USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 554 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 147 GLN : amide:sc= -0.527 K(o=-4.7,f=-2.8) USER MOD Set 1.2: A 150 HIS : no HD1:sc= -2.2! K(o=-4.7!,f=-2.8) USER MOD Set 1.3: A 151 GLN : amide:sc= -2! C(o=-4.7!,f=-2.8!) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= 0.659 K(o=0.66,f=-2.1!) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 SER OG : rot -90:sc= -2.88! USER MOD Single : A 107 ASN : amide:sc= -3.06 K(o=-3.1,f=-2.4) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 HIS : no HD1:sc= -0.253 X(o=-0.25,f=0) USER MOD Single : A 116 LYS NZ :NH3+ 158:sc= -0.0441 (180deg=-0.331) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 TYR OH : rot -160:sc= 0.214 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -4.31 K(o=-4.3,f=-3.5!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 62:sc= 1.06 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 ASN : amide:sc= -0.38 X(o=-0.38,f=-0.038) USER MOD Single : A 141 GLN : amide:sc= -0.0547 X(o=-0.055,f=0) USER MOD Single : A 143 GLN : amide:sc= -0.0485 K(o=-0.048,f=-1.6!) USER MOD Single : A 144 ASN : amide:sc= 0.13 X(o=0.13,f=0) USER MOD Single : A 148 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 GLN : amide:sc= 0.375 X(o=0.37,f=-0.0015) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 96 1.382 12.302 -2.121 1.00 0.00 N ATOM 60 CA GLY A 96 1.800 11.195 -1.281 1.00 0.00 C ATOM 61 C GLY A 96 0.651 10.274 -0.921 1.00 0.00 C ATOM 62 O GLY A 96 -0.493 10.715 -0.803 1.00 0.00 O ATOM 0 HA2 GLY A 96 2.572 10.623 -1.796 1.00 0.00 H new ATOM 0 HA3 GLY A 96 2.249 11.585 -0.367 1.00 0.00 H new ATOM 66 N ILE A 97 0.953 8.992 -0.748 1.00 0.00 N ATOM 67 CA ILE A 97 -0.064 8.007 -0.400 1.00 0.00 C ATOM 68 C ILE A 97 0.487 6.967 0.569 1.00 0.00 C ATOM 69 O ILE A 97 1.699 6.759 0.652 1.00 0.00 O ATOM 70 CB ILE A 97 -0.605 7.291 -1.652 1.00 0.00 C ATOM 71 CG1 ILE A 97 0.538 6.617 -2.415 1.00 0.00 C ATOM 72 CG2 ILE A 97 -1.340 8.275 -2.549 1.00 0.00 C ATOM 73 CD1 ILE A 97 0.067 5.656 -3.483 1.00 0.00 C ATOM 0 H ILE A 97 1.894 8.611 -0.843 1.00 0.00 H new ATOM 0 HA ILE A 97 -0.879 8.550 0.079 1.00 0.00 H new ATOM 0 HB ILE A 97 -1.309 6.521 -1.336 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.158 7.385 -2.877 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.170 6.080 -1.707 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.716 7.754 -3.429 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.175 8.712 -2.002 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.656 9.065 -2.860 1.00 0.00 H new ATOM 0 HD11 ILE A 97 0.930 5.216 -3.983 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.529 4.867 -3.025 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -0.540 6.192 -4.213 1.00 0.00 H new ATOM 85 N LEU A 98 -0.410 6.314 1.299 1.00 0.00 N ATOM 86 CA LEU A 98 -0.014 5.292 2.263 1.00 0.00 C ATOM 87 C LEU A 98 -0.382 3.900 1.761 1.00 0.00 C ATOM 88 O LEU A 98 -1.536 3.634 1.425 1.00 0.00 O ATOM 89 CB LEU A 98 -0.681 5.553 3.615 1.00 0.00 C ATOM 90 CG LEU A 98 -0.554 6.974 4.163 1.00 0.00 C ATOM 91 CD1 LEU A 98 -1.318 7.112 5.471 1.00 0.00 C ATOM 92 CD2 LEU A 98 0.910 7.342 4.358 1.00 0.00 C ATOM 0 H LEU A 98 -1.416 6.473 1.242 1.00 0.00 H new ATOM 0 HA LEU A 98 1.068 5.340 2.384 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.740 5.312 3.527 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.257 4.864 4.346 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.988 7.662 3.438 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.216 8.130 5.846 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.372 6.891 5.302 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.914 6.413 6.204 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.981 8.357 4.749 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.369 6.649 5.063 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.430 7.284 3.402 1.00 0.00 H new ATOM 104 N VAL A 99 0.607 3.012 1.715 1.00 0.00 N ATOM 105 CA VAL A 99 0.387 1.645 1.258 1.00 0.00 C ATOM 106 C VAL A 99 0.183 0.698 2.436 1.00 0.00 C ATOM 107 O VAL A 99 1.145 0.232 3.046 1.00 0.00 O ATOM 108 CB VAL A 99 1.567 1.142 0.407 1.00 0.00 C ATOM 109 CG1 VAL A 99 1.543 -0.376 0.305 1.00 0.00 C ATOM 110 CG2 VAL A 99 1.537 1.777 -0.975 1.00 0.00 C ATOM 0 H VAL A 99 1.568 3.215 1.989 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.514 1.657 0.645 1.00 0.00 H new ATOM 0 HB VAL A 99 2.496 1.435 0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.384 -0.713 -0.300 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.617 -0.809 1.303 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.610 -0.695 -0.161 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.378 1.410 -1.562 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.604 1.516 -1.475 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.607 2.861 -0.879 1.00 0.00 H new ATOM 120 N LYS A 100 -1.077 0.417 2.750 1.00 0.00 N ATOM 121 CA LYS A 100 -1.410 -0.476 3.854 1.00 0.00 C ATOM 122 C LYS A 100 -1.866 -1.836 3.334 1.00 0.00 C ATOM 123 O LYS A 100 -2.283 -1.963 2.184 1.00 0.00 O ATOM 124 CB LYS A 100 -2.505 0.143 4.725 1.00 0.00 C ATOM 125 CG LYS A 100 -2.151 1.520 5.260 1.00 0.00 C ATOM 126 CD LYS A 100 -2.899 1.827 6.547 1.00 0.00 C ATOM 127 CE LYS A 100 -2.242 2.964 7.315 1.00 0.00 C ATOM 128 NZ LYS A 100 -3.210 3.666 8.202 1.00 0.00 N ATOM 0 H LYS A 100 -1.885 0.795 2.255 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.513 -0.619 4.457 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.424 0.214 4.143 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -2.710 -0.522 5.564 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -1.077 1.577 5.440 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -2.389 2.275 4.511 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -3.931 2.091 6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -2.931 0.935 7.172 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.420 2.571 7.913 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -1.811 3.676 6.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -2.724 4.434 8.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -3.981 4.063 7.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -3.602 2.992 8.890 1.00 0.00 H new ATOM 142 N ASN A 101 -1.786 -2.849 4.191 1.00 0.00 N ATOM 143 CA ASN A 101 -2.192 -4.199 3.818 1.00 0.00 C ATOM 144 C ASN A 101 -1.155 -4.846 2.905 1.00 0.00 C ATOM 145 O ASN A 101 -1.498 -5.443 1.884 1.00 0.00 O ATOM 146 CB ASN A 101 -3.554 -4.170 3.122 1.00 0.00 C ATOM 147 CG ASN A 101 -4.307 -5.478 3.272 1.00 0.00 C ATOM 148 OD1 ASN A 101 -3.916 -6.347 4.051 1.00 0.00 O ATOM 149 ND2 ASN A 101 -5.394 -5.624 2.522 1.00 0.00 N ATOM 0 H ASN A 101 -1.444 -2.760 5.148 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.269 -4.793 4.728 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -4.153 -3.359 3.536 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -3.413 -3.954 2.063 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.941 -6.483 2.579 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -5.681 -4.877 1.890 1.00 0.00 H new ATOM 156 N LEU A 102 0.113 -4.725 3.281 1.00 0.00 N ATOM 157 CA LEU A 102 1.202 -5.298 2.497 1.00 0.00 C ATOM 158 C LEU A 102 1.445 -6.753 2.885 1.00 0.00 C ATOM 159 O LEU A 102 1.118 -7.189 3.989 1.00 0.00 O ATOM 160 CB LEU A 102 2.482 -4.485 2.693 1.00 0.00 C ATOM 161 CG LEU A 102 2.541 -3.140 1.968 1.00 0.00 C ATOM 162 CD1 LEU A 102 3.833 -2.410 2.301 1.00 0.00 C ATOM 163 CD2 LEU A 102 2.409 -3.337 0.465 1.00 0.00 C ATOM 0 H LEU A 102 0.413 -4.235 4.124 1.00 0.00 H new ATOM 0 HA LEU A 102 0.916 -5.264 1.446 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.615 -4.306 3.760 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.327 -5.090 2.364 1.00 0.00 H new ATOM 0 HG LEU A 102 1.705 -2.529 2.308 1.00 0.00 H new ATOM 0 HD11 LEU A 102 3.857 -1.455 1.776 1.00 0.00 H new ATOM 0 HD12 LEU A 102 3.885 -2.235 3.376 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.684 -3.016 1.990 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.453 -2.369 -0.034 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.224 -3.967 0.108 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.456 -3.816 0.243 1.00 0.00 H new ATOM 175 N PRO A 103 2.035 -7.523 1.959 1.00 0.00 N ATOM 176 CA PRO A 103 2.338 -8.940 2.183 1.00 0.00 C ATOM 177 C PRO A 103 3.455 -9.139 3.201 1.00 0.00 C ATOM 178 O PRO A 103 3.796 -8.223 3.948 1.00 0.00 O ATOM 179 CB PRO A 103 2.779 -9.431 0.802 1.00 0.00 C ATOM 180 CG PRO A 103 3.285 -8.212 0.110 1.00 0.00 C ATOM 181 CD PRO A 103 2.451 -7.070 0.621 1.00 0.00 C ATOM 0 HA PRO A 103 1.483 -9.481 2.589 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.555 -10.192 0.882 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.948 -9.879 0.257 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.341 -8.051 0.326 1.00 0.00 H new ATOM 0 HG3 PRO A 103 3.192 -8.310 -0.972 1.00 0.00 H new ATOM 0 HD2 PRO A 103 3.024 -6.144 0.670 1.00 0.00 H new ATOM 0 HD3 PRO A 103 1.593 -6.879 -0.023 1.00 0.00 H new ATOM 189 N GLN A 104 4.020 -10.342 3.224 1.00 0.00 N ATOM 190 CA GLN A 104 5.099 -10.661 4.151 1.00 0.00 C ATOM 191 C GLN A 104 6.458 -10.346 3.534 1.00 0.00 C ATOM 192 O GLN A 104 7.410 -10.012 4.241 1.00 0.00 O ATOM 193 CB GLN A 104 5.037 -12.136 4.552 1.00 0.00 C ATOM 194 CG GLN A 104 5.292 -13.091 3.397 1.00 0.00 C ATOM 195 CD GLN A 104 5.478 -14.524 3.855 1.00 0.00 C ATOM 196 OE1 GLN A 104 4.514 -15.204 4.209 1.00 0.00 O ATOM 197 NE2 GLN A 104 6.721 -14.991 3.851 1.00 0.00 N ATOM 0 H GLN A 104 3.749 -11.111 2.612 1.00 0.00 H new ATOM 0 HA GLN A 104 4.973 -10.045 5.041 1.00 0.00 H new ATOM 0 HB2 GLN A 104 5.771 -12.322 5.336 1.00 0.00 H new ATOM 0 HB3 GLN A 104 4.056 -12.347 4.978 1.00 0.00 H new ATOM 0 HG2 GLN A 104 4.456 -13.042 2.699 1.00 0.00 H new ATOM 0 HG3 GLN A 104 6.180 -12.769 2.854 1.00 0.00 H new ATOM 0 HE21 GLN A 104 7.490 -14.392 3.550 1.00 0.00 H new ATOM 0 HE22 GLN A 104 6.907 -15.949 4.149 1.00 0.00 H new ATOM 206 N ASP A 105 6.542 -10.456 2.213 1.00 0.00 N ATOM 207 CA ASP A 105 7.785 -10.182 1.500 1.00 0.00 C ATOM 208 C ASP A 105 7.662 -8.914 0.662 1.00 0.00 C ATOM 209 O ASP A 105 8.207 -8.831 -0.439 1.00 0.00 O ATOM 210 CB ASP A 105 8.155 -11.366 0.606 1.00 0.00 C ATOM 211 CG ASP A 105 9.449 -11.137 -0.151 1.00 0.00 C ATOM 212 OD1 ASP A 105 10.425 -10.669 0.471 1.00 0.00 O ATOM 213 OD2 ASP A 105 9.485 -11.425 -1.366 1.00 0.00 O ATOM 0 H ASP A 105 5.764 -10.733 1.614 1.00 0.00 H new ATOM 0 HA ASP A 105 8.574 -10.033 2.237 1.00 0.00 H new ATOM 0 HB2 ASP A 105 8.249 -12.264 1.217 1.00 0.00 H new ATOM 0 HB3 ASP A 105 7.349 -11.547 -0.105 1.00 0.00 H new ATOM 218 N SER A 106 6.943 -7.929 1.189 1.00 0.00 N ATOM 219 CA SER A 106 6.744 -6.666 0.487 1.00 0.00 C ATOM 220 C SER A 106 8.045 -5.871 0.422 1.00 0.00 C ATOM 221 O SER A 106 8.890 -5.969 1.310 1.00 0.00 O ATOM 222 CB SER A 106 5.661 -5.838 1.180 1.00 0.00 C ATOM 223 OG SER A 106 4.974 -5.018 0.251 1.00 0.00 O ATOM 0 H SER A 106 6.488 -7.981 2.100 1.00 0.00 H new ATOM 0 HA SER A 106 6.424 -6.890 -0.530 1.00 0.00 H new ATOM 0 HB2 SER A 106 4.953 -6.502 1.677 1.00 0.00 H new ATOM 0 HB3 SER A 106 6.113 -5.217 1.954 1.00 0.00 H new ATOM 0 HG SER A 106 5.425 -4.151 0.184 1.00 0.00 H new ATOM 229 N ASN A 107 8.197 -5.083 -0.638 1.00 0.00 N ATOM 230 CA ASN A 107 9.394 -4.271 -0.821 1.00 0.00 C ATOM 231 C ASN A 107 9.102 -3.064 -1.708 1.00 0.00 C ATOM 232 O ASN A 107 8.039 -2.974 -2.322 1.00 0.00 O ATOM 233 CB ASN A 107 10.516 -5.110 -1.435 1.00 0.00 C ATOM 234 CG ASN A 107 10.831 -6.345 -0.612 1.00 0.00 C ATOM 235 OD1 ASN A 107 11.479 -6.261 0.431 1.00 0.00 O ATOM 236 ND2 ASN A 107 10.372 -7.500 -1.080 1.00 0.00 N ATOM 0 H ASN A 107 7.506 -4.990 -1.383 1.00 0.00 H new ATOM 0 HA ASN A 107 9.712 -3.912 0.158 1.00 0.00 H new ATOM 0 HB2 ASN A 107 10.231 -5.411 -2.443 1.00 0.00 H new ATOM 0 HB3 ASN A 107 11.414 -4.499 -1.527 1.00 0.00 H new ATOM 0 HD21 ASN A 107 10.552 -8.365 -0.570 1.00 0.00 H new ATOM 0 HD22 ASN A 107 9.839 -7.522 -1.949 1.00 0.00 H new ATOM 243 N CYS A 108 10.054 -2.139 -1.770 1.00 0.00 N ATOM 244 CA CYS A 108 9.901 -0.938 -2.582 1.00 0.00 C ATOM 245 C CYS A 108 10.041 -1.262 -4.066 1.00 0.00 C ATOM 246 O CYS A 108 9.112 -1.057 -4.847 1.00 0.00 O ATOM 247 CB CYS A 108 10.939 0.112 -2.178 1.00 0.00 C ATOM 248 SG CYS A 108 10.816 1.674 -3.106 1.00 0.00 S ATOM 0 H CYS A 108 10.940 -2.198 -1.267 1.00 0.00 H new ATOM 0 HA CYS A 108 8.902 -0.538 -2.409 1.00 0.00 H new ATOM 0 HB2 CYS A 108 10.830 0.324 -1.114 1.00 0.00 H new ATOM 0 HB3 CYS A 108 11.936 -0.305 -2.320 1.00 0.00 H new ATOM 253 N GLN A 109 11.208 -1.771 -4.448 1.00 0.00 N ATOM 254 CA GLN A 109 11.470 -2.123 -5.838 1.00 0.00 C ATOM 255 C GLN A 109 10.206 -2.644 -6.515 1.00 0.00 C ATOM 256 O GLN A 109 9.863 -2.222 -7.619 1.00 0.00 O ATOM 257 CB GLN A 109 12.576 -3.176 -5.920 1.00 0.00 C ATOM 258 CG GLN A 109 13.944 -2.654 -5.510 1.00 0.00 C ATOM 259 CD GLN A 109 15.079 -3.409 -6.174 1.00 0.00 C ATOM 260 OE1 GLN A 109 15.416 -4.524 -5.775 1.00 0.00 O ATOM 261 NE2 GLN A 109 15.677 -2.803 -7.193 1.00 0.00 N ATOM 0 H GLN A 109 11.987 -1.949 -3.814 1.00 0.00 H new ATOM 0 HA GLN A 109 11.796 -1.223 -6.359 1.00 0.00 H new ATOM 0 HB2 GLN A 109 12.312 -4.019 -5.282 1.00 0.00 H new ATOM 0 HB3 GLN A 109 12.631 -3.554 -6.941 1.00 0.00 H new ATOM 0 HG2 GLN A 109 14.017 -1.597 -5.766 1.00 0.00 H new ATOM 0 HG3 GLN A 109 14.048 -2.728 -4.427 1.00 0.00 H new ATOM 0 HE21 GLN A 109 15.365 -1.879 -7.491 1.00 0.00 H new ATOM 0 HE22 GLN A 109 16.448 -3.262 -7.678 1.00 0.00 H new ATOM 270 N GLU A 110 9.517 -3.562 -5.845 1.00 0.00 N ATOM 271 CA GLU A 110 8.291 -4.140 -6.383 1.00 0.00 C ATOM 272 C GLU A 110 7.240 -3.060 -6.623 1.00 0.00 C ATOM 273 O GLU A 110 6.654 -2.978 -7.703 1.00 0.00 O ATOM 274 CB GLU A 110 7.739 -5.201 -5.428 1.00 0.00 C ATOM 275 CG GLU A 110 6.914 -6.273 -6.121 1.00 0.00 C ATOM 276 CD GLU A 110 7.532 -6.733 -7.426 1.00 0.00 C ATOM 277 OE1 GLU A 110 8.696 -7.187 -7.405 1.00 0.00 O ATOM 278 OE2 GLU A 110 6.853 -6.639 -8.470 1.00 0.00 O ATOM 0 H GLU A 110 9.787 -3.921 -4.929 1.00 0.00 H new ATOM 0 HA GLU A 110 8.529 -4.609 -7.337 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.570 -5.675 -4.905 1.00 0.00 H new ATOM 0 HB3 GLU A 110 7.124 -4.713 -4.672 1.00 0.00 H new ATOM 0 HG2 GLU A 110 6.803 -7.128 -5.454 1.00 0.00 H new ATOM 0 HG3 GLU A 110 5.913 -5.888 -6.314 1.00 0.00 H new ATOM 285 N VAL A 111 7.006 -2.234 -5.609 1.00 0.00 N ATOM 286 CA VAL A 111 6.026 -1.159 -5.708 1.00 0.00 C ATOM 287 C VAL A 111 6.407 -0.169 -6.804 1.00 0.00 C ATOM 288 O VAL A 111 5.564 0.249 -7.598 1.00 0.00 O ATOM 289 CB VAL A 111 5.886 -0.402 -4.374 1.00 0.00 C ATOM 290 CG1 VAL A 111 4.901 0.748 -4.514 1.00 0.00 C ATOM 291 CG2 VAL A 111 5.454 -1.352 -3.267 1.00 0.00 C ATOM 0 H VAL A 111 7.482 -2.289 -4.709 1.00 0.00 H new ATOM 0 HA VAL A 111 5.071 -1.622 -5.956 1.00 0.00 H new ATOM 0 HB VAL A 111 6.858 0.014 -4.108 1.00 0.00 H new ATOM 0 HG11 VAL A 111 4.815 1.271 -3.562 1.00 0.00 H new ATOM 0 HG12 VAL A 111 5.256 1.440 -5.278 1.00 0.00 H new ATOM 0 HG13 VAL A 111 3.925 0.358 -4.803 1.00 0.00 H new ATOM 0 HG21 VAL A 111 5.360 -0.801 -2.331 1.00 0.00 H new ATOM 0 HG22 VAL A 111 4.493 -1.797 -3.524 1.00 0.00 H new ATOM 0 HG23 VAL A 111 6.199 -2.139 -3.151 1.00 0.00 H new ATOM 301 N HIS A 112 7.682 0.203 -6.841 1.00 0.00 N ATOM 302 CA HIS A 112 8.176 1.143 -7.840 1.00 0.00 C ATOM 303 C HIS A 112 7.594 0.830 -9.215 1.00 0.00 C ATOM 304 O HIS A 112 6.878 1.644 -9.798 1.00 0.00 O ATOM 305 CB HIS A 112 9.703 1.104 -7.899 1.00 0.00 C ATOM 306 CG HIS A 112 10.321 2.408 -8.299 1.00 0.00 C ATOM 307 ND1 HIS A 112 10.309 2.881 -9.594 1.00 0.00 N ATOM 308 CD2 HIS A 112 10.971 3.342 -7.565 1.00 0.00 C ATOM 309 CE1 HIS A 112 10.926 4.048 -9.640 1.00 0.00 C ATOM 310 NE2 HIS A 112 11.337 4.351 -8.422 1.00 0.00 N ATOM 0 H HIS A 112 8.392 -0.132 -6.190 1.00 0.00 H new ATOM 0 HA HIS A 112 7.857 2.144 -7.549 1.00 0.00 H new ATOM 0 HB2 HIS A 112 10.089 0.813 -6.922 1.00 0.00 H new ATOM 0 HB3 HIS A 112 10.011 0.333 -8.606 1.00 0.00 H new ATOM 0 HD2 HIS A 112 11.165 3.301 -6.503 1.00 0.00 H new ATOM 0 HE1 HIS A 112 11.070 4.652 -10.524 1.00 0.00 H new ATOM 0 HE2 HIS A 112 11.844 5.197 -8.160 1.00 0.00 H new ATOM 319 N ASP A 113 7.908 -0.355 -9.729 1.00 0.00 N ATOM 320 CA ASP A 113 7.416 -0.776 -11.036 1.00 0.00 C ATOM 321 C ASP A 113 5.899 -0.636 -11.117 1.00 0.00 C ATOM 322 O ASP A 113 5.364 -0.120 -12.099 1.00 0.00 O ATOM 323 CB ASP A 113 7.823 -2.224 -11.315 1.00 0.00 C ATOM 324 CG ASP A 113 8.011 -2.498 -12.794 1.00 0.00 C ATOM 325 OD1 ASP A 113 7.083 -2.199 -13.575 1.00 0.00 O ATOM 326 OD2 ASP A 113 9.085 -3.011 -13.170 1.00 0.00 O ATOM 0 H ASP A 113 8.501 -1.040 -9.261 1.00 0.00 H new ATOM 0 HA ASP A 113 7.863 -0.129 -11.791 1.00 0.00 H new ATOM 0 HB2 ASP A 113 8.750 -2.446 -10.787 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.061 -2.895 -10.918 1.00 0.00 H new ATOM 331 N LEU A 114 5.211 -1.098 -10.079 1.00 0.00 N ATOM 332 CA LEU A 114 3.755 -1.026 -10.032 1.00 0.00 C ATOM 333 C LEU A 114 3.275 0.408 -10.233 1.00 0.00 C ATOM 334 O LEU A 114 2.343 0.660 -10.999 1.00 0.00 O ATOM 335 CB LEU A 114 3.240 -1.566 -8.697 1.00 0.00 C ATOM 336 CG LEU A 114 1.734 -1.451 -8.463 1.00 0.00 C ATOM 337 CD1 LEU A 114 0.985 -2.486 -9.289 1.00 0.00 C ATOM 338 CD2 LEU A 114 1.410 -1.611 -6.984 1.00 0.00 C ATOM 0 H LEU A 114 5.638 -1.527 -9.258 1.00 0.00 H new ATOM 0 HA LEU A 114 3.359 -1.640 -10.841 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.520 -2.617 -8.620 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.754 -1.040 -7.893 1.00 0.00 H new ATOM 0 HG LEU A 114 1.411 -0.459 -8.780 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.086 -2.389 -9.110 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.192 -2.326 -10.347 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.312 -3.486 -9.003 1.00 0.00 H new ATOM 0 HD21 LEU A 114 0.333 -1.526 -6.836 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.747 -2.589 -6.641 1.00 0.00 H new ATOM 0 HD23 LEU A 114 1.917 -0.832 -6.414 1.00 0.00 H new ATOM 350 N LEU A 115 3.917 1.344 -9.544 1.00 0.00 N ATOM 351 CA LEU A 115 3.558 2.754 -9.648 1.00 0.00 C ATOM 352 C LEU A 115 4.440 3.467 -10.668 1.00 0.00 C ATOM 353 O LEU A 115 4.800 4.630 -10.488 1.00 0.00 O ATOM 354 CB LEU A 115 3.683 3.435 -8.284 1.00 0.00 C ATOM 355 CG LEU A 115 2.521 3.215 -7.315 1.00 0.00 C ATOM 356 CD1 LEU A 115 2.946 3.537 -5.890 1.00 0.00 C ATOM 357 CD2 LEU A 115 1.322 4.059 -7.719 1.00 0.00 C ATOM 0 H LEU A 115 4.690 1.152 -8.906 1.00 0.00 H new ATOM 0 HA LEU A 115 2.523 2.816 -9.984 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.598 3.084 -7.808 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.798 4.507 -8.445 1.00 0.00 H new ATOM 0 HG LEU A 115 2.232 2.165 -7.358 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.106 3.375 -5.214 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.774 2.889 -5.602 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.263 4.578 -5.831 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.505 3.889 -7.018 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.598 5.113 -7.706 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.002 3.780 -8.723 1.00 0.00 H new ATOM 369 N LYS A 116 4.782 2.762 -11.741 1.00 0.00 N ATOM 370 CA LYS A 116 5.619 3.327 -12.793 1.00 0.00 C ATOM 371 C LYS A 116 4.968 4.566 -13.400 1.00 0.00 C ATOM 372 O LYS A 116 5.627 5.583 -13.616 1.00 0.00 O ATOM 373 CB LYS A 116 5.874 2.286 -13.885 1.00 0.00 C ATOM 374 CG LYS A 116 4.631 1.917 -14.676 1.00 0.00 C ATOM 375 CD LYS A 116 4.941 0.894 -15.757 1.00 0.00 C ATOM 376 CE LYS A 116 4.795 -0.528 -15.237 1.00 0.00 C ATOM 377 NZ LYS A 116 3.372 -0.875 -14.964 1.00 0.00 N ATOM 0 H LYS A 116 4.492 1.798 -11.905 1.00 0.00 H new ATOM 0 HA LYS A 116 6.570 3.619 -12.348 1.00 0.00 H new ATOM 0 HB2 LYS A 116 6.630 2.669 -14.570 1.00 0.00 H new ATOM 0 HB3 LYS A 116 6.284 1.385 -13.428 1.00 0.00 H new ATOM 0 HG2 LYS A 116 3.875 1.517 -14.001 1.00 0.00 H new ATOM 0 HG3 LYS A 116 4.209 2.813 -15.132 1.00 0.00 H new ATOM 0 HD2 LYS A 116 4.271 1.043 -16.604 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.956 1.046 -16.123 1.00 0.00 H new ATOM 0 HE2 LYS A 116 5.205 -1.226 -15.967 1.00 0.00 H new ATOM 0 HE3 LYS A 116 5.379 -0.642 -14.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 3.258 -1.909 -14.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 3.098 -0.508 -14.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 2.765 -0.451 -15.694 1.00 0.00 H new ATOM 391 N ASP A 117 3.671 4.474 -13.671 1.00 0.00 N ATOM 392 CA ASP A 117 2.930 5.589 -14.250 1.00 0.00 C ATOM 393 C ASP A 117 3.227 6.885 -13.504 1.00 0.00 C ATOM 394 O ASP A 117 3.461 7.927 -14.118 1.00 0.00 O ATOM 395 CB ASP A 117 1.428 5.301 -14.219 1.00 0.00 C ATOM 396 CG ASP A 117 1.098 3.892 -14.670 1.00 0.00 C ATOM 397 OD1 ASP A 117 1.074 3.652 -15.896 1.00 0.00 O ATOM 398 OD2 ASP A 117 0.864 3.029 -13.799 1.00 0.00 O ATOM 0 H ASP A 117 3.111 3.639 -13.499 1.00 0.00 H new ATOM 0 HA ASP A 117 3.249 5.706 -15.286 1.00 0.00 H new ATOM 0 HB2 ASP A 117 1.053 5.452 -13.207 1.00 0.00 H new ATOM 0 HB3 ASP A 117 0.911 6.015 -14.860 1.00 0.00 H new ATOM 403 N TYR A 118 3.217 6.814 -12.178 1.00 0.00 N ATOM 404 CA TYR A 118 3.482 7.983 -11.347 1.00 0.00 C ATOM 405 C TYR A 118 4.960 8.064 -10.976 1.00 0.00 C ATOM 406 O TYR A 118 5.616 7.043 -10.770 1.00 0.00 O ATOM 407 CB TYR A 118 2.628 7.939 -10.079 1.00 0.00 C ATOM 408 CG TYR A 118 1.205 7.490 -10.323 1.00 0.00 C ATOM 409 CD1 TYR A 118 0.860 6.146 -10.266 1.00 0.00 C ATOM 410 CD2 TYR A 118 0.205 8.411 -10.612 1.00 0.00 C ATOM 411 CE1 TYR A 118 -0.439 5.731 -10.488 1.00 0.00 C ATOM 412 CE2 TYR A 118 -1.097 8.005 -10.835 1.00 0.00 C ATOM 413 CZ TYR A 118 -1.413 6.664 -10.772 1.00 0.00 C ATOM 414 OH TYR A 118 -2.709 6.256 -10.995 1.00 0.00 O ATOM 0 H TYR A 118 3.028 5.959 -11.655 1.00 0.00 H new ATOM 0 HA TYR A 118 3.221 8.872 -11.922 1.00 0.00 H new ATOM 0 HB2 TYR A 118 3.094 7.265 -9.360 1.00 0.00 H new ATOM 0 HB3 TYR A 118 2.615 8.930 -9.625 1.00 0.00 H new ATOM 0 HD1 TYR A 118 1.621 5.412 -10.044 1.00 0.00 H new ATOM 0 HD2 TYR A 118 0.450 9.462 -10.663 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -0.690 4.682 -10.439 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -1.863 8.734 -11.057 1.00 0.00 H new ATOM 0 HH TYR A 118 -3.271 7.037 -11.180 1.00 0.00 H new ATOM 424 N ASP A 119 5.476 9.285 -10.892 1.00 0.00 N ATOM 425 CA ASP A 119 6.875 9.501 -10.544 1.00 0.00 C ATOM 426 C ASP A 119 7.079 9.416 -9.034 1.00 0.00 C ATOM 427 O ASP A 119 6.441 10.140 -8.269 1.00 0.00 O ATOM 428 CB ASP A 119 7.347 10.862 -11.059 1.00 0.00 C ATOM 429 CG ASP A 119 8.846 10.909 -11.280 1.00 0.00 C ATOM 430 OD1 ASP A 119 9.399 9.927 -11.817 1.00 0.00 O ATOM 431 OD2 ASP A 119 9.467 11.930 -10.916 1.00 0.00 O ATOM 0 H ASP A 119 4.946 10.140 -11.060 1.00 0.00 H new ATOM 0 HA ASP A 119 7.466 8.717 -11.017 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.837 11.090 -11.995 1.00 0.00 H new ATOM 0 HB3 ASP A 119 7.063 11.636 -10.345 1.00 0.00 H new ATOM 436 N LEU A 120 7.972 8.527 -8.612 1.00 0.00 N ATOM 437 CA LEU A 120 8.259 8.347 -7.194 1.00 0.00 C ATOM 438 C LEU A 120 9.432 9.220 -6.760 1.00 0.00 C ATOM 439 O LEU A 120 10.454 9.291 -7.444 1.00 0.00 O ATOM 440 CB LEU A 120 8.567 6.877 -6.899 1.00 0.00 C ATOM 441 CG LEU A 120 7.375 5.921 -6.939 1.00 0.00 C ATOM 442 CD1 LEU A 120 6.987 5.611 -8.377 1.00 0.00 C ATOM 443 CD2 LEU A 120 7.693 4.639 -6.183 1.00 0.00 C ATOM 0 H LEU A 120 8.509 7.920 -9.232 1.00 0.00 H new ATOM 0 HA LEU A 120 7.377 8.649 -6.629 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.309 6.531 -7.618 1.00 0.00 H new ATOM 0 HB3 LEU A 120 9.025 6.813 -5.912 1.00 0.00 H new ATOM 0 HG LEU A 120 6.529 6.406 -6.452 1.00 0.00 H new ATOM 0 HD11 LEU A 120 6.137 4.929 -8.385 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.716 6.535 -8.888 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.830 5.147 -8.889 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.833 3.971 -6.222 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.553 4.151 -6.641 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.921 4.876 -5.144 1.00 0.00 H new ATOM 455 N LYS A 121 9.279 9.883 -5.619 1.00 0.00 N ATOM 456 CA LYS A 121 10.326 10.750 -5.091 1.00 0.00 C ATOM 457 C LYS A 121 10.988 10.121 -3.869 1.00 0.00 C ATOM 458 O LYS A 121 12.204 10.206 -3.697 1.00 0.00 O ATOM 459 CB LYS A 121 9.746 12.118 -4.723 1.00 0.00 C ATOM 460 CG LYS A 121 9.204 12.889 -5.914 1.00 0.00 C ATOM 461 CD LYS A 121 9.215 14.387 -5.661 1.00 0.00 C ATOM 462 CE LYS A 121 8.796 15.165 -6.899 1.00 0.00 C ATOM 463 NZ LYS A 121 9.963 15.507 -7.759 1.00 0.00 N ATOM 0 H LYS A 121 8.439 9.837 -5.042 1.00 0.00 H new ATOM 0 HA LYS A 121 11.082 10.879 -5.866 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.946 11.980 -3.995 1.00 0.00 H new ATOM 0 HB3 LYS A 121 10.520 12.713 -4.237 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.802 12.664 -6.797 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.186 12.563 -6.127 1.00 0.00 H new ATOM 0 HD2 LYS A 121 8.542 14.623 -4.837 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.214 14.698 -5.355 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.081 14.576 -7.474 1.00 0.00 H new ATOM 0 HE3 LYS A 121 8.286 16.080 -6.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.637 16.037 -8.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 10.633 16.090 -7.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.435 14.633 -8.067 1.00 0.00 H new ATOM 477 N TYR A 122 10.181 9.491 -3.023 1.00 0.00 N ATOM 478 CA TYR A 122 10.688 8.848 -1.817 1.00 0.00 C ATOM 479 C TYR A 122 9.803 7.674 -1.411 1.00 0.00 C ATOM 480 O TYR A 122 8.582 7.802 -1.325 1.00 0.00 O ATOM 481 CB TYR A 122 10.770 9.859 -0.671 1.00 0.00 C ATOM 482 CG TYR A 122 11.400 9.302 0.585 1.00 0.00 C ATOM 483 CD1 TYR A 122 12.781 9.280 0.742 1.00 0.00 C ATOM 484 CD2 TYR A 122 10.616 8.797 1.614 1.00 0.00 C ATOM 485 CE1 TYR A 122 13.361 8.771 1.888 1.00 0.00 C ATOM 486 CE2 TYR A 122 11.187 8.287 2.764 1.00 0.00 C ATOM 487 CZ TYR A 122 12.560 8.276 2.896 1.00 0.00 C ATOM 488 OH TYR A 122 13.135 7.769 4.039 1.00 0.00 O ATOM 0 H TYR A 122 9.172 9.412 -3.150 1.00 0.00 H new ATOM 0 HA TYR A 122 11.687 8.469 -2.031 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.344 10.725 -1.002 1.00 0.00 H new ATOM 0 HB3 TYR A 122 9.766 10.213 -0.437 1.00 0.00 H new ATOM 0 HD1 TYR A 122 13.411 9.667 -0.045 1.00 0.00 H new ATOM 0 HD2 TYR A 122 9.541 8.803 1.513 1.00 0.00 H new ATOM 0 HE1 TYR A 122 14.436 8.761 1.994 1.00 0.00 H new ATOM 0 HE2 TYR A 122 10.562 7.899 3.555 1.00 0.00 H new ATOM 0 HH TYR A 122 12.494 7.186 4.497 1.00 0.00 H new ATOM 498 N CYS A 123 10.429 6.528 -1.162 1.00 0.00 N ATOM 499 CA CYS A 123 9.702 5.329 -0.765 1.00 0.00 C ATOM 500 C CYS A 123 10.314 4.711 0.488 1.00 0.00 C ATOM 501 O CYS A 123 11.522 4.482 0.554 1.00 0.00 O ATOM 502 CB CYS A 123 9.702 4.307 -1.904 1.00 0.00 C ATOM 503 SG CYS A 123 11.142 3.191 -1.900 1.00 0.00 S ATOM 0 H CYS A 123 11.439 6.405 -1.228 1.00 0.00 H new ATOM 0 HA CYS A 123 8.674 5.615 -0.542 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.792 3.710 -1.842 1.00 0.00 H new ATOM 0 HB3 CYS A 123 9.670 4.839 -2.855 1.00 0.00 H new ATOM 508 N TYR A 124 9.473 4.443 1.480 1.00 0.00 N ATOM 509 CA TYR A 124 9.931 3.854 2.733 1.00 0.00 C ATOM 510 C TYR A 124 9.087 2.638 3.104 1.00 0.00 C ATOM 511 O TYR A 124 7.897 2.759 3.395 1.00 0.00 O ATOM 512 CB TYR A 124 9.875 4.889 3.858 1.00 0.00 C ATOM 513 CG TYR A 124 10.711 4.519 5.063 1.00 0.00 C ATOM 514 CD1 TYR A 124 12.065 4.828 5.114 1.00 0.00 C ATOM 515 CD2 TYR A 124 10.148 3.859 6.148 1.00 0.00 C ATOM 516 CE1 TYR A 124 12.833 4.492 6.212 1.00 0.00 C ATOM 517 CE2 TYR A 124 10.908 3.520 7.251 1.00 0.00 C ATOM 518 CZ TYR A 124 12.250 3.838 7.278 1.00 0.00 C ATOM 519 OH TYR A 124 13.011 3.501 8.374 1.00 0.00 O ATOM 0 H TYR A 124 8.470 4.624 1.441 1.00 0.00 H new ATOM 0 HA TYR A 124 10.963 3.530 2.597 1.00 0.00 H new ATOM 0 HB2 TYR A 124 10.214 5.851 3.473 1.00 0.00 H new ATOM 0 HB3 TYR A 124 8.839 5.018 4.171 1.00 0.00 H new ATOM 0 HD1 TYR A 124 12.525 5.339 4.281 1.00 0.00 H new ATOM 0 HD2 TYR A 124 9.098 3.606 6.129 1.00 0.00 H new ATOM 0 HE1 TYR A 124 13.884 4.740 6.236 1.00 0.00 H new ATOM 0 HE2 TYR A 124 10.454 3.009 8.087 1.00 0.00 H new ATOM 0 HH TYR A 124 12.449 3.047 9.036 1.00 0.00 H new ATOM 529 N VAL A 125 9.713 1.465 3.090 1.00 0.00 N ATOM 530 CA VAL A 125 9.022 0.226 3.426 1.00 0.00 C ATOM 531 C VAL A 125 9.207 -0.125 4.898 1.00 0.00 C ATOM 532 O VAL A 125 10.332 -0.187 5.395 1.00 0.00 O ATOM 533 CB VAL A 125 9.523 -0.947 2.563 1.00 0.00 C ATOM 534 CG1 VAL A 125 8.791 -2.230 2.929 1.00 0.00 C ATOM 535 CG2 VAL A 125 9.354 -0.631 1.085 1.00 0.00 C ATOM 0 H VAL A 125 10.697 1.347 2.850 1.00 0.00 H new ATOM 0 HA VAL A 125 7.963 0.389 3.225 1.00 0.00 H new ATOM 0 HB VAL A 125 10.585 -1.093 2.761 1.00 0.00 H new ATOM 0 HG11 VAL A 125 9.158 -3.048 2.309 1.00 0.00 H new ATOM 0 HG12 VAL A 125 8.968 -2.463 3.979 1.00 0.00 H new ATOM 0 HG13 VAL A 125 7.722 -2.099 2.761 1.00 0.00 H new ATOM 0 HG21 VAL A 125 9.713 -1.471 0.490 1.00 0.00 H new ATOM 0 HG22 VAL A 125 8.300 -0.457 0.868 1.00 0.00 H new ATOM 0 HG23 VAL A 125 9.928 0.262 0.836 1.00 0.00 H new ATOM 545 N ASP A 126 8.097 -0.353 5.590 1.00 0.00 N ATOM 546 CA ASP A 126 8.136 -0.700 7.006 1.00 0.00 C ATOM 547 C ASP A 126 7.511 -2.070 7.248 1.00 0.00 C ATOM 548 O ASP A 126 6.305 -2.184 7.468 1.00 0.00 O ATOM 549 CB ASP A 126 7.405 0.360 7.833 1.00 0.00 C ATOM 550 CG ASP A 126 8.326 1.476 8.287 1.00 0.00 C ATOM 551 OD1 ASP A 126 9.437 1.169 8.768 1.00 0.00 O ATOM 552 OD2 ASP A 126 7.935 2.656 8.163 1.00 0.00 O ATOM 0 H ASP A 126 7.158 -0.304 5.194 1.00 0.00 H new ATOM 0 HA ASP A 126 9.180 -0.737 7.316 1.00 0.00 H new ATOM 0 HB2 ASP A 126 6.592 0.781 7.242 1.00 0.00 H new ATOM 0 HB3 ASP A 126 6.953 -0.112 8.705 1.00 0.00 H new ATOM 557 N ARG A 127 8.340 -3.108 7.204 1.00 0.00 N ATOM 558 CA ARG A 127 7.869 -4.472 7.416 1.00 0.00 C ATOM 559 C ARG A 127 7.227 -4.617 8.792 1.00 0.00 C ATOM 560 O ARG A 127 6.326 -5.432 8.984 1.00 0.00 O ATOM 561 CB ARG A 127 9.026 -5.462 7.274 1.00 0.00 C ATOM 562 CG ARG A 127 10.170 -5.205 8.242 1.00 0.00 C ATOM 563 CD ARG A 127 11.099 -6.405 8.338 1.00 0.00 C ATOM 564 NE ARG A 127 10.686 -7.335 9.386 1.00 0.00 N ATOM 565 CZ ARG A 127 10.976 -7.168 10.671 1.00 0.00 C ATOM 566 NH1 ARG A 127 11.676 -6.114 11.065 1.00 0.00 N ATOM 567 NH2 ARG A 127 10.565 -8.058 11.566 1.00 0.00 N ATOM 0 H ARG A 127 9.341 -3.031 7.024 1.00 0.00 H new ATOM 0 HA ARG A 127 7.117 -4.692 6.658 1.00 0.00 H new ATOM 0 HB2 ARG A 127 8.649 -6.473 7.430 1.00 0.00 H new ATOM 0 HB3 ARG A 127 9.408 -5.418 6.254 1.00 0.00 H new ATOM 0 HG2 ARG A 127 10.735 -4.332 7.916 1.00 0.00 H new ATOM 0 HG3 ARG A 127 9.768 -4.975 9.229 1.00 0.00 H new ATOM 0 HD2 ARG A 127 11.120 -6.925 7.380 1.00 0.00 H new ATOM 0 HD3 ARG A 127 12.114 -6.062 8.537 1.00 0.00 H new ATOM 0 HE ARG A 127 10.146 -8.157 9.116 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.994 -5.428 10.380 1.00 0.00 H new ATOM 0 HH12 ARG A 127 11.897 -5.989 12.053 1.00 0.00 H new ATOM 0 HH21 ARG A 127 10.026 -8.871 11.267 1.00 0.00 H new ATOM 0 HH22 ARG A 127 10.788 -7.929 12.553 1.00 0.00 H new ATOM 581 N ASN A 128 7.698 -3.822 9.747 1.00 0.00 N ATOM 582 CA ASN A 128 7.171 -3.863 11.106 1.00 0.00 C ATOM 583 C ASN A 128 5.666 -3.611 11.113 1.00 0.00 C ATOM 584 O ASN A 128 4.913 -4.301 11.800 1.00 0.00 O ATOM 585 CB ASN A 128 7.877 -2.825 11.981 1.00 0.00 C ATOM 586 CG ASN A 128 7.592 -1.404 11.537 1.00 0.00 C ATOM 587 OD1 ASN A 128 6.738 -0.723 12.106 1.00 0.00 O ATOM 588 ND2 ASN A 128 8.307 -0.949 10.515 1.00 0.00 N ATOM 0 H ASN A 128 8.444 -3.141 9.605 1.00 0.00 H new ATOM 0 HA ASN A 128 7.357 -4.857 11.512 1.00 0.00 H new ATOM 0 HB2 ASN A 128 7.559 -2.950 13.016 1.00 0.00 H new ATOM 0 HB3 ASN A 128 8.952 -3.002 11.954 1.00 0.00 H new ATOM 0 HD21 ASN A 128 8.159 -0.000 10.171 1.00 0.00 H new ATOM 0 HD22 ASN A 128 9.004 -1.548 10.073 1.00 0.00 H new ATOM 595 N LYS A 129 5.234 -2.617 10.344 1.00 0.00 N ATOM 596 CA LYS A 129 3.820 -2.274 10.259 1.00 0.00 C ATOM 597 C LYS A 129 3.265 -2.592 8.874 1.00 0.00 C ATOM 598 O LYS A 129 2.176 -2.145 8.514 1.00 0.00 O ATOM 599 CB LYS A 129 3.614 -0.790 10.574 1.00 0.00 C ATOM 600 CG LYS A 129 3.562 -0.485 12.061 1.00 0.00 C ATOM 601 CD LYS A 129 2.999 0.901 12.326 1.00 0.00 C ATOM 602 CE LYS A 129 3.188 1.310 13.779 1.00 0.00 C ATOM 603 NZ LYS A 129 2.150 2.283 14.221 1.00 0.00 N ATOM 0 H LYS A 129 5.844 -2.035 9.770 1.00 0.00 H new ATOM 0 HA LYS A 129 3.282 -2.873 10.993 1.00 0.00 H new ATOM 0 HB2 LYS A 129 4.423 -0.216 10.122 1.00 0.00 H new ATOM 0 HB3 LYS A 129 2.687 -0.454 10.110 1.00 0.00 H new ATOM 0 HG2 LYS A 129 2.948 -1.231 12.565 1.00 0.00 H new ATOM 0 HG3 LYS A 129 4.564 -0.559 12.484 1.00 0.00 H new ATOM 0 HD2 LYS A 129 3.490 1.625 11.676 1.00 0.00 H new ATOM 0 HD3 LYS A 129 1.938 0.918 12.077 1.00 0.00 H new ATOM 0 HE2 LYS A 129 3.149 0.425 14.413 1.00 0.00 H new ATOM 0 HE3 LYS A 129 4.177 1.751 13.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 2.313 2.537 15.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 2.203 3.139 13.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 1.208 1.854 14.124 1.00 0.00 H new ATOM 617 N ARG A 130 4.020 -3.368 8.103 1.00 0.00 N ATOM 618 CA ARG A 130 3.602 -3.746 6.759 1.00 0.00 C ATOM 619 C ARG A 130 2.992 -2.556 6.024 1.00 0.00 C ATOM 620 O ARG A 130 1.875 -2.634 5.512 1.00 0.00 O ATOM 621 CB ARG A 130 2.593 -4.894 6.819 1.00 0.00 C ATOM 622 CG ARG A 130 3.163 -6.176 7.404 1.00 0.00 C ATOM 623 CD ARG A 130 2.163 -7.318 7.322 1.00 0.00 C ATOM 624 NE ARG A 130 2.819 -8.623 7.338 1.00 0.00 N ATOM 625 CZ ARG A 130 2.193 -9.757 7.630 1.00 0.00 C ATOM 626 NH1 ARG A 130 0.901 -9.747 7.929 1.00 0.00 N ATOM 627 NH2 ARG A 130 2.859 -10.905 7.623 1.00 0.00 N ATOM 0 H ARG A 130 4.924 -3.747 8.386 1.00 0.00 H new ATOM 0 HA ARG A 130 4.485 -4.076 6.211 1.00 0.00 H new ATOM 0 HB2 ARG A 130 1.736 -4.582 7.416 1.00 0.00 H new ATOM 0 HB3 ARG A 130 2.225 -5.096 5.813 1.00 0.00 H new ATOM 0 HG2 ARG A 130 4.073 -6.448 6.869 1.00 0.00 H new ATOM 0 HG3 ARG A 130 3.443 -6.010 8.444 1.00 0.00 H new ATOM 0 HD2 ARG A 130 1.468 -7.252 8.159 1.00 0.00 H new ATOM 0 HD3 ARG A 130 1.574 -7.219 6.410 1.00 0.00 H new ATOM 0 HE ARG A 130 3.813 -8.666 7.112 1.00 0.00 H new ATOM 0 HH11 ARG A 130 0.386 -8.867 7.935 1.00 0.00 H new ATOM 0 HH12 ARG A 130 0.423 -10.620 8.153 1.00 0.00 H new ATOM 0 HH21 ARG A 130 3.853 -10.917 7.393 1.00 0.00 H new ATOM 0 HH22 ARG A 130 2.377 -11.776 7.847 1.00 0.00 H new ATOM 641 N THR A 131 3.733 -1.453 5.976 1.00 0.00 N ATOM 642 CA THR A 131 3.265 -0.246 5.306 1.00 0.00 C ATOM 643 C THR A 131 4.397 0.434 4.544 1.00 0.00 C ATOM 644 O THR A 131 5.533 0.482 5.014 1.00 0.00 O ATOM 645 CB THR A 131 2.662 0.755 6.309 1.00 0.00 C ATOM 646 OG1 THR A 131 1.587 0.141 7.028 1.00 0.00 O ATOM 647 CG2 THR A 131 2.156 1.999 5.594 1.00 0.00 C ATOM 0 H THR A 131 4.660 -1.371 6.393 1.00 0.00 H new ATOM 0 HA THR A 131 2.492 -0.554 4.603 1.00 0.00 H new ATOM 0 HB THR A 131 3.444 1.050 7.009 1.00 0.00 H new ATOM 0 HG1 THR A 131 1.930 -0.619 7.543 1.00 0.00 H new ATOM 0 HG21 THR A 131 1.735 2.691 6.323 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.983 2.480 5.072 1.00 0.00 H new ATOM 0 HG23 THR A 131 1.387 1.718 4.874 1.00 0.00 H new ATOM 655 N ALA A 132 4.078 0.959 3.366 1.00 0.00 N ATOM 656 CA ALA A 132 5.069 1.639 2.540 1.00 0.00 C ATOM 657 C ALA A 132 4.610 3.049 2.182 1.00 0.00 C ATOM 658 O ALA A 132 3.567 3.233 1.555 1.00 0.00 O ATOM 659 CB ALA A 132 5.345 0.836 1.278 1.00 0.00 C ATOM 0 H ALA A 132 3.142 0.927 2.962 1.00 0.00 H new ATOM 0 HA ALA A 132 5.992 1.720 3.115 1.00 0.00 H new ATOM 0 HB1 ALA A 132 6.086 1.356 0.671 1.00 0.00 H new ATOM 0 HB2 ALA A 132 5.724 -0.149 1.549 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.423 0.726 0.708 1.00 0.00 H new ATOM 665 N PHE A 133 5.396 4.042 2.585 1.00 0.00 N ATOM 666 CA PHE A 133 5.069 5.436 2.309 1.00 0.00 C ATOM 667 C PHE A 133 5.614 5.862 0.949 1.00 0.00 C ATOM 668 O PHE A 133 6.826 5.898 0.737 1.00 0.00 O ATOM 669 CB PHE A 133 5.634 6.342 3.404 1.00 0.00 C ATOM 670 CG PHE A 133 5.271 5.900 4.793 1.00 0.00 C ATOM 671 CD1 PHE A 133 3.954 5.928 5.221 1.00 0.00 C ATOM 672 CD2 PHE A 133 6.248 5.458 5.671 1.00 0.00 C ATOM 673 CE1 PHE A 133 3.616 5.522 6.499 1.00 0.00 C ATOM 674 CE2 PHE A 133 5.916 5.051 6.950 1.00 0.00 C ATOM 675 CZ PHE A 133 4.599 5.084 7.364 1.00 0.00 C ATOM 0 H PHE A 133 6.264 3.907 3.104 1.00 0.00 H new ATOM 0 HA PHE A 133 3.983 5.532 2.293 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.720 6.374 3.314 1.00 0.00 H new ATOM 0 HB3 PHE A 133 5.271 7.358 3.248 1.00 0.00 H new ATOM 0 HD1 PHE A 133 3.182 6.271 4.548 1.00 0.00 H new ATOM 0 HD2 PHE A 133 7.280 5.431 5.353 1.00 0.00 H new ATOM 0 HE1 PHE A 133 2.585 5.547 6.820 1.00 0.00 H new ATOM 0 HE2 PHE A 133 6.686 4.708 7.625 1.00 0.00 H new ATOM 0 HZ PHE A 133 4.338 4.768 8.363 1.00 0.00 H new ATOM 685 N VAL A 134 4.710 6.186 0.030 1.00 0.00 N ATOM 686 CA VAL A 134 5.098 6.611 -1.310 1.00 0.00 C ATOM 687 C VAL A 134 4.787 8.086 -1.530 1.00 0.00 C ATOM 688 O VAL A 134 3.666 8.539 -1.292 1.00 0.00 O ATOM 689 CB VAL A 134 4.384 5.779 -2.392 1.00 0.00 C ATOM 690 CG1 VAL A 134 4.828 6.215 -3.780 1.00 0.00 C ATOM 691 CG2 VAL A 134 4.645 4.295 -2.181 1.00 0.00 C ATOM 0 H VAL A 134 3.703 6.162 0.189 1.00 0.00 H new ATOM 0 HA VAL A 134 6.173 6.454 -1.393 1.00 0.00 H new ATOM 0 HB VAL A 134 3.311 5.951 -2.309 1.00 0.00 H new ATOM 0 HG11 VAL A 134 4.313 5.616 -4.531 1.00 0.00 H new ATOM 0 HG12 VAL A 134 4.585 7.268 -3.926 1.00 0.00 H new ATOM 0 HG13 VAL A 134 5.904 6.074 -3.879 1.00 0.00 H new ATOM 0 HG21 VAL A 134 4.133 3.722 -2.954 1.00 0.00 H new ATOM 0 HG22 VAL A 134 5.716 4.103 -2.236 1.00 0.00 H new ATOM 0 HG23 VAL A 134 4.273 3.996 -1.201 1.00 0.00 H new ATOM 701 N THR A 135 5.786 8.835 -1.987 1.00 0.00 N ATOM 702 CA THR A 135 5.619 10.261 -2.240 1.00 0.00 C ATOM 703 C THR A 135 5.546 10.549 -3.735 1.00 0.00 C ATOM 704 O THR A 135 6.567 10.570 -4.424 1.00 0.00 O ATOM 705 CB THR A 135 6.771 11.078 -1.626 1.00 0.00 C ATOM 706 OG1 THR A 135 6.868 10.811 -0.223 1.00 0.00 O ATOM 707 CG2 THR A 135 6.557 12.568 -1.851 1.00 0.00 C ATOM 0 H THR A 135 6.720 8.477 -2.190 1.00 0.00 H new ATOM 0 HA THR A 135 4.682 10.559 -1.770 1.00 0.00 H new ATOM 0 HB THR A 135 7.699 10.782 -2.116 1.00 0.00 H new ATOM 0 HG1 THR A 135 7.604 11.333 0.159 1.00 0.00 H new ATOM 0 HG21 THR A 135 7.383 13.125 -1.409 1.00 0.00 H new ATOM 0 HG22 THR A 135 6.513 12.772 -2.921 1.00 0.00 H new ATOM 0 HG23 THR A 135 5.621 12.876 -1.385 1.00 0.00 H new ATOM 715 N LEU A 136 4.334 10.773 -4.231 1.00 0.00 N ATOM 716 CA LEU A 136 4.128 11.062 -5.646 1.00 0.00 C ATOM 717 C LEU A 136 4.556 12.488 -5.978 1.00 0.00 C ATOM 718 O LEU A 136 4.919 13.261 -5.091 1.00 0.00 O ATOM 719 CB LEU A 136 2.659 10.857 -6.020 1.00 0.00 C ATOM 720 CG LEU A 136 2.061 9.494 -5.671 1.00 0.00 C ATOM 721 CD1 LEU A 136 0.566 9.480 -5.948 1.00 0.00 C ATOM 722 CD2 LEU A 136 2.760 8.390 -6.450 1.00 0.00 C ATOM 0 H LEU A 136 3.479 10.760 -3.674 1.00 0.00 H new ATOM 0 HA LEU A 136 4.743 10.374 -6.226 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.068 11.628 -5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.553 11.014 -7.093 1.00 0.00 H new ATOM 0 HG LEU A 136 2.214 9.313 -4.607 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.158 8.502 -5.694 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.077 10.245 -5.345 1.00 0.00 H new ATOM 0 HD13 LEU A 136 0.390 9.683 -7.004 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.321 7.427 -6.189 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.639 8.566 -7.519 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.821 8.385 -6.201 1.00 0.00 H new ATOM 734 N LEU A 137 4.508 12.830 -7.261 1.00 0.00 N ATOM 735 CA LEU A 137 4.889 14.164 -7.711 1.00 0.00 C ATOM 736 C LEU A 137 3.896 15.210 -7.215 1.00 0.00 C ATOM 737 O LEU A 137 4.230 16.052 -6.382 1.00 0.00 O ATOM 738 CB LEU A 137 4.969 14.205 -9.238 1.00 0.00 C ATOM 739 CG LEU A 137 5.120 15.591 -9.866 1.00 0.00 C ATOM 740 CD1 LEU A 137 6.518 16.138 -9.622 1.00 0.00 C ATOM 741 CD2 LEU A 137 4.819 15.538 -11.357 1.00 0.00 C ATOM 0 H LEU A 137 4.209 12.202 -8.007 1.00 0.00 H new ATOM 0 HA LEU A 137 5.870 14.394 -7.295 1.00 0.00 H new ATOM 0 HB2 LEU A 137 5.812 13.591 -9.554 1.00 0.00 H new ATOM 0 HB3 LEU A 137 4.069 13.742 -9.641 1.00 0.00 H new ATOM 0 HG LEU A 137 4.402 16.262 -9.395 1.00 0.00 H new ATOM 0 HD11 LEU A 137 6.607 17.125 -10.076 1.00 0.00 H new ATOM 0 HD12 LEU A 137 6.697 16.215 -8.549 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.254 15.467 -10.065 1.00 0.00 H new ATOM 0 HD21 LEU A 137 4.932 16.533 -11.787 1.00 0.00 H new ATOM 0 HD22 LEU A 137 5.512 14.852 -11.844 1.00 0.00 H new ATOM 0 HD23 LEU A 137 3.797 15.190 -11.510 1.00 0.00 H new ATOM 753 N ASN A 138 2.672 15.149 -7.731 1.00 0.00 N ATOM 754 CA ASN A 138 1.629 16.090 -7.339 1.00 0.00 C ATOM 755 C ASN A 138 0.496 15.374 -6.611 1.00 0.00 C ATOM 756 O ASN A 138 0.396 14.149 -6.649 1.00 0.00 O ATOM 757 CB ASN A 138 1.081 16.817 -8.569 1.00 0.00 C ATOM 758 CG ASN A 138 1.985 17.946 -9.024 1.00 0.00 C ATOM 759 OD1 ASN A 138 2.152 18.945 -8.323 1.00 0.00 O ATOM 760 ND2 ASN A 138 2.575 17.793 -10.204 1.00 0.00 N ATOM 0 H ASN A 138 2.379 14.458 -8.421 1.00 0.00 H new ATOM 0 HA ASN A 138 2.069 16.820 -6.660 1.00 0.00 H new ATOM 0 HB2 ASN A 138 0.957 16.104 -9.384 1.00 0.00 H new ATOM 0 HB3 ASN A 138 0.093 17.216 -8.341 1.00 0.00 H new ATOM 0 HD21 ASN A 138 3.195 18.520 -10.562 1.00 0.00 H new ATOM 0 HD22 ASN A 138 2.408 16.949 -10.752 1.00 0.00 H new ATOM 767 N GLY A 139 -0.357 16.149 -5.947 1.00 0.00 N ATOM 768 CA GLY A 139 -1.472 15.571 -5.220 1.00 0.00 C ATOM 769 C GLY A 139 -2.528 14.995 -6.140 1.00 0.00 C ATOM 770 O GLY A 139 -2.924 13.839 -5.993 1.00 0.00 O ATOM 0 H GLY A 139 -0.295 17.166 -5.900 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -1.103 14.786 -4.559 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -1.924 16.335 -4.587 1.00 0.00 H new ATOM 774 N GLU A 140 -2.987 15.802 -7.092 1.00 0.00 N ATOM 775 CA GLU A 140 -4.006 15.365 -8.038 1.00 0.00 C ATOM 776 C GLU A 140 -3.761 13.924 -8.474 1.00 0.00 C ATOM 777 O GLU A 140 -4.691 13.120 -8.547 1.00 0.00 O ATOM 778 CB GLU A 140 -4.026 16.284 -9.262 1.00 0.00 C ATOM 779 CG GLU A 140 -4.786 17.580 -9.038 1.00 0.00 C ATOM 780 CD GLU A 140 -6.133 17.359 -8.377 1.00 0.00 C ATOM 781 OE1 GLU A 140 -7.101 17.033 -9.095 1.00 0.00 O ATOM 782 OE2 GLU A 140 -6.218 17.513 -7.140 1.00 0.00 O ATOM 0 H GLU A 140 -2.669 16.762 -7.228 1.00 0.00 H new ATOM 0 HA GLU A 140 -4.974 15.416 -7.539 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.000 16.519 -9.546 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -4.475 15.750 -10.100 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -4.186 18.246 -8.418 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -4.933 18.081 -9.995 1.00 0.00 H new ATOM 789 N GLN A 141 -2.504 13.605 -8.765 1.00 0.00 N ATOM 790 CA GLN A 141 -2.137 12.261 -9.195 1.00 0.00 C ATOM 791 C GLN A 141 -2.563 11.223 -8.163 1.00 0.00 C ATOM 792 O GLN A 141 -3.096 10.170 -8.511 1.00 0.00 O ATOM 793 CB GLN A 141 -0.628 12.173 -9.431 1.00 0.00 C ATOM 794 CG GLN A 141 -0.199 12.650 -10.809 1.00 0.00 C ATOM 795 CD GLN A 141 1.106 12.024 -11.263 1.00 0.00 C ATOM 796 OE1 GLN A 141 1.190 11.459 -12.354 1.00 0.00 O ATOM 797 NE2 GLN A 141 2.132 12.123 -10.427 1.00 0.00 N ATOM 0 H GLN A 141 -1.723 14.259 -8.711 1.00 0.00 H new ATOM 0 HA GLN A 141 -2.657 12.051 -10.130 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.115 12.767 -8.674 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.307 11.140 -9.297 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -0.981 12.414 -11.531 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.093 13.735 -10.797 1.00 0.00 H new ATOM 0 HE21 GLN A 141 2.017 12.600 -9.533 1.00 0.00 H new ATOM 0 HE22 GLN A 141 3.035 11.722 -10.679 1.00 0.00 H new ATOM 806 N ALA A 142 -2.325 11.528 -6.891 1.00 0.00 N ATOM 807 CA ALA A 142 -2.687 10.622 -5.808 1.00 0.00 C ATOM 808 C ALA A 142 -4.201 10.498 -5.678 1.00 0.00 C ATOM 809 O ALA A 142 -4.741 9.392 -5.651 1.00 0.00 O ATOM 810 CB ALA A 142 -2.080 11.099 -4.497 1.00 0.00 C ATOM 0 H ALA A 142 -1.883 12.395 -6.586 1.00 0.00 H new ATOM 0 HA ALA A 142 -2.288 9.636 -6.044 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -2.358 10.413 -3.697 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -0.994 11.129 -4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -2.452 12.097 -4.266 1.00 0.00 H new ATOM 816 N GLN A 143 -4.879 11.638 -5.597 1.00 0.00 N ATOM 817 CA GLN A 143 -6.331 11.655 -5.469 1.00 0.00 C ATOM 818 C GLN A 143 -6.961 10.510 -6.255 1.00 0.00 C ATOM 819 O GLN A 143 -7.956 9.926 -5.829 1.00 0.00 O ATOM 820 CB GLN A 143 -6.891 12.992 -5.956 1.00 0.00 C ATOM 821 CG GLN A 143 -6.503 14.171 -5.078 1.00 0.00 C ATOM 822 CD GLN A 143 -7.339 14.259 -3.816 1.00 0.00 C ATOM 823 OE1 GLN A 143 -8.398 13.639 -3.715 1.00 0.00 O ATOM 824 NE2 GLN A 143 -6.866 15.031 -2.845 1.00 0.00 N ATOM 0 H GLN A 143 -4.446 12.561 -5.618 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.579 11.527 -4.415 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -6.540 13.175 -6.972 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.978 12.926 -6.002 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -5.451 14.086 -4.807 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -6.612 15.094 -5.647 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -5.984 15.527 -2.972 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -7.385 15.128 -1.972 1.00 0.00 H new ATOM 833 N ASN A 144 -6.374 10.195 -7.405 1.00 0.00 N ATOM 834 CA ASN A 144 -6.878 9.120 -8.251 1.00 0.00 C ATOM 835 C ASN A 144 -6.217 7.792 -7.895 1.00 0.00 C ATOM 836 O ASN A 144 -6.888 6.839 -7.501 1.00 0.00 O ATOM 837 CB ASN A 144 -6.633 9.446 -9.726 1.00 0.00 C ATOM 838 CG ASN A 144 -7.540 10.550 -10.232 1.00 0.00 C ATOM 839 OD1 ASN A 144 -8.639 10.290 -10.722 1.00 0.00 O ATOM 840 ND2 ASN A 144 -7.083 11.791 -10.117 1.00 0.00 N ATOM 0 H ASN A 144 -5.549 10.669 -7.772 1.00 0.00 H new ATOM 0 HA ASN A 144 -7.951 9.029 -8.079 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -5.593 9.743 -9.862 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -6.789 8.548 -10.324 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -7.649 12.575 -10.441 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -6.166 11.961 -9.704 1.00 0.00 H new ATOM 847 N ALA A 145 -4.897 7.737 -8.038 1.00 0.00 N ATOM 848 CA ALA A 145 -4.144 6.528 -7.729 1.00 0.00 C ATOM 849 C ALA A 145 -4.703 5.835 -6.491 1.00 0.00 C ATOM 850 O ALA A 145 -4.709 4.606 -6.405 1.00 0.00 O ATOM 851 CB ALA A 145 -2.672 6.858 -7.533 1.00 0.00 C ATOM 0 H ALA A 145 -4.327 8.516 -8.366 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.242 5.843 -8.572 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -2.122 5.945 -7.303 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.274 7.301 -8.446 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -2.564 7.564 -6.710 1.00 0.00 H new ATOM 857 N ILE A 146 -5.169 6.630 -5.533 1.00 0.00 N ATOM 858 CA ILE A 146 -5.730 6.092 -4.300 1.00 0.00 C ATOM 859 C ILE A 146 -6.775 5.020 -4.593 1.00 0.00 C ATOM 860 O ILE A 146 -6.571 3.844 -4.294 1.00 0.00 O ATOM 861 CB ILE A 146 -6.372 7.199 -3.444 1.00 0.00 C ATOM 862 CG1 ILE A 146 -5.304 8.178 -2.952 1.00 0.00 C ATOM 863 CG2 ILE A 146 -7.123 6.591 -2.268 1.00 0.00 C ATOM 864 CD1 ILE A 146 -5.858 9.530 -2.562 1.00 0.00 C ATOM 0 H ILE A 146 -5.169 7.649 -5.587 1.00 0.00 H new ATOM 0 HA ILE A 146 -4.904 5.648 -3.745 1.00 0.00 H new ATOM 0 HB ILE A 146 -7.084 7.747 -4.061 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.792 7.743 -2.094 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -4.557 8.312 -3.735 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -7.571 7.386 -1.672 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -7.906 5.930 -2.639 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -6.430 6.021 -1.649 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -5.045 10.172 -2.223 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -6.346 9.986 -3.424 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -6.583 9.408 -1.758 1.00 0.00 H new ATOM 876 N GLN A 147 -7.892 5.436 -5.180 1.00 0.00 N ATOM 877 CA GLN A 147 -8.969 4.511 -5.514 1.00 0.00 C ATOM 878 C GLN A 147 -8.541 3.556 -6.624 1.00 0.00 C ATOM 879 O GLN A 147 -8.756 2.348 -6.534 1.00 0.00 O ATOM 880 CB GLN A 147 -10.218 5.283 -5.942 1.00 0.00 C ATOM 881 CG GLN A 147 -11.057 5.778 -4.775 1.00 0.00 C ATOM 882 CD GLN A 147 -11.426 4.669 -3.810 1.00 0.00 C ATOM 883 OE1 GLN A 147 -11.004 4.671 -2.653 1.00 0.00 O ATOM 884 NE2 GLN A 147 -12.218 3.713 -4.281 1.00 0.00 N ATOM 0 H GLN A 147 -8.075 6.407 -5.434 1.00 0.00 H new ATOM 0 HA GLN A 147 -9.200 3.925 -4.625 1.00 0.00 H new ATOM 0 HB2 GLN A 147 -9.917 6.136 -6.550 1.00 0.00 H new ATOM 0 HB3 GLN A 147 -10.832 4.642 -6.574 1.00 0.00 H new ATOM 0 HG2 GLN A 147 -10.507 6.552 -4.240 1.00 0.00 H new ATOM 0 HG3 GLN A 147 -11.967 6.240 -5.157 1.00 0.00 H new ATOM 0 HE21 GLN A 147 -12.545 3.751 -5.247 1.00 0.00 H new ATOM 0 HE22 GLN A 147 -12.500 2.941 -3.677 1.00 0.00 H new ATOM 893 N MET A 148 -7.935 4.107 -7.671 1.00 0.00 N ATOM 894 CA MET A 148 -7.477 3.304 -8.798 1.00 0.00 C ATOM 895 C MET A 148 -6.772 2.041 -8.314 1.00 0.00 C ATOM 896 O MET A 148 -6.961 0.960 -8.873 1.00 0.00 O ATOM 897 CB MET A 148 -6.535 4.120 -9.685 1.00 0.00 C ATOM 898 CG MET A 148 -7.232 5.235 -10.448 1.00 0.00 C ATOM 899 SD MET A 148 -8.554 4.626 -11.512 1.00 0.00 S ATOM 900 CE MET A 148 -7.664 4.375 -13.047 1.00 0.00 C ATOM 0 H MET A 148 -7.750 5.106 -7.762 1.00 0.00 H new ATOM 0 HA MET A 148 -8.350 3.011 -9.382 1.00 0.00 H new ATOM 0 HB2 MET A 148 -5.749 4.551 -9.066 1.00 0.00 H new ATOM 0 HB3 MET A 148 -6.050 3.452 -10.397 1.00 0.00 H new ATOM 0 HG2 MET A 148 -7.643 5.953 -9.739 1.00 0.00 H new ATOM 0 HG3 MET A 148 -6.500 5.769 -11.054 1.00 0.00 H new ATOM 0 HE1 MET A 148 -8.348 3.998 -13.807 1.00 0.00 H new ATOM 0 HE2 MET A 148 -7.238 5.322 -13.379 1.00 0.00 H new ATOM 0 HE3 MET A 148 -6.863 3.652 -12.889 1.00 0.00 H new ATOM 910 N PHE A 149 -5.958 2.184 -7.274 1.00 0.00 N ATOM 911 CA PHE A 149 -5.224 1.055 -6.716 1.00 0.00 C ATOM 912 C PHE A 149 -6.004 0.409 -5.575 1.00 0.00 C ATOM 913 O PHE A 149 -5.972 -0.809 -5.397 1.00 0.00 O ATOM 914 CB PHE A 149 -3.850 1.509 -6.217 1.00 0.00 C ATOM 915 CG PHE A 149 -2.892 1.846 -7.323 1.00 0.00 C ATOM 916 CD1 PHE A 149 -3.245 2.750 -8.312 1.00 0.00 C ATOM 917 CD2 PHE A 149 -1.638 1.258 -7.374 1.00 0.00 C ATOM 918 CE1 PHE A 149 -2.365 3.062 -9.331 1.00 0.00 C ATOM 919 CE2 PHE A 149 -0.754 1.568 -8.390 1.00 0.00 C ATOM 920 CZ PHE A 149 -1.118 2.470 -9.371 1.00 0.00 C ATOM 0 H PHE A 149 -5.790 3.072 -6.800 1.00 0.00 H new ATOM 0 HA PHE A 149 -5.090 0.315 -7.505 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -3.975 2.382 -5.577 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -3.418 0.721 -5.600 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -4.219 3.216 -8.286 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -1.349 0.550 -6.612 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -2.652 3.768 -10.096 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.221 1.105 -8.417 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.429 2.712 -10.167 1.00 0.00 H new ATOM 930 N HIS A 150 -6.705 1.234 -4.803 1.00 0.00 N ATOM 931 CA HIS A 150 -7.494 0.744 -3.679 1.00 0.00 C ATOM 932 C HIS A 150 -8.173 -0.577 -4.026 1.00 0.00 C ATOM 933 O HIS A 150 -8.893 -0.672 -5.020 1.00 0.00 O ATOM 934 CB HIS A 150 -8.543 1.780 -3.275 1.00 0.00 C ATOM 935 CG HIS A 150 -9.353 1.378 -2.081 1.00 0.00 C ATOM 936 ND1 HIS A 150 -8.797 0.831 -0.944 1.00 0.00 N ATOM 937 CD2 HIS A 150 -10.685 1.449 -1.849 1.00 0.00 C ATOM 938 CE1 HIS A 150 -9.751 0.580 -0.066 1.00 0.00 C ATOM 939 NE2 HIS A 150 -10.907 0.947 -0.591 1.00 0.00 N ATOM 0 H HIS A 150 -6.742 2.245 -4.936 1.00 0.00 H new ATOM 0 HA HIS A 150 -6.819 0.575 -2.840 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -8.045 2.726 -3.064 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -9.213 1.954 -4.117 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -11.434 1.830 -2.528 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -9.610 0.148 0.914 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -11.816 0.870 -0.135 1.00 0.00 H new ATOM 948 N GLN A 151 -7.938 -1.593 -3.202 1.00 0.00 N ATOM 949 CA GLN A 151 -8.527 -2.908 -3.424 1.00 0.00 C ATOM 950 C GLN A 151 -7.940 -3.564 -4.669 1.00 0.00 C ATOM 951 O GLN A 151 -8.662 -4.159 -5.469 1.00 0.00 O ATOM 952 CB GLN A 151 -10.046 -2.794 -3.561 1.00 0.00 C ATOM 953 CG GLN A 151 -10.701 -2.008 -2.437 1.00 0.00 C ATOM 954 CD GLN A 151 -11.110 -2.888 -1.271 1.00 0.00 C ATOM 955 OE1 GLN A 151 -11.382 -4.077 -1.441 1.00 0.00 O ATOM 956 NE2 GLN A 151 -11.155 -2.307 -0.078 1.00 0.00 N ATOM 0 H GLN A 151 -7.344 -1.531 -2.375 1.00 0.00 H new ATOM 0 HA GLN A 151 -8.293 -3.533 -2.562 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -10.282 -2.317 -4.512 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -10.476 -3.795 -3.591 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -10.011 -1.242 -2.084 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -11.580 -1.492 -2.824 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -10.921 -1.319 0.017 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -11.423 -2.849 0.743 1.00 0.00 H new ATOM 965 N TYR A 152 -6.625 -3.452 -4.827 1.00 0.00 N ATOM 966 CA TYR A 152 -5.941 -4.031 -5.976 1.00 0.00 C ATOM 967 C TYR A 152 -5.541 -5.478 -5.700 1.00 0.00 C ATOM 968 O TYR A 152 -5.533 -5.923 -4.552 1.00 0.00 O ATOM 969 CB TYR A 152 -4.702 -3.206 -6.328 1.00 0.00 C ATOM 970 CG TYR A 152 -3.795 -3.875 -7.336 1.00 0.00 C ATOM 971 CD1 TYR A 152 -4.203 -4.063 -8.651 1.00 0.00 C ATOM 972 CD2 TYR A 152 -2.530 -4.319 -6.973 1.00 0.00 C ATOM 973 CE1 TYR A 152 -3.378 -4.675 -9.575 1.00 0.00 C ATOM 974 CE2 TYR A 152 -1.697 -4.931 -7.891 1.00 0.00 C ATOM 975 CZ TYR A 152 -2.126 -5.107 -9.190 1.00 0.00 C ATOM 976 OH TYR A 152 -1.301 -5.715 -10.107 1.00 0.00 O ATOM 0 H TYR A 152 -6.012 -2.965 -4.173 1.00 0.00 H new ATOM 0 HA TYR A 152 -6.630 -4.018 -6.821 1.00 0.00 H new ATOM 0 HB2 TYR A 152 -5.019 -2.240 -6.722 1.00 0.00 H new ATOM 0 HB3 TYR A 152 -4.136 -3.009 -5.417 1.00 0.00 H new ATOM 0 HD1 TYR A 152 -5.182 -3.725 -8.956 1.00 0.00 H new ATOM 0 HD2 TYR A 152 -2.191 -4.184 -5.956 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -3.712 -4.814 -10.593 1.00 0.00 H new ATOM 0 HE2 TYR A 152 -0.716 -5.269 -7.593 1.00 0.00 H new ATOM 0 HH TYR A 152 -0.455 -5.958 -9.676 1.00 0.00 H new ATOM 986 N SER A 153 -5.209 -6.206 -6.761 1.00 0.00 N ATOM 987 CA SER A 153 -4.811 -7.603 -6.635 1.00 0.00 C ATOM 988 C SER A 153 -3.299 -7.724 -6.467 1.00 0.00 C ATOM 989 O SER A 153 -2.538 -7.487 -7.405 1.00 0.00 O ATOM 990 CB SER A 153 -5.264 -8.397 -7.862 1.00 0.00 C ATOM 991 OG SER A 153 -4.826 -9.743 -7.788 1.00 0.00 O ATOM 0 H SER A 153 -5.208 -5.852 -7.717 1.00 0.00 H new ATOM 0 HA SER A 153 -5.292 -8.014 -5.747 1.00 0.00 H new ATOM 0 HB2 SER A 153 -6.351 -8.368 -7.937 1.00 0.00 H new ATOM 0 HB3 SER A 153 -4.870 -7.932 -8.766 1.00 0.00 H new ATOM 0 HG SER A 153 -5.129 -10.230 -8.583 1.00 0.00 H new ATOM 997 N PHE A 154 -2.872 -8.093 -5.264 1.00 0.00 N ATOM 998 CA PHE A 154 -1.452 -8.245 -4.970 1.00 0.00 C ATOM 999 C PHE A 154 -1.233 -9.253 -3.846 1.00 0.00 C ATOM 1000 O PHE A 154 -1.491 -8.961 -2.678 1.00 0.00 O ATOM 1001 CB PHE A 154 -0.842 -6.895 -4.586 1.00 0.00 C ATOM 1002 CG PHE A 154 0.658 -6.872 -4.661 1.00 0.00 C ATOM 1003 CD1 PHE A 154 1.301 -6.609 -5.860 1.00 0.00 C ATOM 1004 CD2 PHE A 154 1.425 -7.114 -3.533 1.00 0.00 C ATOM 1005 CE1 PHE A 154 2.682 -6.587 -5.932 1.00 0.00 C ATOM 1006 CE2 PHE A 154 2.806 -7.093 -3.599 1.00 0.00 C ATOM 1007 CZ PHE A 154 3.435 -6.830 -4.800 1.00 0.00 C ATOM 0 H PHE A 154 -3.489 -8.292 -4.477 1.00 0.00 H new ATOM 0 HA PHE A 154 -0.959 -8.617 -5.868 1.00 0.00 H new ATOM 0 HB2 PHE A 154 -1.243 -6.124 -5.244 1.00 0.00 H new ATOM 0 HB3 PHE A 154 -1.151 -6.641 -3.572 1.00 0.00 H new ATOM 0 HD1 PHE A 154 0.717 -6.419 -6.748 1.00 0.00 H new ATOM 0 HD2 PHE A 154 0.939 -7.321 -2.591 1.00 0.00 H new ATOM 0 HE1 PHE A 154 3.171 -6.380 -6.872 1.00 0.00 H new ATOM 0 HE2 PHE A 154 3.392 -7.282 -2.712 1.00 0.00 H new ATOM 0 HZ PHE A 154 4.514 -6.814 -4.854 1.00 0.00 H new ATOM 1017 N ARG A 155 -0.757 -10.440 -4.207 1.00 0.00 N ATOM 1018 CA ARG A 155 -0.506 -11.492 -3.230 1.00 0.00 C ATOM 1019 C ARG A 155 -1.805 -11.939 -2.566 1.00 0.00 C ATOM 1020 O ARG A 155 -1.831 -12.250 -1.376 1.00 0.00 O ATOM 1021 CB ARG A 155 0.481 -11.005 -2.168 1.00 0.00 C ATOM 1022 CG ARG A 155 1.717 -10.334 -2.746 1.00 0.00 C ATOM 1023 CD ARG A 155 2.829 -11.339 -2.999 1.00 0.00 C ATOM 1024 NE ARG A 155 3.708 -10.920 -4.088 1.00 0.00 N ATOM 1025 CZ ARG A 155 4.966 -11.327 -4.216 1.00 0.00 C ATOM 1026 NH1 ARG A 155 5.490 -12.160 -3.327 1.00 0.00 N ATOM 1027 NH2 ARG A 155 5.702 -10.902 -5.234 1.00 0.00 N ATOM 0 H ARG A 155 -0.537 -10.697 -5.169 1.00 0.00 H new ATOM 0 HA ARG A 155 -0.074 -12.345 -3.754 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -0.027 -10.303 -1.507 1.00 0.00 H new ATOM 0 HB3 ARG A 155 0.791 -11.852 -1.556 1.00 0.00 H new ATOM 0 HG2 ARG A 155 1.458 -9.834 -3.679 1.00 0.00 H new ATOM 0 HG3 ARG A 155 2.070 -9.565 -2.059 1.00 0.00 H new ATOM 0 HD2 ARG A 155 3.415 -11.468 -2.089 1.00 0.00 H new ATOM 0 HD3 ARG A 155 2.393 -12.309 -3.238 1.00 0.00 H new ATOM 0 HE ARG A 155 3.335 -10.280 -4.789 1.00 0.00 H new ATOM 0 HH11 ARG A 155 4.927 -12.489 -2.543 1.00 0.00 H new ATOM 0 HH12 ARG A 155 6.456 -12.471 -3.427 1.00 0.00 H new ATOM 0 HH21 ARG A 155 5.302 -10.262 -5.920 1.00 0.00 H new ATOM 0 HH22 ARG A 155 6.668 -11.215 -5.331 1.00 0.00 H new ATOM 1041 N GLY A 156 -2.882 -11.968 -3.345 1.00 0.00 N ATOM 1042 CA GLY A 156 -4.170 -12.377 -2.815 1.00 0.00 C ATOM 1043 C GLY A 156 -4.647 -11.478 -1.692 1.00 0.00 C ATOM 1044 O GLY A 156 -5.448 -11.891 -0.853 1.00 0.00 O ATOM 0 H GLY A 156 -2.886 -11.716 -4.333 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -4.907 -12.373 -3.618 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.101 -13.402 -2.451 1.00 0.00 H new ATOM 1048 N LYS A 157 -4.152 -10.245 -1.672 1.00 0.00 N ATOM 1049 CA LYS A 157 -4.532 -9.284 -0.644 1.00 0.00 C ATOM 1050 C LYS A 157 -5.264 -8.093 -1.255 1.00 0.00 C ATOM 1051 O LYS A 157 -5.297 -7.933 -2.475 1.00 0.00 O ATOM 1052 CB LYS A 157 -3.293 -8.800 0.113 1.00 0.00 C ATOM 1053 CG LYS A 157 -2.673 -9.861 1.006 1.00 0.00 C ATOM 1054 CD LYS A 157 -3.635 -10.306 2.095 1.00 0.00 C ATOM 1055 CE LYS A 157 -2.934 -11.153 3.146 1.00 0.00 C ATOM 1056 NZ LYS A 157 -2.690 -12.542 2.667 1.00 0.00 N ATOM 0 H LYS A 157 -3.486 -9.888 -2.357 1.00 0.00 H new ATOM 0 HA LYS A 157 -5.205 -9.783 0.053 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -2.547 -8.461 -0.606 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -3.563 -7.937 0.722 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -2.382 -10.721 0.403 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -1.763 -9.469 1.461 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -4.080 -9.431 2.569 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -4.450 -10.877 1.651 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -1.984 -10.689 3.412 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -3.540 -11.182 4.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -2.211 -13.087 3.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -3.598 -12.994 2.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -2.091 -12.516 1.817 1.00 0.00 H new ATOM 1070 N ASP A 158 -5.847 -7.261 -0.400 1.00 0.00 N ATOM 1071 CA ASP A 158 -6.576 -6.083 -0.856 1.00 0.00 C ATOM 1072 C ASP A 158 -5.824 -4.805 -0.498 1.00 0.00 C ATOM 1073 O ASP A 158 -6.218 -4.074 0.411 1.00 0.00 O ATOM 1074 CB ASP A 158 -7.977 -6.054 -0.242 1.00 0.00 C ATOM 1075 CG ASP A 158 -8.987 -6.828 -1.066 1.00 0.00 C ATOM 1076 OD1 ASP A 158 -8.732 -7.040 -2.270 1.00 0.00 O ATOM 1077 OD2 ASP A 158 -10.031 -7.221 -0.507 1.00 0.00 O ATOM 0 H ASP A 158 -5.829 -7.380 0.613 1.00 0.00 H new ATOM 0 HA ASP A 158 -6.664 -6.139 -1.941 1.00 0.00 H new ATOM 0 HB2 ASP A 158 -7.938 -6.471 0.764 1.00 0.00 H new ATOM 0 HB3 ASP A 158 -8.307 -5.020 -0.146 1.00 0.00 H new ATOM 1082 N LEU A 159 -4.738 -4.543 -1.217 1.00 0.00 N ATOM 1083 CA LEU A 159 -3.929 -3.354 -0.975 1.00 0.00 C ATOM 1084 C LEU A 159 -4.811 -2.145 -0.680 1.00 0.00 C ATOM 1085 O LEU A 159 -5.624 -1.741 -1.512 1.00 0.00 O ATOM 1086 CB LEU A 159 -3.036 -3.065 -2.183 1.00 0.00 C ATOM 1087 CG LEU A 159 -1.805 -3.960 -2.338 1.00 0.00 C ATOM 1088 CD1 LEU A 159 -1.009 -3.564 -3.571 1.00 0.00 C ATOM 1089 CD2 LEU A 159 -0.934 -3.887 -1.092 1.00 0.00 C ATOM 0 H LEU A 159 -4.398 -5.138 -1.972 1.00 0.00 H new ATOM 0 HA LEU A 159 -3.302 -3.544 -0.104 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -3.640 -3.153 -3.086 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -2.702 -2.029 -2.123 1.00 0.00 H new ATOM 0 HG LEU A 159 -2.141 -4.989 -2.463 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -0.137 -4.212 -3.665 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.635 -3.668 -4.457 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.683 -2.528 -3.476 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -0.063 -4.530 -1.219 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.607 -2.859 -0.936 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -1.508 -4.220 -0.227 1.00 0.00 H new ATOM 1101 N ILE A 160 -4.644 -1.572 0.506 1.00 0.00 N ATOM 1102 CA ILE A 160 -5.423 -0.408 0.909 1.00 0.00 C ATOM 1103 C ILE A 160 -4.619 0.877 0.739 1.00 0.00 C ATOM 1104 O ILE A 160 -3.722 1.171 1.530 1.00 0.00 O ATOM 1105 CB ILE A 160 -5.887 -0.519 2.373 1.00 0.00 C ATOM 1106 CG1 ILE A 160 -6.901 -1.655 2.524 1.00 0.00 C ATOM 1107 CG2 ILE A 160 -6.485 0.799 2.841 1.00 0.00 C ATOM 1108 CD1 ILE A 160 -7.083 -2.116 3.953 1.00 0.00 C ATOM 0 H ILE A 160 -3.976 -1.895 1.206 1.00 0.00 H new ATOM 0 HA ILE A 160 -6.299 -0.375 0.261 1.00 0.00 H new ATOM 0 HB ILE A 160 -5.022 -0.744 2.997 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -7.863 -1.327 2.131 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -6.580 -2.501 1.916 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -6.808 0.704 3.878 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -5.735 1.586 2.765 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -7.341 1.052 2.216 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -7.816 -2.922 3.985 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -6.131 -2.475 4.344 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -7.434 -1.283 4.562 1.00 0.00 H new ATOM 1120 N VAL A 161 -4.947 1.641 -0.298 1.00 0.00 N ATOM 1121 CA VAL A 161 -4.258 2.897 -0.572 1.00 0.00 C ATOM 1122 C VAL A 161 -5.021 4.080 0.013 1.00 0.00 C ATOM 1123 O VAL A 161 -6.222 4.228 -0.211 1.00 0.00 O ATOM 1124 CB VAL A 161 -4.072 3.117 -2.084 1.00 0.00 C ATOM 1125 CG1 VAL A 161 -3.114 4.270 -2.342 1.00 0.00 C ATOM 1126 CG2 VAL A 161 -3.576 1.842 -2.751 1.00 0.00 C ATOM 0 H VAL A 161 -5.686 1.412 -0.963 1.00 0.00 H new ATOM 0 HA VAL A 161 -3.278 2.830 -0.100 1.00 0.00 H new ATOM 0 HB VAL A 161 -5.038 3.375 -2.517 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -2.995 4.411 -3.416 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -3.514 5.182 -1.899 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -2.145 4.045 -1.896 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -3.450 2.016 -3.820 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -2.620 1.552 -2.315 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.302 1.044 -2.596 1.00 0.00 H new ATOM 1136 N GLN A 162 -4.314 4.921 0.762 1.00 0.00 N ATOM 1137 CA GLN A 162 -4.925 6.092 1.380 1.00 0.00 C ATOM 1138 C GLN A 162 -4.084 7.339 1.131 1.00 0.00 C ATOM 1139 O GLN A 162 -2.939 7.251 0.685 1.00 0.00 O ATOM 1140 CB GLN A 162 -5.098 5.870 2.883 1.00 0.00 C ATOM 1141 CG GLN A 162 -5.947 4.656 3.226 1.00 0.00 C ATOM 1142 CD GLN A 162 -7.434 4.938 3.132 1.00 0.00 C ATOM 1143 OE1 GLN A 162 -8.121 5.052 4.148 1.00 0.00 O ATOM 1144 NE2 GLN A 162 -7.939 5.053 1.909 1.00 0.00 N ATOM 0 H GLN A 162 -3.318 4.813 0.955 1.00 0.00 H new ATOM 0 HA GLN A 162 -5.905 6.241 0.927 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -4.115 5.756 3.340 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -5.554 6.757 3.323 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -5.693 3.838 2.552 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -5.707 4.323 4.236 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -7.333 4.951 1.095 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -8.933 5.243 1.784 1.00 0.00 H new ATOM 1153 N LEU A 163 -4.659 8.502 1.421 1.00 0.00 N ATOM 1154 CA LEU A 163 -3.962 9.769 1.228 1.00 0.00 C ATOM 1155 C LEU A 163 -3.393 10.283 2.547 1.00 0.00 C ATOM 1156 O LEU A 163 -3.974 10.067 3.610 1.00 0.00 O ATOM 1157 CB LEU A 163 -4.910 10.809 0.628 1.00 0.00 C ATOM 1158 CG LEU A 163 -4.361 12.231 0.516 1.00 0.00 C ATOM 1159 CD1 LEU A 163 -3.652 12.427 -0.814 1.00 0.00 C ATOM 1160 CD2 LEU A 163 -5.481 13.249 0.680 1.00 0.00 C ATOM 0 H LEU A 163 -5.605 8.593 1.790 1.00 0.00 H new ATOM 0 HA LEU A 163 -3.135 9.600 0.538 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -5.202 10.474 -0.367 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -5.816 10.837 1.233 1.00 0.00 H new ATOM 0 HG LEU A 163 -3.637 12.384 1.316 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -3.268 13.445 -0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -2.824 11.722 -0.893 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -4.354 12.255 -1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -5.072 14.256 0.597 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -6.229 13.096 -0.098 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -5.945 13.125 1.658 1.00 0.00 H new