0.558 4.964 1.00 0.00 C ATOM 1552 O HIS B 14 -13.191 -0.041 5.920 1.00 0.00 O ATOM 1553 CB HIS B 14 -14.287 -0.120 3.115 1.00 0.00 C ATOM 1554 CG HIS B 14 -15.388 0.448 3.966 1.00 0.00 C ATOM 1555 ND1 HIS B 14 -15.271 1.638 4.652 1.00 0.00 N ATOM 1556 CD2 HIS B 14 -16.628 -0.018 4.240 1.00 0.00 C ATOM 1557 CE1 HIS B 14 -16.390 1.873 5.310 1.00 0.00 C ATOM 1558 NE2 HIS B 14 -17.232 0.885 5.078 1.00 0.00 N ATOM 0 H HIS B 14 -14.877 -2.029 5.020 1.00 0.00 H new ATOM 0 HA HIS B 14 -12.705 -1.541 3.061 1.00 0.00 H new ATOM 0 HB2 HIS B 14 -13.654 0.698 2.772 1.00 0.00 H new ATOM 0 HB3 HIS B 14 -14.730 -0.573 2.228 1.00 0.00 H new ATOM 0 HD2 HIS B 14 -17.063 -0.934 3.867 1.00 0.00 H new ATOM 0 HE1 HIS B 14 -16.584 2.732 5.935 1.00 0.00 H new ATOM 0 HE2 HIS B 14 -18.175 0.805 5.458 1.00 0.00 H new ATOM 1567 N LEU B 15 -11.294 -0.659 4.892 1.00 0.00 N ATOM 1568 CA LEU B 15 -10.445 -0.199 5.977 1.00 0.00 C ATOM 1569 C LEU B 15 -10.506 1.318 6.078 1.00 0.00 C ATOM 1570 O LEU B 15 -10.882 1.865 7.114 1.00 0.00 O ATOM 1571 CB LEU B 15 -9.002 -0.666 5.765 1.00 0.00 C ATOM 1572 CG LEU B 15 -8.835 -2.152 5.431 1.00 0.00 C ATOM 1573 CD1 LEU B 15 -7.364 -2.501 5.332 1.00 0.00 C ATOM 1574 CD2 LEU B 15 -9.521 -3.035 6.468 1.00 0.00 C ATOM 0 H LEU B 15 -10.792 -1.054 4.097 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.807 -0.627 6.912 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -8.562 -0.078 4.959 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -8.431 -0.447 6.667 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.311 -2.338 4.468 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -7.256 -3.559 5.094 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -6.900 -1.904 4.547 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -6.875 -2.291 6.284 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -9.384 -4.083 6.202 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -9.084 -2.850 7.449 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -10.586 -2.804 6.495 1.00 0.00 H new ATOM 1586 N LEU B 16 -10.148 1.992 4.991 1.00 0.00 N ATOM 1587 CA LEU B 16 -10.256 3.443 4.922 1.00 0.00 C ATOM 1588 C LEU B 16 -10.070 3.931 3.494 1.00 0.00 C ATOM 1589 O LEU B 16 -9.242 3.405 2.742 1.00 0.00 O ATOM 1590 CB LEU B 16 -9.223 4.132 5.824 1.00 0.00 C ATOM 1591 CG LEU B 16 -7.760 3.943 5.417 1.00 0.00 C ATOM 1592 CD1 LEU B 16 -6.946 5.169 5.798 1.00 0.00 C ATOM 1593 CD2 LEU B 16 -7.172 2.709 6.079 1.00 0.00 C ATOM 0 H LEU B 16 -9.780 1.556 4.145 1.00 0.00 H new ATOM 0 HA LEU B 16 -11.255 3.703 5.271 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -9.441 5.200 5.845 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -9.350 3.760 6.841 1.00 0.00 H new ATOM 0 HG LEU B 16 -7.722 3.810 4.336 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -5.907 5.022 5.503 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -7.347 6.045 5.288 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -6.999 5.320 6.876 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.131 2.594 5.775 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -7.224 2.817 7.162 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -7.738 1.828 5.775 1.00 0.00 H new ATOM 1605 N THR B 17 -10.858 4.923 3.119 1.00 0.00 N ATOM 1606 CA THR B 17 -10.639 5.633 1.878 1.00 0.00 C ATOM 1607 C THR B 17 -9.524 6.651 2.097 1.00 0.00 C ATOM 1608 O THR B 17 -9.609 7.478 3.005 1.00 0.00 O ATOM 1609 CB THR B 17 -11.925 6.340 1.408 1.00 0.00 C ATOM 1610 OG1 THR B 17 -13.025 5.414 1.424 1.00 0.00 O ATOM 1611 CG2 THR B 17 -11.754 6.905 0.004 1.00 0.00 C ATOM 0 H THR B 17 -11.657 5.254 3.660 1.00 0.00 H new ATOM 0 HA THR B 17 -10.354 4.924 1.101 1.00 0.00 H new ATOM 0 HB THR B 17 -12.130 7.165 2.091 1.00 0.00 H new ATOM 0 HG1 THR B 17 -12.907 4.753 0.710 1.00 0.00 H new ATOM 0 HG21 THR B 17 -12.676 7.399 -0.304 1.00 0.00 H new ATOM 0 HG22 THR B 17 -10.937 7.626 -0.001 1.00 0.00 H new ATOM 0 HG23 THR B 17 -11.527 6.095 -0.689 1.00 0.00 H new ATOM 1619 N LEU B 18 -8.475 6.568 1.293 1.00 0.00 N ATOM 1620 CA LEU B 18 -7.275 7.362 1.527 1.00 0.00 C ATOM 1621 C LEU B 18 -7.463 8.802 1.069 1.00 0.00 C ATOM 1622 O LEU B 18 -7.580 9.714 1.886 1.00 0.00 O ATOM 1623 CB LEU B 18 -6.078 6.744 0.805 1.00 0.00 C ATOM 1624 CG LEU B 18 -5.748 5.307 1.201 1.00 0.00 C ATOM 1625 CD1 LEU B 18 -4.643 4.749 0.320 1.00 0.00 C ATOM 1626 CD2 LEU B 18 -5.340 5.241 2.663 1.00 0.00 C ATOM 0 H LEU B 18 -8.429 5.961 0.475 1.00 0.00 H new ATOM 0 HA LEU B 18 -7.087 7.366 2.601 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -6.267 6.773 -0.268 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -5.202 7.365 0.991 1.00 0.00 H new ATOM 0 HG LEU B 18 -6.642 4.699 1.060 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.422 3.724 0.618 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.966 4.763 -0.721 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.747 5.360 0.430 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.108 4.210 2.930 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.460 5.864 2.824 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -6.159 5.601 3.286 1.00 0.00 H new ATOM 1638 N SER B 19 -7.498 8.995 -0.239 1.00 0.00 N ATOM 1639 CA SER B 19 -7.587 10.328 -0.804 1.00 0.00 C ATOM 1640 C SER B 19 -8.139 10.262 -2.222 1.00 0.00 C ATOM 1641 O SER B 19 -8.099 9.213 -2.865 1.00 0.00 O ATOM 1642 CB SER B 19 -6.201 10.989 -0.801 1.00 0.00 C ATOM 1643 OG SER B 19 -6.249 12.322 -1.285 1.00 0.00 O ATOM 0 H SER B 19 -7.466 8.244 -0.929 1.00 0.00 H new ATOM 0 HA SER B 19 -8.265 10.927 -0.196 1.00 0.00 H new ATOM 0 HB2 SER B 19 -5.799 10.985 0.212 1.00 0.00 H new ATOM 0 HB3 SER B 19 -5.518 10.404 -1.417 1.00 0.00 H new ATOM 0 HG SER B 19 -5.349 12.709 -1.266 1.00 0.00 H new ATOM 1649 N GLU B 20 -8.666 11.378 -2.691 1.00 0.00 N ATOM 1650 CA GLU B 20 -9.179 11.477 -4.044 1.00 0.00 C ATOM 1651 C GLU B 20 -8.293 12.424 -4.845 1.00 0.00 C ATOM 1652 O GLU B 20 -8.245 13.627 -4.573 1.00 0.00 O ATOM 1653 CB GLU B 20 -10.627 11.962 -4.001 1.00 0.00 C ATOM 1654 CG GLU B 20 -11.342 11.926 -5.340 1.00 0.00 C ATOM 1655 CD GLU B 20 -12.826 12.189 -5.198 1.00 0.00 C ATOM 1656 OE1 GLU B 20 -13.211 13.361 -5.012 1.00 0.00 O ATOM 1657 OE2 GLU B 20 -13.615 11.225 -5.250 1.00 0.00 O ATOM 0 H GLU B 20 -8.750 12.237 -2.148 1.00 0.00 H new ATOM 0 HA GLU B 20 -9.165 10.502 -4.532 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -11.181 11.349 -3.291 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -10.644 12.984 -3.622 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -10.904 12.670 -6.005 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -11.189 10.953 -5.806 1.00 0.00 H new ATOM 1664 N ASN B 21 -7.570 11.872 -5.802 1.00 0.00 N ATOM 1665 CA ASN B 21 -6.588 12.632 -6.559 1.00 0.00 C ATOM 1666 C ASN B 21 -7.216 13.247 -7.805 1.00 0.00 C ATOM 1667 O ASN B 21 -8.393 13.014 -8.099 1.00 0.00 O ATOM 1668 CB ASN B 21 -5.402 11.741 -6.948 1.00 0.00 C ATOM 1669 CG ASN B 21 -4.729 11.093 -5.746 1.00 0.00 C ATOM 1670 OD1 ASN B 21 -5.075 9.978 -5.351 1.00 0.00 O ATOM 1671 ND2 ASN B 21 -3.763 11.784 -5.156 1.00 0.00 N ATOM 0 H ASN B 21 -7.644 10.892 -6.076 1.00 0.00 H new ATOM 0 HA ASN B 21 -6.226 13.440 -5.924 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -5.747 10.962 -7.629 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -4.669 12.337 -7.491 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -3.279 11.395 -4.347 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -3.504 12.704 -5.512 1.00 0.00 H new ATOM 1678 N GLU B 22 -6.409 14.015 -8.537 1.00 0.00 N ATOM 1679 CA GLU B 22 -6.868 14.768 -9.706 1.00 0.00 C ATOM 1680 C GLU B 22 -7.643 13.885 -10.681 1.00 0.00 C ATOM 1681 O GLU B 22 -7.362 12.689 -10.807 1.00 0.00 O ATOM 1682 CB GLU B 22 -5.687 15.419 -10.443 1.00 0.00 C ATOM 1683 CG GLU B 22 -4.786 16.271 -9.557 1.00 0.00 C ATOM 1684 CD GLU B 22 -3.689 15.464 -8.887 1.00 0.00 C ATOM 1685 OE1 GLU B 22 -3.966 14.809 -7.861 1.00 0.00 O ATOM 1686 OE2 GLU B 22 -2.547 15.472 -9.393 1.00 0.00 O ATOM 0 H GLU B 22 -5.416 14.133 -8.336 1.00 0.00 H new ATOM 0 HA GLU B 22 -7.535 15.545 -9.334 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -5.086 14.636 -10.905 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -6.076 16.040 -11.250 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -4.335 17.061 -10.158 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -5.391 16.758 -8.793 1.00 0.00 H new ATOM 1693 N LYS B 23 -8.630 14.499 -11.342 1.00 0.00 N ATOM 1694 CA LYS B 23 -9.490 13.833 -12.332 1.00 0.00 C ATOM 1695 C LYS B 23 -10.535 12.949 -11.656 1.00 0.00 C ATOM 1696 O LYS B 23 -11.421 12.409 -12.317 1.00 0.00 O ATOM 1697 CB LYS B 23 -8.678 13.007 -13.339 1.00 0.00 C ATOM 1698 CG LYS B 23 -7.784 13.829 -14.253 1.00 0.00 C ATOM 1699 CD LYS B 23 -8.598 14.707 -15.191 1.00 0.00 C ATOM 1700 CE LYS B 23 -7.710 15.416 -16.205 1.00 0.00 C ATOM 1701 NZ LYS B 23 -6.951 14.455 -17.055 1.00 0.00 N ATOM 0 H LYS B 23 -8.859 15.484 -11.205 1.00 0.00 H new ATOM 0 HA LYS B 23 -10.001 14.625 -12.880 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -8.060 12.295 -12.792 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -9.367 12.426 -13.952 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -7.123 14.453 -13.651 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -7.149 13.163 -14.837 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -9.334 14.097 -15.715 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -9.151 15.446 -14.611 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -8.324 16.054 -16.840 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -7.010 16.067 -15.681 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -6.593 14.946 -17.899 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -6.151 14.069 -16.514 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -7.579 13.678 -17.346 1.00 0.00 H new ATOM 1715 N GLY B 24 -10.437 12.818 -10.340 1.00 0.00 N ATOM 1716 CA GLY B 24 -11.372 11.995 -9.604 1.00 0.00 C ATOM 1717 C GLY B 24 -10.838 10.596 -9.385 1.00 0.00 C ATOM 1718 O GLY B 24 -11.606 9.649 -9.203 1.00 0.00 O ATOM 0 H GLY B 24 -9.723 13.270 -9.768 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -11.584 12.458 -8.640 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -12.316 11.943 -10.147 1.00 0.00 H new ATOM 1722 N TRP B 25 -9.517 10.460 -9.398 1.00 0.00 N ATOM 1723 CA TRP B 25 -8.889 9.166 -9.181 1.00 0.00 C ATOM 1724 C TRP B 25 -8.781 8.891 -7.691 1.00 0.00 C ATOM 1725 O TRP B 25 -7.961 9.487 -6.998 1.00 0.00 O ATOM 1726 CB TRP B 25 -7.507 9.106 -9.834 1.00 0.00 C ATOM 1727 CG TRP B 25 -7.554 8.909 -11.319 1.00 0.00 C ATOM 1728 CD1 TRP B 25 -7.775 9.861 -12.272 1.00 0.00 C ATOM 1729 CD2 TRP B 25 -7.372 7.677 -12.022 1.00 0.00 C ATOM 1730 NE1 TRP B 25 -7.743 9.294 -13.525 1.00 0.00 N ATOM 1731 CE2 TRP B 25 -7.498 7.953 -13.397 1.00 0.00 C ATOM 1732 CE3 TRP B 25 -7.116 6.363 -11.620 1.00 0.00 C ATOM 1733 CZ2 TRP B 25 -7.371 6.964 -14.372 1.00 0.00 C ATOM 1734 CZ3 TRP B 25 -6.991 5.383 -12.587 1.00 0.00 C ATOM 1735 CH2 TRP B 25 -7.120 5.687 -13.947 1.00 0.00 C ATOM 0 H TRP B 25 -8.864 11.228 -9.556 1.00 0.00 H new ATOM 0 HA TRP B 25 -9.510 8.400 -9.644 1.00 0.00 H new ATOM 0 HB2 TRP B 25 -6.970 10.029 -9.615 1.00 0.00 H new ATOM 0 HB3 TRP B 25 -6.937 8.292 -9.386 1.00 0.00 H new ATOM 0 HD1 TRP B 25 -7.950 10.908 -12.071 1.00 0.00 H new ATOM 0 HE1 TRP B 25 -7.879 9.791 -14.405 1.00 0.00 H new ATOM 0 HE3 TRP B 25 -7.018 6.118 -10.573 1.00 0.00 H new ATOM 0 HZ2 TRP B 25 -7.467 7.197 -15.422 1.00 0.00 H new ATOM 0 HZ3 TRP B 25 -6.790 4.365 -12.288 1.00 0.00 H new ATOM 0 HH2 TRP B 25 -7.019 4.897 -14.677 1.00 0.00 H new ATOM 1746 N THR B 26 -9.619 7.999 -7.203 1.00 0.00 N ATOM 1747 CA THR B 26 -9.687 7.730 -5.781 1.00 0.00 C ATOM 1748 C THR B 26 -8.668 6.668 -5.377 1.00 0.00 C ATOM 1749 O THR B 26 -8.455 5.698 -6.095 1.00 0.00 O ATOM 1750 CB THR B 26 -11.102 7.264 -5.393 1.00 0.00 C ATOM 1751 OG1 THR B 26 -12.072 8.127 -6.003 1.00 0.00 O ATOM 1752 CG2 THR B 26 -11.287 7.275 -3.882 1.00 0.00 C ATOM 0 H THR B 26 -10.263 7.448 -7.770 1.00 0.00 H new ATOM 0 HA THR B 26 -9.454 8.654 -5.252 1.00 0.00 H new ATOM 0 HB THR B 26 -11.238 6.242 -5.747 1.00 0.00 H new ATOM 0 HG1 THR B 26 -12.973 7.831 -5.758 1.00 0.00 H new ATOM 0 HG21 THR B 26 -12.295 6.941 -3.636 1.00 0.00 H new ATOM 0 HG22 THR B 26 -10.561 6.605 -3.422 1.00 0.00 H new ATOM 0 HG23 THR B 26 -11.137 8.287 -3.504 1.00 0.00 H new ATOM 1760 N LYS B 27 -8.024 6.873 -4.240 1.00 0.00 N ATOM 1761 CA LYS B 27 -7.099 5.898 -3.697 1.00 0.00 C ATOM 1762 C LYS B 27 -7.689 5.345 -2.404 1.00 0.00 C ATOM 1763 O LYS B 27 -8.004 6.112 -1.494 1.00 0.00 O ATOM 1764 CB LYS B 27 -5.745 6.558 -3.427 1.00 0.00 C ATOM 1765 CG LYS B 27 -4.550 5.669 -3.732 1.00 0.00 C ATOM 1766 CD LYS B 27 -4.334 5.506 -5.230 1.00 0.00 C ATOM 1767 CE LYS B 27 -4.034 6.835 -5.912 1.00 0.00 C ATOM 1768 NZ LYS B 27 -2.723 7.412 -5.501 1.00 0.00 N ATOM 0 H LYS B 27 -8.128 7.714 -3.673 1.00 0.00 H new ATOM 0 HA LYS B 27 -6.945 5.086 -4.408 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -5.670 7.467 -4.024 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -5.702 6.860 -2.381 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -3.655 6.096 -3.280 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -4.700 4.690 -3.278 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -3.509 4.815 -5.404 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -5.223 5.061 -5.678 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -4.041 6.693 -6.993 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -4.827 7.545 -5.679 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -2.484 8.209 -6.124 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -2.784 7.747 -4.518 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -1.985 6.683 -5.573 1.00 0.00 H new ATOM 1782 N GLU B 28 -7.859 4.037 -2.325 1.00 0.00 N ATOM 1783 CA GLU B 28 -8.529 3.442 -1.175 1.00 0.00 C ATOM 1784 C GLU B 28 -7.893 2.111 -0.788 1.00 0.00 C ATOM 1785 O GLU B 28 -7.385 1.382 -1.641 1.00 0.00 O ATOM 1786 CB GLU B 28 -10.015 3.250 -1.488 1.00 0.00 C ATOM 1787 CG GLU B 28 -10.828 2.705 -0.325 1.00 0.00 C ATOM 1788 CD GLU B 28 -12.290 2.547 -0.671 1.00 0.00 C ATOM 1789 OE1 GLU B 28 -13.048 3.530 -0.519 1.00 0.00 O ATOM 1790 OE2 GLU B 28 -12.687 1.449 -1.108 1.00 0.00 O ATOM 0 H GLU B 28 -7.548 3.371 -3.032 1.00 0.00 H new ATOM 0 HA GLU B 28 -8.421 4.118 -0.327 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -10.437 4.207 -1.796 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -10.112 2.571 -2.335 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -10.422 1.740 -0.022 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -10.730 3.375 0.529 1.00 0.00 H new ATOM 1797 N ILE B 29 -7.912 1.816 0.507 1.00 0.00 N ATOM 1798 CA ILE B 29 -7.456 0.531 1.008 1.00 0.00 C ATOM 1799 C ILE B 29 -8.631 -0.221 1.617 1.00 0.00 C ATOM 1800 O ILE B 29 -9.202 0.208 2.625 1.00 0.00 O ATOM 1801 CB ILE B 29 -6.353 0.677 2.075 1.00 0.00 C ATOM 1802 CG1 ILE B 29 -5.189 1.507 1.532 1.00 0.00 C ATOM 1803 CG2 ILE B 29 -5.862 -0.695 2.513 1.00 0.00 C ATOM 1804 CD1 ILE B 29 -4.077 1.726 2.537 1.00 0.00 C ATOM 0 H ILE B 29 -8.241 2.456 1.230 1.00 0.00 H new ATOM 0 HA ILE B 29 -7.038 -0.017 0.164 1.00 0.00 H new ATOM 0 HB ILE B 29 -6.772 1.193 2.939 1.00 0.00 H new ATOM 0 HG12 ILE B 29 -4.779 1.010 0.652 1.00 0.00 H new ATOM 0 HG13 ILE B 29 -5.567 2.476 1.204 1.00 0.00 H new ATOM 0 HG21 ILE B 29 -5.083 -0.579 3.267 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -6.693 -1.262 2.934 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -5.458 -1.229 1.653 1.00 0.00 H new ATOM 0 HD11 ILE B 29 -3.287 2.322 2.081 1.00 0.00 H new ATOM 0 HD12 ILE B 29 -4.471 2.251 3.407 1.00 0.00 H new ATOM 0 HD13 ILE B 29 -3.672 0.763 2.847 1.00 0.00 H new ATOM 1816 N ASN B 30 -8.997 -1.329 1.004 1.00 0.00 N ATOM 1817 CA ASN B 30 -10.141 -2.103 1.453 1.00 0.00 C ATOM 1818 C ASN B 30 -9.791 -3.586 1.498 1.00 0.00 C ATOM 1819 O ASN B 30 -8.683 -3.979 1.136 1.00 0.00 O ATOM 1820 CB ASN B 30 -11.357 -1.834 0.550 1.00 0.00 C ATOM 1821 CG ASN B 30 -11.062 -1.992 -0.934 1.00 0.00 C ATOM 1822 OD1 ASN B 30 -10.314 -2.871 -1.350 1.00 0.00 O ATOM 1823 ND2 ASN B 30 -11.628 -1.109 -1.742 1.00 0.00 N ATOM 0 H ASN B 30 -8.518 -1.716 0.191 1.00 0.00 H new ATOM 0 HA ASN B 30 -10.406 -1.794 2.464 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -12.162 -2.515 0.826 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -11.719 -0.822 0.734 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -11.447 -1.146 -2.745 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -12.245 -0.391 -1.361 1.00 0.00 H new ATOM 1830 N ARG B 31 -10.720 -4.399 1.972 1.00 0.00 N ATOM 1831 CA ARG B 31 -10.479 -5.821 2.112 1.00 0.00 C ATOM 1832 C ARG B 31 -11.420 -6.598 1.197 1.00 0.00 C ATOM 1833 O ARG B 31 -12.645 -6.486 1.302 1.00 0.00 O ATOM 1834 CB ARG B 31 -10.663 -6.242 3.570 1.00 0.00 C ATOM 1835 CG ARG B 31 -9.983 -7.555 3.906 1.00 0.00 C ATOM 1836 CD ARG B 31 -10.067 -7.874 5.386 1.00 0.00 C ATOM 1837 NE ARG B 31 -11.438 -8.078 5.839 1.00 0.00 N ATOM 1838 CZ ARG B 31 -11.771 -8.269 7.110 1.00 0.00 C ATOM 1839 NH1 ARG B 31 -10.840 -8.226 8.058 1.00 0.00 N ATOM 1840 NH2 ARG B 31 -13.033 -8.497 7.433 1.00 0.00 N ATOM 0 H ARG B 31 -11.648 -4.096 2.266 1.00 0.00 H new ATOM 0 HA ARG B 31 -9.453 -6.044 1.820 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -10.269 -5.460 4.219 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -11.728 -6.327 3.785 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -10.446 -8.360 3.335 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -8.937 -7.510 3.603 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -9.482 -8.770 5.594 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -9.617 -7.060 5.955 1.00 0.00 H new ATOM 0 HE ARG B 31 -12.182 -8.074 5.141 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -9.867 -8.046 7.810 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -11.098 -8.373 9.034 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -13.748 -8.526 6.706 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -13.291 -8.644 8.409 1.00 0.00 H new ATOM 1854 N VAL B 32 -10.845 -7.379 0.298 1.00 0.00 N ATOM 1855 CA VAL B 32 -11.618 -8.033 -0.746 1.00 0.00 C ATOM 1856 C VAL B 32 -11.411 -9.544 -0.733 1.00 0.00 C ATOM 1857 O VAL B 32 -10.283 -10.030 -0.617 1.00 0.00 O ATOM 1858 CB VAL B 32 -11.240 -7.491 -2.143 1.00 0.00 C ATOM 1859 CG1 VAL B 32 -12.214 -7.989 -3.197 1.00 0.00 C ATOM 1860 CG2 VAL B 32 -11.179 -5.971 -2.136 1.00 0.00 C ATOM 0 H VAL B 32 -9.845 -7.576 0.270 1.00 0.00 H new ATOM 0 HA VAL B 32 -12.666 -7.814 -0.542 1.00 0.00 H new ATOM 0 HB VAL B 32 -10.248 -7.867 -2.395 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -11.928 -7.595 -4.172 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -12.193 -9.078 -3.226 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -13.221 -7.652 -2.950 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -10.911 -5.613 -3.130 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -12.153 -5.569 -1.856 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -10.429 -5.640 -1.417 1.00 0.00 H new ATOM 1870 N SER B 33 -12.509 -10.278 -0.839 1.00 0.00 N ATOM 1871 CA SER B 33 -12.458 -11.723 -0.989 1.00 0.00 C ATOM 1872 C SER B 33 -12.655 -12.077 -2.464 1.00 0.00 C ATOM 1873 O SER B 33 -13.732 -11.857 -3.028 1.00 0.00 O ATOM 1874 CB SER B 33 -13.537 -12.385 -0.113 1.00 0.00 C ATOM 1875 OG SER B 33 -13.445 -13.801 -0.144 1.00 0.00 O ATOM 0 H SER B 33 -13.453 -9.892 -0.824 1.00 0.00 H new ATOM 0 HA SER B 33 -11.488 -12.096 -0.661 1.00 0.00 H new ATOM 0 HB2 SER B 33 -13.435 -12.037 0.915 1.00 0.00 H new ATOM 0 HB3 SER B 33 -14.524 -12.077 -0.458 1.00 0.00 H new ATOM 0 HG SER B 33 -12.768 -14.099 0.498 1.00 0.00 H new ATOM 1881 N PHE B 34 -11.598 -12.578 -3.092 1.00 0.00 N ATOM 1882 CA PHE B 34 -11.632 -12.916 -4.514 1.00 0.00 C ATOM 1883 C PHE B 34 -12.032 -14.371 -4.697 1.00 0.00 C ATOM 1884 O PHE B 34 -11.260 -15.272 -4.351 1.00 0.00 O ATOM 1885 CB PHE B 34 -10.262 -12.677 -5.160 1.00 0.00 C ATOM 1886 CG PHE B 34 -9.736 -11.278 -4.983 1.00 0.00 C ATOM 1887 CD1 PHE B 34 -10.057 -10.283 -5.894 1.00 0.00 C ATOM 1888 CD2 PHE B 34 -8.920 -10.957 -3.908 1.00 0.00 C ATOM 1889 CE1 PHE B 34 -9.573 -8.997 -5.737 1.00 0.00 C ATOM 1890 CE2 PHE B 34 -8.434 -9.674 -3.746 1.00 0.00 C ATOM 1891 CZ PHE B 34 -8.762 -8.692 -4.662 1.00 0.00 C ATOM 0 H PHE B 34 -10.703 -12.761 -2.639 1.00 0.00 H new ATOM 0 HA PHE B 34 -12.368 -12.274 -4.999 1.00 0.00 H new ATOM 0 HB2 PHE B 34 -9.545 -13.380 -4.736 1.00 0.00 H new ATOM 0 HB3 PHE B 34 -10.331 -12.896 -6.226 1.00 0.00 H new ATOM 0 HD1 PHE B 34 -10.692 -10.515 -6.736 1.00 0.00 H new ATOM 0 HD2 PHE B 34 -8.661 -11.720 -3.189 1.00 0.00 H new ATOM 0 HE1 PHE B 34 -9.829 -8.232 -6.455 1.00 0.00 H new ATOM 0 HE2 PHE B 34 -7.799 -9.439 -2.905 1.00 0.00 H new ATOM 0 HZ PHE B 34 -8.385 -7.688 -4.537 1.00 0.00 H new ATOM 1901 N ASN B 35 -13.239 -14.590 -5.238 1.00 0.00 N ATOM 1902 CA ASN B 35 -13.822 -15.929 -5.394 1.00 0.00 C ATOM 1903 C ASN B 35 -14.192 -16.522 -4.037 1.00 0.00 C ATOM 1904 O ASN B 35 -15.349 -16.863 -3.788 1.00 0.00 O ATOM 1905 CB ASN B 35 -12.866 -16.875 -6.134 1.00 0.00 C ATOM 1906 CG ASN B 35 -13.430 -18.279 -6.290 1.00 0.00 C ATOM 1907 OD1 ASN B 35 -12.697 -19.265 -6.214 1.00 0.00 O ATOM 1908 ND2 ASN B 35 -14.728 -18.383 -6.538 1.00 0.00 N ATOM 0 H ASN B 35 -13.840 -13.840 -5.581 1.00 0.00 H new ATOM 0 HA ASN B 35 -14.727 -15.821 -5.992 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -12.647 -16.465 -7.120 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -11.921 -16.926 -5.593 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -15.149 -19.302 -6.673 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -15.305 -17.544 -6.594 1.00 0.00 H new ATOM 1915 N GLY B 36 -13.203 -16.628 -3.171 1.00 0.00 N ATOM 1916 CA GLY B 36 -13.398 -17.161 -1.844 1.00 0.00 C ATOM 1917 C GLY B 36 -12.159 -16.954 -1.007 1.00 0.00 C ATOM 1918 O GLY B 36 -11.336 -16.092 -1.334 1.00 0.00 O ATOM 0 H GLY B 36 -12.243 -16.346 -3.371 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -14.250 -16.673 -1.371 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -13.632 -18.224 -1.903 1.00 0.00 H new ATOM 1922 N ALA B 37 -12.018 -17.745 0.056 1.00 0.00 N ATOM 1923 CA ALA B 37 -10.841 -17.695 0.926 1.00 0.00 C ATOM 1924 C ALA B 37 -10.820 -16.406 1.759 1.00 0.00 C ATOM 1925 O ALA B 37 -11.585 -15.473 1.493 1.00 0.00 O ATOM 1926 CB ALA B 37 -9.561 -17.847 0.105 1.00 0.00 C ATOM 0 H ALA B 37 -12.713 -18.436 0.339 1.00 0.00 H new ATOM 0 HA ALA B 37 -10.897 -18.531 1.623 1.00 0.00 H new ATOM 0 HB1 ALA B 37 -8.697 -17.807 0.768 1.00 0.00 H new ATOM 0 HB2 ALA B 37 -9.575 -18.804 -0.417 1.00 0.00 H new ATOM 0 HB3 ALA B 37 -9.497 -17.038 -0.623 1.00 0.00 H new ATOM 1932 N PRO B 38 -9.965 -16.352 2.803 1.00 0.00 N ATOM 1933 CA PRO B 38 -9.817 -15.160 3.647 1.00 0.00 C ATOM 1934 C PRO B 38 -9.626 -13.887 2.832 1.00 0.00 C ATOM 1935 O PRO B 38 -8.731 -13.807 1.983 1.00 0.00 O ATOM 1936 CB PRO B 38 -8.563 -15.460 4.469 1.00 0.00 C ATOM 1937 CG PRO B 38 -8.512 -16.945 4.549 1.00 0.00 C ATOM 1938 CD PRO B 38 -9.096 -17.456 3.261 1.00 0.00 C ATOM 0 HA PRO B 38 -10.707 -14.978 4.250 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -7.670 -15.058 3.990 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -8.623 -15.012 5.461 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -7.487 -17.293 4.676 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -9.081 -17.308 5.405 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -8.318 -17.682 2.531 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -9.664 -18.374 3.416 1.00 0.00 H new ATOM 1946 N ALA B 39 -10.483 -12.904 3.088 1.00 0.00 N ATOM 1947 CA ALA B 39 -10.412 -11.624 2.403 1.00 0.00 C ATOM 1948 C ALA B 39 -9.083 -10.938 2.689 1.00 0.00 C ATOM 1949 O ALA B 39 -8.706 -10.747 3.847 1.00 0.00 O ATOM 1950 CB ALA B 39 -11.573 -10.735 2.823 1.00 0.00 C ATOM 0 H ALA B 39 -11.238 -12.973 3.770 1.00 0.00 H new ATOM 0 HA ALA B 39 -10.482 -11.801 1.330 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -11.507 -9.780 2.302 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -12.515 -11.222 2.569 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -11.531 -10.565 3.899 1.00 0.00 H new ATOM 1956 N LYS B 40 -8.377 -10.567 1.633 1.00 0.00 N ATOM 1957 CA LYS B 40 -7.060 -9.969 1.778 1.00 0.00 C ATOM 1958 C LYS B 40 -7.132 -8.463 1.584 1.00 0.00 C ATOM 1959 O LYS B 40 -8.157 -7.933 1.151 1.00 0.00 O ATOM 1960 CB LYS B 40 -6.077 -10.602 0.794 1.00 0.00 C ATOM 1961 CG LYS B 40 -5.821 -12.073 1.079 1.00 0.00 C ATOM 1962 CD LYS B 40 -4.856 -12.681 0.076 1.00 0.00 C ATOM 1963 CE LYS B 40 -4.568 -14.136 0.406 1.00 0.00 C ATOM 1964 NZ LYS B 40 -5.802 -14.967 0.382 1.00 0.00 N ATOM 0 H LYS B 40 -8.693 -10.669 0.669 1.00 0.00 H new ATOM 0 HA LYS B 40 -6.700 -10.161 2.789 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -6.465 -10.495 -0.219 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -5.132 -10.060 0.832 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -5.417 -12.184 2.085 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -6.764 -12.618 1.053 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -5.276 -12.609 -0.927 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -3.925 -12.114 0.073 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -3.848 -14.535 -0.309 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -4.107 -14.200 1.392 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -5.543 -15.974 0.409 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -6.391 -14.738 1.208 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -6.336 -14.770 -0.489 1.00 0.00 H new ATOM 1978 N PHE B 41 -6.045 -7.783 1.902 1.00 0.00 N ATOM 1979 CA PHE B 41 -6.018 -6.332 1.875 1.00 0.00 C ATOM 1980 C PHE B 41 -5.588 -5.838 0.502 1.00 0.00 C ATOM 1981 O PHE B 41 -4.509 -6.188 0.017 1.00 0.00 O ATOM 1982 CB PHE B 41 -5.069 -5.809 2.951 1.00 0.00 C ATOM 1983 CG PHE B 41 -5.316 -6.416 4.306 1.00 0.00 C ATOM 1984 CD1 PHE B 41 -6.400 -6.018 5.072 1.00 0.00 C ATOM 1985 CD2 PHE B 41 -4.472 -7.395 4.807 1.00 0.00 C ATOM 1986 CE1 PHE B 41 -6.633 -6.579 6.313 1.00 0.00 C ATOM 1987 CE2 PHE B 41 -4.700 -7.960 6.046 1.00 0.00 C ATOM 1988 CZ PHE B 41 -5.782 -7.553 6.800 1.00 0.00 C ATOM 0 H PHE B 41 -5.165 -8.215 2.183 1.00 0.00 H new ATOM 0 HA PHE B 41 -7.021 -5.956 2.078 1.00 0.00 H new ATOM 0 HB2 PHE B 41 -4.041 -6.013 2.650 1.00 0.00 H new ATOM 0 HB3 PHE B 41 -5.171 -4.726 3.021 1.00 0.00 H new ATOM 0 HD1 PHE B 41 -7.071 -5.260 4.695 1.00 0.00 H new ATOM 0 HD2 PHE B 41 -3.625 -7.720 4.221 1.00 0.00 H new ATOM 0 HE1 PHE B 41 -7.479 -6.257 6.902 1.00 0.00 H new ATOM 0 HE2 PHE B 41 -4.032 -8.720 6.425 1.00 0.00 H new ATOM 0 HZ PHE B 41 -5.963 -7.995 7.769 1.00 0.00 H new ATOM 1998 N ASP B 42 -6.430 -5.033 -0.115 1.00 0.00 N ATOM 1999 CA ASP B 42 -6.179 -4.553 -1.462 1.00 0.00 C ATOM 2000 C ASP B 42 -6.040 -3.038 -1.469 1.00 0.00 C ATOM 2001 O ASP B 42 -6.955 -2.314 -1.069 1.00 0.00 O ATOM 2002 CB ASP B 42 -7.320 -4.980 -2.385 1.00 0.00 C ATOM 2003 CG ASP B 42 -7.005 -4.755 -3.848 1.00 0.00 C ATOM 2004 OD1 ASP B 42 -6.839 -3.589 -4.258 1.00 0.00 O ATOM 2005 OD2 ASP B 42 -6.950 -5.744 -4.610 1.00 0.00 O ATOM 0 H ASP B 42 -7.300 -4.695 0.297 1.00 0.00 H new ATOM 0 HA ASP B 42 -5.246 -4.988 -1.822 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -7.537 -6.036 -2.223 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -8.221 -4.425 -2.122 1.00 0.00 H new ATOM 2010 N ILE B 43 -4.881 -2.563 -1.890 1.00 0.00 N ATOM 2011 CA ILE B 43 -4.655 -1.135 -2.035 1.00 0.00 C ATOM 2012 C ILE B 43 -4.703 -0.772 -3.512 1.00 0.00 C ATOM 2013 O ILE B 43 -3.769 -1.074 -4.254 1.00 0.00 O ATOM 2014 CB ILE B 43 -3.292 -0.707 -1.445 1.00 0.00 C ATOM 2015 CG1 ILE B 43 -3.167 -1.186 0.004 1.00 0.00 C ATOM 2016 CG2 ILE B 43 -3.126 0.807 -1.525 1.00 0.00 C ATOM 2017 CD1 ILE B 43 -1.836 -0.855 0.643 1.00 0.00 C ATOM 0 H ILE B 43 -4.081 -3.145 -2.138 1.00 0.00 H new ATOM 0 HA ILE B 43 -5.436 -0.610 -1.485 1.00 0.00 H new ATOM 0 HB ILE B 43 -2.499 -1.169 -2.033 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -3.965 -0.737 0.595 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -3.316 -2.265 0.034 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -2.161 1.090 -1.105 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -3.175 1.124 -2.567 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -3.923 1.291 -0.960 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -1.822 -1.226 1.668 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -1.033 -1.326 0.076 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -1.692 0.226 0.646 1.00 0.00 H new ATOM 2029 N ARG B 44 -5.791 -0.146 -3.941 1.00 0.00 N ATOM 2030 CA ARG B 44 -5.997 0.110 -5.362 1.00 0.00 C ATOM 2031 C ARG B 44 -6.484 1.530 -5.616 1.00 0.00 C ATOM 2032 O ARG B 44 -6.785 2.280 -4.684 1.00 0.00 O ATOM 2033 CB ARG B 44 -7.005 -0.886 -5.938 1.00 0.00 C ATOM 2034 CG ARG B 44 -8.393 -0.763 -5.331 1.00 0.00 C ATOM 2035 CD ARG B 44 -9.370 -1.737 -5.967 1.00 0.00 C ATOM 2036 NE ARG B 44 -8.975 -3.127 -5.760 1.00 0.00 N ATOM 2037 CZ ARG B 44 -9.631 -4.176 -6.257 1.00 0.00 C ATOM 2038 NH1 ARG B 44 -10.733 -3.992 -6.977 1.00 0.00 N ATOM 2039 NH2 ARG B 44 -9.187 -5.408 -6.029 1.00 0.00 N ATOM 0 H ARG B 44 -6.538 0.191 -3.334 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.034 -0.012 -5.858 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -7.074 -0.739 -7.016 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -6.635 -1.899 -5.778 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -8.339 -0.949 -4.258 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -8.758 0.256 -5.460 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -10.364 -1.577 -5.549 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -9.438 -1.535 -7.036 1.00 0.00 H new ATOM 0 HE ARG B 44 -8.143 -3.308 -5.198 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -11.078 -3.048 -7.150 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -11.234 -4.795 -7.357 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -8.344 -5.552 -5.473 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -9.690 -6.210 -6.410 1.00 0.00 H new ATOM 2053 N ALA B 45 -6.549 1.884 -6.891 1.00 0.00 N ATOM 2054 CA ALA B 45 -7.066 3.173 -7.309 1.00 0.00 C ATOM 2055 C ALA B 45 -8.361 2.990 -8.092 1.00 0.00 C ATOM 2056 O ALA B 45 -8.536 1.995 -8.800 1.00 0.00 O ATOM 2057 CB ALA B 45 -6.033 3.910 -8.150 1.00 0.00 C ATOM 0 H ALA B 45 -6.246 1.287 -7.660 1.00 0.00 H new ATOM 0 HA ALA B 45 -7.277 3.771 -6.422 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.435 4.876 -8.456 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -5.128 4.064 -7.562 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -5.795 3.319 -9.034 1.00 0.00 H new ATOM 2063 N TRP B 46 -9.258 3.953 -7.963 1.00 0.00 N ATOM 2064 CA TRP B 46 -10.542 3.900 -8.637 1.00 0.00 C ATOM 2065 C TRP B 46 -10.572 4.910 -9.777 1.00 0.00 C ATOM 2066 O TRP B 46 -10.153 6.057 -9.614 1.00 0.00 O ATOM 2067 CB TRP B 46 -11.679 4.185 -7.649 1.00 0.00 C ATOM 2068 CG TRP B 46 -11.756 3.199 -6.523 1.00 0.00 C ATOM 2069 CD1 TRP B 46 -11.272 3.357 -5.255 1.00 0.00 C ATOM 2070 CD2 TRP B 46 -12.354 1.899 -6.563 1.00 0.00 C ATOM 2071 NE1 TRP B 46 -11.539 2.237 -4.506 1.00 0.00 N ATOM 2072 CE2 TRP B 46 -12.199 1.329 -5.285 1.00 0.00 C ATOM 2073 CE3 TRP B 46 -13.010 1.160 -7.553 1.00 0.00 C ATOM 2074 CZ2 TRP B 46 -12.671 0.058 -4.973 1.00 0.00 C ATOM 2075 CZ3 TRP B 46 -13.477 -0.103 -7.242 1.00 0.00 C ATOM 2076 CH2 TRP B 46 -13.307 -0.642 -5.960 1.00 0.00 C ATOM 0 H TRP B 46 -9.118 4.787 -7.393 1.00 0.00 H new ATOM 0 HA TRP B 46 -10.682 2.899 -9.045 1.00 0.00 H new ATOM 0 HB2 TRP B 46 -11.549 5.186 -7.237 1.00 0.00 H new ATOM 0 HB3 TRP B 46 -12.626 4.183 -8.188 1.00 0.00 H new ATOM 0 HD1 TRP B 46 -10.755 4.234 -4.894 1.00 0.00 H new ATOM 0 HE1 TRP B 46 -11.286 2.105 -3.527 1.00 0.00 H new ATOM 0 HE3 TRP B 46 -13.149 1.569 -8.543 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 -12.540 -0.361 -3.986 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -13.981 -0.684 -8.000 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -13.686 -1.631 -5.747 1.00 0.00 H new ATOM 2087 N SER B 47 -11.054 4.467 -10.926 1.00 0.00 N ATOM 2088 CA SER B 47 -11.102 5.301 -12.117 1.00 0.00 C ATOM 2089 C SER B 47 -12.452 6.005 -12.225 1.00 0.00 C ATOM 2090 O SER B 47 -13.464 5.470 -11.777 1.00 0.00 O ATOM 2091 CB SER B 47 -10.884 4.429 -13.353 1.00 0.00 C ATOM 2092 OG SER B 47 -9.773 3.563 -13.177 1.00 0.00 O ATOM 0 H SER B 47 -11.421 3.525 -11.060 1.00 0.00 H new ATOM 0 HA SER B 47 -10.318 6.056 -12.050 1.00 0.00 H new ATOM 0 HB2 SER B 47 -11.780 3.841 -13.550 1.00 0.00 H new ATOM 0 HB3 SER B 47 -10.721 5.063 -14.225 1.00 0.00 H new ATOM 0 HG SER B 47 -8.951 4.093 -13.119 1.00 0.00 H new ATOM 2202 N LYS B 55 -3.881 1.221 -10.687 1.00 0.00 N ATOM 2203 CA LYS B 55 -2.846 0.458 -10.011 1.00 0.00 C ATOM 2204 C LYS B 55 -3.425 -0.168 -8.754 1.00 0.00 C ATOM 2205 O LYS B 55 -4.456 0.286 -8.253 1.00 0.00 O ATOM 2206 CB LYS B 55 -1.645 1.348 -9.661 1.00 0.00 C ATOM 2207 CG LYS B 55 -0.880 1.847 -10.877 1.00 0.00 C ATOM 2208 CD LYS B 55 0.345 2.651 -10.476 1.00 0.00 C ATOM 2209 CE LYS B 55 1.142 3.100 -11.691 1.00 0.00 C ATOM 2210 NZ LYS B 55 2.335 3.896 -11.304 1.00 0.00 N ATOM 0 HA LYS B 55 -2.493 -0.327 -10.680 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -1.995 2.205 -9.086 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -0.965 0.789 -9.019 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -0.575 0.998 -11.489 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -1.535 2.464 -11.492 1.00 0.00 H new ATOM 0 HD2 LYS B 55 0.036 3.523 -9.900 1.00 0.00 H new ATOM 0 HD3 LYS B 55 0.980 2.049 -9.826 1.00 0.00 H new ATOM 0 HE2 LYS B 55 1.457 2.227 -12.262 1.00 0.00 H new ATOM 0 HE3 LYS B 55 0.504 3.695 -12.345 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 2.574 4.558 -12.070 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 2.129 4.431 -10.436 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 3.138 3.258 -11.135 1.00 0.00 H new ATOM 2224 N GLY B 56 -2.763 -1.196 -8.251 1.00 0.00 N ATOM 2225 CA GLY B 56 -3.251 -1.899 -7.084 1.00 0.00 C ATOM 2226 C GLY B 56 -2.355 -3.059 -6.704 1.00 0.00 C ATOM 2227 O GLY B 56 -1.704 -3.656 -7.568 1.00 0.00 O ATOM 0 H GLY B 56 -1.890 -1.559 -8.633 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -3.321 -1.205 -6.246 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -4.258 -2.267 -7.278 1.00 0.00 H new ATOM 2231 N ILE B 57 -2.303 -3.368 -5.417 1.00 0.00 N ATOM 2232 CA ILE B 57 -1.482 -4.464 -4.927 1.00 0.00 C ATOM 2233 C ILE B 57 -2.161 -5.162 -3.750 1.00 0.00 C ATOM 2234 O ILE B 57 -2.779 -4.516 -2.900 1.00 0.00 O ATOM 2235 CB ILE B 57 -0.070 -3.978 -4.511 1.00 0.00 C ATOM 2236 CG1 ILE B 57 0.798 -5.163 -4.076 1.00 0.00 C ATOM 2237 CG2 ILE B 57 -0.159 -2.938 -3.400 1.00 0.00 C ATOM 2238 CD1 ILE B 57 2.225 -4.787 -3.745 1.00 0.00 C ATOM 0 H ILE B 57 -2.822 -2.873 -4.691 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.368 -5.175 -5.745 1.00 0.00 H new ATOM 0 HB ILE B 57 0.398 -3.508 -5.376 1.00 0.00 H new ATOM 0 HG12 ILE B 57 0.344 -5.632 -3.203 1.00 0.00 H new ATOM 0 HG13 ILE B 57 0.804 -5.908 -4.872 1.00 0.00 H new ATOM 0 HG21 ILE B 57 0.844 -2.612 -3.125 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -0.736 -2.081 -3.749 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -0.649 -3.376 -2.530 1.00 0.00 H new ATOM 0 HD11 ILE B 57 2.776 -5.679 -3.446 1.00 0.00 H new ATOM 0 HD12 ILE B 57 2.698 -4.346 -4.622 1.00 0.00 H new ATOM 0 HD13 ILE B 57 2.231 -4.066 -2.928 1.00 0.00 H new ATOM 2250 N THR B 58 -2.055 -6.484 -3.717 1.00 0.00 N ATOM 2251 CA THR B 58 -2.652 -7.275 -2.655 1.00 0.00 C ATOM 2252 C THR B 58 -1.632 -7.592 -1.563 1.00 0.00 C ATOM 2253 O THR B 58 -0.541 -8.110 -1.834 1.00 0.00 O ATOM 2254 CB THR B 58 -3.234 -8.587 -3.213 1.00 0.00 C ATOM 2255 OG1 THR B 58 -2.277 -9.223 -4.077 1.00 0.00 O ATOM 2256 CG2 THR B 58 -4.524 -8.325 -3.980 1.00 0.00 C ATOM 0 H THR B 58 -1.557 -7.031 -4.419 1.00 0.00 H new ATOM 0 HA THR B 58 -3.457 -6.683 -2.220 1.00 0.00 H new ATOM 0 HB THR B 58 -3.457 -9.245 -2.373 1.00 0.00 H new ATOM 0 HG1 THR B 58 -1.405 -9.255 -3.632 1.00 0.00 H new ATOM 0 HG21 THR B 58 -4.916 -9.266 -4.365 1.00 0.00 H new ATOM 0 HG22 THR B 58 -5.258 -7.871 -3.314 1.00 0.00 H new ATOM 0 HG23 THR B 58 -4.322 -7.649 -4.811 1.00 0.00 H new ATOM 2264 N LEU B 59 -1.987 -7.272 -0.328 1.00 0.00 N ATOM 2265 CA LEU B 59 -1.130 -7.544 0.814 1.00 0.00 C ATOM 2266 C LEU B 59 -1.799 -8.554 1.736 1.00 0.00 C ATOM 2267 O LEU B 59 -3.025 -8.563 1.868 1.00 0.00 O ATOM 2268 CB LEU B 59 -0.832 -6.251 1.578 1.00 0.00 C ATOM 2269 CG LEU B 59 -0.161 -5.146 0.759 1.00 0.00 C ATOM 2270 CD1 LEU B 59 0.027 -3.898 1.603 1.00 0.00 C ATOM 2271 CD2 LEU B 59 1.176 -5.617 0.206 1.00 0.00 C ATOM 0 H LEU B 59 -2.870 -6.820 -0.091 1.00 0.00 H new ATOM 0 HA LEU B 59 -0.189 -7.959 0.454 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -1.767 -5.864 1.982 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -0.192 -6.490 2.428 1.00 0.00 H new ATOM 0 HG LEU B 59 -0.812 -4.904 -0.081 1.00 0.00 H new ATOM 0 HD11 LEU B 59 0.505 -3.123 1.005 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -0.944 -3.543 1.948 1.00 0.00 H new ATOM 0 HD13 LEU B 59 0.655 -4.132 2.463 1.00 0.00 H new ATOM 0 HD21 LEU B 59 1.634 -4.814 -0.372 1.00 0.00 H new ATOM 0 HD22 LEU B 59 1.834 -5.891 1.030 1.00 0.00 H new ATOM 0 HD23 LEU B 59 1.019 -6.483 -0.437 1.00 0.00 H new ATOM 2283 N SER B 60 -1.002 -9.406 2.358 1.00 0.00 N ATOM 2284 CA SER B 60 -1.531 -10.420 3.253 1.00 0.00 C ATOM 2285 C SER B 60 -1.505 -9.919 4.693 1.00 0.00 C ATOM 2286 O SER B 60 -1.020 -8.818 4.967 1.00 0.00 O ATOM 2287 CB SER B 60 -0.715 -11.708 3.130 1.00 0.00 C ATOM 2288 OG SER B 60 -0.322 -11.929 1.785 1.00 0.00 O ATOM 0 H SER B 60 0.013 -9.416 2.260 1.00 0.00 H new ATOM 0 HA SER B 60 -2.564 -10.629 2.973 1.00 0.00 H new ATOM 0 HB2 SER B 60 0.168 -11.647 3.766 1.00 0.00 H new ATOM 0 HB3 SER B 60 -1.305 -12.553 3.485 1.00 0.00 H new ATOM 0 HG SER B 60 0.456 -11.372 1.576 1.00 0.00 H new ATOM 2294 N ASN B 61 -2.018 -10.740 5.600 1.00 0.00 N ATOM 2295 CA ASN B 61 -2.136 -10.389 7.017 1.00 0.00 C ATOM 2296 C ASN B 61 -0.807 -9.931 7.616 1.00 0.00 C ATOM 2297 O ASN B 61 -0.753 -8.938 8.346 1.00 0.00 O ATOM 2298 CB ASN B 61 -2.654 -11.593 7.805 1.00 0.00 C ATOM 2299 CG ASN B 61 -4.094 -11.933 7.477 1.00 0.00 C ATOM 2300 OD1 ASN B 61 -4.373 -12.662 6.525 1.00 0.00 O ATOM 2301 ND2 ASN B 61 -5.015 -11.428 8.280 1.00 0.00 N ATOM 0 H ASN B 61 -2.366 -11.672 5.377 1.00 0.00 H new ATOM 0 HA ASN B 61 -2.836 -9.556 7.086 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -2.024 -12.457 7.595 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -2.568 -11.388 8.872 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -6.000 -11.638 8.122 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -4.740 -10.828 9.058 1.00 0.00 H new ATOM 2308 N GLU B 62 0.259 -10.651 7.305 1.00 0.00 N ATOM 2309 CA GLU B 62 1.547 -10.405 7.936 1.00 0.00 C ATOM 2310 C GLU B 62 2.218 -9.137 7.413 1.00 0.00 C ATOM 2311 O GLU B 62 2.637 -8.292 8.206 1.00 0.00 O ATOM 2312 CB GLU B 62 2.462 -11.617 7.771 1.00 0.00 C ATOM 2313 CG GLU B 62 1.950 -12.845 8.506 1.00 0.00 C ATOM 2314 CD GLU B 62 2.934 -13.994 8.495 1.00 0.00 C ATOM 2315 OE1 GLU B 62 3.992 -13.880 9.145 1.00 0.00 O ATOM 2316 OE2 GLU B 62 2.639 -15.030 7.864 1.00 0.00 O ATOM 0 H GLU B 62 0.259 -11.408 6.622 1.00 0.00 H new ATOM 0 HA GLU B 62 1.363 -10.246 8.999 1.00 0.00 H new ATOM 0 HB2 GLU B 62 2.562 -11.849 6.711 1.00 0.00 H new ATOM 0 HB3 GLU B 62 3.457 -11.368 8.138 1.00 0.00 H new ATOM 0 HG2 GLU B 62 1.725 -12.576 9.538 1.00 0.00 H new ATOM 0 HG3 GLU B 62 1.015 -13.171 8.051 1.00 0.00 H new ATOM 2323 N GLU B 63 2.311 -8.985 6.095 1.00 0.00 N ATOM 2324 CA GLU B 63 2.947 -7.798 5.520 1.00 0.00 C ATOM 2325 C GLU B 63 2.215 -6.536 5.962 1.00 0.00 C ATOM 2326 O GLU B 63 2.831 -5.498 6.204 1.00 0.00 O ATOM 2327 CB GLU B 63 2.970 -7.848 3.986 1.00 0.00 C ATOM 2328 CG GLU B 63 3.480 -9.151 3.400 1.00 0.00 C ATOM 2329 CD GLU B 63 2.362 -10.141 3.163 1.00 0.00 C ATOM 2330 OE1 GLU B 63 1.757 -10.108 2.064 1.00 0.00 O ATOM 2331 OE2 GLU B 63 2.065 -10.936 4.075 1.00 0.00 O ATOM 0 H GLU B 63 1.961 -9.656 5.412 1.00 0.00 H new ATOM 0 HA GLU B 63 3.975 -7.780 5.882 1.00 0.00 H new ATOM 0 HB2 GLU B 63 1.961 -7.670 3.615 1.00 0.00 H new ATOM 0 HB3 GLU B 63 3.593 -7.032 3.619 1.00 0.00 H new ATOM 0 HG2 GLU B 63 3.992 -8.950 2.459 1.00 0.00 H new ATOM 0 HG3 GLU B 63 4.215 -9.589 4.075 1.00 0.00 H new ATOM 2338 N PHE B 64 0.899 -6.643 6.083 1.00 0.00 N ATOM 2339 CA PHE B 64 0.065 -5.502 6.426 1.00 0.00 C ATOM 2340 C PHE B 64 0.342 -5.040 7.855 1.00 0.00 C ATOM 2341 O PHE B 64 0.544 -3.856 8.104 1.00 0.00 O ATOM 2342 CB PHE B 64 -1.406 -5.872 6.259 1.00 0.00 C ATOM 2343 CG PHE B 64 -2.266 -4.736 5.790 1.00 0.00 C ATOM 2344 CD1 PHE B 64 -2.165 -4.274 4.486 1.00 0.00 C ATOM 2345 CD2 PHE B 64 -3.181 -4.142 6.638 1.00 0.00 C ATOM 2346 CE1 PHE B 64 -2.961 -3.238 4.040 1.00 0.00 C ATOM 2347 CE2 PHE B 64 -3.977 -3.105 6.199 1.00 0.00 C ATOM 2348 CZ PHE B 64 -3.869 -2.653 4.897 1.00 0.00 C ATOM 0 H PHE B 64 0.385 -7.514 5.948 1.00 0.00 H new ATOM 0 HA PHE B 64 0.303 -4.677 5.754 1.00 0.00 H new ATOM 0 HB2 PHE B 64 -1.486 -6.694 5.547 1.00 0.00 H new ATOM 0 HB3 PHE B 64 -1.790 -6.237 7.212 1.00 0.00 H new ATOM 0 HD1 PHE B 64 -1.455 -4.730 3.812 1.00 0.00 H new ATOM 0 HD2 PHE B 64 -3.274 -4.493 7.655 1.00 0.00 H new ATOM 0 HE1 PHE B 64 -2.873 -2.887 3.023 1.00 0.00 H new ATOM 0 HE2 PHE B 64 -4.685 -2.646 6.873 1.00 0.00 H new ATOM 0 HZ PHE B 64 -4.495 -1.843 4.552 1.00 0.00 H new ATOM 2358 N GLN B 65 0.363 -5.981 8.789 1.00 0.00 N ATOM 2359 CA GLN B 65 0.652 -5.664 10.181 1.00 0.00 C ATOM 2360 C GLN B 65 2.066 -5.101 10.285 1.00 0.00 C ATOM 2361 O GLN B 65 2.301 -4.092 10.953 1.00 0.00 O ATOM 2362 CB GLN B 65 0.490 -6.925 11.038 1.00 0.00 C ATOM 2363 CG GLN B 65 0.110 -6.672 12.497 1.00 0.00 C ATOM 2364 CD GLN B 65 1.236 -6.092 13.329 1.00 0.00 C ATOM 2365 OE1 GLN B 65 2.048 -6.830 13.890 1.00 0.00 O ATOM 2366 NE2 GLN B 65 1.272 -4.775 13.446 1.00 0.00 N ATOM 0 H GLN B 65 0.184 -6.969 8.609 1.00 0.00 H new ATOM 0 HA GLN B 65 -0.046 -4.912 10.549 1.00 0.00 H new ATOM 0 HB2 GLN B 65 -0.272 -7.558 10.585 1.00 0.00 H new ATOM 0 HB3 GLN B 65 1.425 -7.485 11.014 1.00 0.00 H new ATOM 0 HG2 GLN B 65 -0.741 -5.991 12.529 1.00 0.00 H new ATOM 0 HG3 GLN B 65 -0.215 -7.610 12.946 1.00 0.00 H new ATOM 0 HE21 GLN B 65 0.580 -4.201 12.964 1.00 0.00 H new ATOM 0 HE22 GLN B 65 1.992 -4.333 14.018 1.00 0.00 H new ATOM 2375 N THR B 66 2.988 -5.739 9.574 1.00 0.00 N ATOM 2376 CA THR B 66 4.382 -5.322 9.549 1.00 0.00 C ATOM 2377 C THR B 66 4.517 -3.845 9.177 1.00 0.00 C ATOM 2378 O THR B 66 5.253 -3.096 9.826 1.00 0.00 O ATOM 2379 CB THR B 66 5.183 -6.178 8.549 1.00 0.00 C ATOM 2380 OG1 THR B 66 5.110 -7.557 8.929 1.00 0.00 O ATOM 2381 CG2 THR B 66 6.640 -5.743 8.484 1.00 0.00 C ATOM 0 H THR B 66 2.789 -6.558 9.000 1.00 0.00 H new ATOM 0 HA THR B 66 4.783 -5.464 10.553 1.00 0.00 H new ATOM 0 HB THR B 66 4.745 -6.040 7.561 1.00 0.00 H new ATOM 0 HG1 THR B 66 4.376 -7.991 8.446 1.00 0.00 H new ATOM 0 HG21 THR B 66 7.175 -6.368 7.769 1.00 0.00 H new ATOM 0 HG22 THR B 66 6.695 -4.701 8.167 1.00 0.00 H new ATOM 0 HG23 THR B 66 7.095 -5.847 9.469 1.00 0.00 H new ATOM 2389 N MET B 67 3.780 -3.422 8.154 1.00 0.00 N ATOM 2390 CA MET B 67 3.890 -2.055 7.668 1.00 0.00 C ATOM 2391 C MET B 67 3.296 -1.066 8.675 1.00 0.00 C ATOM 2392 O MET B 67 3.771 0.057 8.785 1.00 0.00 O ATOM 2393 CB MET B 67 3.235 -1.891 6.286 1.00 0.00 C ATOM 2394 CG MET B 67 1.728 -1.743 6.318 1.00 0.00 C ATOM 2395 SD MET B 67 1.036 -1.328 4.710 1.00 0.00 S ATOM 2396 CE MET B 67 -0.631 -0.896 5.188 1.00 0.00 C ATOM 0 H MET B 67 3.107 -4.001 7.651 1.00 0.00 H new ATOM 0 HA MET B 67 4.951 -1.832 7.557 1.00 0.00 H new ATOM 0 HB2 MET B 67 3.663 -1.016 5.797 1.00 0.00 H new ATOM 0 HB3 MET B 67 3.489 -2.755 5.673 1.00 0.00 H new ATOM 0 HG2 MET B 67 1.283 -2.673 6.671 1.00 0.00 H new ATOM 0 HG3 MET B 67 1.458 -0.968 7.036 1.00 0.00 H new ATOM 0 HE1 MET B 67 -1.211 -0.646 4.300 1.00 0.00 H new ATOM 0 HE2 MET B 67 -1.094 -1.741 5.698 1.00 0.00 H new ATOM 0 HE3 MET B 67 -0.606 -0.037 5.859 1.00 0.00 H new ATOM 2406 N VAL B 68 2.272 -1.489 9.418 1.00 0.00 N ATOM 2407 CA VAL B 68 1.668 -0.637 10.447 1.00 0.00 C ATOM 2408 C VAL B 68 2.720 -0.211 11.475 1.00 0.00 C ATOM 2409 O VAL B 68 2.890 0.980 11.757 1.00 0.00 O ATOM 2410 CB VAL B 68 0.491 -1.354 11.153 1.00 0.00 C ATOM 2411 CG1 VAL B 68 -0.127 -0.494 12.248 1.00 0.00 C ATOM 2412 CG2 VAL B 68 -0.565 -1.735 10.136 1.00 0.00 C ATOM 0 H VAL B 68 1.845 -2.411 9.328 1.00 0.00 H new ATOM 0 HA VAL B 68 1.275 0.252 9.953 1.00 0.00 H new ATOM 0 HB VAL B 68 0.888 -2.252 11.626 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -0.949 -1.036 12.716 1.00 0.00 H new ATOM 0 HG12 VAL B 68 0.629 -0.262 12.998 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -0.504 0.432 11.814 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -1.390 -2.239 10.639 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -0.936 -0.837 9.642 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -0.130 -2.404 9.393 1.00 0.00 H new ATOM 2422 N ASP B 69 3.451 -1.187 12.005 1.00 0.00 N ATOM 2423 CA ASP B 69 4.518 -0.914 12.972 1.00 0.00 C ATOM 2424 C ASP B 69 5.627 -0.058 12.359 1.00 0.00 C ATOM 2425 O ASP B 69 6.007 0.986 12.905 1.00 0.00 O ATOM 2426 CB ASP B 69 5.118 -2.218 13.506 1.00 0.00 C ATOM 2427 CG ASP B 69 4.393 -2.743 14.730 1.00 0.00 C ATOM 2428 OD1 ASP B 69 4.791 -2.379 15.858 1.00 0.00 O ATOM 2429 OD2 ASP B 69 3.441 -3.537 14.575 1.00 0.00 O ATOM 0 H ASP B 69 3.327 -2.175 11.784 1.00 0.00 H new ATOM 0 HA ASP B 69 4.068 -0.361 13.796 1.00 0.00 H new ATOM 0 HB2 ASP B 69 5.089 -2.974 12.721 1.00 0.00 H new ATOM 0 HB3 ASP B 69 6.167 -2.055 13.753 1.00 0.00 H new ATOM 2434 N ALA B 70 6.138 -0.492 11.215 1.00 0.00 N ATOM 2435 CA ALA B 70 7.244 0.203 10.566 1.00 0.00 C ATOM 2436 C ALA B 70 6.854 1.625 10.166 1.00 0.00 C ATOM 2437 O ALA B 70 7.665 2.546 10.261 1.00 0.00 O ATOM 2438 CB ALA B 70 7.728 -0.582 9.361 1.00 0.00 C ATOM 0 H ALA B 70 5.807 -1.319 10.718 1.00 0.00 H new ATOM 0 HA ALA B 70 8.061 0.277 11.284 1.00 0.00 H new ATOM 0 HB1 ALA B 70 8.553 -0.050 8.888 1.00 0.00 H new ATOM 0 HB2 ALA B 70 8.067 -1.567 9.681 1.00 0.00 H new ATOM 0 HB3 ALA B 70 6.912 -0.693 8.647 1.00 0.00 H new ATOM 2444 N PHE B 71 5.608 1.808 9.737 1.00 0.00 N ATOM 2445 CA PHE B 71 5.119 3.136 9.396 1.00 0.00 C ATOM 2446 C PHE B 71 4.728 3.922 10.641 1.00 0.00 C ATOM 2447 O PHE B 71 4.336 5.069 10.544 1.00 0.00 O ATOM 2448 CB PHE B 71 3.939 3.078 8.420 1.00 0.00 C ATOM 2449 CG PHE B 71 4.333 2.758 7.008 1.00 0.00 C ATOM 2450 CD1 PHE B 71 5.455 3.338 6.433 1.00 0.00 C ATOM 2451 CD2 PHE B 71 3.581 1.876 6.253 1.00 0.00 C ATOM 2452 CE1 PHE B 71 5.815 3.045 5.134 1.00 0.00 C ATOM 2453 CE2 PHE B 71 3.936 1.579 4.953 1.00 0.00 C ATOM 2454 CZ PHE B 71 5.054 2.164 4.394 1.00 0.00 C ATOM 0 H PHE B 71 4.926 1.059 9.619 1.00 0.00 H new ATOM 0 HA PHE B 71 5.942 3.653 8.902 1.00 0.00 H new ATOM 0 HB2 PHE B 71 3.229 2.327 8.768 1.00 0.00 H new ATOM 0 HB3 PHE B 71 3.421 4.037 8.434 1.00 0.00 H new ATOM 0 HD1 PHE B 71 6.054 4.027 7.010 1.00 0.00 H new ATOM 0 HD2 PHE B 71 2.706 1.414 6.686 1.00 0.00 H new ATOM 0 HE1 PHE B 71 6.690 3.504 4.698 1.00 0.00 H new ATOM 0 HE2 PHE B 71 3.340 0.890 4.374 1.00 0.00 H new ATOM 0 HZ PHE B 71 5.333 1.932 3.377 1.00 0.00 H new ATOM 2464 N LYS B 72 4.786 3.298 11.811 1.00 0.00 N ATOM 2465 CA LYS B 72 4.751 4.057 13.060 1.00 0.00 C ATOM 2466 C LYS B 72 6.120 4.661 13.301 1.00 0.00 C ATOM 2467 O LYS B 72 6.262 5.717 13.921 1.00 0.00 O ATOM 2468 CB LYS B 72 4.334 3.173 14.247 1.00 0.00 C ATOM 2469 CG LYS B 72 4.600 3.808 15.608 1.00 0.00 C ATOM 2470 CD LYS B 72 3.890 3.075 16.735 1.00 0.00 C ATOM 2471 CE LYS B 72 2.435 3.505 16.855 1.00 0.00 C ATOM 2472 NZ LYS B 72 2.318 4.965 17.105 1.00 0.00 N ATOM 0 H LYS B 72 4.856 2.287 11.924 1.00 0.00 H new ATOM 0 HA LYS B 72 4.006 4.847 12.973 1.00 0.00 H new ATOM 0 HB2 LYS B 72 3.271 2.946 14.164 1.00 0.00 H new ATOM 0 HB3 LYS B 72 4.868 2.225 14.188 1.00 0.00 H new ATOM 0 HG2 LYS B 72 5.673 3.814 15.800 1.00 0.00 H new ATOM 0 HG3 LYS B 72 4.274 4.848 15.591 1.00 0.00 H new ATOM 0 HD2 LYS B 72 3.939 2.001 16.558 1.00 0.00 H new ATOM 0 HD3 LYS B 72 4.405 3.267 17.676 1.00 0.00 H new ATOM 0 HE2 LYS B 72 1.902 3.248 15.940 1.00 0.00 H new ATOM 0 HE3 LYS B 72 1.958 2.956 17.667 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 1.443 5.158 17.633 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 3.136 5.289 17.660 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 2.293 5.472 16.197 1.00 0.00 H new ATOM 2486 N GLY B 73 7.116 3.975 12.775 1.00 0.00 N ATOM 2487 CA GLY B 73 8.486 4.429 12.898 1.00 0.00 C ATOM 2488 C GLY B 73 8.725 5.770 12.223 1.00 0.00 C ATOM 2489 O GLY B 73 9.154 6.727 12.865 1.00 0.00 O ATOM 0 H GLY B 73 7.002 3.102 12.259 1.00 0.00 H new ATOM 0 HA2 GLY B 73 8.744 4.508 13.954 1.00 0.00 H new ATOM 0 HA3 GLY B 73 9.151 3.684 12.462 1.00 0.00 H new ATOM 2493 N ASN B 74 8.438 5.844 10.931 1.00 0.00 N ATOM 2494 CA ASN B 74 8.691 7.061 10.160 1.00 0.00 C ATOM 2495 C ASN B 74 7.510 8.035 10.212 1.00 0.00 C ATOM 2496 O ASN B 74 7.512 8.970 11.016 1.00 0.00 O ATOM 2497 CB ASN B 74 9.052 6.729 8.703 1.00 0.00 C ATOM 2498 CG ASN B 74 8.423 5.437 8.222 1.00 0.00 C ATOM 2499 OD1 ASN B 74 7.258 5.403 7.843 1.00 0.00 O ATOM 2500 ND2 ASN B 74 9.206 4.371 8.224 1.00 0.00 N ATOM 0 H ASN B 74 8.031 5.080 10.392 1.00 0.00 H new ATOM 0 HA ASN B 74 9.543 7.556 10.625 1.00 0.00 H new ATOM 0 HB2 ASN B 74 8.730 7.547 8.058 1.00 0.00 H new ATOM 0 HB3 ASN B 74 10.136 6.657 8.609 1.00 0.00 H new ATOM 0 HD21 ASN B 74 8.846 3.473 7.901 1.00 0.00 H new ATOM 0 HD22 ASN B 74 10.170 4.447 8.549 1.00 0.00 H new ATOM 2507 N LEU B 75 6.501 7.819 9.374 1.00 0.00 N ATOM 2508 CA LEU B 75 5.371 8.747 9.296 1.00 0.00 C ATOM 2509 C LEU B 75 4.432 8.573 10.485 1.00 0.00 C ATOM 2510 O LEU B 75 4.450 7.539 11.139 1.00 0.00 O ATOM 2511 CB LEU B 75 4.565 8.561 7.998 1.00 0.00 C ATOM 2512 CG LEU B 75 5.283 8.915 6.688 1.00 0.00 C ATOM 2513 CD1 LEU B 75 6.109 7.747 6.192 1.00 0.00 C ATOM 2514 CD2 LEU B 75 4.279 9.329 5.623 1.00 0.00 C ATOM 0 H LEU B 75 6.439 7.019 8.744 1.00 0.00 H new ATOM 0 HA LEU B 75 5.796 9.751 9.308 1.00 0.00 H new ATOM 0 HB2 LEU B 75 4.245 7.520 7.941 1.00 0.00 H new ATOM 0 HB3 LEU B 75 3.662 9.168 8.067 1.00 0.00 H new ATOM 0 HG LEU B 75 5.951 9.753 6.888 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.608 8.023 5.263 1.00 0.00 H new ATOM 0 HD12 LEU B 75 6.856 7.486 6.941 1.00 0.00 H new ATOM 0 HD13 LEU B 75 5.458 6.891 6.014 1.00 0.00 H new ATOM 0 HD21 LEU B 75 4.807 9.576 4.702 1.00 0.00 H new ATOM 0 HD22 LEU B 75 3.588 8.507 5.436 1.00 0.00 H new ATOM 0 HD23 LEU B 75 3.722 10.201 5.967 1.00 0.00 H new ATOM 2526 N GLU B 76 3.643 9.613 10.760 1.00 0.00 N ATOM 2527 CA GLU B 76 2.545 9.558 11.732 1.00 0.00 C ATOM 2528 C GLU B 76 2.067 10.972 12.016 1.00 0.00 C ATOM 2529 O GLU B 76 0.865 11.240 12.042 1.00 0.00 O ATOM 2530 CB GLU B 76 2.951 8.874 13.042 1.00 0.00 C ATOM 2531 CG GLU B 76 1.761 8.396 13.857 1.00 0.00 C ATOM 2532 CD GLU B 76 2.159 7.471 14.988 1.00 0.00 C ATOM 2533 OE1 GLU B 76 2.402 6.275 14.723 1.00 0.00 O ATOM 2534 OE2 GLU B 76 2.218 7.930 16.144 1.00 0.00 O ATOM 0 H GLU B 76 3.747 10.524 10.313 1.00 0.00 H new ATOM 0 HA GLU B 76 1.744 8.960 11.297 1.00 0.00 H new ATOM 0 HB2 GLU B 76 3.595 8.024 12.817 1.00 0.00 H new ATOM 0 HB3 GLU B 76 3.539 9.569 13.641 1.00 0.00 H new ATOM 0 HG2 GLU B 76 1.237 9.259 14.267 1.00 0.00 H new ATOM 0 HG3 GLU B 76 1.060 7.880 13.201 1.00 0.00 H new