USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1094 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 137 ASN : amide:sc= -1.34 K(o=-2,f=-8.1!) USER MOD Set 1.2: A 144 THR OG1 : rot -160:sc= -0.63 USER MOD Set 2.1: A 45 SER OG : rot 90:sc= -1.01! USER MOD Set 2.2: A 143 THR OG1 : rot -160:sc= 1.03 USER MOD Set 3.1: A 62 LYS NZ :NH3+ -113:sc= 0.611 (180deg=-1.05!) USER MOD Set 3.2: A 64 TYR OH : rot 165:sc= -0.0561 USER MOD Set 3.3: A 125 GLN : amide:sc= -0.132 X(o=0.42,f=0.65) USER MOD Set 4.1: A 81 LYS NZ :NH3+ -170:sc= -0.115 (180deg=0) USER MOD Set 4.2: A 135 GLN : amide:sc= -1.21 K(o=-1.3,f=-1.9) USER MOD Set 5.1: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 131 THR OG1 : rot 180:sc= -0.0237 USER MOD Set 6.1: A 13 MET CE :methyl -112:sc= -2.45 (180deg=-5!) USER MOD Set 6.2: A 150 THR OG1 : rot 124:sc= 0.0605 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -157:sc= -2.79 (180deg=-4.19!) USER MOD Single : A 17 ASN : amide:sc= -0.0157 K(o=-0.016,f=-1.7!) USER MOD Single : A 18 LYS NZ :NH3+ 152:sc= -0.268 (180deg=-1.91) USER MOD Single : A 21 CYS SG : rot 56:sc= 0.179 USER MOD Single : A 23 CYS SG : rot 180:sc= -0.0474 USER MOD Single : A 25 ASN : amide:sc= -0.365 X(o=-0.36,f=-0.024) USER MOD Single : A 27 SER OG : rot 180:sc= 0.309 USER MOD Single : A 30 HIS : no HD1:sc= -0.36 K(o=-0.36,f=-1.3) USER MOD Single : A 34 ASN : amide:sc= -1.48 K(o=-1.5,f=-0.91) USER MOD Single : A 35 CYS SG : rot -56:sc= 0.508 USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.0899 X(o=-0.09,f=0) USER MOD Single : A 58 ASN : amide:sc= -0.178 X(o=-0.18,f=-0.0016) USER MOD Single : A 59 GLN : amide:sc= -4.99! C(o=-5!,f=-6.7!) USER MOD Single : A 65 SER OG : rot 180:sc= -0.203 USER MOD Single : A 66 MET CE :methyl -160:sc= 0 (180deg=-0.196) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.645 K(o=-0.65,f=-2.2) USER MOD Single : A 73 ASN : amide:sc= -4.77 K(o=-4.8,f=-5.8!) USER MOD Single : A 75 GLN : amide:sc= -3.77! K(o=-3.8!,f=0.35) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -1.71 K(o=-1.7,f=-0.23) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl -174:sc= -2.98 (180deg=-3.33) USER MOD Single : A 98 SER OG : rot 94:sc= 0.00301 USER MOD Single : A 101 THR OG1 : rot -130:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -2.19 K(o=-2.2,f=-4.8!) USER MOD Single : A 107 THR OG1 : rot 42:sc= -0.139 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 ASN : amide:sc= -6.06! C(o=-6.1!,f=-5.4!) USER MOD Single : A 128 ASN : amide:sc= -1.37 X(o=-1.4,f=-1.6) USER MOD Single : A 129 SER OG : rot 36:sc= 0.219 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= -1.54 K(o=-1.5,f=-6.6!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.851 USER MOD Single : A 157 GLN : amide:sc= -0.0541 X(o=-0.054,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 73 N TYR A 9 12.784 9.337 0.917 1.00 0.00 N ATOM 74 CA TYR A 9 11.867 8.682 1.842 1.00 0.00 C ATOM 75 C TYR A 9 12.223 7.207 2.009 1.00 0.00 C ATOM 76 O TYR A 9 13.258 6.749 1.525 1.00 0.00 O ATOM 77 CB TYR A 9 10.426 8.817 1.348 1.00 0.00 C ATOM 78 CG TYR A 9 10.030 10.239 1.020 1.00 0.00 C ATOM 79 CD1 TYR A 9 9.569 11.098 2.010 1.00 0.00 C ATOM 80 CD2 TYR A 9 10.115 10.722 -0.280 1.00 0.00 C ATOM 81 CE1 TYR A 9 9.205 12.398 1.715 1.00 0.00 C ATOM 82 CE2 TYR A 9 9.754 12.021 -0.584 1.00 0.00 C ATOM 83 CZ TYR A 9 9.300 12.855 0.417 1.00 0.00 C ATOM 84 OH TYR A 9 8.938 14.148 0.118 1.00 0.00 O ATOM 0 HA TYR A 9 11.959 9.172 2.811 1.00 0.00 H new ATOM 0 HB2 TYR A 9 10.295 8.198 0.460 1.00 0.00 H new ATOM 0 HB3 TYR A 9 9.751 8.427 2.110 1.00 0.00 H new ATOM 0 HD1 TYR A 9 9.494 10.744 3.027 1.00 0.00 H new ATOM 0 HD2 TYR A 9 10.469 10.071 -1.066 1.00 0.00 H new ATOM 0 HE1 TYR A 9 8.848 13.053 2.496 1.00 0.00 H new ATOM 0 HE2 TYR A 9 9.827 12.381 -1.600 1.00 0.00 H new ATOM 0 HH TYR A 9 9.066 14.310 -0.840 1.00 0.00 H new ATOM 94 N MET A 10 11.357 6.470 2.696 1.00 0.00 N ATOM 95 CA MET A 10 11.578 5.047 2.925 1.00 0.00 C ATOM 96 C MET A 10 10.309 4.248 2.646 1.00 0.00 C ATOM 97 O MET A 10 9.198 4.734 2.861 1.00 0.00 O ATOM 98 CB MET A 10 12.041 4.806 4.363 1.00 0.00 C ATOM 99 CG MET A 10 12.732 6.007 4.988 1.00 0.00 C ATOM 100 SD MET A 10 13.637 5.585 6.490 1.00 0.00 S ATOM 101 CE MET A 10 12.445 4.535 7.319 1.00 0.00 C ATOM 0 H MET A 10 10.496 6.834 3.104 1.00 0.00 H new ATOM 0 HA MET A 10 12.356 4.711 2.240 1.00 0.00 H new ATOM 0 HB2 MET A 10 11.179 4.535 4.973 1.00 0.00 H new ATOM 0 HB3 MET A 10 12.723 3.956 4.379 1.00 0.00 H new ATOM 0 HG2 MET A 10 13.421 6.442 4.264 1.00 0.00 H new ATOM 0 HG3 MET A 10 11.988 6.770 5.219 1.00 0.00 H new ATOM 0 HE1 MET A 10 12.652 4.524 8.389 1.00 0.00 H new ATOM 0 HE2 MET A 10 11.440 4.920 7.147 1.00 0.00 H new ATOM 0 HE3 MET A 10 12.517 3.521 6.925 1.00 0.00 H new ATOM 111 N ASP A 11 10.481 3.021 2.168 1.00 0.00 N ATOM 112 CA ASP A 11 9.349 2.154 1.861 1.00 0.00 C ATOM 113 C ASP A 11 8.654 1.695 3.138 1.00 0.00 C ATOM 114 O ASP A 11 7.555 1.140 3.095 1.00 0.00 O ATOM 115 CB ASP A 11 9.813 0.940 1.053 1.00 0.00 C ATOM 116 CG ASP A 11 11.057 0.299 1.636 1.00 0.00 C ATOM 117 OD1 ASP A 11 11.257 0.399 2.865 1.00 0.00 O ATOM 118 OD2 ASP A 11 11.830 -0.305 0.863 1.00 0.00 O ATOM 0 H ASP A 11 11.394 2.604 1.985 1.00 0.00 H new ATOM 0 HA ASP A 11 8.636 2.726 1.266 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.011 0.203 1.017 1.00 0.00 H new ATOM 0 HB3 ASP A 11 10.012 1.245 0.026 1.00 0.00 H new ATOM 123 N LEU A 12 9.301 1.929 4.275 1.00 0.00 N ATOM 124 CA LEU A 12 8.746 1.539 5.566 1.00 0.00 C ATOM 125 C LEU A 12 8.492 0.036 5.618 1.00 0.00 C ATOM 126 O LEU A 12 7.704 -0.443 6.432 1.00 0.00 O ATOM 127 CB LEU A 12 7.444 2.296 5.833 1.00 0.00 C ATOM 128 CG LEU A 12 7.457 3.790 5.505 1.00 0.00 C ATOM 129 CD1 LEU A 12 6.048 4.360 5.557 1.00 0.00 C ATOM 130 CD2 LEU A 12 8.373 4.539 6.462 1.00 0.00 C ATOM 0 H LEU A 12 10.211 2.387 4.329 1.00 0.00 H new ATOM 0 HA LEU A 12 9.473 1.793 6.338 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.648 1.825 5.256 1.00 0.00 H new ATOM 0 HB3 LEU A 12 7.188 2.178 6.886 1.00 0.00 H new ATOM 0 HG LEU A 12 7.841 3.917 4.493 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.077 5.424 5.321 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.420 3.844 4.831 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.636 4.221 6.557 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.370 5.600 6.213 1.00 0.00 H new ATOM 0 HD22 LEU A 12 8.019 4.405 7.484 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.387 4.149 6.375 1.00 0.00 H new ATOM 142 N MET A 13 9.168 -0.704 4.744 1.00 0.00 N ATOM 143 CA MET A 13 9.019 -2.153 4.693 1.00 0.00 C ATOM 144 C MET A 13 9.362 -2.783 6.039 1.00 0.00 C ATOM 145 O MET A 13 8.580 -3.538 6.617 1.00 0.00 O ATOM 146 CB MET A 13 9.912 -2.741 3.599 1.00 0.00 C ATOM 147 CG MET A 13 9.226 -3.811 2.765 1.00 0.00 C ATOM 148 SD MET A 13 8.390 -3.134 1.318 1.00 0.00 S ATOM 149 CE MET A 13 6.704 -3.651 1.628 1.00 0.00 C ATOM 0 H MET A 13 9.824 -0.323 4.062 1.00 0.00 H new ATOM 0 HA MET A 13 7.978 -2.378 4.462 1.00 0.00 H new ATOM 0 HB2 MET A 13 10.245 -1.937 2.942 1.00 0.00 H new ATOM 0 HB3 MET A 13 10.804 -3.167 4.059 1.00 0.00 H new ATOM 0 HG2 MET A 13 9.965 -4.544 2.443 1.00 0.00 H new ATOM 0 HG3 MET A 13 8.501 -4.340 3.384 1.00 0.00 H new ATOM 0 HE1 MET A 13 6.411 -4.399 0.891 1.00 0.00 H new ATOM 0 HE2 MET A 13 6.633 -4.080 2.628 1.00 0.00 H new ATOM 0 HE3 MET A 13 6.040 -2.790 1.555 1.00 0.00 H new ATOM 159 N PRO A 14 10.561 -2.468 6.552 1.00 0.00 N ATOM 160 CA PRO A 14 11.035 -2.992 7.837 1.00 0.00 C ATOM 161 C PRO A 14 10.266 -2.412 9.019 1.00 0.00 C ATOM 162 O PRO A 14 10.479 -2.808 10.165 1.00 0.00 O ATOM 163 CB PRO A 14 12.499 -2.549 7.882 1.00 0.00 C ATOM 164 CG PRO A 14 12.558 -1.345 7.006 1.00 0.00 C ATOM 165 CD PRO A 14 11.545 -1.574 5.919 1.00 0.00 C ATOM 0 HA PRO A 14 10.899 -4.071 7.912 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.810 -2.314 8.900 1.00 0.00 H new ATOM 0 HB3 PRO A 14 13.162 -3.335 7.520 1.00 0.00 H new ATOM 0 HG2 PRO A 14 12.328 -0.441 7.570 1.00 0.00 H new ATOM 0 HG3 PRO A 14 13.556 -1.215 6.588 1.00 0.00 H new ATOM 0 HD2 PRO A 14 11.088 -0.640 5.593 1.00 0.00 H new ATOM 0 HD3 PRO A 14 11.997 -2.032 5.039 1.00 0.00 H new ATOM 173 N PHE A 15 9.372 -1.471 8.733 1.00 0.00 N ATOM 174 CA PHE A 15 8.572 -0.835 9.774 1.00 0.00 C ATOM 175 C PHE A 15 7.171 -1.438 9.827 1.00 0.00 C ATOM 176 O PHE A 15 6.369 -1.095 10.696 1.00 0.00 O ATOM 177 CB PHE A 15 8.483 0.672 9.529 1.00 0.00 C ATOM 178 CG PHE A 15 9.784 1.392 9.739 1.00 0.00 C ATOM 179 CD1 PHE A 15 10.824 1.250 8.835 1.00 0.00 C ATOM 180 CD2 PHE A 15 9.967 2.212 10.841 1.00 0.00 C ATOM 181 CE1 PHE A 15 12.022 1.911 9.026 1.00 0.00 C ATOM 182 CE2 PHE A 15 11.163 2.876 11.038 1.00 0.00 C ATOM 183 CZ PHE A 15 12.192 2.726 10.128 1.00 0.00 C ATOM 0 H PHE A 15 9.183 -1.132 7.790 1.00 0.00 H new ATOM 0 HA PHE A 15 9.061 -1.011 10.732 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.141 0.846 8.509 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.731 1.096 10.194 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.697 0.615 7.971 1.00 0.00 H new ATOM 0 HD2 PHE A 15 9.165 2.334 11.554 1.00 0.00 H new ATOM 0 HE1 PHE A 15 12.825 1.791 8.314 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.293 3.511 11.902 1.00 0.00 H new ATOM 0 HZ PHE A 15 13.127 3.245 10.278 1.00 0.00 H new ATOM 193 N ILE A 16 6.885 -2.336 8.891 1.00 0.00 N ATOM 194 CA ILE A 16 5.581 -2.986 8.830 1.00 0.00 C ATOM 195 C ILE A 16 5.573 -4.278 9.642 1.00 0.00 C ATOM 196 O ILE A 16 6.518 -5.063 9.586 1.00 0.00 O ATOM 197 CB ILE A 16 5.177 -3.303 7.379 1.00 0.00 C ATOM 198 CG1 ILE A 16 5.042 -2.011 6.570 1.00 0.00 C ATOM 199 CG2 ILE A 16 3.875 -4.090 7.351 1.00 0.00 C ATOM 200 CD1 ILE A 16 5.484 -2.150 5.130 1.00 0.00 C ATOM 0 H ILE A 16 7.538 -2.630 8.165 1.00 0.00 H new ATOM 0 HA ILE A 16 4.860 -2.287 9.254 1.00 0.00 H new ATOM 0 HB ILE A 16 5.958 -3.914 6.926 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.002 -1.685 6.592 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.632 -1.229 7.049 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.603 -4.306 6.318 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.003 -5.025 7.896 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.085 -3.503 7.819 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.360 -1.196 4.618 1.00 0.00 H new ATOM 0 HD12 ILE A 16 6.533 -2.446 5.098 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.878 -2.909 4.635 1.00 0.00 H new ATOM 212 N ASN A 17 4.499 -4.491 10.394 1.00 0.00 N ATOM 213 CA ASN A 17 4.366 -5.688 11.216 1.00 0.00 C ATOM 214 C ASN A 17 3.591 -6.773 10.476 1.00 0.00 C ATOM 215 O ASN A 17 2.363 -6.825 10.535 1.00 0.00 O ATOM 216 CB ASN A 17 3.664 -5.352 12.533 1.00 0.00 C ATOM 217 CG ASN A 17 3.779 -6.470 13.551 1.00 0.00 C ATOM 218 OD1 ASN A 17 4.675 -7.309 13.470 1.00 0.00 O ATOM 219 ND2 ASN A 17 2.868 -6.486 14.518 1.00 0.00 N ATOM 0 H ASN A 17 3.708 -3.850 10.451 1.00 0.00 H new ATOM 0 HA ASN A 17 5.366 -6.064 11.431 1.00 0.00 H new ATOM 0 HB2 ASN A 17 4.094 -4.440 12.948 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.611 -5.148 12.339 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.895 -7.214 15.232 1.00 0.00 H new ATOM 0 HD22 ASN A 17 2.142 -5.770 14.547 1.00 0.00 H new ATOM 226 N LYS A 18 4.318 -7.640 9.779 1.00 0.00 N ATOM 227 CA LYS A 18 3.701 -8.727 9.028 1.00 0.00 C ATOM 228 C LYS A 18 2.983 -9.696 9.963 1.00 0.00 C ATOM 229 O LYS A 18 2.054 -10.392 9.556 1.00 0.00 O ATOM 230 CB LYS A 18 4.758 -9.476 8.213 1.00 0.00 C ATOM 231 CG LYS A 18 5.469 -8.605 7.192 1.00 0.00 C ATOM 232 CD LYS A 18 5.123 -9.018 5.771 1.00 0.00 C ATOM 233 CE LYS A 18 5.948 -10.214 5.321 1.00 0.00 C ATOM 234 NZ LYS A 18 5.290 -11.504 5.668 1.00 0.00 N ATOM 0 H LYS A 18 5.336 -7.611 9.719 1.00 0.00 H new ATOM 0 HA LYS A 18 2.967 -8.294 8.348 1.00 0.00 H new ATOM 0 HB2 LYS A 18 5.496 -9.900 8.894 1.00 0.00 H new ATOM 0 HB3 LYS A 18 4.283 -10.311 7.698 1.00 0.00 H new ATOM 0 HG2 LYS A 18 5.193 -7.562 7.346 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.547 -8.675 7.340 1.00 0.00 H new ATOM 0 HD2 LYS A 18 4.063 -9.263 5.710 1.00 0.00 H new ATOM 0 HD3 LYS A 18 5.296 -8.180 5.095 1.00 0.00 H new ATOM 0 HE2 LYS A 18 6.103 -10.164 4.243 1.00 0.00 H new ATOM 0 HE3 LYS A 18 6.933 -10.172 5.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 5.578 -12.235 4.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 5.575 -11.792 6.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 4.257 -11.387 5.634 1.00 0.00 H new ATOM 248 N ALA A 19 3.420 -9.734 11.217 1.00 0.00 N ATOM 249 CA ALA A 19 2.817 -10.614 12.210 1.00 0.00 C ATOM 250 C ALA A 19 1.446 -10.102 12.637 1.00 0.00 C ATOM 251 O ALA A 19 0.609 -10.866 13.115 1.00 0.00 O ATOM 252 CB ALA A 19 3.731 -10.751 13.419 1.00 0.00 C ATOM 0 H ALA A 19 4.190 -9.165 11.570 1.00 0.00 H new ATOM 0 HA ALA A 19 2.684 -11.596 11.756 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.268 -11.411 14.152 1.00 0.00 H new ATOM 0 HB2 ALA A 19 4.687 -11.170 13.106 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.893 -9.770 13.865 1.00 0.00 H new ATOM 258 N GLY A 20 1.223 -8.803 12.461 1.00 0.00 N ATOM 259 CA GLY A 20 -0.049 -8.212 12.834 1.00 0.00 C ATOM 260 C GLY A 20 -0.876 -7.808 11.630 1.00 0.00 C ATOM 261 O GLY A 20 -1.974 -7.270 11.775 1.00 0.00 O ATOM 0 H GLY A 20 1.900 -8.150 12.067 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -0.614 -8.923 13.437 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.130 -7.337 13.458 1.00 0.00 H new ATOM 265 N CYS A 21 -0.348 -8.066 10.439 1.00 0.00 N ATOM 266 CA CYS A 21 -1.045 -7.724 9.204 1.00 0.00 C ATOM 267 C CYS A 21 -2.257 -8.625 8.995 1.00 0.00 C ATOM 268 O CYS A 21 -2.313 -9.737 9.520 1.00 0.00 O ATOM 269 CB CYS A 21 -0.096 -7.840 8.010 1.00 0.00 C ATOM 270 SG CYS A 21 0.989 -6.411 7.788 1.00 0.00 S ATOM 0 H CYS A 21 0.560 -8.511 10.302 1.00 0.00 H new ATOM 0 HA CYS A 21 -1.392 -6.694 9.285 1.00 0.00 H new ATOM 0 HB2 CYS A 21 0.517 -8.733 8.132 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.685 -7.980 7.104 1.00 0.00 H new ATOM 0 HG CYS A 21 1.663 -6.204 8.880 1.00 0.00 H new ATOM 276 N GLU A 22 -3.226 -8.137 8.227 1.00 0.00 N ATOM 277 CA GLU A 22 -4.438 -8.899 7.951 1.00 0.00 C ATOM 278 C GLU A 22 -4.836 -8.778 6.483 1.00 0.00 C ATOM 279 O GLU A 22 -4.774 -7.695 5.900 1.00 0.00 O ATOM 280 CB GLU A 22 -5.584 -8.416 8.843 1.00 0.00 C ATOM 281 CG GLU A 22 -6.947 -8.940 8.421 1.00 0.00 C ATOM 282 CD GLU A 22 -7.797 -9.372 9.600 1.00 0.00 C ATOM 283 OE1 GLU A 22 -7.367 -10.280 10.341 1.00 0.00 O ATOM 284 OE2 GLU A 22 -8.892 -8.800 9.782 1.00 0.00 O ATOM 0 H GLU A 22 -3.195 -7.218 7.785 1.00 0.00 H new ATOM 0 HA GLU A 22 -4.234 -9.948 8.168 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.388 -8.724 9.870 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.605 -7.326 8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -7.473 -8.165 7.863 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.814 -9.785 7.745 1.00 0.00 H new ATOM 291 N CYS A 23 -5.242 -9.896 5.892 1.00 0.00 N ATOM 292 CA CYS A 23 -5.648 -9.916 4.491 1.00 0.00 C ATOM 293 C CYS A 23 -7.051 -10.496 4.340 1.00 0.00 C ATOM 294 O CYS A 23 -7.428 -11.429 5.051 1.00 0.00 O ATOM 295 CB CYS A 23 -4.654 -10.730 3.662 1.00 0.00 C ATOM 296 SG CYS A 23 -4.239 -12.338 4.378 1.00 0.00 S ATOM 0 H CYS A 23 -5.299 -10.800 6.361 1.00 0.00 H new ATOM 0 HA CYS A 23 -5.658 -8.889 4.126 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -5.068 -10.884 2.666 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -3.738 -10.151 3.541 1.00 0.00 H new ATOM 0 HG CYS A 23 -3.394 -12.953 3.604 1.00 0.00 H new ATOM 302 N LEU A 24 -7.819 -9.938 3.411 1.00 0.00 N ATOM 303 CA LEU A 24 -9.182 -10.399 3.168 1.00 0.00 C ATOM 304 C LEU A 24 -9.296 -11.060 1.798 1.00 0.00 C ATOM 305 O LEU A 24 -8.784 -10.546 0.805 1.00 0.00 O ATOM 306 CB LEU A 24 -10.162 -9.228 3.265 1.00 0.00 C ATOM 307 CG LEU A 24 -10.020 -8.335 4.498 1.00 0.00 C ATOM 308 CD1 LEU A 24 -11.206 -7.390 4.611 1.00 0.00 C ATOM 309 CD2 LEU A 24 -9.887 -9.180 5.756 1.00 0.00 C ATOM 0 H LEU A 24 -7.522 -9.166 2.814 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.431 -11.138 3.930 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -10.045 -8.608 2.376 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.176 -9.626 3.244 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.115 -7.738 4.389 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -11.088 -6.762 5.494 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.256 -6.761 3.722 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -12.126 -7.969 4.698 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.787 -8.528 6.624 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -10.774 -9.803 5.871 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.005 -9.815 5.676 1.00 0.00 H new ATOM 321 N ASN A 25 -9.973 -12.203 1.753 1.00 0.00 N ATOM 322 CA ASN A 25 -10.157 -12.934 0.505 1.00 0.00 C ATOM 323 C ASN A 25 -8.812 -13.344 -0.088 1.00 0.00 C ATOM 324 O ASN A 25 -8.632 -13.338 -1.305 1.00 0.00 O ATOM 325 CB ASN A 25 -10.931 -12.080 -0.502 1.00 0.00 C ATOM 326 CG ASN A 25 -11.810 -12.915 -1.413 1.00 0.00 C ATOM 327 OD1 ASN A 25 -12.731 -13.592 -0.956 1.00 0.00 O ATOM 328 ND2 ASN A 25 -11.527 -12.872 -2.710 1.00 0.00 N ATOM 0 H ASN A 25 -10.403 -12.643 2.567 1.00 0.00 H new ATOM 0 HA ASN A 25 -10.729 -13.836 0.722 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -11.549 -11.360 0.035 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.227 -11.507 -1.106 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -12.083 -13.414 -3.371 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -10.754 -12.297 -3.045 1.00 0.00 H new ATOM 335 N GLU A 26 -7.872 -13.700 0.782 1.00 0.00 N ATOM 336 CA GLU A 26 -6.544 -14.113 0.344 1.00 0.00 C ATOM 337 C GLU A 26 -6.574 -15.530 -0.223 1.00 0.00 C ATOM 338 O GLU A 26 -7.152 -16.437 0.375 1.00 0.00 O ATOM 339 CB GLU A 26 -5.553 -14.038 1.507 1.00 0.00 C ATOM 340 CG GLU A 26 -4.165 -14.549 1.158 1.00 0.00 C ATOM 341 CD GLU A 26 -3.698 -15.652 2.088 1.00 0.00 C ATOM 342 OE1 GLU A 26 -4.467 -16.612 2.304 1.00 0.00 O ATOM 343 OE2 GLU A 26 -2.563 -15.555 2.599 1.00 0.00 O ATOM 0 H GLU A 26 -8.005 -13.711 1.793 1.00 0.00 H new ATOM 0 HA GLU A 26 -6.221 -13.432 -0.443 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -5.477 -13.004 1.842 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -5.944 -14.616 2.344 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.165 -14.919 0.133 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -3.457 -13.721 1.198 1.00 0.00 H new ATOM 350 N SER A 27 -5.947 -15.711 -1.381 1.00 0.00 N ATOM 351 CA SER A 27 -5.905 -17.015 -2.032 1.00 0.00 C ATOM 352 C SER A 27 -5.174 -18.033 -1.161 1.00 0.00 C ATOM 353 O SER A 27 -4.377 -17.669 -0.296 1.00 0.00 O ATOM 354 CB SER A 27 -5.219 -16.907 -3.395 1.00 0.00 C ATOM 355 OG SER A 27 -4.618 -18.136 -3.763 1.00 0.00 O ATOM 0 H SER A 27 -5.461 -14.971 -1.888 1.00 0.00 H new ATOM 0 HA SER A 27 -6.931 -17.355 -2.176 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.948 -16.615 -4.150 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.462 -16.124 -3.363 1.00 0.00 H new ATOM 0 HG SER A 27 -4.188 -18.041 -4.638 1.00 0.00 H new ATOM 361 N ASP A 28 -5.451 -19.311 -1.397 1.00 0.00 N ATOM 362 CA ASP A 28 -4.820 -20.383 -0.636 1.00 0.00 C ATOM 363 C ASP A 28 -3.427 -20.686 -1.178 1.00 0.00 C ATOM 364 O ASP A 28 -2.480 -20.868 -0.413 1.00 0.00 O ATOM 365 CB ASP A 28 -5.684 -21.645 -0.680 1.00 0.00 C ATOM 366 CG ASP A 28 -6.805 -21.615 0.340 1.00 0.00 C ATOM 367 OD1 ASP A 28 -6.520 -21.813 1.540 1.00 0.00 O ATOM 368 OD2 ASP A 28 -7.966 -21.393 -0.061 1.00 0.00 O ATOM 0 H ASP A 28 -6.108 -19.630 -2.109 1.00 0.00 H new ATOM 0 HA ASP A 28 -4.724 -20.054 0.399 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -6.108 -21.757 -1.678 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.056 -22.518 -0.500 1.00 0.00 H new ATOM 373 N GLU A 29 -3.311 -20.741 -2.501 1.00 0.00 N ATOM 374 CA GLU A 29 -2.033 -21.025 -3.144 1.00 0.00 C ATOM 375 C GLU A 29 -1.098 -19.821 -3.052 1.00 0.00 C ATOM 376 O GLU A 29 0.093 -19.966 -2.775 1.00 0.00 O ATOM 377 CB GLU A 29 -2.248 -21.406 -4.610 1.00 0.00 C ATOM 378 CG GLU A 29 -3.383 -22.394 -4.822 1.00 0.00 C ATOM 379 CD GLU A 29 -3.381 -23.513 -3.798 1.00 0.00 C ATOM 380 OE1 GLU A 29 -2.281 -23.975 -3.428 1.00 0.00 O ATOM 381 OE2 GLU A 29 -4.477 -23.926 -3.368 1.00 0.00 O ATOM 0 H GLU A 29 -4.085 -20.593 -3.148 1.00 0.00 H new ATOM 0 HA GLU A 29 -1.571 -21.863 -2.622 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.452 -20.503 -5.185 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.326 -21.834 -5.004 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.334 -21.864 -4.774 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.306 -22.821 -5.822 1.00 0.00 H new ATOM 388 N HIS A 30 -1.648 -18.634 -3.286 1.00 0.00 N ATOM 389 CA HIS A 30 -0.864 -17.405 -3.230 1.00 0.00 C ATOM 390 C HIS A 30 -1.161 -16.630 -1.949 1.00 0.00 C ATOM 391 O HIS A 30 -2.287 -16.637 -1.455 1.00 0.00 O ATOM 392 CB HIS A 30 -1.159 -16.531 -4.449 1.00 0.00 C ATOM 393 CG HIS A 30 -1.176 -17.290 -5.740 1.00 0.00 C ATOM 394 ND1 HIS A 30 -2.306 -17.422 -6.520 1.00 0.00 N ATOM 395 CD2 HIS A 30 -0.194 -17.958 -6.388 1.00 0.00 C ATOM 396 CE1 HIS A 30 -2.018 -18.140 -7.590 1.00 0.00 C ATOM 397 NE2 HIS A 30 -0.742 -18.477 -7.534 1.00 0.00 N ATOM 0 H HIS A 30 -2.632 -18.497 -3.516 1.00 0.00 H new ATOM 0 HA HIS A 30 0.192 -17.676 -3.234 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -2.124 -16.043 -4.311 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.409 -15.742 -4.510 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.831 -18.063 -6.064 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -2.708 -18.406 -8.377 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -0.245 -19.033 -8.230 1.00 0.00 H new ATOM 405 N GLY A 31 -0.141 -15.962 -1.418 1.00 0.00 N ATOM 406 CA GLY A 31 -0.314 -15.192 -0.200 1.00 0.00 C ATOM 407 C GLY A 31 -0.325 -13.698 -0.455 1.00 0.00 C ATOM 408 O GLY A 31 0.238 -13.225 -1.442 1.00 0.00 O ATOM 0 H GLY A 31 0.801 -15.940 -1.809 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -1.249 -15.482 0.280 1.00 0.00 H new ATOM 0 HA3 GLY A 31 0.490 -15.433 0.496 1.00 0.00 H new ATOM 412 N PHE A 32 -0.970 -12.952 0.436 1.00 0.00 N ATOM 413 CA PHE A 32 -1.055 -11.502 0.301 1.00 0.00 C ATOM 414 C PHE A 32 0.214 -10.832 0.818 1.00 0.00 C ATOM 415 O PHE A 32 0.341 -9.608 0.784 1.00 0.00 O ATOM 416 CB PHE A 32 -2.272 -10.969 1.060 1.00 0.00 C ATOM 417 CG PHE A 32 -3.244 -10.225 0.188 1.00 0.00 C ATOM 418 CD1 PHE A 32 -2.819 -9.166 -0.597 1.00 0.00 C ATOM 419 CD2 PHE A 32 -4.581 -10.586 0.154 1.00 0.00 C ATOM 420 CE1 PHE A 32 -3.711 -8.480 -1.400 1.00 0.00 C ATOM 421 CE2 PHE A 32 -5.477 -9.904 -0.647 1.00 0.00 C ATOM 422 CZ PHE A 32 -5.042 -8.850 -1.425 1.00 0.00 C ATOM 0 H PHE A 32 -1.441 -13.327 1.259 1.00 0.00 H new ATOM 0 HA PHE A 32 -1.163 -11.266 -0.758 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -2.788 -11.803 1.535 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -1.932 -10.308 1.857 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -1.780 -8.873 -0.582 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -4.927 -11.410 0.760 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -3.368 -7.656 -2.007 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.517 -10.195 -0.664 1.00 0.00 H new ATOM 0 HZ PHE A 32 -5.741 -8.316 -2.052 1.00 0.00 H new ATOM 432 N ASP A 33 1.151 -11.643 1.298 1.00 0.00 N ATOM 433 CA ASP A 33 2.411 -11.131 1.822 1.00 0.00 C ATOM 434 C ASP A 33 3.505 -11.187 0.760 1.00 0.00 C ATOM 435 O ASP A 33 4.493 -10.459 0.834 1.00 0.00 O ATOM 436 CB ASP A 33 2.839 -11.930 3.054 1.00 0.00 C ATOM 437 CG ASP A 33 1.708 -12.111 4.048 1.00 0.00 C ATOM 438 OD1 ASP A 33 1.492 -11.199 4.874 1.00 0.00 O ATOM 439 OD2 ASP A 33 1.038 -13.163 3.998 1.00 0.00 O ATOM 0 H ASP A 33 1.061 -12.658 1.335 1.00 0.00 H new ATOM 0 HA ASP A 33 2.260 -10.090 2.108 1.00 0.00 H new ATOM 0 HB2 ASP A 33 3.203 -12.908 2.740 1.00 0.00 H new ATOM 0 HB3 ASP A 33 3.670 -11.422 3.542 1.00 0.00 H new ATOM 444 N ASN A 34 3.319 -12.057 -0.228 1.00 0.00 N ATOM 445 CA ASN A 34 4.291 -12.209 -1.305 1.00 0.00 C ATOM 446 C ASN A 34 4.256 -11.007 -2.243 1.00 0.00 C ATOM 447 O ASN A 34 5.173 -10.801 -3.039 1.00 0.00 O ATOM 448 CB ASN A 34 4.014 -13.492 -2.091 1.00 0.00 C ATOM 449 CG ASN A 34 3.668 -14.661 -1.188 1.00 0.00 C ATOM 450 OD1 ASN A 34 4.067 -14.700 -0.024 1.00 0.00 O ATOM 451 ND2 ASN A 34 2.922 -15.620 -1.723 1.00 0.00 N ATOM 0 H ASN A 34 2.505 -12.667 -0.305 1.00 0.00 H new ATOM 0 HA ASN A 34 5.284 -12.270 -0.860 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.193 -13.318 -2.787 1.00 0.00 H new ATOM 0 HB3 ASN A 34 4.890 -13.745 -2.688 1.00 0.00 H new ATOM 0 HD21 ASN A 34 2.657 -16.431 -1.165 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.614 -15.545 -2.692 1.00 0.00 H new ATOM 458 N CYS A 35 3.193 -10.216 -2.143 1.00 0.00 N ATOM 459 CA CYS A 35 3.038 -9.034 -2.983 1.00 0.00 C ATOM 460 C CYS A 35 3.591 -7.795 -2.285 1.00 0.00 C ATOM 461 O CYS A 35 3.292 -6.665 -2.673 1.00 0.00 O ATOM 462 CB CYS A 35 1.565 -8.822 -3.334 1.00 0.00 C ATOM 463 SG CYS A 35 0.560 -8.209 -1.961 1.00 0.00 S ATOM 0 H CYS A 35 2.426 -10.372 -1.489 1.00 0.00 H new ATOM 0 HA CYS A 35 3.603 -9.194 -3.901 1.00 0.00 H new ATOM 0 HB2 CYS A 35 1.498 -8.117 -4.163 1.00 0.00 H new ATOM 0 HB3 CYS A 35 1.146 -9.766 -3.684 1.00 0.00 H new ATOM 0 HG CYS A 35 0.673 -9.014 -0.947 1.00 0.00 H new ATOM 469 N LEU A 36 4.397 -8.015 -1.252 1.00 0.00 N ATOM 470 CA LEU A 36 4.991 -6.916 -0.498 1.00 0.00 C ATOM 471 C LEU A 36 6.412 -6.634 -0.975 1.00 0.00 C ATOM 472 O LEU A 36 6.840 -5.481 -1.036 1.00 0.00 O ATOM 473 CB LEU A 36 4.998 -7.242 0.996 1.00 0.00 C ATOM 474 CG LEU A 36 3.695 -6.971 1.748 1.00 0.00 C ATOM 475 CD1 LEU A 36 3.571 -7.892 2.952 1.00 0.00 C ATOM 476 CD2 LEU A 36 3.621 -5.514 2.180 1.00 0.00 C ATOM 0 H LEU A 36 4.654 -8.944 -0.917 1.00 0.00 H new ATOM 0 HA LEU A 36 4.387 -6.024 -0.666 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.251 -8.295 1.116 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.794 -6.667 1.469 1.00 0.00 H new ATOM 0 HG LEU A 36 2.862 -7.173 1.075 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.637 -7.684 3.475 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.577 -8.930 2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.410 -7.723 3.627 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.687 -5.340 2.714 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.461 -5.286 2.835 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.662 -4.871 1.301 1.00 0.00 H new ATOM 594 N LEU A 43 -0.027 -12.204 -5.883 1.00 0.00 N ATOM 595 CA LEU A 43 -1.260 -12.486 -5.157 1.00 0.00 C ATOM 596 C LEU A 43 -2.465 -12.438 -6.091 1.00 0.00 C ATOM 597 O LEU A 43 -2.895 -11.364 -6.510 1.00 0.00 O ATOM 598 CB LEU A 43 -1.445 -11.482 -4.017 1.00 0.00 C ATOM 599 CG LEU A 43 -2.698 -11.663 -3.160 1.00 0.00 C ATOM 600 CD1 LEU A 43 -3.895 -10.993 -3.817 1.00 0.00 C ATOM 601 CD2 LEU A 43 -2.975 -13.140 -2.924 1.00 0.00 C ATOM 0 HA LEU A 43 -1.185 -13.491 -4.741 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.573 -11.537 -3.366 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.462 -10.479 -4.442 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.526 -11.188 -2.194 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -4.778 -11.132 -3.193 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.697 -9.927 -3.933 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.069 -11.439 -4.796 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -3.870 -13.249 -2.312 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.126 -13.639 -3.881 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.127 -13.592 -2.409 1.00 0.00 H new ATOM 613 N GLU A 44 -3.006 -13.609 -6.411 1.00 0.00 N ATOM 614 CA GLU A 44 -4.163 -13.700 -7.295 1.00 0.00 C ATOM 615 C GLU A 44 -5.456 -13.790 -6.490 1.00 0.00 C ATOM 616 O GLU A 44 -5.496 -14.406 -5.425 1.00 0.00 O ATOM 617 CB GLU A 44 -4.036 -14.916 -8.214 1.00 0.00 C ATOM 618 CG GLU A 44 -5.224 -15.104 -9.143 1.00 0.00 C ATOM 619 CD GLU A 44 -5.213 -16.451 -9.839 1.00 0.00 C ATOM 620 OE1 GLU A 44 -4.155 -16.831 -10.381 1.00 0.00 O ATOM 621 OE2 GLU A 44 -6.265 -17.125 -9.840 1.00 0.00 O ATOM 0 H GLU A 44 -2.662 -14.507 -6.072 1.00 0.00 H new ATOM 0 HA GLU A 44 -4.196 -12.796 -7.903 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -3.130 -14.816 -8.812 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.918 -15.811 -7.604 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -6.147 -15.002 -8.572 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.224 -14.312 -9.892 1.00 0.00 H new ATOM 628 N SER A 45 -6.512 -13.170 -7.008 1.00 0.00 N ATOM 629 CA SER A 45 -7.807 -13.176 -6.337 1.00 0.00 C ATOM 630 C SER A 45 -8.656 -14.354 -6.804 1.00 0.00 C ATOM 631 O SER A 45 -8.753 -14.627 -8.001 1.00 0.00 O ATOM 632 CB SER A 45 -8.547 -11.863 -6.599 1.00 0.00 C ATOM 633 OG SER A 45 -7.674 -10.883 -7.132 1.00 0.00 O ATOM 0 H SER A 45 -6.496 -12.657 -7.890 1.00 0.00 H new ATOM 0 HA SER A 45 -7.633 -13.279 -5.266 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.369 -12.038 -7.293 1.00 0.00 H new ATOM 0 HB3 SER A 45 -8.985 -11.498 -5.670 1.00 0.00 H new ATOM 0 HG SER A 45 -7.678 -10.939 -8.110 1.00 0.00 H new ATOM 639 N ASP A 46 -9.269 -15.049 -5.852 1.00 0.00 N ATOM 640 CA ASP A 46 -10.111 -16.197 -6.165 1.00 0.00 C ATOM 641 C ASP A 46 -11.578 -15.787 -6.254 1.00 0.00 C ATOM 642 O ASP A 46 -12.475 -16.604 -6.042 1.00 0.00 O ATOM 643 CB ASP A 46 -9.937 -17.288 -5.107 1.00 0.00 C ATOM 644 CG ASP A 46 -10.413 -18.644 -5.589 1.00 0.00 C ATOM 645 OD1 ASP A 46 -10.226 -18.947 -6.786 1.00 0.00 O ATOM 646 OD2 ASP A 46 -10.972 -19.402 -4.770 1.00 0.00 O ATOM 0 H ASP A 46 -9.198 -14.837 -4.857 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.802 -16.589 -7.134 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.886 -17.354 -4.827 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.489 -17.011 -4.209 1.00 0.00 H new ATOM 651 N CYS A 47 -11.814 -14.518 -6.566 1.00 0.00 N ATOM 652 CA CYS A 47 -13.172 -13.999 -6.681 1.00 0.00 C ATOM 653 C CYS A 47 -13.224 -12.821 -7.649 1.00 0.00 C ATOM 654 O CYS A 47 -13.846 -12.902 -8.709 1.00 0.00 O ATOM 655 CB CYS A 47 -13.695 -13.570 -5.309 1.00 0.00 C ATOM 656 SG CYS A 47 -15.471 -13.237 -5.266 1.00 0.00 S ATOM 0 H CYS A 47 -11.083 -13.829 -6.744 1.00 0.00 H new ATOM 0 HA CYS A 47 -13.806 -14.795 -7.071 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -13.465 -14.351 -4.584 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -13.161 -12.674 -4.992 1.00 0.00 H new ATOM 0 HG CYS A 47 -15.817 -12.884 -4.064 1.00 0.00 H new ATOM 662 N ASP A 48 -12.569 -11.727 -7.277 1.00 0.00 N ATOM 663 CA ASP A 48 -12.540 -10.532 -8.112 1.00 0.00 C ATOM 664 C ASP A 48 -11.711 -9.431 -7.458 1.00 0.00 C ATOM 665 O ASP A 48 -11.017 -9.669 -6.470 1.00 0.00 O ATOM 666 CB ASP A 48 -13.962 -10.031 -8.371 1.00 0.00 C ATOM 667 CG ASP A 48 -14.324 -10.052 -9.843 1.00 0.00 C ATOM 668 OD1 ASP A 48 -14.795 -11.104 -10.323 1.00 0.00 O ATOM 669 OD2 ASP A 48 -14.136 -9.017 -10.516 1.00 0.00 O ATOM 0 H ASP A 48 -12.051 -11.643 -6.402 1.00 0.00 H new ATOM 0 HA ASP A 48 -12.076 -10.794 -9.063 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -14.668 -10.649 -7.817 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -14.061 -9.015 -7.990 1.00 0.00 H new ATOM 674 N GLU A 49 -11.789 -8.227 -8.016 1.00 0.00 N ATOM 675 CA GLU A 49 -11.044 -7.091 -7.487 1.00 0.00 C ATOM 676 C GLU A 49 -11.726 -6.523 -6.246 1.00 0.00 C ATOM 677 O GLU A 49 -12.055 -5.339 -6.194 1.00 0.00 O ATOM 678 CB GLU A 49 -10.908 -6.001 -8.552 1.00 0.00 C ATOM 679 CG GLU A 49 -12.217 -5.661 -9.244 1.00 0.00 C ATOM 680 CD GLU A 49 -12.409 -6.427 -10.539 1.00 0.00 C ATOM 681 OE1 GLU A 49 -11.671 -7.408 -10.763 1.00 0.00 O ATOM 682 OE2 GLU A 49 -13.298 -6.044 -11.328 1.00 0.00 O ATOM 0 H GLU A 49 -12.360 -8.013 -8.834 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.050 -7.440 -7.206 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.507 -5.100 -8.088 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.184 -6.324 -9.300 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -13.046 -5.879 -8.571 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -12.247 -4.591 -9.451 1.00 0.00 H new ATOM 689 N GLN A 50 -11.935 -7.378 -5.250 1.00 0.00 N ATOM 690 CA GLN A 50 -12.580 -6.962 -4.010 1.00 0.00 C ATOM 691 C GLN A 50 -11.799 -7.458 -2.797 1.00 0.00 C ATOM 692 O GLN A 50 -12.384 -7.859 -1.790 1.00 0.00 O ATOM 693 CB GLN A 50 -14.016 -7.485 -3.956 1.00 0.00 C ATOM 694 CG GLN A 50 -14.950 -6.801 -4.940 1.00 0.00 C ATOM 695 CD GLN A 50 -15.893 -5.823 -4.267 1.00 0.00 C ATOM 696 OE1 GLN A 50 -16.808 -6.221 -3.546 1.00 0.00 O ATOM 697 NE2 GLN A 50 -15.674 -4.534 -4.500 1.00 0.00 N ATOM 0 H GLN A 50 -11.667 -8.362 -5.277 1.00 0.00 H new ATOM 0 HA GLN A 50 -12.597 -5.872 -3.987 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -14.011 -8.556 -4.157 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -14.405 -7.352 -2.946 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -14.359 -6.273 -5.689 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -15.532 -7.557 -5.468 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -14.904 -4.249 -5.105 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -16.276 -3.829 -4.074 1.00 0.00 H new ATOM 706 N LEU A 51 -10.475 -7.430 -2.900 1.00 0.00 N ATOM 707 CA LEU A 51 -9.613 -7.877 -1.812 1.00 0.00 C ATOM 708 C LEU A 51 -9.125 -6.694 -0.982 1.00 0.00 C ATOM 709 O LEU A 51 -8.941 -5.592 -1.500 1.00 0.00 O ATOM 710 CB LEU A 51 -8.417 -8.653 -2.368 1.00 0.00 C ATOM 711 CG LEU A 51 -8.723 -9.642 -3.493 1.00 0.00 C ATOM 712 CD1 LEU A 51 -7.982 -9.252 -4.763 1.00 0.00 C ATOM 713 CD2 LEU A 51 -8.357 -11.058 -3.073 1.00 0.00 C ATOM 0 H LEU A 51 -9.975 -7.102 -3.726 1.00 0.00 H new ATOM 0 HA LEU A 51 -10.196 -8.534 -1.166 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -7.681 -7.936 -2.732 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.951 -9.199 -1.548 1.00 0.00 H new ATOM 0 HG LEU A 51 -9.793 -9.611 -3.697 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -8.212 -9.967 -5.553 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.294 -8.255 -5.074 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -6.909 -9.254 -4.573 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -8.582 -11.748 -3.886 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.293 -11.105 -2.841 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.934 -11.336 -2.191 1.00 0.00 H new ATOM 725 N LEU A 52 -8.915 -6.930 0.308 1.00 0.00 N ATOM 726 CA LEU A 52 -8.445 -5.884 1.211 1.00 0.00 C ATOM 727 C LEU A 52 -7.046 -6.201 1.730 1.00 0.00 C ATOM 728 O LEU A 52 -6.653 -7.365 1.813 1.00 0.00 O ATOM 729 CB LEU A 52 -9.413 -5.724 2.385 1.00 0.00 C ATOM 730 CG LEU A 52 -10.372 -4.535 2.307 1.00 0.00 C ATOM 731 CD1 LEU A 52 -11.811 -4.999 2.467 1.00 0.00 C ATOM 732 CD2 LEU A 52 -10.023 -3.499 3.365 1.00 0.00 C ATOM 0 H LEU A 52 -9.063 -7.836 0.753 1.00 0.00 H new ATOM 0 HA LEU A 52 -8.402 -4.949 0.653 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.003 -6.636 2.470 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.830 -5.635 3.301 1.00 0.00 H new ATOM 0 HG LEU A 52 -10.268 -4.072 1.326 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.479 -4.140 2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -12.056 -5.704 1.673 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.931 -5.487 3.434 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.715 -2.660 3.295 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.098 -3.950 4.355 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.005 -3.144 3.205 1.00 0.00 H new ATOM 744 N ILE A 53 -6.301 -5.158 2.079 1.00 0.00 N ATOM 745 CA ILE A 53 -4.947 -5.325 2.593 1.00 0.00 C ATOM 746 C ILE A 53 -4.722 -4.472 3.837 1.00 0.00 C ATOM 747 O ILE A 53 -4.686 -3.243 3.763 1.00 0.00 O ATOM 748 CB ILE A 53 -3.893 -4.956 1.533 1.00 0.00 C ATOM 749 CG1 ILE A 53 -4.072 -5.818 0.282 1.00 0.00 C ATOM 750 CG2 ILE A 53 -2.491 -5.120 2.101 1.00 0.00 C ATOM 751 CD1 ILE A 53 -4.573 -5.046 -0.918 1.00 0.00 C ATOM 0 H ILE A 53 -6.612 -4.189 2.015 1.00 0.00 H new ATOM 0 HA ILE A 53 -4.836 -6.378 2.853 1.00 0.00 H new ATOM 0 HB ILE A 53 -4.030 -3.912 1.253 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -3.119 -6.283 0.032 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.772 -6.624 0.503 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.757 -4.855 1.340 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.370 -4.467 2.965 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.341 -6.156 2.406 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.676 -5.721 -1.768 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -5.542 -4.603 -0.687 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -3.863 -4.257 -1.165 1.00 0.00 H new ATOM 763 N THR A 54 -4.570 -5.131 4.981 1.00 0.00 N ATOM 764 CA THR A 54 -4.347 -4.434 6.241 1.00 0.00 C ATOM 765 C THR A 54 -2.862 -4.372 6.581 1.00 0.00 C ATOM 766 O THR A 54 -2.098 -5.274 6.236 1.00 0.00 O ATOM 767 CB THR A 54 -5.099 -5.115 7.401 1.00 0.00 C ATOM 768 OG1 THR A 54 -6.487 -5.247 7.074 1.00 0.00 O ATOM 769 CG2 THR A 54 -4.949 -4.316 8.686 1.00 0.00 C ATOM 0 H THR A 54 -4.597 -6.148 5.061 1.00 0.00 H new ATOM 0 HA THR A 54 -4.730 -3.422 6.113 1.00 0.00 H new ATOM 0 HB THR A 54 -4.667 -6.104 7.555 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.958 -5.682 7.815 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.488 -4.816 9.490 1.00 0.00 H new ATOM 0 HG22 THR A 54 -3.893 -4.242 8.948 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.358 -3.316 8.542 1.00 0.00 H new ATOM 777 N VAL A 55 -2.459 -3.302 7.259 1.00 0.00 N ATOM 778 CA VAL A 55 -1.065 -3.123 7.646 1.00 0.00 C ATOM 779 C VAL A 55 -0.955 -2.543 9.052 1.00 0.00 C ATOM 780 O VAL A 55 -1.490 -1.472 9.335 1.00 0.00 O ATOM 781 CB VAL A 55 -0.322 -2.200 6.662 1.00 0.00 C ATOM 782 CG1 VAL A 55 1.182 -2.377 6.795 1.00 0.00 C ATOM 783 CG2 VAL A 55 -0.775 -2.470 5.235 1.00 0.00 C ATOM 0 H VAL A 55 -3.078 -2.546 7.552 1.00 0.00 H new ATOM 0 HA VAL A 55 -0.602 -4.110 7.626 1.00 0.00 H new ATOM 0 HB VAL A 55 -0.564 -1.166 6.907 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.690 -1.717 6.092 1.00 0.00 H new ATOM 0 HG12 VAL A 55 1.489 -2.130 7.811 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.447 -3.412 6.577 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.240 -1.809 4.552 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.563 -3.507 4.976 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -1.846 -2.287 5.153 1.00 0.00 H new ATOM 793 N ALA A 56 -0.257 -3.257 9.928 1.00 0.00 N ATOM 794 CA ALA A 56 -0.075 -2.812 11.304 1.00 0.00 C ATOM 795 C ALA A 56 1.333 -2.269 11.523 1.00 0.00 C ATOM 796 O ALA A 56 2.312 -3.015 11.470 1.00 0.00 O ATOM 797 CB ALA A 56 -0.360 -3.952 12.270 1.00 0.00 C ATOM 0 H ALA A 56 0.192 -4.146 9.709 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.782 -2.004 11.495 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.220 -3.605 13.294 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -1.387 -4.291 12.139 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.323 -4.778 12.070 1.00 0.00 H new ATOM 803 N PHE A 57 1.429 -0.967 11.769 1.00 0.00 N ATOM 804 CA PHE A 57 2.719 -0.324 11.995 1.00 0.00 C ATOM 805 C PHE A 57 3.025 -0.228 13.487 1.00 0.00 C ATOM 806 O PHE A 57 2.267 0.371 14.249 1.00 0.00 O ATOM 807 CB PHE A 57 2.733 1.072 11.368 1.00 0.00 C ATOM 808 CG PHE A 57 3.013 1.064 9.893 1.00 0.00 C ATOM 809 CD1 PHE A 57 4.303 0.882 9.420 1.00 0.00 C ATOM 810 CD2 PHE A 57 1.987 1.238 8.978 1.00 0.00 C ATOM 811 CE1 PHE A 57 4.565 0.873 8.063 1.00 0.00 C ATOM 812 CE2 PHE A 57 2.242 1.231 7.620 1.00 0.00 C ATOM 813 CZ PHE A 57 3.533 1.049 7.162 1.00 0.00 C ATOM 0 H PHE A 57 0.629 -0.336 11.817 1.00 0.00 H new ATOM 0 HA PHE A 57 3.489 -0.934 11.523 1.00 0.00 H new ATOM 0 HB2 PHE A 57 1.769 1.550 11.544 1.00 0.00 H new ATOM 0 HB3 PHE A 57 3.487 1.679 11.869 1.00 0.00 H new ATOM 0 HD1 PHE A 57 5.114 0.746 10.121 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.976 1.381 9.330 1.00 0.00 H new ATOM 0 HE1 PHE A 57 5.575 0.729 7.708 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.433 1.368 6.917 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.735 1.044 6.101 1.00 0.00 H new ATOM 823 N ASN A 58 4.141 -0.823 13.895 1.00 0.00 N ATOM 824 CA ASN A 58 4.547 -0.805 15.296 1.00 0.00 C ATOM 825 C ASN A 58 4.822 0.620 15.765 1.00 0.00 C ATOM 826 O ASN A 58 4.757 0.914 16.958 1.00 0.00 O ATOM 827 CB ASN A 58 5.793 -1.670 15.497 1.00 0.00 C ATOM 828 CG ASN A 58 5.501 -3.150 15.344 1.00 0.00 C ATOM 829 OD1 ASN A 58 4.703 -3.717 16.091 1.00 0.00 O ATOM 830 ND2 ASN A 58 6.148 -3.783 14.373 1.00 0.00 N ATOM 0 H ASN A 58 4.780 -1.323 13.277 1.00 0.00 H new ATOM 0 HA ASN A 58 3.730 -1.212 15.891 1.00 0.00 H new ATOM 0 HB2 ASN A 58 6.556 -1.377 14.776 1.00 0.00 H new ATOM 0 HB3 ASN A 58 6.204 -1.484 16.489 1.00 0.00 H new ATOM 0 HD21 ASN A 58 5.993 -4.780 14.222 1.00 0.00 H new ATOM 0 HD22 ASN A 58 6.800 -3.273 13.778 1.00 0.00 H new ATOM 837 N GLN A 59 5.130 1.500 14.817 1.00 0.00 N ATOM 838 CA GLN A 59 5.414 2.895 15.134 1.00 0.00 C ATOM 839 C GLN A 59 4.657 3.831 14.198 1.00 0.00 C ATOM 840 O GLN A 59 4.479 3.552 13.012 1.00 0.00 O ATOM 841 CB GLN A 59 6.917 3.164 15.038 1.00 0.00 C ATOM 842 CG GLN A 59 7.463 3.069 13.623 1.00 0.00 C ATOM 843 CD GLN A 59 8.181 4.332 13.188 1.00 0.00 C ATOM 844 OE1 GLN A 59 9.345 4.291 12.787 1.00 0.00 O ATOM 845 NE2 GLN A 59 7.489 5.462 13.264 1.00 0.00 N ATOM 0 H GLN A 59 5.189 1.272 13.825 1.00 0.00 H new ATOM 0 HA GLN A 59 5.082 3.085 16.154 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.126 4.158 15.433 1.00 0.00 H new ATOM 0 HB3 GLN A 59 7.446 2.452 15.671 1.00 0.00 H new ATOM 0 HG2 GLN A 59 8.150 2.225 13.559 1.00 0.00 H new ATOM 0 HG3 GLN A 59 6.643 2.866 12.934 1.00 0.00 H new ATOM 0 HE21 GLN A 59 6.527 5.449 13.602 1.00 0.00 H new ATOM 0 HE22 GLN A 59 7.919 6.343 12.984 1.00 0.00 H new ATOM 854 N PRO A 60 4.200 4.969 14.741 1.00 0.00 N ATOM 855 CA PRO A 60 3.454 5.969 13.973 1.00 0.00 C ATOM 856 C PRO A 60 4.332 6.693 12.957 1.00 0.00 C ATOM 857 O PRO A 60 5.192 7.494 13.323 1.00 0.00 O ATOM 858 CB PRO A 60 2.961 6.945 15.044 1.00 0.00 C ATOM 859 CG PRO A 60 3.936 6.804 16.162 1.00 0.00 C ATOM 860 CD PRO A 60 4.376 5.366 16.148 1.00 0.00 C ATOM 0 HA PRO A 60 2.653 5.518 13.387 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.936 7.967 14.667 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.949 6.700 15.368 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.785 7.473 16.026 1.00 0.00 H new ATOM 0 HG3 PRO A 60 3.476 7.062 17.116 1.00 0.00 H new ATOM 0 HD2 PRO A 60 5.412 5.260 16.469 1.00 0.00 H new ATOM 0 HD3 PRO A 60 3.771 4.754 16.817 1.00 0.00 H new ATOM 868 N VAL A 61 4.110 6.405 11.678 1.00 0.00 N ATOM 869 CA VAL A 61 4.880 7.029 10.609 1.00 0.00 C ATOM 870 C VAL A 61 4.008 7.964 9.778 1.00 0.00 C ATOM 871 O VAL A 61 2.860 8.237 10.129 1.00 0.00 O ATOM 872 CB VAL A 61 5.511 5.974 9.682 1.00 0.00 C ATOM 873 CG1 VAL A 61 6.339 4.983 10.486 1.00 0.00 C ATOM 874 CG2 VAL A 61 4.434 5.256 8.882 1.00 0.00 C ATOM 0 H VAL A 61 3.403 5.743 11.357 1.00 0.00 H new ATOM 0 HA VAL A 61 5.674 7.604 11.085 1.00 0.00 H new ATOM 0 HB VAL A 61 6.175 6.481 8.982 1.00 0.00 H new ATOM 0 HG11 VAL A 61 6.777 4.245 9.814 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.134 5.514 11.010 1.00 0.00 H new ATOM 0 HG13 VAL A 61 5.700 4.479 11.211 1.00 0.00 H new ATOM 0 HG21 VAL A 61 4.898 4.514 8.232 1.00 0.00 H new ATOM 0 HG22 VAL A 61 3.744 4.760 9.564 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.888 5.979 8.276 1.00 0.00 H new ATOM 884 N LYS A 62 4.561 8.453 8.673 1.00 0.00 N ATOM 885 CA LYS A 62 3.835 9.357 7.789 1.00 0.00 C ATOM 886 C LYS A 62 3.771 8.796 6.371 1.00 0.00 C ATOM 887 O LYS A 62 4.802 8.553 5.742 1.00 0.00 O ATOM 888 CB LYS A 62 4.502 10.734 7.775 1.00 0.00 C ATOM 889 CG LYS A 62 4.527 11.412 9.134 1.00 0.00 C ATOM 890 CD LYS A 62 4.138 12.877 9.034 1.00 0.00 C ATOM 891 CE LYS A 62 5.359 13.768 8.869 1.00 0.00 C ATOM 892 NZ LYS A 62 4.984 15.163 8.506 1.00 0.00 N ATOM 0 H LYS A 62 5.510 8.238 8.368 1.00 0.00 H new ATOM 0 HA LYS A 62 2.818 9.457 8.168 1.00 0.00 H new ATOM 0 HB2 LYS A 62 5.524 10.629 7.412 1.00 0.00 H new ATOM 0 HB3 LYS A 62 3.976 11.376 7.068 1.00 0.00 H new ATOM 0 HG2 LYS A 62 3.843 10.899 9.810 1.00 0.00 H new ATOM 0 HG3 LYS A 62 5.525 11.328 9.565 1.00 0.00 H new ATOM 0 HD2 LYS A 62 3.466 13.019 8.188 1.00 0.00 H new ATOM 0 HD3 LYS A 62 3.590 13.171 9.929 1.00 0.00 H new ATOM 0 HE2 LYS A 62 5.931 13.776 9.797 1.00 0.00 H new ATOM 0 HE3 LYS A 62 6.009 13.354 8.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 5.307 15.369 7.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 3.951 15.269 8.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 5.432 15.827 9.169 1.00 0.00 H new ATOM 906 N LEU A 63 2.556 8.595 5.874 1.00 0.00 N ATOM 907 CA LEU A 63 2.358 8.065 4.529 1.00 0.00 C ATOM 908 C LEU A 63 2.381 9.185 3.494 1.00 0.00 C ATOM 909 O LEU A 63 1.345 9.768 3.173 1.00 0.00 O ATOM 910 CB LEU A 63 1.032 7.307 4.449 1.00 0.00 C ATOM 911 CG LEU A 63 0.827 6.202 5.485 1.00 0.00 C ATOM 912 CD1 LEU A 63 -0.458 5.438 5.204 1.00 0.00 C ATOM 913 CD2 LEU A 63 2.019 5.256 5.499 1.00 0.00 C ATOM 0 H LEU A 63 1.693 8.791 6.381 1.00 0.00 H new ATOM 0 HA LEU A 63 3.176 7.378 4.311 1.00 0.00 H new ATOM 0 HB2 LEU A 63 0.219 8.026 4.549 1.00 0.00 H new ATOM 0 HB3 LEU A 63 0.948 6.866 3.456 1.00 0.00 H new ATOM 0 HG LEU A 63 0.743 6.664 6.469 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.587 4.655 5.952 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -1.305 6.123 5.246 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.404 4.987 4.213 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.856 4.476 6.242 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.134 4.801 4.515 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.922 5.812 5.750 1.00 0.00 H new ATOM 925 N TYR A 64 3.567 9.477 2.973 1.00 0.00 N ATOM 926 CA TYR A 64 3.725 10.527 1.973 1.00 0.00 C ATOM 927 C TYR A 64 3.322 10.027 0.589 1.00 0.00 C ATOM 928 O TYR A 64 2.830 10.791 -0.240 1.00 0.00 O ATOM 929 CB TYR A 64 5.172 11.022 1.947 1.00 0.00 C ATOM 930 CG TYR A 64 5.509 11.968 3.078 1.00 0.00 C ATOM 931 CD1 TYR A 64 5.982 11.487 4.293 1.00 0.00 C ATOM 932 CD2 TYR A 64 5.354 13.340 2.932 1.00 0.00 C ATOM 933 CE1 TYR A 64 6.291 12.347 5.329 1.00 0.00 C ATOM 934 CE2 TYR A 64 5.662 14.207 3.962 1.00 0.00 C ATOM 935 CZ TYR A 64 6.129 13.706 5.159 1.00 0.00 C ATOM 936 OH TYR A 64 6.436 14.567 6.188 1.00 0.00 O ATOM 0 H TYR A 64 4.433 9.002 3.226 1.00 0.00 H new ATOM 0 HA TYR A 64 3.070 11.354 2.246 1.00 0.00 H new ATOM 0 HB2 TYR A 64 5.842 10.163 1.991 1.00 0.00 H new ATOM 0 HB3 TYR A 64 5.359 11.523 0.997 1.00 0.00 H new ATOM 0 HD1 TYR A 64 6.110 10.423 4.430 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.986 13.736 1.997 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.658 11.957 6.267 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.538 15.272 3.831 1.00 0.00 H new ATOM 0 HH TYR A 64 6.499 15.482 5.842 1.00 0.00 H new ATOM 946 N SER A 65 3.533 8.737 0.349 1.00 0.00 N ATOM 947 CA SER A 65 3.195 8.133 -0.935 1.00 0.00 C ATOM 948 C SER A 65 3.005 6.626 -0.793 1.00 0.00 C ATOM 949 O SER A 65 3.338 6.042 0.238 1.00 0.00 O ATOM 950 CB SER A 65 4.289 8.426 -1.964 1.00 0.00 C ATOM 951 OG SER A 65 5.255 9.321 -1.441 1.00 0.00 O ATOM 0 H SER A 65 3.936 8.090 1.026 1.00 0.00 H new ATOM 0 HA SER A 65 2.257 8.569 -1.278 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.773 7.495 -2.259 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.843 8.852 -2.862 1.00 0.00 H new ATOM 0 HG SER A 65 5.944 9.491 -2.117 1.00 0.00 H new ATOM 957 N MET A 66 2.467 6.003 -1.836 1.00 0.00 N ATOM 958 CA MET A 66 2.233 4.564 -1.829 1.00 0.00 C ATOM 959 C MET A 66 2.589 3.948 -3.179 1.00 0.00 C ATOM 960 O MET A 66 2.181 4.448 -4.228 1.00 0.00 O ATOM 961 CB MET A 66 0.772 4.265 -1.489 1.00 0.00 C ATOM 962 CG MET A 66 0.299 2.906 -1.979 1.00 0.00 C ATOM 963 SD MET A 66 -1.382 2.523 -1.453 1.00 0.00 S ATOM 964 CE MET A 66 -2.311 3.005 -2.907 1.00 0.00 C ATOM 0 H MET A 66 2.185 6.472 -2.697 1.00 0.00 H new ATOM 0 HA MET A 66 2.874 4.121 -1.067 1.00 0.00 H new ATOM 0 HB2 MET A 66 0.641 4.318 -0.408 1.00 0.00 H new ATOM 0 HB3 MET A 66 0.140 5.039 -1.925 1.00 0.00 H new ATOM 0 HG2 MET A 66 0.350 2.879 -3.067 1.00 0.00 H new ATOM 0 HG3 MET A 66 0.975 2.135 -1.609 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.354 3.169 -2.635 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.894 3.925 -3.317 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.251 2.215 -3.655 1.00 0.00 H new ATOM 974 N LYS A 67 3.352 2.861 -3.146 1.00 0.00 N ATOM 975 CA LYS A 67 3.763 2.177 -4.366 1.00 0.00 C ATOM 976 C LYS A 67 2.919 0.927 -4.598 1.00 0.00 C ATOM 977 O LYS A 67 3.203 -0.137 -4.047 1.00 0.00 O ATOM 978 CB LYS A 67 5.244 1.798 -4.289 1.00 0.00 C ATOM 979 CG LYS A 67 6.182 2.988 -4.397 1.00 0.00 C ATOM 980 CD LYS A 67 7.586 2.557 -4.786 1.00 0.00 C ATOM 981 CE LYS A 67 8.360 3.697 -5.430 1.00 0.00 C ATOM 982 NZ LYS A 67 9.412 3.198 -6.359 1.00 0.00 N ATOM 0 H LYS A 67 3.699 2.434 -2.287 1.00 0.00 H new ATOM 0 HA LYS A 67 3.612 2.858 -5.204 1.00 0.00 H new ATOM 0 HB2 LYS A 67 5.430 1.283 -3.346 1.00 0.00 H new ATOM 0 HB3 LYS A 67 5.472 1.092 -5.088 1.00 0.00 H new ATOM 0 HG2 LYS A 67 5.797 3.690 -5.137 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.213 3.516 -3.444 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.119 2.208 -3.902 1.00 0.00 H new ATOM 0 HD3 LYS A 67 7.531 1.716 -5.478 1.00 0.00 H new ATOM 0 HE2 LYS A 67 7.671 4.342 -5.975 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.821 4.307 -4.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 9.917 4.005 -6.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.085 2.603 -5.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.970 2.637 -7.115 1.00 0.00 H new ATOM 996 N PHE A 68 1.883 1.063 -5.419 1.00 0.00 N ATOM 997 CA PHE A 68 0.999 -0.055 -5.725 1.00 0.00 C ATOM 998 C PHE A 68 1.112 -0.452 -7.194 1.00 0.00 C ATOM 999 O PHE A 68 0.871 0.360 -8.087 1.00 0.00 O ATOM 1000 CB PHE A 68 -0.450 0.307 -5.393 1.00 0.00 C ATOM 1001 CG PHE A 68 -1.195 -0.788 -4.685 1.00 0.00 C ATOM 1002 CD1 PHE A 68 -0.634 -1.432 -3.593 1.00 0.00 C ATOM 1003 CD2 PHE A 68 -2.456 -1.175 -5.111 1.00 0.00 C ATOM 1004 CE1 PHE A 68 -1.317 -2.440 -2.939 1.00 0.00 C ATOM 1005 CE2 PHE A 68 -3.143 -2.182 -4.460 1.00 0.00 C ATOM 1006 CZ PHE A 68 -2.573 -2.816 -3.374 1.00 0.00 C ATOM 0 H PHE A 68 1.635 1.936 -5.884 1.00 0.00 H new ATOM 0 HA PHE A 68 1.303 -0.904 -5.113 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.459 1.202 -4.771 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -0.975 0.555 -6.316 1.00 0.00 H new ATOM 0 HD1 PHE A 68 0.348 -1.143 -3.249 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.907 -0.684 -5.961 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.869 -2.933 -2.089 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -4.126 -2.473 -4.801 1.00 0.00 H new ATOM 0 HZ PHE A 68 -3.108 -3.604 -2.866 1.00 0.00 H new ATOM 1016 N GLN A 69 1.480 -1.706 -7.436 1.00 0.00 N ATOM 1017 CA GLN A 69 1.627 -2.210 -8.796 1.00 0.00 C ATOM 1018 C GLN A 69 1.162 -3.659 -8.893 1.00 0.00 C ATOM 1019 O GLN A 69 0.546 -4.187 -7.968 1.00 0.00 O ATOM 1020 CB GLN A 69 3.084 -2.098 -9.250 1.00 0.00 C ATOM 1021 CG GLN A 69 3.802 -0.880 -8.693 1.00 0.00 C ATOM 1022 CD GLN A 69 5.278 -0.863 -9.042 1.00 0.00 C ATOM 1023 OE1 GLN A 69 5.723 -1.578 -9.940 1.00 0.00 O ATOM 1024 NE2 GLN A 69 6.045 -0.044 -8.332 1.00 0.00 N ATOM 0 H GLN A 69 1.682 -2.391 -6.708 1.00 0.00 H new ATOM 0 HA GLN A 69 1.002 -1.602 -9.451 1.00 0.00 H new ATOM 0 HB2 GLN A 69 3.621 -2.997 -8.946 1.00 0.00 H new ATOM 0 HB3 GLN A 69 3.115 -2.061 -10.339 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.331 0.023 -9.080 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.688 -0.860 -7.609 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.633 0.531 -7.597 1.00 0.00 H new ATOM 0 HE22 GLN A 69 7.046 0.010 -8.522 1.00 0.00 H new ATOM 1033 N GLY A 70 1.460 -4.298 -10.020 1.00 0.00 N ATOM 1034 CA GLY A 70 1.064 -5.680 -10.217 1.00 0.00 C ATOM 1035 C GLY A 70 1.953 -6.402 -11.210 1.00 0.00 C ATOM 1036 O GLY A 70 3.067 -5.970 -11.507 1.00 0.00 O ATOM 0 H GLY A 70 1.969 -3.883 -10.800 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.093 -6.203 -9.261 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.032 -5.713 -10.567 1.00 0.00 H new ATOM 1040 N PRO A 71 1.460 -7.531 -11.740 1.00 0.00 N ATOM 1041 CA PRO A 71 2.202 -8.339 -12.713 1.00 0.00 C ATOM 1042 C PRO A 71 2.332 -7.645 -14.064 1.00 0.00 C ATOM 1043 O PRO A 71 2.043 -6.455 -14.192 1.00 0.00 O ATOM 1044 CB PRO A 71 1.353 -9.606 -12.842 1.00 0.00 C ATOM 1045 CG PRO A 71 -0.025 -9.179 -12.472 1.00 0.00 C ATOM 1046 CD PRO A 71 0.140 -8.105 -11.432 1.00 0.00 C ATOM 0 HA PRO A 71 3.226 -8.526 -12.391 1.00 0.00 H new ATOM 0 HB2 PRO A 71 1.385 -10.002 -13.857 1.00 0.00 H new ATOM 0 HB3 PRO A 71 1.714 -10.393 -12.181 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -0.563 -8.801 -13.341 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -0.601 -10.017 -12.080 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.649 -7.356 -11.499 1.00 0.00 H new ATOM 0 HD3 PRO A 71 0.106 -8.515 -10.422 1.00 0.00 H new ATOM 1054 N ASP A 72 2.768 -8.396 -15.070 1.00 0.00 N ATOM 1055 CA ASP A 72 2.934 -7.853 -16.413 1.00 0.00 C ATOM 1056 C ASP A 72 2.044 -8.587 -17.410 1.00 0.00 C ATOM 1057 O ASP A 72 2.433 -8.813 -18.555 1.00 0.00 O ATOM 1058 CB ASP A 72 4.397 -7.951 -16.848 1.00 0.00 C ATOM 1059 CG ASP A 72 5.060 -9.226 -16.365 1.00 0.00 C ATOM 1060 OD1 ASP A 72 4.546 -10.319 -16.682 1.00 0.00 O ATOM 1061 OD2 ASP A 72 6.094 -9.131 -15.672 1.00 0.00 O ATOM 0 H ASP A 72 3.013 -9.382 -14.981 1.00 0.00 H new ATOM 0 HA ASP A 72 2.638 -6.804 -16.393 1.00 0.00 H new ATOM 0 HB2 ASP A 72 4.454 -7.905 -17.936 1.00 0.00 H new ATOM 0 HB3 ASP A 72 4.946 -7.091 -16.464 1.00 0.00 H new ATOM 1066 N ASN A 73 0.847 -8.958 -16.966 1.00 0.00 N ATOM 1067 CA ASN A 73 -0.098 -9.669 -17.819 1.00 0.00 C ATOM 1068 C ASN A 73 -1.232 -8.748 -18.259 1.00 0.00 C ATOM 1069 O ASN A 73 -1.841 -8.954 -19.309 1.00 0.00 O ATOM 1070 CB ASN A 73 -0.668 -10.883 -17.083 1.00 0.00 C ATOM 1071 CG ASN A 73 -0.919 -10.604 -15.614 1.00 0.00 C ATOM 1072 OD1 ASN A 73 -0.305 -11.217 -14.741 1.00 0.00 O ATOM 1073 ND2 ASN A 73 -1.825 -9.674 -15.335 1.00 0.00 N ATOM 0 H ASN A 73 0.509 -8.778 -16.021 1.00 0.00 H new ATOM 0 HA ASN A 73 0.436 -10.009 -18.707 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -1.602 -11.186 -17.557 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.024 -11.720 -17.178 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -2.036 -9.443 -14.364 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.310 -9.191 -16.091 1.00 0.00 H new ATOM 1080 N GLY A 74 -1.510 -7.732 -17.449 1.00 0.00 N ATOM 1081 CA GLY A 74 -2.570 -6.794 -17.772 1.00 0.00 C ATOM 1082 C GLY A 74 -3.612 -6.697 -16.675 1.00 0.00 C ATOM 1083 O GLY A 74 -4.778 -6.409 -16.943 1.00 0.00 O ATOM 0 H GLY A 74 -1.021 -7.541 -16.575 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.138 -5.809 -17.947 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -3.052 -7.100 -18.701 1.00 0.00 H new ATOM 1087 N GLN A 75 -3.191 -6.938 -15.438 1.00 0.00 N ATOM 1088 CA GLN A 75 -4.098 -6.878 -14.298 1.00 0.00 C ATOM 1089 C GLN A 75 -3.477 -6.089 -13.149 1.00 0.00 C ATOM 1090 O GLN A 75 -2.586 -6.579 -12.457 1.00 0.00 O ATOM 1091 CB GLN A 75 -4.454 -8.290 -13.828 1.00 0.00 C ATOM 1092 CG GLN A 75 -5.087 -9.149 -14.910 1.00 0.00 C ATOM 1093 CD GLN A 75 -5.953 -10.257 -14.343 1.00 0.00 C ATOM 1094 OE1 GLN A 75 -7.055 -10.511 -14.831 1.00 0.00 O ATOM 1095 NE2 GLN A 75 -5.458 -10.925 -13.308 1.00 0.00 N ATOM 0 H GLN A 75 -2.228 -7.176 -15.200 1.00 0.00 H new ATOM 0 HA GLN A 75 -5.007 -6.368 -14.616 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -3.551 -8.782 -13.467 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -5.139 -8.221 -12.983 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -5.691 -8.518 -15.562 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.302 -9.586 -15.527 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.540 -10.681 -12.935 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -5.995 -11.682 -12.885 1.00 0.00 H new ATOM 1104 N GLY A 76 -3.954 -4.864 -12.954 1.00 0.00 N ATOM 1105 CA GLY A 76 -3.434 -4.026 -11.889 1.00 0.00 C ATOM 1106 C GLY A 76 -4.520 -3.224 -11.199 1.00 0.00 C ATOM 1107 O GLY A 76 -5.534 -2.867 -11.799 1.00 0.00 O ATOM 0 H GLY A 76 -4.691 -4.437 -13.514 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.926 -4.651 -11.154 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.688 -3.345 -12.298 1.00 0.00 H new ATOM 1111 N PRO A 77 -4.314 -2.931 -9.907 1.00 0.00 N ATOM 1112 CA PRO A 77 -5.273 -2.164 -9.106 1.00 0.00 C ATOM 1113 C PRO A 77 -5.342 -0.700 -9.529 1.00 0.00 C ATOM 1114 O PRO A 77 -4.315 -0.035 -9.671 1.00 0.00 O ATOM 1115 CB PRO A 77 -4.724 -2.284 -7.683 1.00 0.00 C ATOM 1116 CG PRO A 77 -3.264 -2.528 -7.859 1.00 0.00 C ATOM 1117 CD PRO A 77 -3.128 -3.324 -9.127 1.00 0.00 C ATOM 0 HA PRO A 77 -6.290 -2.540 -9.218 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -4.907 -1.375 -7.110 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -5.200 -3.102 -7.143 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.717 -1.588 -7.928 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -2.854 -3.074 -7.009 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -2.204 -3.086 -9.654 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -3.115 -4.396 -8.929 1.00 0.00 H new ATOM 1125 N LYS A 78 -6.558 -0.203 -9.729 1.00 0.00 N ATOM 1126 CA LYS A 78 -6.761 1.182 -10.134 1.00 0.00 C ATOM 1127 C LYS A 78 -7.401 1.990 -9.009 1.00 0.00 C ATOM 1128 O LYS A 78 -6.729 2.763 -8.327 1.00 0.00 O ATOM 1129 CB LYS A 78 -7.640 1.246 -11.385 1.00 0.00 C ATOM 1130 CG LYS A 78 -8.148 2.642 -11.702 1.00 0.00 C ATOM 1131 CD LYS A 78 -8.506 2.785 -13.172 1.00 0.00 C ATOM 1132 CE LYS A 78 -7.319 3.268 -13.990 1.00 0.00 C ATOM 1133 NZ LYS A 78 -7.730 3.732 -15.344 1.00 0.00 N ATOM 0 H LYS A 78 -7.418 -0.740 -9.617 1.00 0.00 H new ATOM 0 HA LYS A 78 -5.786 1.614 -10.360 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.072 0.873 -12.237 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.492 0.579 -11.254 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -9.024 2.859 -11.091 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -7.386 3.376 -11.439 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -8.850 1.826 -13.559 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.333 3.487 -13.280 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -6.822 4.082 -13.463 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.593 2.461 -14.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.892 4.053 -15.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -8.182 2.948 -15.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -8.403 4.519 -15.252 1.00 0.00 H new ATOM 1147 N TYR A 79 -8.703 1.804 -8.820 1.00 0.00 N ATOM 1148 CA TYR A 79 -9.433 2.515 -7.778 1.00 0.00 C ATOM 1149 C TYR A 79 -9.348 1.773 -6.448 1.00 0.00 C ATOM 1150 O TYR A 79 -10.043 0.780 -6.232 1.00 0.00 O ATOM 1151 CB TYR A 79 -10.898 2.692 -8.183 1.00 0.00 C ATOM 1152 CG TYR A 79 -11.614 3.775 -7.407 1.00 0.00 C ATOM 1153 CD1 TYR A 79 -11.518 5.108 -7.787 1.00 0.00 C ATOM 1154 CD2 TYR A 79 -12.385 3.465 -6.294 1.00 0.00 C ATOM 1155 CE1 TYR A 79 -12.170 6.101 -7.082 1.00 0.00 C ATOM 1156 CE2 TYR A 79 -13.042 4.451 -5.583 1.00 0.00 C ATOM 1157 CZ TYR A 79 -12.931 5.767 -5.981 1.00 0.00 C ATOM 1158 OH TYR A 79 -13.582 6.752 -5.275 1.00 0.00 O ATOM 0 H TYR A 79 -9.274 1.167 -9.375 1.00 0.00 H new ATOM 0 HA TYR A 79 -8.975 3.496 -7.655 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.947 2.926 -9.246 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.422 1.747 -8.040 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -10.923 5.372 -8.649 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -12.472 2.436 -5.979 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -12.084 7.132 -7.391 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -13.639 4.193 -4.721 1.00 0.00 H new ATOM 0 HH TYR A 79 -14.075 6.349 -4.530 1.00 0.00 H new ATOM 1168 N VAL A 80 -8.489 2.262 -5.559 1.00 0.00 N ATOM 1169 CA VAL A 80 -8.312 1.647 -4.249 1.00 0.00 C ATOM 1170 C VAL A 80 -8.627 2.635 -3.131 1.00 0.00 C ATOM 1171 O VAL A 80 -8.229 3.799 -3.186 1.00 0.00 O ATOM 1172 CB VAL A 80 -6.876 1.122 -4.065 1.00 0.00 C ATOM 1173 CG1 VAL A 80 -6.873 -0.395 -3.946 1.00 0.00 C ATOM 1174 CG2 VAL A 80 -5.991 1.575 -5.217 1.00 0.00 C ATOM 0 H VAL A 80 -7.905 3.082 -5.722 1.00 0.00 H new ATOM 0 HA VAL A 80 -9.007 0.809 -4.196 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.472 1.537 -3.141 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -5.850 -0.748 -3.817 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -7.471 -0.694 -3.085 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -7.296 -0.832 -4.851 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -4.980 1.195 -5.070 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -6.391 1.191 -6.156 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -5.968 2.664 -5.251 1.00 0.00 H new ATOM 1184 N LYS A 81 -9.344 2.164 -2.117 1.00 0.00 N ATOM 1185 CA LYS A 81 -9.712 3.004 -0.984 1.00 0.00 C ATOM 1186 C LYS A 81 -8.713 2.846 0.158 1.00 0.00 C ATOM 1187 O LYS A 81 -8.504 1.743 0.664 1.00 0.00 O ATOM 1188 CB LYS A 81 -11.119 2.652 -0.496 1.00 0.00 C ATOM 1189 CG LYS A 81 -12.179 2.746 -1.580 1.00 0.00 C ATOM 1190 CD LYS A 81 -13.573 2.529 -1.017 1.00 0.00 C ATOM 1191 CE LYS A 81 -14.384 3.815 -1.025 1.00 0.00 C ATOM 1192 NZ LYS A 81 -15.374 3.840 -2.137 1.00 0.00 N ATOM 0 H LYS A 81 -9.682 1.204 -2.057 1.00 0.00 H new ATOM 0 HA LYS A 81 -9.698 4.042 -1.315 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -11.112 1.639 -0.093 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.388 3.319 0.323 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.127 3.725 -2.057 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.978 2.003 -2.352 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.089 1.769 -1.603 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -13.500 2.150 0.002 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.904 3.922 -0.073 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -13.712 4.668 -1.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.786 4.792 -2.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.900 3.595 -3.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.129 3.151 -1.945 1.00 0.00 H new ATOM 1206 N ILE A 82 -8.099 3.954 0.560 1.00 0.00 N ATOM 1207 CA ILE A 82 -7.125 3.937 1.643 1.00 0.00 C ATOM 1208 C ILE A 82 -7.775 4.302 2.973 1.00 0.00 C ATOM 1209 O ILE A 82 -8.568 5.241 3.052 1.00 0.00 O ATOM 1210 CB ILE A 82 -5.962 4.909 1.370 1.00 0.00 C ATOM 1211 CG1 ILE A 82 -5.251 4.536 0.067 1.00 0.00 C ATOM 1212 CG2 ILE A 82 -4.982 4.905 2.534 1.00 0.00 C ATOM 1213 CD1 ILE A 82 -4.445 5.668 -0.528 1.00 0.00 C ATOM 0 H ILE A 82 -8.259 4.875 0.151 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.734 2.921 1.699 1.00 0.00 H new ATOM 0 HB ILE A 82 -6.367 5.915 1.266 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -4.590 3.689 0.253 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -5.993 4.208 -0.661 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.166 5.597 2.325 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -5.496 5.214 3.444 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -4.580 3.901 2.668 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.969 5.331 -1.449 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -5.104 6.508 -0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.680 5.982 0.182 1.00 0.00 H new ATOM 1225 N PHE A 83 -7.433 3.555 4.017 1.00 0.00 N ATOM 1226 CA PHE A 83 -7.984 3.800 5.346 1.00 0.00 C ATOM 1227 C PHE A 83 -6.878 3.820 6.397 1.00 0.00 C ATOM 1228 O PHE A 83 -5.911 3.063 6.310 1.00 0.00 O ATOM 1229 CB PHE A 83 -9.018 2.729 5.698 1.00 0.00 C ATOM 1230 CG PHE A 83 -10.245 2.772 4.832 1.00 0.00 C ATOM 1231 CD1 PHE A 83 -10.273 2.112 3.614 1.00 0.00 C ATOM 1232 CD2 PHE A 83 -11.369 3.474 5.236 1.00 0.00 C ATOM 1233 CE1 PHE A 83 -11.400 2.151 2.815 1.00 0.00 C ATOM 1234 CE2 PHE A 83 -12.500 3.516 4.441 1.00 0.00 C ATOM 1235 CZ PHE A 83 -12.515 2.853 3.230 1.00 0.00 C ATOM 0 H PHE A 83 -6.777 2.775 3.969 1.00 0.00 H new ATOM 0 HA PHE A 83 -8.471 4.775 5.337 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -8.555 1.746 5.610 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -9.314 2.850 6.740 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -9.404 1.561 3.285 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.362 3.994 6.182 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -11.409 1.633 1.867 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -13.370 4.067 4.767 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.397 2.883 2.608 1.00 0.00 H new ATOM 1245 N ILE A 84 -7.028 4.691 7.388 1.00 0.00 N ATOM 1246 CA ILE A 84 -6.044 4.810 8.457 1.00 0.00 C ATOM 1247 C ILE A 84 -6.715 5.111 9.792 1.00 0.00 C ATOM 1248 O ILE A 84 -7.889 5.477 9.840 1.00 0.00 O ATOM 1249 CB ILE A 84 -5.013 5.914 8.152 1.00 0.00 C ATOM 1250 CG1 ILE A 84 -5.714 7.265 7.989 1.00 0.00 C ATOM 1251 CG2 ILE A 84 -4.220 5.568 6.901 1.00 0.00 C ATOM 1252 CD1 ILE A 84 -4.950 8.419 8.600 1.00 0.00 C ATOM 0 H ILE A 84 -7.822 5.325 7.473 1.00 0.00 H new ATOM 0 HA ILE A 84 -5.530 3.851 8.521 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.319 5.984 8.990 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.865 7.461 6.928 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.702 7.210 8.447 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.496 6.358 6.699 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -3.695 4.625 7.052 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.900 5.474 6.054 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -5.505 9.344 8.447 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.821 8.245 9.668 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.972 8.500 8.125 1.00 0.00 H new ATOM 1264 N ASN A 85 -5.961 4.956 10.876 1.00 0.00 N ATOM 1265 CA ASN A 85 -6.483 5.212 12.213 1.00 0.00 C ATOM 1266 C ASN A 85 -7.761 4.417 12.460 1.00 0.00 C ATOM 1267 O ASN A 85 -8.707 4.915 13.072 1.00 0.00 O ATOM 1268 CB ASN A 85 -6.755 6.706 12.399 1.00 0.00 C ATOM 1269 CG ASN A 85 -5.495 7.488 12.718 1.00 0.00 C ATOM 1270 OD1 ASN A 85 -5.436 8.215 13.709 1.00 0.00 O ATOM 1271 ND2 ASN A 85 -4.479 7.341 11.875 1.00 0.00 N ATOM 0 H ASN A 85 -4.987 4.654 10.854 1.00 0.00 H new ATOM 0 HA ASN A 85 -5.732 4.893 12.936 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -7.207 7.106 11.492 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.478 6.844 13.203 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.605 7.842 12.037 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -4.573 6.727 11.066 1.00 0.00 H new ATOM 1278 N LEU A 86 -7.782 3.178 11.981 1.00 0.00 N ATOM 1279 CA LEU A 86 -8.944 2.312 12.150 1.00 0.00 C ATOM 1280 C LEU A 86 -9.017 1.771 13.575 1.00 0.00 C ATOM 1281 O LEU A 86 -8.013 1.673 14.280 1.00 0.00 O ATOM 1282 CB LEU A 86 -8.889 1.152 11.155 1.00 0.00 C ATOM 1283 CG LEU A 86 -9.097 1.519 9.685 1.00 0.00 C ATOM 1284 CD1 LEU A 86 -8.843 0.313 8.793 1.00 0.00 C ATOM 1285 CD2 LEU A 86 -10.501 2.062 9.464 1.00 0.00 C ATOM 0 H LEU A 86 -7.008 2.751 11.473 1.00 0.00 H new ATOM 0 HA LEU A 86 -9.839 2.905 11.959 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -7.921 0.661 11.253 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.647 0.421 11.437 1.00 0.00 H new ATOM 0 HG LEU A 86 -8.382 2.298 9.420 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -8.996 0.593 7.751 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.818 -0.031 8.930 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -9.533 -0.488 9.059 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.631 2.318 8.412 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -11.233 1.305 9.746 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -10.647 2.953 10.075 1.00 0.00 H new ATOM 1297 N PRO A 87 -10.234 1.409 14.009 1.00 0.00 N ATOM 1298 CA PRO A 87 -10.467 0.869 15.351 1.00 0.00 C ATOM 1299 C PRO A 87 -9.882 -0.528 15.524 1.00 0.00 C ATOM 1300 O PRO A 87 -9.606 -0.962 16.643 1.00 0.00 O ATOM 1301 CB PRO A 87 -11.994 0.827 15.456 1.00 0.00 C ATOM 1302 CG PRO A 87 -12.468 0.728 14.047 1.00 0.00 C ATOM 1303 CD PRO A 87 -11.475 1.499 13.221 1.00 0.00 C ATOM 0 HA PRO A 87 -9.989 1.474 16.122 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -12.327 -0.027 16.047 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -12.382 1.722 15.942 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -12.520 -0.312 13.725 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -13.470 1.144 13.942 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -11.354 1.064 12.229 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -11.787 2.534 13.079 1.00 0.00 H new ATOM 1311 N ARG A 88 -9.696 -1.228 14.410 1.00 0.00 N ATOM 1312 CA ARG A 88 -9.145 -2.578 14.439 1.00 0.00 C ATOM 1313 C ARG A 88 -8.834 -3.068 13.028 1.00 0.00 C ATOM 1314 O ARG A 88 -7.672 -3.157 12.632 1.00 0.00 O ATOM 1315 CB ARG A 88 -10.122 -3.537 15.120 1.00 0.00 C ATOM 1316 CG ARG A 88 -11.570 -3.079 15.055 1.00 0.00 C ATOM 1317 CD ARG A 88 -12.530 -4.257 15.099 1.00 0.00 C ATOM 1318 NE ARG A 88 -13.231 -4.344 16.377 1.00 0.00 N ATOM 1319 CZ ARG A 88 -14.152 -5.263 16.649 1.00 0.00 C ATOM 1320 NH1 ARG A 88 -14.479 -6.168 15.737 1.00 0.00 N ATOM 1321 NH2 ARG A 88 -14.746 -5.278 17.835 1.00 0.00 N ATOM 0 H ARG A 88 -9.919 -0.883 13.476 1.00 0.00 H new ATOM 0 HA ARG A 88 -8.216 -2.552 15.009 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -10.039 -4.519 14.654 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -9.834 -3.655 16.165 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -11.778 -2.408 15.888 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -11.732 -2.510 14.139 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -13.257 -4.162 14.292 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -11.979 -5.181 14.924 1.00 0.00 H new ATOM 0 HE ARG A 88 -13.001 -3.662 17.100 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -14.024 -6.160 14.824 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -15.186 -6.872 15.948 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -14.496 -4.584 18.539 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -15.453 -5.984 18.043 1.00 0.00 H new ATOM 1335 N SER A 89 -9.881 -3.387 12.274 1.00 0.00 N ATOM 1336 CA SER A 89 -9.720 -3.873 10.908 1.00 0.00 C ATOM 1337 C SER A 89 -10.831 -3.341 10.008 1.00 0.00 C ATOM 1338 O SER A 89 -11.770 -2.698 10.476 1.00 0.00 O ATOM 1339 CB SER A 89 -9.719 -5.403 10.886 1.00 0.00 C ATOM 1340 OG SER A 89 -10.966 -5.920 11.316 1.00 0.00 O ATOM 0 H SER A 89 -10.850 -3.318 12.586 1.00 0.00 H new ATOM 0 HA SER A 89 -8.764 -3.510 10.529 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.504 -5.755 9.877 1.00 0.00 H new ATOM 0 HB3 SER A 89 -8.924 -5.779 11.531 1.00 0.00 H new ATOM 0 HG SER A 89 -10.940 -6.899 11.291 1.00 0.00 H new ATOM 1346 N MET A 90 -10.715 -3.613 8.712 1.00 0.00 N ATOM 1347 CA MET A 90 -11.709 -3.162 7.745 1.00 0.00 C ATOM 1348 C MET A 90 -12.320 -4.346 7.002 1.00 0.00 C ATOM 1349 O MET A 90 -11.604 -5.210 6.495 1.00 0.00 O ATOM 1350 CB MET A 90 -11.077 -2.190 6.747 1.00 0.00 C ATOM 1351 CG MET A 90 -12.082 -1.548 5.805 1.00 0.00 C ATOM 1352 SD MET A 90 -12.513 0.135 6.291 1.00 0.00 S ATOM 1353 CE MET A 90 -12.761 -0.075 8.052 1.00 0.00 C ATOM 0 H MET A 90 -9.943 -4.143 8.308 1.00 0.00 H new ATOM 0 HA MET A 90 -12.502 -2.648 8.289 1.00 0.00 H new ATOM 0 HB2 MET A 90 -10.554 -1.407 7.296 1.00 0.00 H new ATOM 0 HB3 MET A 90 -10.328 -2.721 6.159 1.00 0.00 H new ATOM 0 HG2 MET A 90 -11.672 -1.537 4.795 1.00 0.00 H new ATOM 0 HG3 MET A 90 -12.986 -2.156 5.775 1.00 0.00 H new ATOM 0 HE1 MET A 90 -13.137 0.854 8.480 1.00 0.00 H new ATOM 0 HE2 MET A 90 -13.484 -0.872 8.225 1.00 0.00 H new ATOM 0 HE3 MET A 90 -11.814 -0.335 8.524 1.00 0.00 H new ATOM 1363 N ASP A 91 -13.647 -4.380 6.942 1.00 0.00 N ATOM 1364 CA ASP A 91 -14.354 -5.458 6.261 1.00 0.00 C ATOM 1365 C ASP A 91 -14.876 -4.993 4.905 1.00 0.00 C ATOM 1366 O ASP A 91 -14.522 -3.915 4.428 1.00 0.00 O ATOM 1367 CB ASP A 91 -15.513 -5.961 7.122 1.00 0.00 C ATOM 1368 CG ASP A 91 -15.179 -5.960 8.601 1.00 0.00 C ATOM 1369 OD1 ASP A 91 -14.299 -6.745 9.011 1.00 0.00 O ATOM 1370 OD2 ASP A 91 -15.798 -5.174 9.349 1.00 0.00 O ATOM 0 H ASP A 91 -14.254 -3.673 7.357 1.00 0.00 H new ATOM 0 HA ASP A 91 -13.651 -6.275 6.099 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -16.388 -5.334 6.950 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -15.779 -6.972 6.813 1.00 0.00 H new ATOM 1375 N PHE A 92 -15.719 -5.815 4.288 1.00 0.00 N ATOM 1376 CA PHE A 92 -16.288 -5.489 2.985 1.00 0.00 C ATOM 1377 C PHE A 92 -17.409 -4.463 3.123 1.00 0.00 C ATOM 1378 O PHE A 92 -17.586 -3.603 2.260 1.00 0.00 O ATOM 1379 CB PHE A 92 -16.820 -6.754 2.307 1.00 0.00 C ATOM 1380 CG PHE A 92 -15.741 -7.725 1.920 1.00 0.00 C ATOM 1381 CD1 PHE A 92 -15.065 -8.451 2.887 1.00 0.00 C ATOM 1382 CD2 PHE A 92 -15.404 -7.911 0.589 1.00 0.00 C ATOM 1383 CE1 PHE A 92 -14.072 -9.345 2.534 1.00 0.00 C ATOM 1384 CE2 PHE A 92 -14.412 -8.805 0.230 1.00 0.00 C ATOM 1385 CZ PHE A 92 -13.745 -9.522 1.204 1.00 0.00 C ATOM 0 H PHE A 92 -16.023 -6.711 4.669 1.00 0.00 H new ATOM 0 HA PHE A 92 -15.499 -5.059 2.368 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -17.520 -7.250 2.979 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -17.380 -6.471 1.416 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -15.317 -8.317 3.929 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -15.922 -7.352 -0.176 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -13.552 -9.905 3.298 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -14.159 -8.942 -0.811 1.00 0.00 H new ATOM 0 HZ PHE A 92 -12.969 -10.220 0.926 1.00 0.00 H new ATOM 1395 N GLU A 93 -18.163 -4.561 4.214 1.00 0.00 N ATOM 1396 CA GLU A 93 -19.267 -3.642 4.463 1.00 0.00 C ATOM 1397 C GLU A 93 -18.762 -2.337 5.073 1.00 0.00 C ATOM 1398 O GLU A 93 -19.267 -1.259 4.762 1.00 0.00 O ATOM 1399 CB GLU A 93 -20.297 -4.288 5.393 1.00 0.00 C ATOM 1400 CG GLU A 93 -21.320 -5.144 4.667 1.00 0.00 C ATOM 1401 CD GLU A 93 -22.735 -4.900 5.152 1.00 0.00 C ATOM 1402 OE1 GLU A 93 -22.944 -4.877 6.383 1.00 0.00 O ATOM 1403 OE2 GLU A 93 -23.634 -4.731 4.301 1.00 0.00 O ATOM 0 H GLU A 93 -18.029 -5.267 4.938 1.00 0.00 H new ATOM 0 HA GLU A 93 -19.741 -3.416 3.508 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -19.776 -4.903 6.127 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -20.817 -3.505 5.945 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -21.266 -4.939 3.598 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -21.070 -6.196 4.803 1.00 0.00 H new ATOM 1410 N GLU A 94 -17.763 -2.446 5.943 1.00 0.00 N ATOM 1411 CA GLU A 94 -17.191 -1.275 6.598 1.00 0.00 C ATOM 1412 C GLU A 94 -16.368 -0.448 5.613 1.00 0.00 C ATOM 1413 O GLU A 94 -16.161 0.748 5.812 1.00 0.00 O ATOM 1414 CB GLU A 94 -16.316 -1.700 7.779 1.00 0.00 C ATOM 1415 CG GLU A 94 -17.084 -1.849 9.082 1.00 0.00 C ATOM 1416 CD GLU A 94 -16.350 -1.245 10.264 1.00 0.00 C ATOM 1417 OE1 GLU A 94 -15.820 -0.123 10.121 1.00 0.00 O ATOM 1418 OE2 GLU A 94 -16.306 -1.893 11.330 1.00 0.00 O ATOM 0 H GLU A 94 -17.333 -3.332 6.210 1.00 0.00 H new ATOM 0 HA GLU A 94 -18.012 -0.659 6.966 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.834 -2.648 7.541 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -15.523 -0.965 7.916 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -18.059 -1.371 8.982 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -17.266 -2.907 9.274 1.00 0.00 H new ATOM 1425 N ALA A 95 -15.902 -1.097 4.551 1.00 0.00 N ATOM 1426 CA ALA A 95 -15.103 -0.423 3.534 1.00 0.00 C ATOM 1427 C ALA A 95 -15.992 0.301 2.529 1.00 0.00 C ATOM 1428 O ALA A 95 -15.511 1.092 1.718 1.00 0.00 O ATOM 1429 CB ALA A 95 -14.203 -1.422 2.823 1.00 0.00 C ATOM 0 H ALA A 95 -16.064 -2.088 4.372 1.00 0.00 H new ATOM 0 HA ALA A 95 -14.480 0.321 4.030 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.612 -0.905 2.067 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.536 -1.890 3.547 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -14.815 -2.187 2.345 1.00 0.00 H new ATOM 1435 N GLU A 96 -17.291 0.025 2.588 1.00 0.00 N ATOM 1436 CA GLU A 96 -18.247 0.650 1.680 1.00 0.00 C ATOM 1437 C GLU A 96 -18.993 1.785 2.374 1.00 0.00 C ATOM 1438 O GLU A 96 -19.100 2.890 1.841 1.00 0.00 O ATOM 1439 CB GLU A 96 -19.243 -0.388 1.160 1.00 0.00 C ATOM 1440 CG GLU A 96 -19.180 -0.591 -0.344 1.00 0.00 C ATOM 1441 CD GLU A 96 -20.516 -0.355 -1.022 1.00 0.00 C ATOM 1442 OE1 GLU A 96 -20.785 0.799 -1.416 1.00 0.00 O ATOM 1443 OE2 GLU A 96 -21.293 -1.324 -1.157 1.00 0.00 O ATOM 0 H GLU A 96 -17.706 -0.627 3.254 1.00 0.00 H new ATOM 0 HA GLU A 96 -17.693 1.064 0.838 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -19.054 -1.341 1.655 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -20.252 -0.081 1.435 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -18.438 0.086 -0.767 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -18.844 -1.606 -0.556 1.00 0.00 H new ATOM 1450 N ARG A 97 -19.509 1.505 3.567 1.00 0.00 N ATOM 1451 CA ARG A 97 -20.247 2.501 4.333 1.00 0.00 C ATOM 1452 C ARG A 97 -19.341 3.661 4.733 1.00 0.00 C ATOM 1453 O ARG A 97 -19.719 4.827 4.615 1.00 0.00 O ATOM 1454 CB ARG A 97 -20.859 1.864 5.582 1.00 0.00 C ATOM 1455 CG ARG A 97 -19.842 1.169 6.472 1.00 0.00 C ATOM 1456 CD ARG A 97 -20.480 0.049 7.279 1.00 0.00 C ATOM 1457 NE ARG A 97 -21.672 0.500 7.993 1.00 0.00 N ATOM 1458 CZ ARG A 97 -21.632 1.170 9.139 1.00 0.00 C ATOM 1459 NH1 ARG A 97 -20.467 1.467 9.697 1.00 0.00 N ATOM 1460 NH2 ARG A 97 -22.760 1.546 9.728 1.00 0.00 N ATOM 0 H ARG A 97 -19.429 0.596 4.023 1.00 0.00 H new ATOM 0 HA ARG A 97 -21.047 2.888 3.702 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -21.368 2.635 6.160 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -21.616 1.142 5.277 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -19.037 0.764 5.859 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -19.392 1.896 7.149 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -20.745 -0.772 6.613 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -19.755 -0.341 7.993 1.00 0.00 H new ATOM 0 HE ARG A 97 -22.585 0.289 7.589 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -19.598 1.181 9.246 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -20.440 1.982 10.577 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -23.658 1.320 9.301 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -22.729 2.061 10.608 1.00 0.00 H new ATOM 1474 N SER A 98 -18.143 3.334 5.206 1.00 0.00 N ATOM 1475 CA SER A 98 -17.183 4.348 5.628 1.00 0.00 C ATOM 1476 C SER A 98 -16.286 4.762 4.466 1.00 0.00 C ATOM 1477 O SER A 98 -15.773 3.918 3.732 1.00 0.00 O ATOM 1478 CB SER A 98 -16.330 3.824 6.785 1.00 0.00 C ATOM 1479 OG SER A 98 -17.119 3.097 7.711 1.00 0.00 O ATOM 0 H SER A 98 -17.813 2.374 5.307 1.00 0.00 H new ATOM 0 HA SER A 98 -17.740 5.223 5.965 1.00 0.00 H new ATOM 0 HB2 SER A 98 -15.538 3.184 6.396 1.00 0.00 H new ATOM 0 HB3 SER A 98 -15.846 4.659 7.291 1.00 0.00 H new ATOM 0 HG SER A 98 -17.087 2.143 7.490 1.00 0.00 H new ATOM 1485 N GLU A 99 -16.101 6.069 4.306 1.00 0.00 N ATOM 1486 CA GLU A 99 -15.265 6.596 3.233 1.00 0.00 C ATOM 1487 C GLU A 99 -13.792 6.571 3.629 1.00 0.00 C ATOM 1488 O GLU A 99 -13.433 6.721 4.797 1.00 0.00 O ATOM 1489 CB GLU A 99 -15.686 8.025 2.885 1.00 0.00 C ATOM 1490 CG GLU A 99 -15.269 9.053 3.923 1.00 0.00 C ATOM 1491 CD GLU A 99 -16.204 10.246 3.972 1.00 0.00 C ATOM 1492 OE1 GLU A 99 -16.489 10.820 2.900 1.00 0.00 O ATOM 1493 OE2 GLU A 99 -16.650 10.605 5.081 1.00 0.00 O ATOM 0 H GLU A 99 -16.518 6.782 4.905 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.399 5.961 2.357 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -15.254 8.298 1.922 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -16.769 8.057 2.769 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.238 8.580 4.905 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -14.259 9.397 3.702 1.00 0.00 H new ATOM 1500 N PRO A 100 -12.916 6.374 2.632 1.00 0.00 N ATOM 1501 CA PRO A 100 -11.467 6.324 2.850 1.00 0.00 C ATOM 1502 C PRO A 100 -10.889 7.685 3.222 1.00 0.00 C ATOM 1503 O PRO A 100 -11.575 8.705 3.147 1.00 0.00 O ATOM 1504 CB PRO A 100 -10.920 5.862 1.497 1.00 0.00 C ATOM 1505 CG PRO A 100 -11.949 6.289 0.507 1.00 0.00 C ATOM 1506 CD PRO A 100 -13.272 6.187 1.216 1.00 0.00 C ATOM 0 HA PRO A 100 -11.202 5.667 3.679 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -9.953 6.318 1.284 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -10.775 4.782 1.476 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.765 7.309 0.168 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.929 5.651 -0.376 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -13.971 6.950 0.873 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.746 5.220 1.045 1.00 0.00 H new ATOM 1514 N THR A 101 -9.621 7.696 3.623 1.00 0.00 N ATOM 1515 CA THR A 101 -8.951 8.932 4.007 1.00 0.00 C ATOM 1516 C THR A 101 -8.424 9.674 2.784 1.00 0.00 C ATOM 1517 O THR A 101 -8.241 10.890 2.817 1.00 0.00 O ATOM 1518 CB THR A 101 -7.782 8.660 4.972 1.00 0.00 C ATOM 1519 OG1 THR A 101 -8.267 8.039 6.167 1.00 0.00 O ATOM 1520 CG2 THR A 101 -7.059 9.952 5.323 1.00 0.00 C ATOM 0 H THR A 101 -9.038 6.862 3.690 1.00 0.00 H new ATOM 0 HA THR A 101 -9.693 9.551 4.512 1.00 0.00 H new ATOM 0 HB THR A 101 -7.078 7.991 4.476 1.00 0.00 H new ATOM 0 HG1 THR A 101 -7.917 8.516 6.949 1.00 0.00 H new ATOM 0 HG21 THR A 101 -6.237 9.735 6.006 1.00 0.00 H new ATOM 0 HG22 THR A 101 -6.665 10.407 4.414 1.00 0.00 H new ATOM 0 HG23 THR A 101 -7.756 10.641 5.801 1.00 0.00 H new ATOM 1528 N GLN A 102 -8.184 8.934 1.706 1.00 0.00 N ATOM 1529 CA GLN A 102 -7.677 9.524 0.473 1.00 0.00 C ATOM 1530 C GLN A 102 -8.401 8.951 -0.742 1.00 0.00 C ATOM 1531 O GLN A 102 -9.250 9.611 -1.339 1.00 0.00 O ATOM 1532 CB GLN A 102 -6.173 9.281 0.346 1.00 0.00 C ATOM 1533 CG GLN A 102 -5.608 9.654 -1.015 1.00 0.00 C ATOM 1534 CD GLN A 102 -5.709 11.139 -1.302 1.00 0.00 C ATOM 1535 OE1 GLN A 102 -6.773 11.741 -1.153 1.00 0.00 O ATOM 1536 NE2 GLN A 102 -4.598 11.739 -1.715 1.00 0.00 N ATOM 0 H GLN A 102 -8.332 7.926 1.662 1.00 0.00 H new ATOM 0 HA GLN A 102 -7.862 10.598 0.511 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.655 9.855 1.115 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -5.966 8.229 0.540 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -4.563 9.348 -1.066 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.140 9.101 -1.789 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -3.738 11.201 -1.825 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -4.605 12.738 -1.923 1.00 0.00 H new ATOM 1545 N ALA A 103 -8.058 7.719 -1.101 1.00 0.00 N ATOM 1546 CA ALA A 103 -8.675 7.056 -2.243 1.00 0.00 C ATOM 1547 C ALA A 103 -8.333 7.773 -3.545 1.00 0.00 C ATOM 1548 O ALA A 103 -8.724 8.922 -3.754 1.00 0.00 O ATOM 1549 CB ALA A 103 -10.184 6.984 -2.059 1.00 0.00 C ATOM 0 H ALA A 103 -7.356 7.159 -0.617 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.278 6.043 -2.302 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.632 6.487 -2.919 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -10.414 6.421 -1.154 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.588 7.992 -1.972 1.00 0.00 H new ATOM 1555 N LEU A 104 -7.601 7.089 -4.417 1.00 0.00 N ATOM 1556 CA LEU A 104 -7.205 7.661 -5.699 1.00 0.00 C ATOM 1557 C LEU A 104 -7.328 6.630 -6.817 1.00 0.00 C ATOM 1558 O LEU A 104 -7.336 5.426 -6.564 1.00 0.00 O ATOM 1559 CB LEU A 104 -5.768 8.182 -5.626 1.00 0.00 C ATOM 1560 CG LEU A 104 -5.331 8.759 -4.279 1.00 0.00 C ATOM 1561 CD1 LEU A 104 -4.724 7.673 -3.405 1.00 0.00 C ATOM 1562 CD2 LEU A 104 -4.342 9.897 -4.482 1.00 0.00 C ATOM 0 H LEU A 104 -7.270 6.137 -4.260 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.875 8.492 -5.920 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.093 7.366 -5.885 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.643 8.953 -6.387 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.211 9.155 -3.772 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.419 8.102 -2.451 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.463 6.890 -3.231 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.855 7.247 -3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.042 10.296 -3.513 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.463 9.526 -5.009 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.811 10.686 -5.069 1.00 0.00 H new ATOM 1574 N GLU A 105 -7.423 7.113 -8.052 1.00 0.00 N ATOM 1575 CA GLU A 105 -7.544 6.232 -9.208 1.00 0.00 C ATOM 1576 C GLU A 105 -6.183 5.992 -9.854 1.00 0.00 C ATOM 1577 O GLU A 105 -5.774 6.721 -10.759 1.00 0.00 O ATOM 1578 CB GLU A 105 -8.509 6.830 -10.233 1.00 0.00 C ATOM 1579 CG GLU A 105 -8.591 6.038 -11.527 1.00 0.00 C ATOM 1580 CD GLU A 105 -9.438 6.725 -12.580 1.00 0.00 C ATOM 1581 OE1 GLU A 105 -9.096 7.861 -12.969 1.00 0.00 O ATOM 1582 OE2 GLU A 105 -10.444 6.126 -13.015 1.00 0.00 O ATOM 0 H GLU A 105 -7.419 8.108 -8.278 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.937 5.275 -8.864 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.503 6.891 -9.791 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.198 7.850 -10.460 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.585 5.884 -11.919 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.006 5.052 -11.319 1.00 0.00 H new ATOM 1589 N LEU A 106 -5.484 4.965 -9.383 1.00 0.00 N ATOM 1590 CA LEU A 106 -4.168 4.627 -9.914 1.00 0.00 C ATOM 1591 C LEU A 106 -4.227 4.414 -11.423 1.00 0.00 C ATOM 1592 O LEU A 106 -5.151 3.781 -11.936 1.00 0.00 O ATOM 1593 CB LEU A 106 -3.628 3.370 -9.230 1.00 0.00 C ATOM 1594 CG LEU A 106 -3.680 3.361 -7.702 1.00 0.00 C ATOM 1595 CD1 LEU A 106 -2.981 2.128 -7.151 1.00 0.00 C ATOM 1596 CD2 LEU A 106 -3.053 4.628 -7.140 1.00 0.00 C ATOM 0 H LEU A 106 -5.807 4.352 -8.634 1.00 0.00 H new ATOM 0 HA LEU A 106 -3.496 5.461 -9.710 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.190 2.511 -9.598 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.592 3.229 -9.539 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.725 3.329 -7.393 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -3.028 2.139 -6.062 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.475 1.232 -7.527 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.938 2.128 -7.469 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.099 4.605 -6.051 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.012 4.691 -7.458 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.598 5.498 -7.507 1.00 0.00 H new ATOM 1608 N THR A 107 -3.235 4.944 -12.130 1.00 0.00 N ATOM 1609 CA THR A 107 -3.173 4.811 -13.580 1.00 0.00 C ATOM 1610 C THR A 107 -2.034 3.889 -14.000 1.00 0.00 C ATOM 1611 O THR A 107 -1.272 3.409 -13.162 1.00 0.00 O ATOM 1612 CB THR A 107 -2.989 6.179 -14.263 1.00 0.00 C ATOM 1613 OG1 THR A 107 -3.161 6.048 -15.678 1.00 0.00 O ATOM 1614 CG2 THR A 107 -1.610 6.751 -13.965 1.00 0.00 C ATOM 0 H THR A 107 -2.462 5.470 -11.722 1.00 0.00 H new ATOM 0 HA THR A 107 -4.122 4.379 -13.898 1.00 0.00 H new ATOM 0 HB THR A 107 -3.742 6.862 -13.868 1.00 0.00 H new ATOM 0 HG1 THR A 107 -3.921 5.457 -15.862 1.00 0.00 H new ATOM 0 HG21 THR A 107 -1.503 7.717 -14.458 1.00 0.00 H new ATOM 0 HG22 THR A 107 -1.493 6.877 -12.889 1.00 0.00 H new ATOM 0 HG23 THR A 107 -0.845 6.068 -14.335 1.00 0.00 H new ATOM 1622 N GLU A 108 -1.925 3.646 -15.302 1.00 0.00 N ATOM 1623 CA GLU A 108 -0.878 2.780 -15.832 1.00 0.00 C ATOM 1624 C GLU A 108 0.504 3.293 -15.436 1.00 0.00 C ATOM 1625 O GLU A 108 1.453 2.519 -15.313 1.00 0.00 O ATOM 1626 CB GLU A 108 -0.982 2.690 -17.356 1.00 0.00 C ATOM 1627 CG GLU A 108 -1.087 4.042 -18.040 1.00 0.00 C ATOM 1628 CD GLU A 108 -0.745 3.977 -19.516 1.00 0.00 C ATOM 1629 OE1 GLU A 108 -1.505 3.338 -20.273 1.00 0.00 O ATOM 1630 OE2 GLU A 108 0.282 4.565 -19.914 1.00 0.00 O ATOM 0 H GLU A 108 -2.548 4.036 -16.009 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.014 1.786 -15.406 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -0.108 2.165 -17.741 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.855 2.091 -17.617 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -2.100 4.427 -17.922 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -0.418 4.748 -17.547 1.00 0.00 H new ATOM 1637 N ASP A 109 0.608 4.602 -15.238 1.00 0.00 N ATOM 1638 CA ASP A 109 1.873 5.219 -14.855 1.00 0.00 C ATOM 1639 C ASP A 109 2.102 5.100 -13.352 1.00 0.00 C ATOM 1640 O ASP A 109 3.215 5.305 -12.865 1.00 0.00 O ATOM 1641 CB ASP A 109 1.894 6.691 -15.272 1.00 0.00 C ATOM 1642 CG ASP A 109 2.760 6.935 -16.492 1.00 0.00 C ATOM 1643 OD1 ASP A 109 2.320 6.594 -17.609 1.00 0.00 O ATOM 1644 OD2 ASP A 109 3.879 7.466 -16.329 1.00 0.00 O ATOM 0 H ASP A 109 -0.168 5.257 -15.336 1.00 0.00 H new ATOM 0 HA ASP A 109 2.677 4.692 -15.370 1.00 0.00 H new ATOM 0 HB2 ASP A 109 0.876 7.021 -15.481 1.00 0.00 H new ATOM 0 HB3 ASP A 109 2.261 7.295 -14.443 1.00 0.00 H new ATOM 1649 N ASP A 110 1.043 4.770 -12.621 1.00 0.00 N ATOM 1650 CA ASP A 110 1.129 4.623 -11.173 1.00 0.00 C ATOM 1651 C ASP A 110 1.330 3.162 -10.785 1.00 0.00 C ATOM 1652 O ASP A 110 1.647 2.852 -9.636 1.00 0.00 O ATOM 1653 CB ASP A 110 -0.134 5.172 -10.508 1.00 0.00 C ATOM 1654 CG ASP A 110 -0.445 6.592 -10.938 1.00 0.00 C ATOM 1655 OD1 ASP A 110 0.502 7.327 -11.286 1.00 0.00 O ATOM 1656 OD2 ASP A 110 -1.636 6.968 -10.926 1.00 0.00 O ATOM 0 H ASP A 110 0.115 4.599 -13.008 1.00 0.00 H new ATOM 0 HA ASP A 110 1.991 5.193 -10.825 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -0.979 4.528 -10.753 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -0.013 5.142 -9.425 1.00 0.00 H new ATOM 1661 N ILE A 111 1.142 2.268 -11.750 1.00 0.00 N ATOM 1662 CA ILE A 111 1.302 0.839 -11.509 1.00 0.00 C ATOM 1663 C ILE A 111 2.357 0.241 -12.433 1.00 0.00 C ATOM 1664 O ILE A 111 2.381 -0.967 -12.667 1.00 0.00 O ATOM 1665 CB ILE A 111 -0.025 0.083 -11.706 1.00 0.00 C ATOM 1666 CG1 ILE A 111 -0.487 0.189 -13.161 1.00 0.00 C ATOM 1667 CG2 ILE A 111 -1.090 0.627 -10.765 1.00 0.00 C ATOM 1668 CD1 ILE A 111 -0.774 -1.149 -13.803 1.00 0.00 C ATOM 0 H ILE A 111 0.879 2.508 -12.706 1.00 0.00 H new ATOM 0 HA ILE A 111 1.624 0.727 -10.474 1.00 0.00 H new ATOM 0 HB ILE A 111 0.136 -0.969 -11.471 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -1.386 0.804 -13.204 1.00 0.00 H new ATOM 0 HG13 ILE A 111 0.279 0.704 -13.740 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.022 0.082 -10.916 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -0.761 0.504 -9.733 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -1.251 1.685 -10.970 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -1.096 -0.997 -14.833 1.00 0.00 H new ATOM 0 HD12 ILE A 111 0.129 -1.759 -13.792 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -1.562 -1.657 -13.248 1.00 0.00 H new ATOM 1680 N LYS A 112 3.231 1.095 -12.955 1.00 0.00 N ATOM 1681 CA LYS A 112 4.292 0.652 -13.852 1.00 0.00 C ATOM 1682 C LYS A 112 5.530 0.235 -13.065 1.00 0.00 C ATOM 1683 O LYS A 112 5.495 0.143 -11.838 1.00 0.00 O ATOM 1684 CB LYS A 112 4.653 1.766 -14.837 1.00 0.00 C ATOM 1685 CG LYS A 112 5.222 3.007 -14.172 1.00 0.00 C ATOM 1686 CD LYS A 112 6.267 3.680 -15.046 1.00 0.00 C ATOM 1687 CE LYS A 112 6.143 5.195 -14.997 1.00 0.00 C ATOM 1688 NZ LYS A 112 7.416 5.868 -15.376 1.00 0.00 N ATOM 0 H LYS A 112 3.225 2.098 -12.772 1.00 0.00 H new ATOM 0 HA LYS A 112 3.927 -0.212 -14.407 1.00 0.00 H new ATOM 0 HB2 LYS A 112 5.379 1.384 -15.554 1.00 0.00 H new ATOM 0 HB3 LYS A 112 3.763 2.043 -15.401 1.00 0.00 H new ATOM 0 HG2 LYS A 112 4.416 3.710 -13.961 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.667 2.736 -13.215 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.263 3.385 -14.717 1.00 0.00 H new ATOM 0 HD3 LYS A 112 6.157 3.338 -16.075 1.00 0.00 H new ATOM 0 HE2 LYS A 112 5.348 5.516 -15.670 1.00 0.00 H new ATOM 0 HE3 LYS A 112 5.854 5.503 -13.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 7.290 6.899 -15.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 8.169 5.581 -14.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 7.679 5.594 -16.344 1.00 0.00 H new ATOM 1702 N GLU A 113 6.624 -0.016 -13.779 1.00 0.00 N ATOM 1703 CA GLU A 113 7.872 -0.423 -13.145 1.00 0.00 C ATOM 1704 C GLU A 113 8.236 0.522 -12.003 1.00 0.00 C ATOM 1705 O GLU A 113 8.777 0.098 -10.981 1.00 0.00 O ATOM 1706 CB GLU A 113 9.005 -0.456 -14.174 1.00 0.00 C ATOM 1707 CG GLU A 113 9.298 0.897 -14.801 1.00 0.00 C ATOM 1708 CD GLU A 113 10.223 0.797 -15.998 1.00 0.00 C ATOM 1709 OE1 GLU A 113 11.242 0.082 -15.902 1.00 0.00 O ATOM 1710 OE2 GLU A 113 9.928 1.435 -17.030 1.00 0.00 O ATOM 0 H GLU A 113 6.670 0.055 -14.795 1.00 0.00 H new ATOM 0 HA GLU A 113 7.732 -1.423 -12.736 1.00 0.00 H new ATOM 0 HB2 GLU A 113 9.910 -0.828 -13.694 1.00 0.00 H new ATOM 0 HB3 GLU A 113 8.748 -1.164 -14.962 1.00 0.00 H new ATOM 0 HG2 GLU A 113 8.361 1.361 -15.108 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.747 1.550 -14.053 1.00 0.00 H new ATOM 1717 N ASP A 114 7.935 1.803 -12.184 1.00 0.00 N ATOM 1718 CA ASP A 114 8.229 2.808 -11.169 1.00 0.00 C ATOM 1719 C ASP A 114 6.958 3.533 -10.738 1.00 0.00 C ATOM 1720 O ASP A 114 6.990 4.715 -10.400 1.00 0.00 O ATOM 1721 CB ASP A 114 9.251 3.815 -11.699 1.00 0.00 C ATOM 1722 CG ASP A 114 10.148 4.360 -10.606 1.00 0.00 C ATOM 1723 OD1 ASP A 114 10.563 3.571 -9.731 1.00 0.00 O ATOM 1724 OD2 ASP A 114 10.435 5.575 -10.624 1.00 0.00 O ATOM 0 H ASP A 114 7.488 2.170 -13.024 1.00 0.00 H new ATOM 0 HA ASP A 114 8.648 2.300 -10.300 1.00 0.00 H new ATOM 0 HB2 ASP A 114 9.864 3.338 -12.464 1.00 0.00 H new ATOM 0 HB3 ASP A 114 8.727 4.641 -12.180 1.00 0.00 H new ATOM 1729 N GLY A 115 5.839 2.815 -10.754 1.00 0.00 N ATOM 1730 CA GLY A 115 4.573 3.407 -10.364 1.00 0.00 C ATOM 1731 C GLY A 115 4.620 4.017 -8.977 1.00 0.00 C ATOM 1732 O GLY A 115 5.022 3.360 -8.016 1.00 0.00 O ATOM 0 H GLY A 115 5.787 1.834 -11.030 1.00 0.00 H new ATOM 0 HA2 GLY A 115 4.297 4.175 -11.086 1.00 0.00 H new ATOM 0 HA3 GLY A 115 3.794 2.645 -10.396 1.00 0.00 H new ATOM 1736 N ILE A 116 4.211 5.277 -8.872 1.00 0.00 N ATOM 1737 CA ILE A 116 4.209 5.975 -7.592 1.00 0.00 C ATOM 1738 C ILE A 116 2.883 6.689 -7.357 1.00 0.00 C ATOM 1739 O ILE A 116 2.384 7.400 -8.230 1.00 0.00 O ATOM 1740 CB ILE A 116 5.354 7.002 -7.510 1.00 0.00 C ATOM 1741 CG1 ILE A 116 5.314 7.737 -6.169 1.00 0.00 C ATOM 1742 CG2 ILE A 116 5.263 7.989 -8.664 1.00 0.00 C ATOM 1743 CD1 ILE A 116 5.420 6.817 -4.972 1.00 0.00 C ATOM 0 H ILE A 116 3.877 5.835 -9.658 1.00 0.00 H new ATOM 0 HA ILE A 116 4.353 5.219 -6.820 1.00 0.00 H new ATOM 0 HB ILE A 116 6.304 6.472 -7.584 1.00 0.00 H new ATOM 0 HG12 ILE A 116 6.130 8.459 -6.135 1.00 0.00 H new ATOM 0 HG13 ILE A 116 4.385 8.302 -6.101 1.00 0.00 H new ATOM 0 HG21 ILE A 116 6.079 8.709 -8.593 1.00 0.00 H new ATOM 0 HG22 ILE A 116 5.335 7.451 -9.609 1.00 0.00 H new ATOM 0 HG23 ILE A 116 4.310 8.516 -8.618 1.00 0.00 H new ATOM 0 HD11 ILE A 116 5.385 7.406 -4.056 1.00 0.00 H new ATOM 0 HD12 ILE A 116 4.590 6.111 -4.981 1.00 0.00 H new ATOM 0 HD13 ILE A 116 6.362 6.270 -5.016 1.00 0.00 H new ATOM 1755 N VAL A 117 2.315 6.496 -6.170 1.00 0.00 N ATOM 1756 CA VAL A 117 1.047 7.123 -5.818 1.00 0.00 C ATOM 1757 C VAL A 117 1.235 8.163 -4.719 1.00 0.00 C ATOM 1758 O VAL A 117 1.319 7.841 -3.534 1.00 0.00 O ATOM 1759 CB VAL A 117 0.015 6.080 -5.351 1.00 0.00 C ATOM 1760 CG1 VAL A 117 -1.371 6.700 -5.268 1.00 0.00 C ATOM 1761 CG2 VAL A 117 0.015 4.877 -6.283 1.00 0.00 C ATOM 0 H VAL A 117 2.714 5.910 -5.436 1.00 0.00 H new ATOM 0 HA VAL A 117 0.675 7.612 -6.718 1.00 0.00 H new ATOM 0 HB VAL A 117 0.294 5.739 -4.354 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -2.087 5.948 -4.936 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.358 7.527 -4.558 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -1.663 7.071 -6.251 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -0.720 4.150 -5.938 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.239 5.199 -7.293 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.004 4.419 -6.286 1.00 0.00 H new ATOM 1771 N PRO A 118 1.303 9.441 -5.120 1.00 0.00 N ATOM 1772 CA PRO A 118 1.481 10.556 -4.184 1.00 0.00 C ATOM 1773 C PRO A 118 0.246 10.789 -3.319 1.00 0.00 C ATOM 1774 O PRO A 118 -0.793 11.233 -3.810 1.00 0.00 O ATOM 1775 CB PRO A 118 1.724 11.755 -5.103 1.00 0.00 C ATOM 1776 CG PRO A 118 1.065 11.389 -6.387 1.00 0.00 C ATOM 1777 CD PRO A 118 1.210 9.898 -6.517 1.00 0.00 C ATOM 0 HA PRO A 118 2.291 10.371 -3.479 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.297 12.667 -4.685 1.00 0.00 H new ATOM 0 HB3 PRO A 118 2.790 11.937 -5.243 1.00 0.00 H new ATOM 0 HG2 PRO A 118 0.015 11.680 -6.383 1.00 0.00 H new ATOM 0 HG3 PRO A 118 1.535 11.901 -7.227 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.356 9.454 -7.029 1.00 0.00 H new ATOM 0 HD3 PRO A 118 2.099 9.629 -7.088 1.00 0.00 H new ATOM 1785 N LEU A 119 0.367 10.489 -2.031 1.00 0.00 N ATOM 1786 CA LEU A 119 -0.740 10.667 -1.097 1.00 0.00 C ATOM 1787 C LEU A 119 -0.646 12.016 -0.393 1.00 0.00 C ATOM 1788 O LEU A 119 0.184 12.855 -0.745 1.00 0.00 O ATOM 1789 CB LEU A 119 -0.748 9.539 -0.064 1.00 0.00 C ATOM 1790 CG LEU A 119 -0.575 8.123 -0.615 1.00 0.00 C ATOM 1791 CD1 LEU A 119 0.076 7.222 0.423 1.00 0.00 C ATOM 1792 CD2 LEU A 119 -1.917 7.553 -1.051 1.00 0.00 C ATOM 0 H LEU A 119 1.220 10.122 -1.609 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.670 10.638 -1.664 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.049 9.727 0.656 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -1.689 9.582 0.484 1.00 0.00 H new ATOM 0 HG LEU A 119 0.078 8.170 -1.486 1.00 0.00 H new ATOM 0 HD11 LEU A 119 0.191 6.219 0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.056 7.620 0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -0.551 7.180 1.313 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -1.775 6.545 -1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -2.593 7.520 -0.197 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.346 8.185 -1.829 1.00 0.00 H new ATOM 1804 N ARG A 120 -1.501 12.218 0.605 1.00 0.00 N ATOM 1805 CA ARG A 120 -1.514 13.465 1.360 1.00 0.00 C ATOM 1806 C ARG A 120 -1.089 13.230 2.806 1.00 0.00 C ATOM 1807 O ARG A 120 -1.904 12.858 3.651 1.00 0.00 O ATOM 1808 CB ARG A 120 -2.908 14.094 1.322 1.00 0.00 C ATOM 1809 CG ARG A 120 -4.034 13.093 1.521 1.00 0.00 C ATOM 1810 CD ARG A 120 -5.396 13.740 1.329 1.00 0.00 C ATOM 1811 NE ARG A 120 -5.512 14.394 0.028 1.00 0.00 N ATOM 1812 CZ ARG A 120 -6.410 15.334 -0.244 1.00 0.00 C ATOM 1813 NH1 ARG A 120 -7.265 15.729 0.689 1.00 0.00 N ATOM 1814 NH2 ARG A 120 -6.454 15.882 -1.452 1.00 0.00 N ATOM 0 H ARG A 120 -2.194 11.534 0.909 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.802 14.148 0.897 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -2.973 14.859 2.095 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -3.045 14.596 0.364 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.919 12.270 0.816 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -3.971 12.667 2.522 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -6.174 12.983 1.425 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -5.564 14.472 2.119 1.00 0.00 H new ATOM 0 HE ARG A 120 -4.868 14.113 -0.712 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.234 15.311 1.619 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -7.953 16.451 0.477 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -5.798 15.581 -2.173 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -7.144 16.604 -1.660 1.00 0.00 H new ATOM 1828 N TYR A 121 0.192 13.447 3.084 1.00 0.00 N ATOM 1829 CA TYR A 121 0.726 13.256 4.427 1.00 0.00 C ATOM 1830 C TYR A 121 -0.037 14.102 5.442 1.00 0.00 C ATOM 1831 O TYR A 121 -0.056 13.795 6.634 1.00 0.00 O ATOM 1832 CB TYR A 121 2.213 13.612 4.463 1.00 0.00 C ATOM 1833 CG TYR A 121 2.477 15.099 4.535 1.00 0.00 C ATOM 1834 CD1 TYR A 121 1.947 15.965 3.587 1.00 0.00 C ATOM 1835 CD2 TYR A 121 3.258 15.637 5.550 1.00 0.00 C ATOM 1836 CE1 TYR A 121 2.187 17.325 3.648 1.00 0.00 C ATOM 1837 CE2 TYR A 121 3.502 16.995 5.620 1.00 0.00 C ATOM 1838 CZ TYR A 121 2.964 17.835 4.667 1.00 0.00 C ATOM 1839 OH TYR A 121 3.205 19.188 4.732 1.00 0.00 O ATOM 0 H TYR A 121 0.880 13.755 2.397 1.00 0.00 H new ATOM 0 HA TYR A 121 0.605 12.206 4.693 1.00 0.00 H new ATOM 0 HB2 TYR A 121 2.673 13.127 5.324 1.00 0.00 H new ATOM 0 HB3 TYR A 121 2.697 13.208 3.574 1.00 0.00 H new ATOM 0 HD1 TYR A 121 1.337 15.569 2.789 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.682 14.982 6.297 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.768 17.984 2.902 1.00 0.00 H new ATOM 0 HE2 TYR A 121 4.111 17.397 6.417 1.00 0.00 H new ATOM 0 HH TYR A 121 3.769 19.383 5.510 1.00 0.00 H new ATOM 1849 N VAL A 122 -0.664 15.170 4.960 1.00 0.00 N ATOM 1850 CA VAL A 122 -1.430 16.061 5.823 1.00 0.00 C ATOM 1851 C VAL A 122 -2.503 15.296 6.589 1.00 0.00 C ATOM 1852 O VAL A 122 -2.960 15.735 7.645 1.00 0.00 O ATOM 1853 CB VAL A 122 -2.098 17.189 5.014 1.00 0.00 C ATOM 1854 CG1 VAL A 122 -3.047 16.612 3.975 1.00 0.00 C ATOM 1855 CG2 VAL A 122 -2.828 18.149 5.941 1.00 0.00 C ATOM 0 H VAL A 122 -0.657 15.439 3.976 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.726 16.499 6.530 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.321 17.746 4.491 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.509 17.424 3.414 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.492 15.969 3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -3.821 16.029 4.473 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -3.294 18.939 5.353 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -3.596 17.608 6.494 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -2.118 18.589 6.642 1.00 0.00 H new ATOM 1865 N LYS A 123 -2.902 14.149 6.050 1.00 0.00 N ATOM 1866 CA LYS A 123 -3.921 13.320 6.683 1.00 0.00 C ATOM 1867 C LYS A 123 -3.286 12.148 7.425 1.00 0.00 C ATOM 1868 O LYS A 123 -3.813 11.681 8.435 1.00 0.00 O ATOM 1869 CB LYS A 123 -4.907 12.799 5.635 1.00 0.00 C ATOM 1870 CG LYS A 123 -5.607 13.900 4.858 1.00 0.00 C ATOM 1871 CD LYS A 123 -6.902 14.321 5.532 1.00 0.00 C ATOM 1872 CE LYS A 123 -6.698 15.540 6.419 1.00 0.00 C ATOM 1873 NZ LYS A 123 -7.938 16.358 6.532 1.00 0.00 N ATOM 0 H LYS A 123 -2.535 13.772 5.176 1.00 0.00 H new ATOM 0 HA LYS A 123 -4.458 13.936 7.404 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -4.374 12.155 4.936 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.657 12.181 6.129 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -4.945 14.761 4.769 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -5.818 13.555 3.846 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -7.653 14.543 4.774 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.288 13.495 6.130 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.384 15.218 7.412 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -5.894 16.154 6.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -7.758 17.179 7.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.224 16.687 5.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.699 15.780 6.943 1.00 0.00 H new ATOM 1887 N PHE A 124 -2.150 11.679 6.919 1.00 0.00 N ATOM 1888 CA PHE A 124 -1.442 10.562 7.534 1.00 0.00 C ATOM 1889 C PHE A 124 -0.271 11.059 8.377 1.00 0.00 C ATOM 1890 O PHE A 124 0.754 10.388 8.489 1.00 0.00 O ATOM 1891 CB PHE A 124 -0.939 9.596 6.460 1.00 0.00 C ATOM 1892 CG PHE A 124 -1.944 9.328 5.376 1.00 0.00 C ATOM 1893 CD1 PHE A 124 -2.992 8.447 5.587 1.00 0.00 C ATOM 1894 CD2 PHE A 124 -1.840 9.957 4.146 1.00 0.00 C ATOM 1895 CE1 PHE A 124 -3.918 8.198 4.592 1.00 0.00 C ATOM 1896 CE2 PHE A 124 -2.763 9.713 3.148 1.00 0.00 C ATOM 1897 CZ PHE A 124 -3.803 8.832 3.370 1.00 0.00 C ATOM 0 H PHE A 124 -1.700 12.055 6.085 1.00 0.00 H new ATOM 0 HA PHE A 124 -2.139 10.037 8.187 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.033 10.004 6.012 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.665 8.652 6.931 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -3.086 7.949 6.541 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -1.028 10.646 3.966 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -4.730 7.509 4.769 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -2.671 10.211 2.194 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.525 8.639 2.590 1.00 0.00 H new ATOM 1907 N GLN A 125 -0.433 12.239 8.967 1.00 0.00 N ATOM 1908 CA GLN A 125 0.611 12.826 9.799 1.00 0.00 C ATOM 1909 C GLN A 125 1.088 11.834 10.855 1.00 0.00 C ATOM 1910 O GLN A 125 2.265 11.811 11.212 1.00 0.00 O ATOM 1911 CB GLN A 125 0.099 14.100 10.473 1.00 0.00 C ATOM 1912 CG GLN A 125 -0.415 15.142 9.493 1.00 0.00 C ATOM 1913 CD GLN A 125 0.671 16.090 9.026 1.00 0.00 C ATOM 1914 OE1 GLN A 125 0.716 17.251 9.434 1.00 0.00 O ATOM 1915 NE2 GLN A 125 1.554 15.600 8.164 1.00 0.00 N ATOM 0 H GLN A 125 -1.276 12.807 8.884 1.00 0.00 H new ATOM 0 HA GLN A 125 1.455 13.077 9.156 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -0.701 13.838 11.165 1.00 0.00 H new ATOM 0 HB3 GLN A 125 0.903 14.536 11.066 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -0.849 14.639 8.629 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -1.214 15.715 9.964 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.479 14.632 7.852 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.307 16.192 7.814 1.00 0.00 H new ATOM 1924 N ASN A 126 0.165 11.016 11.351 1.00 0.00 N ATOM 1925 CA ASN A 126 0.492 10.022 12.367 1.00 0.00 C ATOM 1926 C ASN A 126 -0.484 8.850 12.315 1.00 0.00 C ATOM 1927 O ASN A 126 -1.572 8.908 12.888 1.00 0.00 O ATOM 1928 CB ASN A 126 0.468 10.658 13.758 1.00 0.00 C ATOM 1929 CG ASN A 126 1.844 11.108 14.211 1.00 0.00 C ATOM 1930 OD1 ASN A 126 2.338 12.154 13.789 1.00 0.00 O ATOM 1931 ND2 ASN A 126 2.470 10.317 15.076 1.00 0.00 N ATOM 0 H ASN A 126 -0.814 11.022 11.066 1.00 0.00 H new ATOM 0 HA ASN A 126 1.495 9.647 12.163 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -0.207 11.513 13.752 1.00 0.00 H new ATOM 0 HB3 ASN A 126 0.068 9.941 14.476 1.00 0.00 H new ATOM 0 HD21 ASN A 126 3.398 10.568 15.417 1.00 0.00 H new ATOM 0 HD22 ASN A 126 2.022 9.459 15.399 1.00 0.00 H new ATOM 1938 N VAL A 127 -0.086 7.787 11.624 1.00 0.00 N ATOM 1939 CA VAL A 127 -0.924 6.600 11.498 1.00 0.00 C ATOM 1940 C VAL A 127 -0.216 5.366 12.046 1.00 0.00 C ATOM 1941 O VAL A 127 0.991 5.202 11.872 1.00 0.00 O ATOM 1942 CB VAL A 127 -1.317 6.343 10.031 1.00 0.00 C ATOM 1943 CG1 VAL A 127 -1.801 7.627 9.375 1.00 0.00 C ATOM 1944 CG2 VAL A 127 -0.146 5.750 9.262 1.00 0.00 C ATOM 0 H VAL A 127 0.811 7.723 11.143 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.826 6.787 12.081 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.136 5.623 10.013 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -2.074 7.426 8.339 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.671 8.005 9.913 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.006 8.372 9.402 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.441 5.575 8.228 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.694 6.444 9.287 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.149 4.806 9.720 1.00 0.00 H new ATOM 1954 N ASN A 128 -0.975 4.501 12.710 1.00 0.00 N ATOM 1955 CA ASN A 128 -0.419 3.280 13.284 1.00 0.00 C ATOM 1956 C ASN A 128 -0.968 2.046 12.574 1.00 0.00 C ATOM 1957 O ASN A 128 -0.433 0.947 12.716 1.00 0.00 O ATOM 1958 CB ASN A 128 -0.736 3.205 14.779 1.00 0.00 C ATOM 1959 CG ASN A 128 -0.444 1.837 15.364 1.00 0.00 C ATOM 1960 OD1 ASN A 128 0.645 1.592 15.884 1.00 0.00 O ATOM 1961 ND2 ASN A 128 -1.417 0.938 15.282 1.00 0.00 N ATOM 0 H ASN A 128 -1.976 4.622 12.864 1.00 0.00 H new ATOM 0 HA ASN A 128 0.662 3.304 13.149 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -0.151 3.956 15.310 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -1.787 3.448 14.937 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -1.278 0.000 15.659 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -2.304 1.185 14.842 1.00 0.00 H new ATOM 1968 N SER A 129 -2.038 2.237 11.810 1.00 0.00 N ATOM 1969 CA SER A 129 -2.662 1.139 11.080 1.00 0.00 C ATOM 1970 C SER A 129 -3.312 1.641 9.794 1.00 0.00 C ATOM 1971 O SER A 129 -4.192 2.501 9.825 1.00 0.00 O ATOM 1972 CB SER A 129 -3.707 0.445 11.956 1.00 0.00 C ATOM 1973 OG SER A 129 -4.679 1.367 12.418 1.00 0.00 O ATOM 0 H SER A 129 -2.491 3.141 11.680 1.00 0.00 H new ATOM 0 HA SER A 129 -1.884 0.422 10.817 1.00 0.00 H new ATOM 0 HB2 SER A 129 -4.194 -0.347 11.388 1.00 0.00 H new ATOM 0 HB3 SER A 129 -3.217 -0.028 12.807 1.00 0.00 H new ATOM 0 HG SER A 129 -4.854 2.034 11.722 1.00 0.00 H new ATOM 1979 N VAL A 130 -2.870 1.098 8.664 1.00 0.00 N ATOM 1980 CA VAL A 130 -3.408 1.489 7.367 1.00 0.00 C ATOM 1981 C VAL A 130 -3.958 0.283 6.614 1.00 0.00 C ATOM 1982 O VAL A 130 -3.391 -0.809 6.669 1.00 0.00 O ATOM 1983 CB VAL A 130 -2.338 2.178 6.500 1.00 0.00 C ATOM 1984 CG1 VAL A 130 -1.092 1.310 6.400 1.00 0.00 C ATOM 1985 CG2 VAL A 130 -2.892 2.491 5.118 1.00 0.00 C ATOM 0 H VAL A 130 -2.141 0.386 8.621 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.217 2.193 7.559 1.00 0.00 H new ATOM 0 HB VAL A 130 -2.060 3.118 6.976 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -0.347 1.813 5.784 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -0.685 1.142 7.397 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -1.351 0.353 5.948 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.122 2.978 4.519 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -3.200 1.566 4.631 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -3.752 3.154 5.212 1.00 0.00 H new ATOM 1995 N THR A 131 -5.067 0.487 5.909 1.00 0.00 N ATOM 1996 CA THR A 131 -5.694 -0.584 5.145 1.00 0.00 C ATOM 1997 C THR A 131 -6.067 -0.113 3.743 1.00 0.00 C ATOM 1998 O THR A 131 -6.465 1.036 3.550 1.00 0.00 O ATOM 1999 CB THR A 131 -6.958 -1.111 5.850 1.00 0.00 C ATOM 2000 OG1 THR A 131 -6.613 -1.666 7.124 1.00 0.00 O ATOM 2001 CG2 THR A 131 -7.651 -2.167 5.001 1.00 0.00 C ATOM 0 H THR A 131 -5.549 1.384 5.852 1.00 0.00 H new ATOM 0 HA THR A 131 -4.964 -1.390 5.073 1.00 0.00 H new ATOM 0 HB THR A 131 -7.643 -0.275 5.992 1.00 0.00 H new ATOM 0 HG1 THR A 131 -7.422 -1.997 7.566 1.00 0.00 H new ATOM 0 HG21 THR A 131 -8.541 -2.524 5.519 1.00 0.00 H new ATOM 0 HG22 THR A 131 -7.939 -1.733 4.044 1.00 0.00 H new ATOM 0 HG23 THR A 131 -6.971 -3.001 4.831 1.00 0.00 H new ATOM 2009 N ILE A 132 -5.936 -1.008 2.770 1.00 0.00 N ATOM 2010 CA ILE A 132 -6.261 -0.684 1.386 1.00 0.00 C ATOM 2011 C ILE A 132 -7.241 -1.694 0.801 1.00 0.00 C ATOM 2012 O ILE A 132 -6.961 -2.892 0.755 1.00 0.00 O ATOM 2013 CB ILE A 132 -4.998 -0.641 0.506 1.00 0.00 C ATOM 2014 CG1 ILE A 132 -4.048 0.455 0.993 1.00 0.00 C ATOM 2015 CG2 ILE A 132 -5.374 -0.416 -0.950 1.00 0.00 C ATOM 2016 CD1 ILE A 132 -2.601 0.019 1.052 1.00 0.00 C ATOM 0 H ILE A 132 -5.607 -1.963 2.914 1.00 0.00 H new ATOM 0 HA ILE A 132 -6.722 0.304 1.393 1.00 0.00 H new ATOM 0 HB ILE A 132 -4.486 -1.600 0.584 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -4.132 1.318 0.332 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -4.361 0.782 1.985 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -4.470 -0.388 -1.559 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -6.016 -1.229 -1.290 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -5.906 0.531 -1.046 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.986 0.846 1.406 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -2.503 -0.824 1.736 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -2.270 -0.280 0.057 1.00 0.00 H new ATOM 2028 N PHE A 133 -8.391 -1.203 0.351 1.00 0.00 N ATOM 2029 CA PHE A 133 -9.413 -2.063 -0.234 1.00 0.00 C ATOM 2030 C PHE A 133 -9.443 -1.918 -1.752 1.00 0.00 C ATOM 2031 O PHE A 133 -9.618 -0.819 -2.279 1.00 0.00 O ATOM 2032 CB PHE A 133 -10.788 -1.726 0.349 1.00 0.00 C ATOM 2033 CG PHE A 133 -11.925 -2.387 -0.377 1.00 0.00 C ATOM 2034 CD1 PHE A 133 -11.836 -3.712 -0.771 1.00 0.00 C ATOM 2035 CD2 PHE A 133 -13.083 -1.682 -0.664 1.00 0.00 C ATOM 2036 CE1 PHE A 133 -12.880 -4.323 -1.439 1.00 0.00 C ATOM 2037 CE2 PHE A 133 -14.131 -2.288 -1.331 1.00 0.00 C ATOM 2038 CZ PHE A 133 -14.029 -3.610 -1.720 1.00 0.00 C ATOM 0 H PHE A 133 -8.639 -0.214 0.380 1.00 0.00 H new ATOM 0 HA PHE A 133 -9.165 -3.096 0.010 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -10.813 -2.026 1.397 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -10.930 -0.646 0.323 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -10.940 -4.274 -0.553 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -13.167 -0.648 -0.363 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -12.798 -5.357 -1.741 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -15.029 -1.729 -1.548 1.00 0.00 H new ATOM 0 HZ PHE A 133 -14.846 -4.085 -2.243 1.00 0.00 H new ATOM 2048 N VAL A 134 -9.270 -3.035 -2.451 1.00 0.00 N ATOM 2049 CA VAL A 134 -9.277 -3.034 -3.909 1.00 0.00 C ATOM 2050 C VAL A 134 -10.701 -3.021 -4.452 1.00 0.00 C ATOM 2051 O VAL A 134 -11.510 -3.886 -4.118 1.00 0.00 O ATOM 2052 CB VAL A 134 -8.534 -4.259 -4.475 1.00 0.00 C ATOM 2053 CG1 VAL A 134 -8.581 -4.256 -5.995 1.00 0.00 C ATOM 2054 CG2 VAL A 134 -7.097 -4.287 -3.978 1.00 0.00 C ATOM 0 H VAL A 134 -9.123 -3.953 -2.031 1.00 0.00 H new ATOM 0 HA VAL A 134 -8.762 -2.127 -4.227 1.00 0.00 H new ATOM 0 HB VAL A 134 -9.034 -5.161 -4.121 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -8.051 -5.129 -6.377 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -9.619 -4.287 -6.327 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -8.107 -3.350 -6.372 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -6.587 -5.159 -4.388 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -6.583 -3.381 -4.300 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -7.090 -4.341 -2.889 1.00 0.00 H new ATOM 2064 N GLN A 135 -11.000 -2.034 -5.291 1.00 0.00 N ATOM 2065 CA GLN A 135 -12.328 -1.909 -5.880 1.00 0.00 C ATOM 2066 C GLN A 135 -12.304 -2.280 -7.359 1.00 0.00 C ATOM 2067 O GLN A 135 -12.919 -3.264 -7.772 1.00 0.00 O ATOM 2068 CB GLN A 135 -12.853 -0.483 -5.709 1.00 0.00 C ATOM 2069 CG GLN A 135 -14.359 -0.407 -5.522 1.00 0.00 C ATOM 2070 CD GLN A 135 -14.800 0.877 -4.847 1.00 0.00 C ATOM 2071 OE1 GLN A 135 -14.767 1.951 -5.448 1.00 0.00 O ATOM 2072 NE2 GLN A 135 -15.217 0.772 -3.590 1.00 0.00 N ATOM 0 H GLN A 135 -10.341 -1.310 -5.578 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.994 -2.598 -5.361 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -12.365 -0.026 -4.848 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -12.574 0.105 -6.583 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -14.846 -0.488 -6.494 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -14.691 -1.258 -4.927 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.228 -0.139 -3.131 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -15.527 1.602 -3.084 1.00 0.00 H new ATOM 2081 N SER A 136 -11.592 -1.487 -8.152 1.00 0.00 N ATOM 2082 CA SER A 136 -11.492 -1.730 -9.587 1.00 0.00 C ATOM 2083 C SER A 136 -10.032 -1.799 -10.025 1.00 0.00 C ATOM 2084 O SER A 136 -9.128 -1.447 -9.269 1.00 0.00 O ATOM 2085 CB SER A 136 -12.218 -0.630 -10.364 1.00 0.00 C ATOM 2086 OG SER A 136 -13.334 -1.151 -11.063 1.00 0.00 O ATOM 0 H SER A 136 -11.075 -0.670 -7.826 1.00 0.00 H new ATOM 0 HA SER A 136 -11.964 -2.689 -9.802 1.00 0.00 H new ATOM 0 HB2 SER A 136 -12.547 0.149 -9.676 1.00 0.00 H new ATOM 0 HB3 SER A 136 -11.530 -0.163 -11.068 1.00 0.00 H new ATOM 0 HG SER A 136 -13.782 -0.428 -11.550 1.00 0.00 H new ATOM 2092 N ASN A 137 -9.811 -2.257 -11.254 1.00 0.00 N ATOM 2093 CA ASN A 137 -8.462 -2.374 -11.794 1.00 0.00 C ATOM 2094 C ASN A 137 -8.231 -1.356 -12.907 1.00 0.00 C ATOM 2095 O ASN A 137 -9.083 -0.508 -13.171 1.00 0.00 O ATOM 2096 CB ASN A 137 -8.224 -3.789 -12.325 1.00 0.00 C ATOM 2097 CG ASN A 137 -9.463 -4.658 -12.232 1.00 0.00 C ATOM 2098 OD1 ASN A 137 -10.504 -4.336 -12.805 1.00 0.00 O ATOM 2099 ND2 ASN A 137 -9.356 -5.765 -11.508 1.00 0.00 N ATOM 0 H ASN A 137 -10.549 -2.553 -11.893 1.00 0.00 H new ATOM 0 HA ASN A 137 -7.756 -2.172 -10.988 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -7.899 -3.734 -13.364 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -7.415 -4.254 -11.762 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -10.157 -6.389 -11.409 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -8.473 -5.992 -11.051 1.00 0.00 H new ATOM 2106 N GLN A 138 -7.075 -1.447 -13.555 1.00 0.00 N ATOM 2107 CA GLN A 138 -6.733 -0.534 -14.639 1.00 0.00 C ATOM 2108 C GLN A 138 -7.647 -0.749 -15.841 1.00 0.00 C ATOM 2109 O GLN A 138 -8.344 0.168 -16.275 1.00 0.00 O ATOM 2110 CB GLN A 138 -5.273 -0.725 -15.054 1.00 0.00 C ATOM 2111 CG GLN A 138 -4.291 -0.591 -13.901 1.00 0.00 C ATOM 2112 CD GLN A 138 -4.094 0.848 -13.467 1.00 0.00 C ATOM 2113 OE1 GLN A 138 -3.838 1.728 -14.289 1.00 0.00 O ATOM 2114 NE2 GLN A 138 -4.213 1.096 -12.167 1.00 0.00 N ATOM 0 H GLN A 138 -6.359 -2.144 -13.348 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.871 0.485 -14.278 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -5.158 -1.710 -15.506 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.023 0.008 -15.821 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -4.649 -1.176 -13.054 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -3.330 -1.012 -14.196 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -4.426 0.337 -11.520 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -4.091 2.046 -11.816 1.00 0.00 H new ATOM 2123 N GLY A 139 -7.639 -1.966 -16.375 1.00 0.00 N ATOM 2124 CA GLY A 139 -8.471 -2.279 -17.522 1.00 0.00 C ATOM 2125 C GLY A 139 -9.757 -2.979 -17.132 1.00 0.00 C ATOM 2126 O GLY A 139 -10.306 -3.760 -17.908 1.00 0.00 O ATOM 0 H GLY A 139 -7.071 -2.741 -16.034 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -8.709 -1.359 -18.056 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -7.911 -2.912 -18.211 1.00 0.00 H new ATOM 2130 N GLU A 140 -10.239 -2.699 -15.924 1.00 0.00 N ATOM 2131 CA GLU A 140 -11.468 -3.310 -15.432 1.00 0.00 C ATOM 2132 C GLU A 140 -11.418 -4.828 -15.580 1.00 0.00 C ATOM 2133 O GLU A 140 -12.413 -5.460 -15.932 1.00 0.00 O ATOM 2134 CB GLU A 140 -12.678 -2.752 -16.185 1.00 0.00 C ATOM 2135 CG GLU A 140 -12.969 -1.294 -15.873 1.00 0.00 C ATOM 2136 CD GLU A 140 -14.120 -0.741 -16.692 1.00 0.00 C ATOM 2137 OE1 GLU A 140 -15.285 -1.022 -16.342 1.00 0.00 O ATOM 2138 OE2 GLU A 140 -13.854 -0.028 -17.682 1.00 0.00 O ATOM 0 H GLU A 140 -9.797 -2.054 -15.269 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.565 -3.069 -14.373 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -12.509 -2.859 -17.257 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -13.556 -3.350 -15.939 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -13.200 -1.192 -14.813 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -12.075 -0.700 -16.062 1.00 0.00 H new ATOM 2145 N GLU A 141 -10.252 -5.405 -15.310 1.00 0.00 N ATOM 2146 CA GLU A 141 -10.072 -6.848 -15.415 1.00 0.00 C ATOM 2147 C GLU A 141 -11.045 -7.586 -14.500 1.00 0.00 C ATOM 2148 O GLU A 141 -11.888 -6.970 -13.849 1.00 0.00 O ATOM 2149 CB GLU A 141 -8.633 -7.232 -15.062 1.00 0.00 C ATOM 2150 CG GLU A 141 -7.622 -6.854 -16.131 1.00 0.00 C ATOM 2151 CD GLU A 141 -7.495 -7.909 -17.213 1.00 0.00 C ATOM 2152 OE1 GLU A 141 -8.103 -8.989 -17.064 1.00 0.00 O ATOM 2153 OE2 GLU A 141 -6.786 -7.653 -18.209 1.00 0.00 O ATOM 0 H GLU A 141 -9.418 -4.896 -15.017 1.00 0.00 H new ATOM 0 HA GLU A 141 -10.276 -7.139 -16.445 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.356 -6.748 -14.125 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.584 -8.308 -14.892 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.915 -5.907 -16.585 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -6.649 -6.697 -15.666 1.00 0.00 H new ATOM 2160 N GLU A 142 -10.922 -8.909 -14.458 1.00 0.00 N ATOM 2161 CA GLU A 142 -11.792 -9.730 -13.624 1.00 0.00 C ATOM 2162 C GLU A 142 -11.199 -9.909 -12.230 1.00 0.00 C ATOM 2163 O GLU A 142 -11.922 -10.140 -11.259 1.00 0.00 O ATOM 2164 CB GLU A 142 -12.017 -11.097 -14.275 1.00 0.00 C ATOM 2165 CG GLU A 142 -10.729 -11.808 -14.656 1.00 0.00 C ATOM 2166 CD GLU A 142 -10.856 -13.318 -14.594 1.00 0.00 C ATOM 2167 OE1 GLU A 142 -12.001 -13.817 -14.602 1.00 0.00 O ATOM 2168 OE2 GLU A 142 -9.812 -14.000 -14.536 1.00 0.00 O ATOM 0 H GLU A 142 -10.229 -9.435 -14.991 1.00 0.00 H new ATOM 0 HA GLU A 142 -12.750 -9.219 -13.529 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -12.582 -11.728 -13.589 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -12.629 -10.969 -15.168 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -10.440 -11.513 -15.665 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.930 -11.487 -13.988 1.00 0.00 H new ATOM 2175 N THR A 143 -9.877 -9.802 -12.137 1.00 0.00 N ATOM 2176 CA THR A 143 -9.186 -9.954 -10.863 1.00 0.00 C ATOM 2177 C THR A 143 -7.929 -9.092 -10.814 1.00 0.00 C ATOM 2178 O THR A 143 -7.254 -8.901 -11.826 1.00 0.00 O ATOM 2179 CB THR A 143 -8.798 -11.422 -10.605 1.00 0.00 C ATOM 2180 OG1 THR A 143 -7.737 -11.487 -9.646 1.00 0.00 O ATOM 2181 CG2 THR A 143 -8.365 -12.101 -11.896 1.00 0.00 C ATOM 0 H THR A 143 -9.264 -9.611 -12.929 1.00 0.00 H new ATOM 0 HA THR A 143 -9.879 -9.628 -10.087 1.00 0.00 H new ATOM 0 HB THR A 143 -9.672 -11.943 -10.214 1.00 0.00 H new ATOM 0 HG1 THR A 143 -7.285 -12.354 -9.716 1.00 0.00 H new ATOM 0 HG21 THR A 143 -8.096 -13.137 -11.690 1.00 0.00 H new ATOM 0 HG22 THR A 143 -9.185 -12.075 -12.613 1.00 0.00 H new ATOM 0 HG23 THR A 143 -7.504 -11.578 -12.311 1.00 0.00 H new ATOM 2189 N THR A 144 -7.619 -8.574 -9.629 1.00 0.00 N ATOM 2190 CA THR A 144 -6.443 -7.732 -9.448 1.00 0.00 C ATOM 2191 C THR A 144 -5.297 -8.516 -8.819 1.00 0.00 C ATOM 2192 O THR A 144 -5.417 -9.021 -7.703 1.00 0.00 O ATOM 2193 CB THR A 144 -6.758 -6.509 -8.566 1.00 0.00 C ATOM 2194 OG1 THR A 144 -7.977 -5.894 -8.998 1.00 0.00 O ATOM 2195 CG2 THR A 144 -5.626 -5.495 -8.621 1.00 0.00 C ATOM 0 H THR A 144 -8.166 -8.723 -8.781 1.00 0.00 H new ATOM 0 HA THR A 144 -6.144 -7.389 -10.439 1.00 0.00 H new ATOM 0 HB THR A 144 -6.868 -6.851 -7.537 1.00 0.00 H new ATOM 0 HG1 THR A 144 -8.013 -4.972 -8.669 1.00 0.00 H new ATOM 0 HG21 THR A 144 -5.872 -4.641 -7.990 1.00 0.00 H new ATOM 0 HG22 THR A 144 -4.706 -5.957 -8.263 1.00 0.00 H new ATOM 0 HG23 THR A 144 -5.488 -5.159 -9.649 1.00 0.00 H new ATOM 2203 N ARG A 145 -4.186 -8.613 -9.542 1.00 0.00 N ATOM 2204 CA ARG A 145 -3.018 -9.337 -9.055 1.00 0.00 C ATOM 2205 C ARG A 145 -2.003 -8.378 -8.440 1.00 0.00 C ATOM 2206 O ARG A 145 -1.583 -7.411 -9.076 1.00 0.00 O ATOM 2207 CB ARG A 145 -2.368 -10.124 -10.193 1.00 0.00 C ATOM 2208 CG ARG A 145 -2.532 -11.630 -10.064 1.00 0.00 C ATOM 2209 CD ARG A 145 -3.502 -12.175 -11.101 1.00 0.00 C ATOM 2210 NE ARG A 145 -2.859 -12.381 -12.397 1.00 0.00 N ATOM 2211 CZ ARG A 145 -2.131 -13.451 -12.694 1.00 0.00 C ATOM 2212 NH1 ARG A 145 -1.955 -14.408 -11.794 1.00 0.00 N ATOM 2213 NH2 ARG A 145 -1.579 -13.566 -13.895 1.00 0.00 N ATOM 0 H ARG A 145 -4.070 -8.199 -10.467 1.00 0.00 H new ATOM 0 HA ARG A 145 -3.348 -10.033 -8.284 1.00 0.00 H new ATOM 0 HB2 ARG A 145 -2.799 -9.800 -11.140 1.00 0.00 H new ATOM 0 HB3 ARG A 145 -1.305 -9.885 -10.228 1.00 0.00 H new ATOM 0 HG2 ARG A 145 -1.562 -12.114 -10.181 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -2.891 -11.874 -9.064 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -3.917 -13.119 -10.748 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -4.336 -11.483 -11.216 1.00 0.00 H new ATOM 0 HE ARG A 145 -2.976 -11.664 -13.113 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -2.379 -14.324 -10.870 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -1.395 -15.229 -12.025 1.00 0.00 H new ATOM 0 HH21 ARG A 145 -1.714 -12.832 -14.591 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -1.020 -14.388 -14.123 1.00 0.00 H new ATOM 2227 N ILE A 146 -1.614 -8.653 -7.199 1.00 0.00 N ATOM 2228 CA ILE A 146 -0.647 -7.816 -6.499 1.00 0.00 C ATOM 2229 C ILE A 146 0.733 -8.464 -6.484 1.00 0.00 C ATOM 2230 O ILE A 146 0.859 -9.675 -6.302 1.00 0.00 O ATOM 2231 CB ILE A 146 -1.088 -7.539 -5.050 1.00 0.00 C ATOM 2232 CG1 ILE A 146 -2.614 -7.455 -4.965 1.00 0.00 C ATOM 2233 CG2 ILE A 146 -0.453 -6.255 -4.539 1.00 0.00 C ATOM 2234 CD1 ILE A 146 -3.215 -6.422 -5.891 1.00 0.00 C ATOM 0 H ILE A 146 -1.953 -9.448 -6.658 1.00 0.00 H new ATOM 0 HA ILE A 146 -0.596 -6.872 -7.042 1.00 0.00 H new ATOM 0 HB ILE A 146 -0.752 -8.363 -4.420 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.037 -8.432 -5.200 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -2.900 -7.222 -3.939 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -0.775 -6.073 -3.514 1.00 0.00 H new ATOM 0 HG22 ILE A 146 0.633 -6.350 -4.568 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -0.761 -5.421 -5.169 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.299 -6.418 -5.777 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.820 -5.437 -5.642 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -2.959 -6.665 -6.922 1.00 0.00 H new ATOM 2246 N SER A 147 1.765 -7.649 -6.675 1.00 0.00 N ATOM 2247 CA SER A 147 3.137 -8.143 -6.685 1.00 0.00 C ATOM 2248 C SER A 147 4.037 -7.268 -5.818 1.00 0.00 C ATOM 2249 O SER A 147 4.900 -7.768 -5.097 1.00 0.00 O ATOM 2250 CB SER A 147 3.675 -8.186 -8.117 1.00 0.00 C ATOM 2251 OG SER A 147 3.159 -9.301 -8.823 1.00 0.00 O ATOM 0 H SER A 147 1.677 -6.644 -6.825 1.00 0.00 H new ATOM 0 HA SER A 147 3.136 -9.152 -6.273 1.00 0.00 H new ATOM 0 HB2 SER A 147 3.407 -7.266 -8.637 1.00 0.00 H new ATOM 0 HB3 SER A 147 4.764 -8.236 -8.098 1.00 0.00 H new ATOM 0 HG SER A 147 3.517 -9.304 -9.735 1.00 0.00 H new ATOM 2257 N TYR A 148 3.827 -5.958 -5.894 1.00 0.00 N ATOM 2258 CA TYR A 148 4.620 -5.011 -5.118 1.00 0.00 C ATOM 2259 C TYR A 148 3.720 -4.044 -4.356 1.00 0.00 C ATOM 2260 O TYR A 148 2.895 -3.348 -4.947 1.00 0.00 O ATOM 2261 CB TYR A 148 5.563 -4.232 -6.036 1.00 0.00 C ATOM 2262 CG TYR A 148 6.662 -3.503 -5.296 1.00 0.00 C ATOM 2263 CD1 TYR A 148 7.370 -4.124 -4.275 1.00 0.00 C ATOM 2264 CD2 TYR A 148 6.992 -2.192 -5.618 1.00 0.00 C ATOM 2265 CE1 TYR A 148 8.374 -3.462 -3.595 1.00 0.00 C ATOM 2266 CE2 TYR A 148 7.996 -1.522 -4.945 1.00 0.00 C ATOM 2267 CZ TYR A 148 8.684 -2.161 -3.934 1.00 0.00 C ATOM 2268 OH TYR A 148 9.683 -1.497 -3.261 1.00 0.00 O ATOM 0 H TYR A 148 3.115 -5.528 -6.484 1.00 0.00 H new ATOM 0 HA TYR A 148 5.210 -5.575 -4.396 1.00 0.00 H new ATOM 0 HB2 TYR A 148 6.013 -4.921 -6.751 1.00 0.00 H new ATOM 0 HB3 TYR A 148 4.983 -3.510 -6.611 1.00 0.00 H new ATOM 0 HD1 TYR A 148 7.131 -5.143 -4.008 1.00 0.00 H new ATOM 0 HD2 TYR A 148 6.455 -1.688 -6.408 1.00 0.00 H new ATOM 0 HE1 TYR A 148 8.913 -3.960 -2.803 1.00 0.00 H new ATOM 0 HE2 TYR A 148 8.241 -0.504 -5.209 1.00 0.00 H new ATOM 0 HH TYR A 148 9.775 -0.591 -3.623 1.00 0.00 H new ATOM 2278 N PHE A 149 3.886 -4.006 -3.038 1.00 0.00 N ATOM 2279 CA PHE A 149 3.089 -3.125 -2.192 1.00 0.00 C ATOM 2280 C PHE A 149 3.916 -2.601 -1.021 1.00 0.00 C ATOM 2281 O PHE A 149 4.588 -3.366 -0.328 1.00 0.00 O ATOM 2282 CB PHE A 149 1.856 -3.863 -1.669 1.00 0.00 C ATOM 2283 CG PHE A 149 1.213 -3.195 -0.487 1.00 0.00 C ATOM 2284 CD1 PHE A 149 0.892 -1.848 -0.526 1.00 0.00 C ATOM 2285 CD2 PHE A 149 0.930 -3.914 0.663 1.00 0.00 C ATOM 2286 CE1 PHE A 149 0.301 -1.230 0.560 1.00 0.00 C ATOM 2287 CE2 PHE A 149 0.339 -3.302 1.752 1.00 0.00 C ATOM 2288 CZ PHE A 149 0.024 -1.959 1.700 1.00 0.00 C ATOM 0 H PHE A 149 4.565 -4.575 -2.533 1.00 0.00 H new ATOM 0 HA PHE A 149 2.767 -2.277 -2.796 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.124 -3.945 -2.472 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.141 -4.878 -1.392 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.106 -1.274 -1.415 1.00 0.00 H new ATOM 0 HD2 PHE A 149 1.174 -4.965 0.709 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.056 -0.179 0.517 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.124 -3.874 2.643 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.438 -1.479 2.550 1.00 0.00 H new ATOM 2298 N THR A 150 3.864 -1.290 -0.807 1.00 0.00 N ATOM 2299 CA THR A 150 4.608 -0.662 0.277 1.00 0.00 C ATOM 2300 C THR A 150 4.146 0.773 0.503 1.00 0.00 C ATOM 2301 O THR A 150 3.342 1.305 -0.264 1.00 0.00 O ATOM 2302 CB THR A 150 6.122 -0.663 -0.006 1.00 0.00 C ATOM 2303 OG1 THR A 150 6.849 -0.476 1.213 1.00 0.00 O ATOM 2304 CG2 THR A 150 6.488 0.434 -0.994 1.00 0.00 C ATOM 0 H THR A 150 3.314 -0.642 -1.371 1.00 0.00 H new ATOM 0 HA THR A 150 4.413 -1.249 1.175 1.00 0.00 H new ATOM 0 HB THR A 150 6.387 -1.626 -0.442 1.00 0.00 H new ATOM 0 HG1 THR A 150 7.473 -1.221 1.339 1.00 0.00 H new ATOM 0 HG21 THR A 150 7.562 0.414 -1.179 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.956 0.272 -1.931 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.209 1.403 -0.581 1.00 0.00 H new ATOM 2312 N PHE A 151 4.659 1.396 1.559 1.00 0.00 N ATOM 2313 CA PHE A 151 4.298 2.771 1.885 1.00 0.00 C ATOM 2314 C PHE A 151 5.536 3.661 1.935 1.00 0.00 C ATOM 2315 O PHE A 151 6.436 3.446 2.748 1.00 0.00 O ATOM 2316 CB PHE A 151 3.564 2.823 3.226 1.00 0.00 C ATOM 2317 CG PHE A 151 2.075 2.968 3.090 1.00 0.00 C ATOM 2318 CD1 PHE A 151 1.528 4.077 2.466 1.00 0.00 C ATOM 2319 CD2 PHE A 151 1.223 1.995 3.586 1.00 0.00 C ATOM 2320 CE1 PHE A 151 0.159 4.214 2.340 1.00 0.00 C ATOM 2321 CE2 PHE A 151 -0.148 2.125 3.463 1.00 0.00 C ATOM 2322 CZ PHE A 151 -0.680 3.236 2.838 1.00 0.00 C ATOM 0 H PHE A 151 5.326 0.971 2.203 1.00 0.00 H new ATOM 0 HA PHE A 151 3.637 3.142 1.102 1.00 0.00 H new ATOM 0 HB2 PHE A 151 3.783 1.914 3.786 1.00 0.00 H new ATOM 0 HB3 PHE A 151 3.950 3.658 3.810 1.00 0.00 H new ATOM 0 HD1 PHE A 151 2.179 4.844 2.073 1.00 0.00 H new ATOM 0 HD2 PHE A 151 1.635 1.124 4.075 1.00 0.00 H new ATOM 0 HE1 PHE A 151 -0.255 5.085 1.853 1.00 0.00 H new ATOM 0 HE2 PHE A 151 -0.802 1.360 3.855 1.00 0.00 H new ATOM 0 HZ PHE A 151 -1.750 3.340 2.739 1.00 0.00 H new ATOM 2332 N ILE A 152 5.574 4.660 1.060 1.00 0.00 N ATOM 2333 CA ILE A 152 6.701 5.583 1.004 1.00 0.00 C ATOM 2334 C ILE A 152 6.499 6.756 1.958 1.00 0.00 C ATOM 2335 O ILE A 152 5.447 7.395 1.958 1.00 0.00 O ATOM 2336 CB ILE A 152 6.915 6.126 -0.421 1.00 0.00 C ATOM 2337 CG1 ILE A 152 6.916 4.978 -1.432 1.00 0.00 C ATOM 2338 CG2 ILE A 152 8.216 6.910 -0.500 1.00 0.00 C ATOM 2339 CD1 ILE A 152 7.977 3.934 -1.160 1.00 0.00 C ATOM 0 H ILE A 152 4.838 4.851 0.380 1.00 0.00 H new ATOM 0 HA ILE A 152 7.584 5.020 1.305 1.00 0.00 H new ATOM 0 HB ILE A 152 6.093 6.799 -0.665 1.00 0.00 H new ATOM 0 HG12 ILE A 152 5.937 4.499 -1.427 1.00 0.00 H new ATOM 0 HG13 ILE A 152 7.066 5.385 -2.432 1.00 0.00 H new ATOM 0 HG21 ILE A 152 8.353 7.287 -1.514 1.00 0.00 H new ATOM 0 HG22 ILE A 152 8.179 7.747 0.197 1.00 0.00 H new ATOM 0 HG23 ILE A 152 9.050 6.258 -0.240 1.00 0.00 H new ATOM 0 HD11 ILE A 152 7.919 3.151 -1.916 1.00 0.00 H new ATOM 0 HD12 ILE A 152 8.962 4.399 -1.194 1.00 0.00 H new ATOM 0 HD13 ILE A 152 7.815 3.499 -0.174 1.00 0.00 H new ATOM 2351 N GLY A 153 7.515 7.035 2.768 1.00 0.00 N ATOM 2352 CA GLY A 153 7.430 8.133 3.714 1.00 0.00 C ATOM 2353 C GLY A 153 8.545 8.101 4.741 1.00 0.00 C ATOM 2354 O GLY A 153 9.685 7.762 4.421 1.00 0.00 O ATOM 0 H GLY A 153 8.396 6.521 2.786 1.00 0.00 H new ATOM 0 HA2 GLY A 153 7.466 9.078 3.173 1.00 0.00 H new ATOM 0 HA3 GLY A 153 6.468 8.095 4.225 1.00 0.00 H new ATOM 2358 N THR A 154 8.217 8.458 5.979 1.00 0.00 N ATOM 2359 CA THR A 154 9.200 8.472 7.055 1.00 0.00 C ATOM 2360 C THR A 154 8.521 8.512 8.419 1.00 0.00 C ATOM 2361 O THR A 154 7.370 8.929 8.555 1.00 0.00 O ATOM 2362 CB THR A 154 10.150 9.678 6.932 1.00 0.00 C ATOM 2363 OG1 THR A 154 10.386 10.250 8.224 1.00 0.00 O ATOM 2364 CG2 THR A 154 9.568 10.733 6.004 1.00 0.00 C ATOM 0 H THR A 154 7.279 8.741 6.261 1.00 0.00 H new ATOM 0 HA THR A 154 9.779 7.552 6.967 1.00 0.00 H new ATOM 0 HB THR A 154 11.093 9.328 6.512 1.00 0.00 H new ATOM 0 HG1 THR A 154 10.992 11.015 8.137 1.00 0.00 H new ATOM 0 HG21 THR A 154 10.257 11.575 5.933 1.00 0.00 H new ATOM 0 HG22 THR A 154 9.417 10.303 5.014 1.00 0.00 H new ATOM 0 HG23 THR A 154 8.613 11.078 6.399 1.00 0.00 H new ATOM 2372 N PRO A 155 9.247 8.069 9.456 1.00 0.00 N ATOM 2373 CA PRO A 155 8.734 8.045 10.829 1.00 0.00 C ATOM 2374 C PRO A 155 8.575 9.445 11.413 1.00 0.00 C ATOM 2375 O PRO A 155 9.446 10.300 11.248 1.00 0.00 O ATOM 2376 CB PRO A 155 9.806 7.265 11.595 1.00 0.00 C ATOM 2377 CG PRO A 155 11.054 7.463 10.806 1.00 0.00 C ATOM 2378 CD PRO A 155 10.625 7.557 9.368 1.00 0.00 C ATOM 0 HA PRO A 155 7.741 7.599 10.885 1.00 0.00 H new ATOM 0 HB2 PRO A 155 9.917 7.640 12.613 1.00 0.00 H new ATOM 0 HB3 PRO A 155 9.549 6.208 11.671 1.00 0.00 H new ATOM 0 HG2 PRO A 155 11.573 8.369 11.118 1.00 0.00 H new ATOM 0 HG3 PRO A 155 11.745 6.633 10.954 1.00 0.00 H new ATOM 0 HD2 PRO A 155 11.268 8.229 8.800 1.00 0.00 H new ATOM 0 HD3 PRO A 155 10.662 6.586 8.873 1.00 0.00 H new ATOM 2386 N VAL A 156 7.458 9.673 12.096 1.00 0.00 N ATOM 2387 CA VAL A 156 7.186 10.969 12.706 1.00 0.00 C ATOM 2388 C VAL A 156 8.361 11.433 13.559 1.00 0.00 C ATOM 2389 O VAL A 156 8.605 12.631 13.697 1.00 0.00 O ATOM 2390 CB VAL A 156 5.918 10.923 13.580 1.00 0.00 C ATOM 2391 CG1 VAL A 156 4.714 10.500 12.752 1.00 0.00 C ATOM 2392 CG2 VAL A 156 6.119 9.986 14.761 1.00 0.00 C ATOM 0 H VAL A 156 6.727 8.977 12.241 1.00 0.00 H new ATOM 0 HA VAL A 156 7.031 11.676 11.891 1.00 0.00 H new ATOM 0 HB VAL A 156 5.728 11.924 13.968 1.00 0.00 H new ATOM 0 HG11 VAL A 156 3.828 10.473 13.386 1.00 0.00 H new ATOM 0 HG12 VAL A 156 4.560 11.214 11.943 1.00 0.00 H new ATOM 0 HG13 VAL A 156 4.891 9.509 12.333 1.00 0.00 H new ATOM 0 HG21 VAL A 156 5.214 9.966 15.368 1.00 0.00 H new ATOM 0 HG22 VAL A 156 6.334 8.982 14.396 1.00 0.00 H new ATOM 0 HG23 VAL A 156 6.954 10.338 15.367 1.00 0.00 H new ATOM 2402 N GLN A 157 9.086 10.475 14.128 1.00 0.00 N ATOM 2403 CA GLN A 157 10.237 10.786 14.968 1.00 0.00 C ATOM 2404 C GLN A 157 11.355 9.771 14.757 1.00 0.00 C ATOM 2405 O GLN A 157 11.100 8.604 14.463 1.00 0.00 O ATOM 2406 CB GLN A 157 9.827 10.812 16.442 1.00 0.00 C ATOM 2407 CG GLN A 157 9.590 9.430 17.031 1.00 0.00 C ATOM 2408 CD GLN A 157 10.746 8.956 17.889 1.00 0.00 C ATOM 2409 OE1 GLN A 157 11.165 9.643 18.821 1.00 0.00 O ATOM 2410 NE2 GLN A 157 11.268 7.775 17.579 1.00 0.00 N ATOM 0 H GLN A 157 8.897 9.478 14.023 1.00 0.00 H new ATOM 0 HA GLN A 157 10.607 11.771 14.684 1.00 0.00 H new ATOM 0 HB2 GLN A 157 10.604 11.315 17.018 1.00 0.00 H new ATOM 0 HB3 GLN A 157 8.918 11.404 16.548 1.00 0.00 H new ATOM 0 HG2 GLN A 157 8.680 9.446 17.631 1.00 0.00 H new ATOM 0 HG3 GLN A 157 9.427 8.718 16.222 1.00 0.00 H new ATOM 0 HE21 GLN A 157 10.889 7.239 16.798 1.00 0.00 H new ATOM 0 HE22 GLN A 157 12.048 7.404 18.122 1.00 0.00 H new