USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 797 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 91 SER OG : rot 25:sc= 0.934 USER MOD Set 1.2: A 93 THR OG1 : rot -93:sc= 0.827 USER MOD Set 2.1: A 45 LYS NZ :NH3+ -146:sc= 1.16 (180deg=0) USER MOD Set 2.2: A 66 ASN : amide:sc= 0.682 K(o=1.8,f=-1.8) USER MOD Set 3.1: A 6 SER OG : rot -175:sc= 1.33 USER MOD Set 3.2: A 34 HIS : no HD1:sc= -1.47! C(o=-0.14!,f=-6.6!) USER MOD Set 4.1: A 26 GLN :FLIP amide:sc= -0.0129 F(o=-2.1!,f=-0.013) USER MOD Set 4.2: A 30 MET CE :methyl -157:sc= 0 (180deg=0) USER MOD Set 5.1: A 12 CYS SG : rot 98:sc= -0.482 USER MOD Set 5.2: A 50 HIS :FLIP no HD1:sc= 0.625 F(o=-11!,f=0.14) USER MOD Single : A 1 ILE N :NH3+ -168:sc=-0.00807 (180deg=-0.161) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.11 USER MOD Single : A 4 GLN : amide:sc= -0.81 X(o=-0.81,f=-0.71) USER MOD Single : A 5 SER OG : rot 126:sc= 0.185 USER MOD Single : A 7 LYS NZ :NH3+ 172:sc=-0.00123 (180deg=-0.0892) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc=-0.00637 K(o=-0.0064,f=-0.98) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.554 X(o=-0.55,f=-1) USER MOD Single : A 37 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0153) USER MOD Single : A 40 HIS :FLIP no HD1:sc= -0.195 F(o=-2.1!,f=-0.19) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 173:sc= -0.0146 (180deg=-0.104) USER MOD Single : A 47 THR OG1 : rot -109:sc= 0.256 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 174:sc=-0.00282 (180deg=-0.0677) USER MOD Single : A 67 TYR OH : rot -124:sc= -0.974 USER MOD Single : A 68 LYS NZ :NH3+ 149:sc= 0.745 (180deg=0.185) USER MOD Single : A 71 SER OG : rot 69:sc= 0.168 USER MOD Single : A 78 SER OG : rot 86:sc= 0.891 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= 0.0899 X(o=0.09,f=0) USER MOD Single : A 90 TYR OH : rot 130:sc= -0.21 USER MOD Single : A 94 SER OG : rot -80:sc= 0.556 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 1 6.219 -0.457 -1.514 1.00 0.00 N ATOM 2 CA ILE A 1 6.397 -1.908 -1.243 1.00 0.00 C ATOM 3 C ILE A 1 5.060 -2.511 -0.773 1.00 0.00 C ATOM 4 O ILE A 1 4.501 -2.084 0.245 1.00 0.00 O ATOM 5 CB ILE A 1 7.526 -2.166 -0.161 1.00 0.00 C ATOM 6 CG1 ILE A 1 8.912 -1.630 -0.658 1.00 0.00 C ATOM 7 CG2 ILE A 1 7.617 -3.666 0.236 1.00 0.00 C ATOM 8 CD1 ILE A 1 9.456 -2.297 -1.920 1.00 0.00 C ATOM 0 H1 ILE A 1 7.052 -0.093 -2.019 1.00 0.00 H new ATOM 0 H2 ILE A 1 5.370 -0.314 -2.098 1.00 0.00 H new ATOM 0 H3 ILE A 1 6.110 0.053 -0.614 1.00 0.00 H new ATOM 0 HA ILE A 1 6.713 -2.392 -2.167 1.00 0.00 H new ATOM 0 HB ILE A 1 7.248 -1.612 0.736 1.00 0.00 H new ATOM 0 HG12 ILE A 1 8.824 -0.559 -0.842 1.00 0.00 H new ATOM 0 HG13 ILE A 1 9.640 -1.757 0.143 1.00 0.00 H new ATOM 0 HG21 ILE A 1 8.403 -3.799 0.979 1.00 0.00 H new ATOM 0 HG22 ILE A 1 6.664 -3.990 0.654 1.00 0.00 H new ATOM 0 HG23 ILE A 1 7.848 -4.263 -0.647 1.00 0.00 H new ATOM 0 HD11 ILE A 1 10.418 -1.855 -2.180 1.00 0.00 H new ATOM 0 HD12 ILE A 1 9.584 -3.365 -1.741 1.00 0.00 H new ATOM 0 HD13 ILE A 1 8.755 -2.148 -2.741 1.00 0.00 H new ATOM 22 N SER A 2 4.542 -3.470 -1.552 1.00 0.00 N ATOM 23 CA SER A 2 3.349 -4.257 -1.212 1.00 0.00 C ATOM 24 C SER A 2 3.754 -5.725 -1.049 1.00 0.00 C ATOM 25 O SER A 2 4.624 -6.217 -1.781 1.00 0.00 O ATOM 26 CB SER A 2 2.283 -4.115 -2.322 1.00 0.00 C ATOM 27 OG SER A 2 1.108 -4.868 -2.030 1.00 0.00 O ATOM 0 H SER A 2 4.948 -3.725 -2.452 1.00 0.00 H new ATOM 0 HA SER A 2 2.921 -3.891 -0.279 1.00 0.00 H new ATOM 0 HB2 SER A 2 2.020 -3.064 -2.441 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.701 -4.448 -3.272 1.00 0.00 H new ATOM 0 HG SER A 2 0.457 -4.752 -2.753 1.00 0.00 H new ATOM 33 N SER A 3 3.118 -6.413 -0.091 1.00 0.00 N ATOM 34 CA SER A 3 3.378 -7.827 0.192 1.00 0.00 C ATOM 35 C SER A 3 2.253 -8.403 1.061 1.00 0.00 C ATOM 36 O SER A 3 1.396 -7.669 1.583 1.00 0.00 O ATOM 37 CB SER A 3 4.757 -8.006 0.887 1.00 0.00 C ATOM 38 OG SER A 3 5.082 -9.374 1.084 1.00 0.00 O ATOM 0 H SER A 3 2.406 -6.000 0.511 1.00 0.00 H new ATOM 0 HA SER A 3 3.405 -8.372 -0.751 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.531 -7.533 0.283 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.747 -7.494 1.849 1.00 0.00 H new ATOM 0 HG SER A 3 5.956 -9.443 1.522 1.00 0.00 H new ATOM 44 N GLN A 4 2.260 -9.731 1.194 1.00 0.00 N ATOM 45 CA GLN A 4 1.343 -10.473 2.058 1.00 0.00 C ATOM 46 C GLN A 4 2.182 -11.370 2.980 1.00 0.00 C ATOM 47 O GLN A 4 2.591 -12.465 2.574 1.00 0.00 O ATOM 48 CB GLN A 4 0.342 -11.324 1.208 1.00 0.00 C ATOM 49 CG GLN A 4 -0.535 -10.519 0.223 1.00 0.00 C ATOM 50 CD GLN A 4 -1.433 -11.390 -0.669 1.00 0.00 C ATOM 51 OE1 GLN A 4 -1.091 -12.527 -1.004 1.00 0.00 O ATOM 52 NE2 GLN A 4 -2.581 -10.860 -1.074 1.00 0.00 N ATOM 0 H GLN A 4 2.916 -10.331 0.694 1.00 0.00 H new ATOM 0 HA GLN A 4 0.748 -9.781 2.653 1.00 0.00 H new ATOM 0 HB2 GLN A 4 0.908 -12.065 0.643 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -0.311 -11.872 1.887 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -1.162 -9.830 0.790 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.112 -9.913 -0.411 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -2.839 -9.917 -0.782 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -3.205 -11.395 -1.677 1.00 0.00 H new ATOM 61 N SER A 5 2.492 -10.863 4.195 1.00 0.00 N ATOM 62 CA SER A 5 3.154 -11.652 5.261 1.00 0.00 C ATOM 63 C SER A 5 2.295 -12.888 5.584 1.00 0.00 C ATOM 64 O SER A 5 2.800 -13.998 5.800 1.00 0.00 O ATOM 65 CB SER A 5 3.358 -10.769 6.521 1.00 0.00 C ATOM 66 OG SER A 5 2.129 -10.195 6.957 1.00 0.00 O ATOM 0 H SER A 5 2.292 -9.900 4.464 1.00 0.00 H new ATOM 0 HA SER A 5 4.134 -11.987 4.921 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.786 -11.370 7.323 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.073 -9.977 6.300 1.00 0.00 H new ATOM 0 HG SER A 5 1.987 -10.406 7.903 1.00 0.00 H new ATOM 72 N SER A 6 0.981 -12.648 5.607 1.00 0.00 N ATOM 73 CA SER A 6 -0.046 -13.687 5.561 1.00 0.00 C ATOM 74 C SER A 6 -1.213 -13.166 4.707 1.00 0.00 C ATOM 75 O SER A 6 -1.509 -11.961 4.713 1.00 0.00 O ATOM 76 CB SER A 6 -0.544 -14.055 6.973 1.00 0.00 C ATOM 77 OG SER A 6 0.519 -14.244 7.894 1.00 0.00 O ATOM 0 H SER A 6 0.596 -11.705 5.659 1.00 0.00 H new ATOM 0 HA SER A 6 0.377 -14.592 5.124 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.202 -13.267 7.339 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.139 -14.967 6.918 1.00 0.00 H new ATOM 0 HG SER A 6 0.159 -14.558 8.750 1.00 0.00 H new ATOM 83 N LYS A 7 -1.863 -14.067 3.967 1.00 0.00 N ATOM 84 CA LYS A 7 -3.058 -13.743 3.162 1.00 0.00 C ATOM 85 C LYS A 7 -4.309 -14.414 3.765 1.00 0.00 C ATOM 86 O LYS A 7 -5.339 -14.550 3.092 1.00 0.00 O ATOM 87 CB LYS A 7 -2.832 -14.159 1.677 1.00 0.00 C ATOM 88 CG LYS A 7 -2.365 -15.614 1.489 1.00 0.00 C ATOM 89 CD LYS A 7 -2.186 -16.004 0.005 1.00 0.00 C ATOM 90 CE LYS A 7 -1.604 -17.417 -0.161 1.00 0.00 C ATOM 91 NZ LYS A 7 -2.421 -18.450 0.537 1.00 0.00 N ATOM 0 H LYS A 7 -1.581 -15.045 3.904 1.00 0.00 H new ATOM 0 HA LYS A 7 -3.225 -12.666 3.182 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -3.761 -14.014 1.126 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -2.092 -13.492 1.234 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -1.420 -15.757 2.013 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -3.090 -16.285 1.950 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -3.150 -15.949 -0.502 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -1.528 -15.283 -0.481 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -1.543 -17.660 -1.222 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -0.586 -17.437 0.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -2.071 -19.397 0.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -2.348 -18.314 1.565 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -3.415 -18.361 0.246 1.00 0.00 H new ATOM 105 N ILE A 8 -4.214 -14.759 5.065 1.00 0.00 N ATOM 106 CA ILE A 8 -5.273 -15.477 5.805 1.00 0.00 C ATOM 107 C ILE A 8 -6.533 -14.597 5.939 1.00 0.00 C ATOM 108 O ILE A 8 -7.648 -15.012 5.600 1.00 0.00 O ATOM 109 CB ILE A 8 -4.779 -15.857 7.255 1.00 0.00 C ATOM 110 CG1 ILE A 8 -3.418 -16.616 7.212 1.00 0.00 C ATOM 111 CG2 ILE A 8 -5.843 -16.681 8.024 1.00 0.00 C ATOM 112 CD1 ILE A 8 -2.777 -16.831 8.575 1.00 0.00 C ATOM 0 H ILE A 8 -3.395 -14.546 5.635 1.00 0.00 H new ATOM 0 HA ILE A 8 -5.509 -16.382 5.245 1.00 0.00 H new ATOM 0 HB ILE A 8 -4.627 -14.923 7.796 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -3.571 -17.586 6.739 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -2.725 -16.059 6.581 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -5.467 -16.924 9.018 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -6.759 -16.097 8.115 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -6.053 -17.602 7.480 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -1.835 -17.366 8.454 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -2.588 -15.866 9.045 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -3.448 -17.416 9.204 1.00 0.00 H new ATOM 124 N PHE A 9 -6.313 -13.354 6.399 1.00 0.00 N ATOM 125 CA PHE A 9 -7.387 -12.385 6.676 1.00 0.00 C ATOM 126 C PHE A 9 -7.318 -11.215 5.674 1.00 0.00 C ATOM 127 O PHE A 9 -7.995 -10.209 5.869 1.00 0.00 O ATOM 128 CB PHE A 9 -7.254 -11.851 8.139 1.00 0.00 C ATOM 129 CG PHE A 9 -7.164 -12.929 9.224 1.00 0.00 C ATOM 130 CD1 PHE A 9 -8.253 -13.751 9.516 1.00 0.00 C ATOM 131 CD2 PHE A 9 -5.987 -13.118 9.957 1.00 0.00 C ATOM 132 CE1 PHE A 9 -8.163 -14.730 10.496 1.00 0.00 C ATOM 133 CE2 PHE A 9 -5.900 -14.097 10.933 1.00 0.00 C ATOM 134 CZ PHE A 9 -6.990 -14.899 11.204 1.00 0.00 C ATOM 0 H PHE A 9 -5.379 -12.991 6.590 1.00 0.00 H new ATOM 0 HA PHE A 9 -8.351 -12.882 6.566 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -6.365 -11.223 8.200 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -8.111 -11.213 8.354 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -9.178 -13.624 8.973 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.131 -12.490 9.758 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -9.014 -15.362 10.705 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -4.980 -14.233 11.482 1.00 0.00 H new ATOM 0 HZ PHE A 9 -6.925 -15.658 11.969 1.00 0.00 H new ATOM 144 N LYS A 10 -6.544 -11.400 4.576 1.00 0.00 N ATOM 145 CA LYS A 10 -6.108 -10.306 3.672 1.00 0.00 C ATOM 146 C LYS A 10 -7.273 -9.447 3.141 1.00 0.00 C ATOM 147 O LYS A 10 -7.281 -8.221 3.308 1.00 0.00 O ATOM 148 CB LYS A 10 -5.286 -10.889 2.492 1.00 0.00 C ATOM 149 CG LYS A 10 -4.686 -9.842 1.520 1.00 0.00 C ATOM 150 CD LYS A 10 -3.832 -8.778 2.248 1.00 0.00 C ATOM 151 CE LYS A 10 -3.229 -7.735 1.296 1.00 0.00 C ATOM 152 NZ LYS A 10 -2.555 -6.639 2.035 1.00 0.00 N ATOM 0 H LYS A 10 -6.203 -12.318 4.291 1.00 0.00 H new ATOM 0 HA LYS A 10 -5.484 -9.639 4.267 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -4.473 -11.490 2.899 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -5.926 -11.563 1.923 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -4.071 -10.351 0.778 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -5.494 -9.348 0.980 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -4.449 -8.271 2.989 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.027 -9.275 2.790 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -2.513 -8.220 0.632 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -4.016 -7.319 0.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -2.161 -5.955 1.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -3.244 -6.160 2.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -1.787 -7.033 2.616 1.00 0.00 H new ATOM 166 N ASN A 11 -8.249 -10.104 2.509 1.00 0.00 N ATOM 167 CA ASN A 11 -9.410 -9.423 1.898 1.00 0.00 C ATOM 168 C ASN A 11 -10.638 -9.526 2.840 1.00 0.00 C ATOM 169 O ASN A 11 -11.776 -9.289 2.437 1.00 0.00 O ATOM 170 CB ASN A 11 -9.687 -10.036 0.488 1.00 0.00 C ATOM 171 CG ASN A 11 -10.572 -9.163 -0.414 1.00 0.00 C ATOM 172 OD1 ASN A 11 -10.605 -7.935 -0.283 1.00 0.00 O ATOM 173 ND2 ASN A 11 -11.267 -9.784 -1.362 1.00 0.00 N ATOM 0 H ASN A 11 -8.264 -11.118 2.403 1.00 0.00 H new ATOM 0 HA ASN A 11 -9.198 -8.362 1.762 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -8.735 -10.210 -0.014 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -10.163 -11.008 0.614 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -11.847 -9.245 -2.005 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -11.220 -10.799 -1.446 1.00 0.00 H new ATOM 180 N CYS A 12 -10.368 -9.847 4.119 1.00 0.00 N ATOM 181 CA CYS A 12 -11.379 -10.106 5.157 1.00 0.00 C ATOM 182 C CYS A 12 -11.345 -9.008 6.247 1.00 0.00 C ATOM 183 O CYS A 12 -10.281 -8.680 6.787 1.00 0.00 O ATOM 184 CB CYS A 12 -11.104 -11.501 5.769 1.00 0.00 C ATOM 185 SG CYS A 12 -12.107 -11.924 7.205 1.00 0.00 S ATOM 0 H CYS A 12 -9.413 -9.935 4.467 1.00 0.00 H new ATOM 0 HA CYS A 12 -12.375 -10.088 4.714 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -11.265 -12.255 4.999 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -10.053 -11.554 6.052 1.00 0.00 H new ATOM 0 HG CYS A 12 -13.109 -12.663 6.832 1.00 0.00 H new ATOM 191 N VAL A 13 -12.523 -8.428 6.537 1.00 0.00 N ATOM 192 CA VAL A 13 -12.720 -7.440 7.620 1.00 0.00 C ATOM 193 C VAL A 13 -13.351 -8.141 8.841 1.00 0.00 C ATOM 194 O VAL A 13 -14.350 -8.864 8.688 1.00 0.00 O ATOM 195 CB VAL A 13 -13.652 -6.261 7.147 1.00 0.00 C ATOM 196 CG1 VAL A 13 -13.805 -5.171 8.241 1.00 0.00 C ATOM 197 CG2 VAL A 13 -13.143 -5.648 5.816 1.00 0.00 C ATOM 0 H VAL A 13 -13.378 -8.633 6.021 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.750 -7.022 7.889 1.00 0.00 H new ATOM 0 HB VAL A 13 -14.642 -6.682 6.970 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -14.455 -4.376 7.875 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -14.242 -5.613 9.137 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -12.826 -4.757 8.481 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -13.805 -4.837 5.513 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -12.134 -5.260 5.956 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -13.132 -6.416 5.042 1.00 0.00 H new ATOM 207 N ILE A 14 -12.773 -7.943 10.053 1.00 0.00 N ATOM 208 CA ILE A 14 -13.231 -8.641 11.277 1.00 0.00 C ATOM 209 C ILE A 14 -13.603 -7.637 12.414 1.00 0.00 C ATOM 210 O ILE A 14 -12.816 -6.755 12.778 1.00 0.00 O ATOM 211 CB ILE A 14 -12.169 -9.686 11.822 1.00 0.00 C ATOM 212 CG1 ILE A 14 -11.760 -10.772 10.752 1.00 0.00 C ATOM 213 CG2 ILE A 14 -12.682 -10.379 13.106 1.00 0.00 C ATOM 214 CD1 ILE A 14 -10.674 -10.351 9.775 1.00 0.00 C ATOM 0 H ILE A 14 -11.991 -7.307 10.206 1.00 0.00 H new ATOM 0 HA ILE A 14 -14.125 -9.190 10.981 1.00 0.00 H new ATOM 0 HB ILE A 14 -11.273 -9.110 12.053 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -11.425 -11.666 11.277 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -12.648 -11.050 10.184 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -11.935 -11.090 13.459 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -12.862 -9.630 13.877 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -13.611 -10.906 12.889 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -10.469 -11.169 9.084 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -11.008 -9.478 9.214 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -9.766 -10.104 10.325 1.00 0.00 H new ATOM 226 N TYR A 15 -14.811 -7.833 12.977 1.00 0.00 N ATOM 227 CA TYR A 15 -15.350 -7.136 14.167 1.00 0.00 C ATOM 228 C TYR A 15 -15.274 -8.091 15.362 1.00 0.00 C ATOM 229 O TYR A 15 -15.260 -9.297 15.163 1.00 0.00 O ATOM 230 CB TYR A 15 -16.825 -6.715 13.903 1.00 0.00 C ATOM 231 CG TYR A 15 -17.625 -6.211 15.125 1.00 0.00 C ATOM 232 CD1 TYR A 15 -17.351 -4.977 15.712 1.00 0.00 C ATOM 233 CD2 TYR A 15 -18.659 -6.972 15.684 1.00 0.00 C ATOM 234 CE1 TYR A 15 -18.077 -4.526 16.801 1.00 0.00 C ATOM 235 CE2 TYR A 15 -19.386 -6.518 16.766 1.00 0.00 C ATOM 236 CZ TYR A 15 -19.092 -5.296 17.321 1.00 0.00 C ATOM 237 OH TYR A 15 -19.819 -4.842 18.400 1.00 0.00 O ATOM 0 H TYR A 15 -15.471 -8.513 12.599 1.00 0.00 H new ATOM 0 HA TYR A 15 -14.768 -6.239 14.377 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -16.826 -5.930 13.147 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -17.353 -7.568 13.477 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -16.559 -4.362 15.311 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -18.893 -7.937 15.259 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -17.846 -3.568 17.243 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -20.183 -7.121 17.175 1.00 0.00 H new ATOM 0 HH TYR A 15 -20.498 -5.507 18.640 1.00 0.00 H new ATOM 247 N ILE A 16 -15.160 -7.558 16.592 1.00 0.00 N ATOM 248 CA ILE A 16 -15.122 -8.375 17.826 1.00 0.00 C ATOM 249 C ILE A 16 -16.252 -7.946 18.775 1.00 0.00 C ATOM 250 O ILE A 16 -16.508 -6.745 18.944 1.00 0.00 O ATOM 251 CB ILE A 16 -13.724 -8.265 18.537 1.00 0.00 C ATOM 252 CG1 ILE A 16 -12.583 -8.625 17.527 1.00 0.00 C ATOM 253 CG2 ILE A 16 -13.657 -9.164 19.806 1.00 0.00 C ATOM 254 CD1 ILE A 16 -11.185 -8.458 18.063 1.00 0.00 C ATOM 0 H ILE A 16 -15.092 -6.555 16.762 1.00 0.00 H new ATOM 0 HA ILE A 16 -15.271 -9.420 17.552 1.00 0.00 H new ATOM 0 HB ILE A 16 -13.586 -7.236 18.868 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -12.713 -9.659 17.208 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -12.693 -8.002 16.640 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -12.677 -9.063 20.272 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -14.428 -8.855 20.512 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -13.819 -10.204 19.524 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -10.465 -8.731 17.292 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -11.029 -7.419 18.354 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.049 -9.103 18.931 1.00 0.00 H new ATOM 266 N ASN A 17 -16.912 -8.942 19.386 1.00 0.00 N ATOM 267 CA ASN A 17 -18.095 -8.753 20.245 1.00 0.00 C ATOM 268 C ASN A 17 -18.048 -9.761 21.406 1.00 0.00 C ATOM 269 O ASN A 17 -17.644 -10.916 21.217 1.00 0.00 O ATOM 270 CB ASN A 17 -19.393 -8.948 19.414 1.00 0.00 C ATOM 271 CG ASN A 17 -20.686 -8.632 20.180 1.00 0.00 C ATOM 272 OD1 ASN A 17 -20.706 -7.803 21.097 1.00 0.00 O ATOM 273 ND2 ASN A 17 -21.780 -9.278 19.794 1.00 0.00 N ATOM 0 H ASN A 17 -16.635 -9.920 19.296 1.00 0.00 H new ATOM 0 HA ASN A 17 -18.092 -7.741 20.649 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -19.344 -8.312 18.530 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -19.435 -9.979 19.063 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -22.670 -9.096 20.258 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -21.730 -9.956 19.034 1.00 0.00 H new ATOM 280 N GLY A 18 -18.464 -9.314 22.606 1.00 0.00 N ATOM 281 CA GLY A 18 -18.432 -10.154 23.813 1.00 0.00 C ATOM 282 C GLY A 18 -17.020 -10.321 24.379 1.00 0.00 C ATOM 283 O GLY A 18 -16.055 -9.767 23.839 1.00 0.00 O ATOM 0 H GLY A 18 -18.826 -8.374 22.763 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -19.075 -9.713 24.575 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -18.843 -11.136 23.578 1.00 0.00 H new ATOM 287 N TYR A 19 -16.893 -11.093 25.471 1.00 0.00 N ATOM 288 CA TYR A 19 -15.596 -11.316 26.141 1.00 0.00 C ATOM 289 C TYR A 19 -14.935 -12.581 25.591 1.00 0.00 C ATOM 290 O TYR A 19 -15.410 -13.697 25.820 1.00 0.00 O ATOM 291 CB TYR A 19 -15.794 -11.385 27.674 1.00 0.00 C ATOM 292 CG TYR A 19 -16.344 -10.066 28.239 1.00 0.00 C ATOM 293 CD1 TYR A 19 -15.527 -8.933 28.339 1.00 0.00 C ATOM 294 CD2 TYR A 19 -17.689 -9.929 28.611 1.00 0.00 C ATOM 295 CE1 TYR A 19 -16.022 -7.726 28.799 1.00 0.00 C ATOM 296 CE2 TYR A 19 -18.185 -8.715 29.063 1.00 0.00 C ATOM 297 CZ TYR A 19 -17.348 -7.619 29.155 1.00 0.00 C ATOM 298 OH TYR A 19 -17.840 -6.406 29.596 1.00 0.00 O ATOM 0 H TYR A 19 -17.675 -11.576 25.912 1.00 0.00 H new ATOM 0 HA TYR A 19 -14.929 -10.479 25.935 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -16.479 -12.198 27.916 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -14.843 -11.617 28.153 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -14.489 -9.003 28.051 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -18.349 -10.782 28.545 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -15.370 -6.869 28.879 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -19.224 -8.626 29.343 1.00 0.00 H new ATOM 0 HH TYR A 19 -18.793 -6.496 29.806 1.00 0.00 H new ATOM 308 N THR A 20 -13.841 -12.373 24.851 1.00 0.00 N ATOM 309 CA THR A 20 -13.109 -13.418 24.133 1.00 0.00 C ATOM 310 C THR A 20 -11.646 -13.440 24.600 1.00 0.00 C ATOM 311 O THR A 20 -11.080 -12.380 24.896 1.00 0.00 O ATOM 312 CB THR A 20 -13.164 -13.132 22.590 1.00 0.00 C ATOM 313 OG1 THR A 20 -12.625 -11.819 22.315 1.00 0.00 O ATOM 314 CG2 THR A 20 -14.603 -13.209 22.034 1.00 0.00 C ATOM 0 H THR A 20 -13.430 -11.447 24.733 1.00 0.00 H new ATOM 0 HA THR A 20 -13.567 -14.385 24.339 1.00 0.00 H new ATOM 0 HB THR A 20 -12.568 -13.901 22.098 1.00 0.00 H new ATOM 0 HG1 THR A 20 -12.660 -11.646 21.351 1.00 0.00 H new ATOM 0 HG21 THR A 20 -14.591 -13.004 20.963 1.00 0.00 H new ATOM 0 HG22 THR A 20 -15.007 -14.206 22.208 1.00 0.00 H new ATOM 0 HG23 THR A 20 -15.228 -12.471 22.538 1.00 0.00 H new ATOM 322 N LYS A 21 -11.046 -14.643 24.710 1.00 0.00 N ATOM 323 CA LYS A 21 -9.584 -14.782 24.881 1.00 0.00 C ATOM 324 C LYS A 21 -8.918 -15.053 23.513 1.00 0.00 C ATOM 325 O LYS A 21 -9.394 -15.910 22.756 1.00 0.00 O ATOM 326 CB LYS A 21 -9.187 -15.903 25.879 1.00 0.00 C ATOM 327 CG LYS A 21 -9.736 -15.735 27.320 1.00 0.00 C ATOM 328 CD LYS A 21 -9.339 -14.386 27.982 1.00 0.00 C ATOM 329 CE LYS A 21 -7.816 -14.198 28.120 1.00 0.00 C ATOM 330 NZ LYS A 21 -7.465 -12.879 28.709 1.00 0.00 N ATOM 0 H LYS A 21 -11.549 -15.530 24.684 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.230 -13.840 25.301 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.535 -16.858 25.485 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.099 -15.956 25.926 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -10.823 -15.813 27.297 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.370 -16.555 27.938 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -9.747 -13.566 27.391 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -9.796 -14.326 28.970 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -7.408 -14.993 28.744 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -7.350 -14.292 27.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -6.431 -12.796 28.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -7.831 -12.119 28.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.888 -12.798 29.656 1.00 0.00 H new ATOM 344 N PRO A 22 -7.829 -14.304 23.142 1.00 0.00 N ATOM 345 CA PRO A 22 -7.285 -13.162 23.916 1.00 0.00 C ATOM 346 C PRO A 22 -8.112 -11.870 23.688 1.00 0.00 C ATOM 347 O PRO A 22 -9.075 -11.878 22.902 1.00 0.00 O ATOM 348 CB PRO A 22 -5.854 -13.048 23.367 1.00 0.00 C ATOM 349 CG PRO A 22 -5.995 -13.424 21.928 1.00 0.00 C ATOM 350 CD PRO A 22 -7.032 -14.530 21.910 1.00 0.00 C ATOM 0 HA PRO A 22 -7.318 -13.306 24.996 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -5.461 -12.038 23.480 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -5.170 -13.716 23.890 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -6.316 -12.573 21.327 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -5.046 -13.766 21.515 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -7.655 -14.477 21.017 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -6.564 -15.514 21.914 1.00 0.00 H new ATOM 358 N GLY A 23 -7.743 -10.792 24.410 1.00 0.00 N ATOM 359 CA GLY A 23 -8.464 -9.508 24.360 1.00 0.00 C ATOM 360 C GLY A 23 -8.662 -8.961 22.952 1.00 0.00 C ATOM 361 O GLY A 23 -7.852 -9.238 22.073 1.00 0.00 O ATOM 0 H GLY A 23 -6.941 -10.789 25.040 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.439 -9.633 24.830 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.917 -8.773 24.950 1.00 0.00 H new ATOM 365 N ARG A 24 -9.736 -8.181 22.759 1.00 0.00 N ATOM 366 CA ARG A 24 -10.118 -7.597 21.453 1.00 0.00 C ATOM 367 C ARG A 24 -8.967 -6.797 20.812 1.00 0.00 C ATOM 368 O ARG A 24 -8.817 -6.779 19.580 1.00 0.00 O ATOM 369 CB ARG A 24 -11.398 -6.734 21.599 1.00 0.00 C ATOM 370 CG ARG A 24 -11.269 -5.508 22.531 1.00 0.00 C ATOM 371 CD ARG A 24 -12.613 -4.789 22.761 1.00 0.00 C ATOM 372 NE ARG A 24 -13.250 -4.373 21.492 1.00 0.00 N ATOM 373 CZ ARG A 24 -14.563 -4.435 21.220 1.00 0.00 C ATOM 374 NH1 ARG A 24 -15.410 -4.986 22.082 1.00 0.00 N ATOM 375 NH2 ARG A 24 -15.023 -3.963 20.066 1.00 0.00 N ATOM 0 H ARG A 24 -10.376 -7.931 23.513 1.00 0.00 H new ATOM 0 HA ARG A 24 -10.335 -8.422 20.774 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -11.696 -6.387 20.610 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -12.203 -7.368 21.971 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -10.864 -5.828 23.491 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -10.555 -4.805 22.102 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -13.288 -5.450 23.305 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -12.451 -3.913 23.389 1.00 0.00 H new ATOM 0 HE ARG A 24 -12.639 -4.008 20.761 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -15.065 -5.368 22.963 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -16.405 -5.027 21.863 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -14.379 -3.555 19.389 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -16.020 -4.009 19.857 1.00 0.00 H new ATOM 389 N LEU A 25 -8.176 -6.135 21.667 1.00 0.00 N ATOM 390 CA LEU A 25 -6.950 -5.434 21.260 1.00 0.00 C ATOM 391 C LEU A 25 -5.959 -6.407 20.574 1.00 0.00 C ATOM 392 O LEU A 25 -5.504 -6.143 19.457 1.00 0.00 O ATOM 393 CB LEU A 25 -6.326 -4.699 22.495 1.00 0.00 C ATOM 394 CG LEU A 25 -6.024 -5.569 23.788 1.00 0.00 C ATOM 395 CD1 LEU A 25 -4.578 -6.123 23.819 1.00 0.00 C ATOM 396 CD2 LEU A 25 -6.331 -4.794 25.091 1.00 0.00 C ATOM 0 H LEU A 25 -8.370 -6.070 22.666 1.00 0.00 H new ATOM 0 HA LEU A 25 -7.193 -4.675 20.517 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.392 -4.236 22.175 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.000 -3.892 22.782 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.698 -6.424 23.729 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.432 -6.709 24.726 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.412 -6.756 22.947 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.870 -5.294 23.805 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.110 -5.426 25.951 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.715 -3.896 25.134 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.384 -4.513 25.108 1.00 0.00 H new ATOM 408 N GLN A 26 -5.724 -7.573 21.210 1.00 0.00 N ATOM 409 CA GLN A 26 -4.733 -8.565 20.747 1.00 0.00 C ATOM 410 C GLN A 26 -5.221 -9.311 19.501 1.00 0.00 C ATOM 411 O GLN A 26 -4.441 -9.542 18.586 1.00 0.00 O ATOM 412 CB GLN A 26 -4.366 -9.574 21.873 1.00 0.00 C ATOM 413 CG GLN A 26 -3.311 -10.646 21.464 1.00 0.00 C ATOM 414 CD GLN A 26 -1.833 -10.180 21.398 1.00 0.00 C ATOM 415 OE1 GLN A 26 -1.560 -8.896 21.173 1.00 0.00 O flip ATOM 416 NE2 GLN A 26 -0.922 -10.996 21.568 1.00 0.00 N flip ATOM 0 H GLN A 26 -6.216 -7.853 22.059 1.00 0.00 H new ATOM 0 HA GLN A 26 -3.833 -8.011 20.480 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -3.987 -9.019 22.731 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -5.274 -10.082 22.198 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -3.375 -11.474 22.170 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -3.588 -11.040 20.486 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -1.142 -11.977 21.740 1.00 0.00 H new ATOM 0 HE22 GLN A 26 0.050 -10.689 21.537 1.00 0.00 H new ATOM 425 N LEU A 27 -6.507 -9.689 19.480 1.00 0.00 N ATOM 426 CA LEU A 27 -7.127 -10.369 18.326 1.00 0.00 C ATOM 427 C LEU A 27 -7.008 -9.503 17.057 1.00 0.00 C ATOM 428 O LEU A 27 -6.650 -10.010 16.002 1.00 0.00 O ATOM 429 CB LEU A 27 -8.610 -10.714 18.611 1.00 0.00 C ATOM 430 CG LEU A 27 -8.879 -11.994 19.461 1.00 0.00 C ATOM 431 CD1 LEU A 27 -10.355 -12.071 19.905 1.00 0.00 C ATOM 432 CD2 LEU A 27 -8.474 -13.268 18.679 1.00 0.00 C ATOM 0 H LEU A 27 -7.148 -9.534 20.258 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.590 -11.303 18.160 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.065 -9.865 19.121 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.123 -10.825 17.656 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.264 -11.933 20.359 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.511 -12.974 20.495 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.600 -11.197 20.508 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.999 -12.097 19.026 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.670 -14.148 19.291 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.054 -13.329 17.758 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.412 -13.224 18.437 1.00 0.00 H new ATOM 444 N HIS A 28 -7.290 -8.193 17.187 1.00 0.00 N ATOM 445 CA HIS A 28 -7.159 -7.236 16.068 1.00 0.00 C ATOM 446 C HIS A 28 -5.686 -7.073 15.632 1.00 0.00 C ATOM 447 O HIS A 28 -5.420 -6.919 14.443 1.00 0.00 O ATOM 448 CB HIS A 28 -7.823 -5.872 16.414 1.00 0.00 C ATOM 449 CG HIS A 28 -9.313 -5.821 16.138 1.00 0.00 C ATOM 450 ND1 HIS A 28 -10.179 -4.944 16.764 1.00 0.00 N ATOM 451 CD2 HIS A 28 -10.075 -6.515 15.252 1.00 0.00 C ATOM 452 CE1 HIS A 28 -11.401 -5.112 16.282 1.00 0.00 C ATOM 453 NE2 HIS A 28 -11.362 -6.054 15.363 1.00 0.00 N ATOM 0 H HIS A 28 -7.611 -7.770 18.058 1.00 0.00 H new ATOM 0 HA HIS A 28 -7.696 -7.646 15.213 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -7.652 -5.654 17.468 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -7.331 -5.085 15.842 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -9.730 -7.289 14.582 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -12.281 -4.568 16.591 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -12.160 -6.387 14.821 1.00 0.00 H new ATOM 462 N GLU A 29 -4.737 -7.134 16.586 1.00 0.00 N ATOM 463 CA GLU A 29 -3.284 -7.154 16.265 1.00 0.00 C ATOM 464 C GLU A 29 -2.928 -8.420 15.450 1.00 0.00 C ATOM 465 O GLU A 29 -2.191 -8.348 14.466 1.00 0.00 O ATOM 466 CB GLU A 29 -2.427 -7.094 17.558 1.00 0.00 C ATOM 467 CG GLU A 29 -2.547 -5.780 18.349 1.00 0.00 C ATOM 468 CD GLU A 29 -1.779 -5.817 19.677 1.00 0.00 C ATOM 469 OE1 GLU A 29 -0.546 -5.583 19.678 1.00 0.00 O ATOM 470 OE2 GLU A 29 -2.397 -6.096 20.727 1.00 0.00 O ATOM 0 H GLU A 29 -4.943 -7.170 17.584 1.00 0.00 H new ATOM 0 HA GLU A 29 -3.060 -6.272 15.664 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.715 -7.921 18.207 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -1.381 -7.248 17.292 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.172 -4.958 17.739 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -3.599 -5.575 18.548 1.00 0.00 H new ATOM 477 N MET A 30 -3.504 -9.563 15.863 1.00 0.00 N ATOM 478 CA MET A 30 -3.305 -10.874 15.202 1.00 0.00 C ATOM 479 C MET A 30 -3.825 -10.837 13.754 1.00 0.00 C ATOM 480 O MET A 30 -3.219 -11.406 12.844 1.00 0.00 O ATOM 481 CB MET A 30 -4.032 -11.994 16.001 1.00 0.00 C ATOM 482 CG MET A 30 -3.410 -12.333 17.360 1.00 0.00 C ATOM 483 SD MET A 30 -1.703 -12.904 17.214 1.00 0.00 S ATOM 484 CE MET A 30 -1.318 -13.347 18.907 1.00 0.00 C ATOM 0 H MET A 30 -4.126 -9.608 16.670 1.00 0.00 H new ATOM 0 HA MET A 30 -2.237 -11.089 15.181 1.00 0.00 H new ATOM 0 HB2 MET A 30 -5.068 -11.693 16.158 1.00 0.00 H new ATOM 0 HB3 MET A 30 -4.052 -12.898 15.393 1.00 0.00 H new ATOM 0 HG2 MET A 30 -3.442 -11.452 18.001 1.00 0.00 H new ATOM 0 HG3 MET A 30 -4.007 -13.103 17.848 1.00 0.00 H new ATOM 0 HE1 MET A 30 -0.238 -13.320 19.054 1.00 0.00 H new ATOM 0 HE2 MET A 30 -1.794 -12.639 19.586 1.00 0.00 H new ATOM 0 HE3 MET A 30 -1.687 -14.352 19.113 1.00 0.00 H new ATOM 494 N ILE A 31 -4.956 -10.154 13.574 1.00 0.00 N ATOM 495 CA ILE A 31 -5.605 -9.969 12.272 1.00 0.00 C ATOM 496 C ILE A 31 -4.739 -9.116 11.327 1.00 0.00 C ATOM 497 O ILE A 31 -4.428 -9.552 10.221 1.00 0.00 O ATOM 498 CB ILE A 31 -7.028 -9.329 12.505 1.00 0.00 C ATOM 499 CG1 ILE A 31 -7.977 -10.360 13.207 1.00 0.00 C ATOM 500 CG2 ILE A 31 -7.663 -8.783 11.209 1.00 0.00 C ATOM 501 CD1 ILE A 31 -9.210 -9.754 13.852 1.00 0.00 C ATOM 0 H ILE A 31 -5.457 -9.705 14.341 1.00 0.00 H new ATOM 0 HA ILE A 31 -5.724 -10.936 11.783 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.889 -8.469 13.159 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -8.295 -11.099 12.472 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.410 -10.893 13.970 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -8.640 -8.356 11.435 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -7.019 -8.012 10.785 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -7.779 -9.595 10.491 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -9.805 -10.543 14.312 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -8.906 -9.037 14.615 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -9.805 -9.246 13.093 1.00 0.00 H new ATOM 513 N VAL A 32 -4.297 -7.943 11.803 1.00 0.00 N ATOM 514 CA VAL A 32 -3.581 -6.954 10.966 1.00 0.00 C ATOM 515 C VAL A 32 -2.181 -7.465 10.553 1.00 0.00 C ATOM 516 O VAL A 32 -1.789 -7.345 9.386 1.00 0.00 O ATOM 517 CB VAL A 32 -3.459 -5.562 11.684 1.00 0.00 C ATOM 518 CG1 VAL A 32 -2.678 -4.553 10.815 1.00 0.00 C ATOM 519 CG2 VAL A 32 -4.852 -4.999 12.041 1.00 0.00 C ATOM 0 H VAL A 32 -4.422 -7.649 12.772 1.00 0.00 H new ATOM 0 HA VAL A 32 -4.177 -6.820 10.064 1.00 0.00 H new ATOM 0 HB VAL A 32 -2.903 -5.717 12.609 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.610 -3.599 11.338 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -1.675 -4.936 10.626 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.197 -4.411 9.867 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -4.739 -4.035 12.537 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.437 -4.872 11.130 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -5.365 -5.692 12.708 1.00 0.00 H new ATOM 529 N LEU A 33 -1.451 -8.061 11.513 1.00 0.00 N ATOM 530 CA LEU A 33 -0.120 -8.667 11.265 1.00 0.00 C ATOM 531 C LEU A 33 -0.206 -9.861 10.284 1.00 0.00 C ATOM 532 O LEU A 33 0.804 -10.278 9.710 1.00 0.00 O ATOM 533 CB LEU A 33 0.563 -9.086 12.614 1.00 0.00 C ATOM 534 CG LEU A 33 1.396 -7.984 13.356 1.00 0.00 C ATOM 535 CD1 LEU A 33 2.564 -7.492 12.477 1.00 0.00 C ATOM 536 CD2 LEU A 33 0.515 -6.808 13.829 1.00 0.00 C ATOM 0 H LEU A 33 -1.762 -8.139 12.481 1.00 0.00 H new ATOM 0 HA LEU A 33 0.503 -7.908 10.792 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -0.213 -9.440 13.293 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.221 -9.932 12.414 1.00 0.00 H new ATOM 0 HG LEU A 33 1.815 -8.443 14.251 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.127 -6.728 13.014 1.00 0.00 H new ATOM 0 HD12 LEU A 33 3.221 -8.330 12.243 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.171 -7.070 11.552 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.136 -6.070 14.337 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.033 -6.345 12.968 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -0.246 -7.177 14.516 1.00 0.00 H new ATOM 548 N HIS A 34 -1.426 -10.404 10.102 1.00 0.00 N ATOM 549 CA HIS A 34 -1.702 -11.491 9.147 1.00 0.00 C ATOM 550 C HIS A 34 -2.525 -10.987 7.930 1.00 0.00 C ATOM 551 O HIS A 34 -3.258 -11.762 7.291 1.00 0.00 O ATOM 552 CB HIS A 34 -2.369 -12.684 9.887 1.00 0.00 C ATOM 553 CG HIS A 34 -1.392 -13.454 10.751 1.00 0.00 C ATOM 554 ND1 HIS A 34 -0.843 -14.660 10.367 1.00 0.00 N ATOM 555 CD2 HIS A 34 -0.834 -13.165 11.953 1.00 0.00 C ATOM 556 CE1 HIS A 34 0.009 -15.072 11.282 1.00 0.00 C ATOM 557 NE2 HIS A 34 0.032 -14.184 12.255 1.00 0.00 N ATOM 0 H HIS A 34 -2.251 -10.098 10.617 1.00 0.00 H new ATOM 0 HA HIS A 34 -0.761 -11.851 8.731 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -3.183 -12.311 10.509 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -2.811 -13.360 9.155 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -1.035 -12.294 12.559 1.00 0.00 H new ATOM 0 HE1 HIS A 34 0.590 -15.982 11.242 1.00 0.00 H new ATOM 0 HE2 HIS A 34 0.603 -14.245 13.098 1.00 0.00 H new ATOM 566 N GLY A 35 -2.382 -9.676 7.630 1.00 0.00 N ATOM 567 CA GLY A 35 -2.868 -9.074 6.371 1.00 0.00 C ATOM 568 C GLY A 35 -4.279 -8.503 6.438 1.00 0.00 C ATOM 569 O GLY A 35 -4.765 -7.933 5.455 1.00 0.00 O ATOM 0 H GLY A 35 -1.927 -9.009 8.253 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.183 -8.279 6.077 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -2.834 -9.830 5.587 1.00 0.00 H new ATOM 573 N GLY A 36 -4.909 -8.615 7.604 1.00 0.00 N ATOM 574 CA GLY A 36 -6.345 -8.391 7.748 1.00 0.00 C ATOM 575 C GLY A 36 -6.761 -6.984 8.123 1.00 0.00 C ATOM 576 O GLY A 36 -5.927 -6.116 8.410 1.00 0.00 O ATOM 0 H GLY A 36 -4.440 -8.863 8.475 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.830 -8.654 6.808 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.726 -9.076 8.506 1.00 0.00 H new ATOM 580 N LYS A 37 -8.094 -6.785 8.121 1.00 0.00 N ATOM 581 CA LYS A 37 -8.749 -5.506 8.442 1.00 0.00 C ATOM 582 C LYS A 37 -9.627 -5.675 9.692 1.00 0.00 C ATOM 583 O LYS A 37 -10.028 -6.793 10.044 1.00 0.00 O ATOM 584 CB LYS A 37 -9.610 -5.023 7.231 1.00 0.00 C ATOM 585 CG LYS A 37 -8.863 -5.006 5.878 1.00 0.00 C ATOM 586 CD LYS A 37 -7.649 -4.048 5.872 1.00 0.00 C ATOM 587 CE LYS A 37 -6.775 -4.220 4.623 1.00 0.00 C ATOM 588 NZ LYS A 37 -7.526 -3.985 3.363 1.00 0.00 N ATOM 0 H LYS A 37 -8.757 -7.525 7.891 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.987 -4.753 8.644 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.483 -5.670 7.141 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -9.978 -4.019 7.441 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.524 -6.015 5.643 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.556 -4.711 5.090 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.002 -3.018 5.926 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -7.045 -4.225 6.762 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -5.934 -3.529 4.675 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -6.359 -5.227 4.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -6.882 -4.081 2.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -8.293 -4.683 3.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -7.930 -3.027 3.373 1.00 0.00 H new ATOM 602 N PHE A 38 -9.936 -4.551 10.350 1.00 0.00 N ATOM 603 CA PHE A 38 -10.702 -4.523 11.608 1.00 0.00 C ATOM 604 C PHE A 38 -11.926 -3.605 11.486 1.00 0.00 C ATOM 605 O PHE A 38 -11.958 -2.689 10.650 1.00 0.00 O ATOM 606 CB PHE A 38 -9.784 -4.092 12.793 1.00 0.00 C ATOM 607 CG PHE A 38 -8.941 -2.842 12.538 1.00 0.00 C ATOM 608 CD1 PHE A 38 -7.701 -2.952 11.917 1.00 0.00 C ATOM 609 CD2 PHE A 38 -9.381 -1.573 12.905 1.00 0.00 C ATOM 610 CE1 PHE A 38 -6.925 -1.837 11.667 1.00 0.00 C ATOM 611 CE2 PHE A 38 -8.604 -0.456 12.657 1.00 0.00 C ATOM 612 CZ PHE A 38 -7.377 -0.588 12.036 1.00 0.00 C ATOM 0 H PHE A 38 -9.660 -3.625 10.023 1.00 0.00 H new ATOM 0 HA PHE A 38 -11.068 -5.529 11.812 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -10.407 -3.919 13.671 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -9.116 -4.919 13.034 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -7.339 -3.927 11.625 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -10.340 -1.460 13.389 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -5.965 -1.944 11.183 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -8.957 0.522 12.950 1.00 0.00 H new ATOM 0 HZ PHE A 38 -6.773 0.286 11.840 1.00 0.00 H new ATOM 622 N LEU A 39 -12.925 -3.869 12.341 1.00 0.00 N ATOM 623 CA LEU A 39 -14.203 -3.149 12.369 1.00 0.00 C ATOM 624 C LEU A 39 -14.532 -2.824 13.841 1.00 0.00 C ATOM 625 O LEU A 39 -14.474 -3.710 14.707 1.00 0.00 O ATOM 626 CB LEU A 39 -15.303 -4.027 11.673 1.00 0.00 C ATOM 627 CG LEU A 39 -16.631 -3.331 11.200 1.00 0.00 C ATOM 628 CD1 LEU A 39 -17.588 -3.018 12.363 1.00 0.00 C ATOM 629 CD2 LEU A 39 -16.332 -2.071 10.362 1.00 0.00 C ATOM 0 H LEU A 39 -12.864 -4.604 13.046 1.00 0.00 H new ATOM 0 HA LEU A 39 -14.155 -2.209 11.819 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -14.848 -4.499 10.802 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -15.575 -4.826 12.363 1.00 0.00 H new ATOM 0 HG LEU A 39 -17.148 -4.048 10.562 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -18.487 -2.538 11.976 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -17.860 -3.944 12.869 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -17.096 -2.349 13.069 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -17.269 -1.611 10.049 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -15.762 -1.362 10.962 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -15.752 -2.349 9.482 1.00 0.00 H new ATOM 641 N HIS A 40 -14.852 -1.541 14.105 1.00 0.00 N ATOM 642 CA HIS A 40 -15.057 -1.006 15.470 1.00 0.00 C ATOM 643 C HIS A 40 -16.450 -1.333 16.060 1.00 0.00 C ATOM 644 O HIS A 40 -16.555 -1.742 17.228 1.00 0.00 O ATOM 645 CB HIS A 40 -14.784 0.540 15.497 1.00 0.00 C ATOM 646 CG HIS A 40 -15.418 1.379 14.390 1.00 0.00 C ATOM 647 ND1 HIS A 40 -16.567 1.244 13.663 1.00 0.00 N flip ATOM 648 CD2 HIS A 40 -14.837 2.548 13.938 1.00 0.00 C flip ATOM 649 CE1 HIS A 40 -16.639 2.313 12.809 1.00 0.00 C flip ATOM 650 NE2 HIS A 40 -15.585 3.082 12.996 1.00 0.00 N flip ATOM 0 H HIS A 40 -14.977 -0.841 13.374 1.00 0.00 H new ATOM 0 HA HIS A 40 -14.336 -1.511 16.112 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -15.130 0.928 16.455 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -13.705 0.693 15.462 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -13.908 2.962 14.303 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -17.431 2.496 12.098 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -15.383 3.947 12.494 1.00 0.00 H new ATOM 659 N TYR A 41 -17.499 -1.184 15.232 1.00 0.00 N ATOM 660 CA TYR A 41 -18.908 -1.247 15.661 1.00 0.00 C ATOM 661 C TYR A 41 -19.831 -1.150 14.431 1.00 0.00 C ATOM 662 O TYR A 41 -19.505 -0.453 13.461 1.00 0.00 O ATOM 663 CB TYR A 41 -19.231 -0.113 16.676 1.00 0.00 C ATOM 664 CG TYR A 41 -20.652 -0.171 17.251 1.00 0.00 C ATOM 665 CD1 TYR A 41 -21.022 -1.184 18.139 1.00 0.00 C ATOM 666 CD2 TYR A 41 -21.625 0.769 16.898 1.00 0.00 C ATOM 667 CE1 TYR A 41 -22.303 -1.254 18.650 1.00 0.00 C ATOM 668 CE2 TYR A 41 -22.909 0.701 17.413 1.00 0.00 C ATOM 669 CZ TYR A 41 -23.245 -0.311 18.287 1.00 0.00 C ATOM 670 OH TYR A 41 -24.530 -0.386 18.795 1.00 0.00 O ATOM 0 H TYR A 41 -17.391 -1.014 14.232 1.00 0.00 H new ATOM 0 HA TYR A 41 -19.078 -2.201 16.160 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -18.516 -0.161 17.498 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -19.088 0.850 16.186 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -20.293 -1.926 18.431 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -21.371 1.563 16.211 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -22.569 -2.047 19.334 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -23.645 1.439 17.131 1.00 0.00 H new ATOM 0 HH TYR A 41 -25.066 0.354 18.440 1.00 0.00 H new ATOM 680 N LEU A 42 -20.982 -1.848 14.487 1.00 0.00 N ATOM 681 CA LEU A 42 -21.972 -1.867 13.396 1.00 0.00 C ATOM 682 C LEU A 42 -22.969 -0.711 13.563 1.00 0.00 C ATOM 683 O LEU A 42 -23.889 -0.792 14.378 1.00 0.00 O ATOM 684 CB LEU A 42 -22.746 -3.227 13.323 1.00 0.00 C ATOM 685 CG LEU A 42 -21.936 -4.483 12.876 1.00 0.00 C ATOM 686 CD1 LEU A 42 -21.244 -4.243 11.526 1.00 0.00 C ATOM 687 CD2 LEU A 42 -20.924 -4.915 13.945 1.00 0.00 C ATOM 0 H LEU A 42 -21.250 -2.415 15.292 1.00 0.00 H new ATOM 0 HA LEU A 42 -21.423 -1.748 12.462 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -23.168 -3.429 14.308 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -23.584 -3.103 12.637 1.00 0.00 H new ATOM 0 HG LEU A 42 -22.646 -5.300 12.751 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -20.687 -5.135 11.239 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -21.994 -4.024 10.766 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -20.559 -3.400 11.613 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -20.379 -5.793 13.597 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -20.222 -4.102 14.131 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -21.451 -5.157 14.868 1.00 0.00 H new ATOM 699 N SER A 43 -22.722 0.387 12.842 1.00 0.00 N ATOM 700 CA SER A 43 -23.717 1.446 12.619 1.00 0.00 C ATOM 701 C SER A 43 -24.495 1.145 11.318 1.00 0.00 C ATOM 702 O SER A 43 -25.636 1.594 11.139 1.00 0.00 O ATOM 703 CB SER A 43 -23.016 2.822 12.532 1.00 0.00 C ATOM 704 OG SER A 43 -23.946 3.890 12.416 1.00 0.00 O ATOM 0 H SER A 43 -21.824 0.569 12.394 1.00 0.00 H new ATOM 0 HA SER A 43 -24.418 1.475 13.454 1.00 0.00 H new ATOM 0 HB2 SER A 43 -22.402 2.972 13.420 1.00 0.00 H new ATOM 0 HB3 SER A 43 -22.344 2.832 11.674 1.00 0.00 H new ATOM 0 HG SER A 43 -23.462 4.741 12.365 1.00 0.00 H new ATOM 710 N SER A 44 -23.856 0.370 10.418 1.00 0.00 N ATOM 711 CA SER A 44 -24.417 0.000 9.105 1.00 0.00 C ATOM 712 C SER A 44 -24.068 -1.456 8.752 1.00 0.00 C ATOM 713 O SER A 44 -23.169 -2.055 9.363 1.00 0.00 O ATOM 714 CB SER A 44 -23.887 0.963 8.015 1.00 0.00 C ATOM 715 OG SER A 44 -24.244 2.310 8.298 1.00 0.00 O ATOM 0 H SER A 44 -22.928 -0.019 10.585 1.00 0.00 H new ATOM 0 HA SER A 44 -25.503 0.084 9.155 1.00 0.00 H new ATOM 0 HB2 SER A 44 -22.802 0.878 7.948 1.00 0.00 H new ATOM 0 HB3 SER A 44 -24.290 0.674 7.044 1.00 0.00 H new ATOM 0 HG SER A 44 -23.895 2.896 7.594 1.00 0.00 H new ATOM 721 N LYS A 45 -24.794 -2.014 7.760 1.00 0.00 N ATOM 722 CA LYS A 45 -24.550 -3.376 7.243 1.00 0.00 C ATOM 723 C LYS A 45 -23.442 -3.381 6.170 1.00 0.00 C ATOM 724 O LYS A 45 -23.042 -2.320 5.677 1.00 0.00 O ATOM 725 CB LYS A 45 -25.854 -3.999 6.663 1.00 0.00 C ATOM 726 CG LYS A 45 -26.978 -4.247 7.701 1.00 0.00 C ATOM 727 CD LYS A 45 -28.162 -5.066 7.123 1.00 0.00 C ATOM 728 CE LYS A 45 -27.736 -6.480 6.673 1.00 0.00 C ATOM 729 NZ LYS A 45 -28.877 -7.276 6.154 1.00 0.00 N ATOM 0 H LYS A 45 -25.565 -1.533 7.296 1.00 0.00 H new ATOM 0 HA LYS A 45 -24.217 -3.984 8.084 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -26.238 -3.341 5.884 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -25.605 -4.947 6.186 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -26.563 -4.774 8.560 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -27.349 -3.288 8.064 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -28.945 -5.148 7.876 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -28.590 -4.531 6.275 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -26.972 -6.398 5.900 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -27.283 -7.005 7.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -28.741 -8.278 6.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -29.762 -6.933 6.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -28.928 -7.176 5.120 1.00 0.00 H new ATOM 743 N LYS A 46 -22.952 -4.605 5.846 1.00 0.00 N ATOM 744 CA LYS A 46 -21.905 -4.859 4.811 1.00 0.00 C ATOM 745 C LYS A 46 -20.519 -4.310 5.213 1.00 0.00 C ATOM 746 O LYS A 46 -19.566 -4.420 4.434 1.00 0.00 O ATOM 747 CB LYS A 46 -22.318 -4.318 3.394 1.00 0.00 C ATOM 748 CG LYS A 46 -23.268 -5.226 2.578 1.00 0.00 C ATOM 749 CD LYS A 46 -24.613 -5.505 3.279 1.00 0.00 C ATOM 750 CE LYS A 46 -25.583 -6.293 2.390 1.00 0.00 C ATOM 751 NZ LYS A 46 -24.981 -7.559 1.889 1.00 0.00 N ATOM 0 H LYS A 46 -23.275 -5.459 6.301 1.00 0.00 H new ATOM 0 HA LYS A 46 -21.823 -5.944 4.746 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -22.795 -3.346 3.522 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -21.412 -4.154 2.810 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -23.462 -4.759 1.612 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -22.768 -6.174 2.379 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -24.432 -6.063 4.198 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -25.073 -4.559 3.565 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -26.488 -6.521 2.954 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -25.882 -5.675 1.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -25.706 -8.115 1.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -24.204 -7.338 1.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -24.611 -8.109 2.691 1.00 0.00 H new ATOM 765 N THR A 47 -20.398 -3.763 6.433 1.00 0.00 N ATOM 766 CA THR A 47 -19.169 -3.102 6.898 1.00 0.00 C ATOM 767 C THR A 47 -18.156 -4.131 7.441 1.00 0.00 C ATOM 768 O THR A 47 -16.956 -3.841 7.543 1.00 0.00 O ATOM 769 CB THR A 47 -19.505 -2.038 7.987 1.00 0.00 C ATOM 770 OG1 THR A 47 -20.141 -2.675 9.101 1.00 0.00 O ATOM 771 CG2 THR A 47 -20.434 -0.939 7.434 1.00 0.00 C ATOM 0 H THR A 47 -21.149 -3.767 7.124 1.00 0.00 H new ATOM 0 HA THR A 47 -18.712 -2.599 6.046 1.00 0.00 H new ATOM 0 HB THR A 47 -18.571 -1.572 8.301 1.00 0.00 H new ATOM 0 HG1 THR A 47 -21.087 -2.419 9.128 1.00 0.00 H new ATOM 0 HG21 THR A 47 -20.648 -0.214 8.219 1.00 0.00 H new ATOM 0 HG22 THR A 47 -19.946 -0.436 6.599 1.00 0.00 H new ATOM 0 HG23 THR A 47 -21.366 -1.389 7.092 1.00 0.00 H new ATOM 779 N VAL A 48 -18.655 -5.339 7.773 1.00 0.00 N ATOM 780 CA VAL A 48 -17.823 -6.463 8.231 1.00 0.00 C ATOM 781 C VAL A 48 -18.285 -7.767 7.552 1.00 0.00 C ATOM 782 O VAL A 48 -19.424 -7.847 7.086 1.00 0.00 O ATOM 783 CB VAL A 48 -17.877 -6.604 9.800 1.00 0.00 C ATOM 784 CG1 VAL A 48 -19.231 -7.157 10.316 1.00 0.00 C ATOM 785 CG2 VAL A 48 -16.703 -7.446 10.314 1.00 0.00 C ATOM 0 H VAL A 48 -19.650 -5.560 7.730 1.00 0.00 H new ATOM 0 HA VAL A 48 -16.788 -6.265 7.951 1.00 0.00 H new ATOM 0 HB VAL A 48 -17.787 -5.596 10.205 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -19.204 -7.230 11.403 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -20.036 -6.485 10.018 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -19.407 -8.145 9.890 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -16.762 -7.529 11.399 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -16.747 -8.441 9.871 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -15.763 -6.967 10.037 1.00 0.00 H new ATOM 795 N THR A 49 -17.387 -8.768 7.461 1.00 0.00 N ATOM 796 CA THR A 49 -17.714 -10.112 6.932 1.00 0.00 C ATOM 797 C THR A 49 -17.593 -11.190 8.035 1.00 0.00 C ATOM 798 O THR A 49 -18.238 -12.237 7.954 1.00 0.00 O ATOM 799 CB THR A 49 -16.815 -10.470 5.693 1.00 0.00 C ATOM 800 OG1 THR A 49 -17.054 -11.819 5.252 1.00 0.00 O ATOM 801 CG2 THR A 49 -15.324 -10.294 5.992 1.00 0.00 C ATOM 0 H THR A 49 -16.414 -8.670 7.751 1.00 0.00 H new ATOM 0 HA THR A 49 -18.751 -10.092 6.596 1.00 0.00 H new ATOM 0 HB THR A 49 -17.091 -9.774 4.901 1.00 0.00 H new ATOM 0 HG1 THR A 49 -16.484 -12.017 4.480 1.00 0.00 H new ATOM 0 HG21 THR A 49 -14.742 -10.553 5.107 1.00 0.00 H new ATOM 0 HG22 THR A 49 -15.128 -9.257 6.265 1.00 0.00 H new ATOM 0 HG23 THR A 49 -15.039 -10.947 6.817 1.00 0.00 H new ATOM 809 N HIS A 50 -16.763 -10.934 9.070 1.00 0.00 N ATOM 810 CA HIS A 50 -16.536 -11.896 10.182 1.00 0.00 C ATOM 811 C HIS A 50 -16.641 -11.192 11.531 1.00 0.00 C ATOM 812 O HIS A 50 -16.015 -10.166 11.737 1.00 0.00 O ATOM 813 CB HIS A 50 -15.148 -12.587 10.066 1.00 0.00 C ATOM 814 CG HIS A 50 -15.045 -13.568 8.935 1.00 0.00 C ATOM 815 ND1 HIS A 50 -14.742 -13.397 7.631 1.00 0.00 N flip ATOM 816 CD2 HIS A 50 -15.270 -14.913 9.090 1.00 0.00 C flip ATOM 817 CE1 HIS A 50 -14.793 -14.618 7.035 1.00 0.00 C flip ATOM 818 NE2 HIS A 50 -15.110 -15.510 7.934 1.00 0.00 N flip ATOM 0 H HIS A 50 -16.235 -10.066 9.162 1.00 0.00 H new ATOM 0 HA HIS A 50 -17.309 -12.661 10.110 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -14.382 -11.822 9.940 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -14.932 -13.103 11.001 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -15.536 -15.401 10.016 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -14.603 -14.817 5.991 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -15.216 -16.510 7.764 1.00 0.00 H new ATOM 827 N ILE A 51 -17.426 -11.765 12.450 1.00 0.00 N ATOM 828 CA ILE A 51 -17.550 -11.261 13.829 1.00 0.00 C ATOM 829 C ILE A 51 -16.989 -12.314 14.786 1.00 0.00 C ATOM 830 O ILE A 51 -17.255 -13.496 14.625 1.00 0.00 O ATOM 831 CB ILE A 51 -19.045 -10.926 14.186 1.00 0.00 C ATOM 832 CG1 ILE A 51 -19.583 -9.791 13.248 1.00 0.00 C ATOM 833 CG2 ILE A 51 -19.221 -10.562 15.687 1.00 0.00 C ATOM 834 CD1 ILE A 51 -21.028 -9.377 13.488 1.00 0.00 C ATOM 0 H ILE A 51 -17.994 -12.591 12.262 1.00 0.00 H new ATOM 0 HA ILE A 51 -16.984 -10.334 13.923 1.00 0.00 H new ATOM 0 HB ILE A 51 -19.640 -11.824 14.017 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -18.947 -8.914 13.366 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -19.484 -10.120 12.214 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -20.269 -10.338 15.887 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -18.905 -11.403 16.305 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -18.612 -9.689 15.924 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -21.301 -8.587 12.788 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -21.682 -10.236 13.339 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -21.137 -9.011 14.509 1.00 0.00 H new ATOM 846 N VAL A 52 -16.190 -11.875 15.756 1.00 0.00 N ATOM 847 CA VAL A 52 -15.645 -12.731 16.806 1.00 0.00 C ATOM 848 C VAL A 52 -16.604 -12.695 17.992 1.00 0.00 C ATOM 849 O VAL A 52 -17.008 -11.615 18.430 1.00 0.00 O ATOM 850 CB VAL A 52 -14.222 -12.250 17.261 1.00 0.00 C ATOM 851 CG1 VAL A 52 -13.667 -13.107 18.416 1.00 0.00 C ATOM 852 CG2 VAL A 52 -13.239 -12.231 16.075 1.00 0.00 C ATOM 0 H VAL A 52 -15.899 -10.901 15.835 1.00 0.00 H new ATOM 0 HA VAL A 52 -15.540 -13.745 16.421 1.00 0.00 H new ATOM 0 HB VAL A 52 -14.332 -11.231 17.633 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -12.681 -12.740 18.700 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -14.339 -13.042 19.272 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -13.589 -14.145 18.094 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -12.261 -11.894 16.418 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -13.151 -13.235 15.659 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -13.608 -11.551 15.307 1.00 0.00 H new ATOM 862 N ALA A 53 -16.985 -13.869 18.478 1.00 0.00 N ATOM 863 CA ALA A 53 -17.821 -14.013 19.665 1.00 0.00 C ATOM 864 C ALA A 53 -17.422 -15.295 20.397 1.00 0.00 C ATOM 865 O ALA A 53 -16.999 -16.269 19.766 1.00 0.00 O ATOM 866 CB ALA A 53 -19.314 -14.021 19.280 1.00 0.00 C ATOM 0 H ALA A 53 -16.720 -14.759 18.055 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.668 -13.164 20.331 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -19.921 -14.129 20.179 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -19.566 -13.085 18.782 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -19.512 -14.855 18.606 1.00 0.00 H new ATOM 872 N SER A 54 -17.504 -15.273 21.730 1.00 0.00 N ATOM 873 CA SER A 54 -17.347 -16.481 22.551 1.00 0.00 C ATOM 874 C SER A 54 -18.729 -17.138 22.700 1.00 0.00 C ATOM 875 O SER A 54 -18.867 -18.364 22.642 1.00 0.00 O ATOM 876 CB SER A 54 -16.731 -16.125 23.919 1.00 0.00 C ATOM 877 OG SER A 54 -16.502 -17.283 24.707 1.00 0.00 O ATOM 0 H SER A 54 -17.680 -14.425 22.269 1.00 0.00 H new ATOM 0 HA SER A 54 -16.665 -17.185 22.073 1.00 0.00 H new ATOM 0 HB2 SER A 54 -15.790 -15.595 23.768 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.397 -15.447 24.453 1.00 0.00 H new ATOM 0 HG SER A 54 -16.110 -17.022 25.566 1.00 0.00 H new ATOM 883 N ASN A 55 -19.747 -16.280 22.864 1.00 0.00 N ATOM 884 CA ASN A 55 -21.169 -16.659 22.835 1.00 0.00 C ATOM 885 C ASN A 55 -21.959 -15.518 22.168 1.00 0.00 C ATOM 886 O ASN A 55 -21.671 -14.336 22.406 1.00 0.00 O ATOM 887 CB ASN A 55 -21.700 -16.928 24.275 1.00 0.00 C ATOM 888 CG ASN A 55 -23.187 -17.337 24.339 1.00 0.00 C ATOM 889 OD1 ASN A 55 -23.726 -17.960 23.415 1.00 0.00 O ATOM 890 ND2 ASN A 55 -23.859 -16.986 25.433 1.00 0.00 N ATOM 0 H ASN A 55 -19.603 -15.283 23.024 1.00 0.00 H new ATOM 0 HA ASN A 55 -21.294 -17.580 22.266 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -21.099 -17.716 24.730 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -21.556 -16.030 24.876 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -24.845 -17.230 25.526 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -23.388 -16.473 26.178 1.00 0.00 H new ATOM 897 N LEU A 56 -22.937 -15.878 21.330 1.00 0.00 N ATOM 898 CA LEU A 56 -23.808 -14.914 20.635 1.00 0.00 C ATOM 899 C LEU A 56 -25.278 -15.317 20.893 1.00 0.00 C ATOM 900 O LEU A 56 -25.611 -16.492 20.697 1.00 0.00 O ATOM 901 CB LEU A 56 -23.502 -14.903 19.103 1.00 0.00 C ATOM 902 CG LEU A 56 -24.189 -13.758 18.284 1.00 0.00 C ATOM 903 CD1 LEU A 56 -23.614 -12.371 18.660 1.00 0.00 C ATOM 904 CD2 LEU A 56 -24.091 -14.003 16.763 1.00 0.00 C ATOM 0 H LEU A 56 -23.151 -16.851 21.111 1.00 0.00 H new ATOM 0 HA LEU A 56 -23.626 -13.908 21.014 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -22.423 -14.826 18.967 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -23.809 -15.861 18.682 1.00 0.00 H new ATOM 0 HG LEU A 56 -25.246 -13.766 18.550 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -24.113 -11.599 18.073 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -23.779 -12.184 19.721 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -22.544 -12.352 18.451 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -24.579 -13.187 16.231 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -23.042 -14.052 16.469 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -24.582 -14.944 16.514 1.00 0.00 H new ATOM 916 N PRO A 57 -26.170 -14.370 21.366 1.00 0.00 N ATOM 917 CA PRO A 57 -27.613 -14.662 21.613 1.00 0.00 C ATOM 918 C PRO A 57 -28.340 -15.145 20.339 1.00 0.00 C ATOM 919 O PRO A 57 -27.970 -14.732 19.241 1.00 0.00 O ATOM 920 CB PRO A 57 -28.185 -13.298 22.104 1.00 0.00 C ATOM 921 CG PRO A 57 -26.987 -12.542 22.596 1.00 0.00 C ATOM 922 CD PRO A 57 -25.842 -12.962 21.707 1.00 0.00 C ATOM 0 HA PRO A 57 -27.750 -15.469 22.332 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -28.687 -12.765 21.297 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -28.919 -13.438 22.898 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -27.153 -11.466 22.538 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -26.778 -12.777 23.640 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -25.775 -12.338 20.816 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -24.884 -12.886 22.222 1.00 0.00 H new ATOM 930 N LEU A 58 -29.379 -15.986 20.510 1.00 0.00 N ATOM 931 CA LEU A 58 -30.136 -16.607 19.393 1.00 0.00 C ATOM 932 C LEU A 58 -30.727 -15.536 18.451 1.00 0.00 C ATOM 933 O LEU A 58 -30.704 -15.686 17.219 1.00 0.00 O ATOM 934 CB LEU A 58 -31.267 -17.511 19.957 1.00 0.00 C ATOM 935 CG LEU A 58 -30.824 -18.641 20.943 1.00 0.00 C ATOM 936 CD1 LEU A 58 -32.041 -19.462 21.430 1.00 0.00 C ATOM 937 CD2 LEU A 58 -29.742 -19.552 20.312 1.00 0.00 C ATOM 0 H LEU A 58 -29.723 -16.258 21.431 1.00 0.00 H new ATOM 0 HA LEU A 58 -29.444 -17.217 18.812 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -31.990 -16.875 20.468 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -31.786 -17.974 19.117 1.00 0.00 H new ATOM 0 HG LEU A 58 -30.376 -18.163 21.814 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -31.704 -20.241 22.114 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -32.741 -18.804 21.945 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -32.537 -19.920 20.574 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -29.457 -20.326 21.025 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -30.139 -20.017 19.410 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -28.867 -18.954 20.057 1.00 0.00 H new ATOM 949 N LYS A 59 -31.223 -14.450 19.063 1.00 0.00 N ATOM 950 CA LYS A 59 -31.796 -13.296 18.344 1.00 0.00 C ATOM 951 C LYS A 59 -30.727 -12.631 17.458 1.00 0.00 C ATOM 952 O LYS A 59 -30.973 -12.296 16.295 1.00 0.00 O ATOM 953 CB LYS A 59 -32.356 -12.275 19.368 1.00 0.00 C ATOM 954 CG LYS A 59 -33.418 -12.865 20.328 1.00 0.00 C ATOM 955 CD LYS A 59 -33.868 -11.871 21.422 1.00 0.00 C ATOM 956 CE LYS A 59 -34.849 -12.500 22.431 1.00 0.00 C ATOM 957 NZ LYS A 59 -35.270 -11.533 23.475 1.00 0.00 N ATOM 0 H LYS A 59 -31.239 -14.345 20.077 1.00 0.00 H new ATOM 0 HA LYS A 59 -32.606 -13.642 17.702 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -31.530 -11.876 19.957 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -32.796 -11.437 18.827 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -34.288 -13.177 19.750 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -33.013 -13.759 20.803 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -32.992 -11.503 21.955 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -34.340 -11.009 20.951 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -35.728 -12.867 21.901 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -34.379 -13.362 22.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -35.929 -11.997 24.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -34.435 -11.202 23.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -35.742 -10.722 23.027 1.00 0.00 H new ATOM 971 N LYS A 60 -29.529 -12.482 18.034 1.00 0.00 N ATOM 972 CA LYS A 60 -28.381 -11.839 17.374 1.00 0.00 C ATOM 973 C LYS A 60 -27.725 -12.773 16.341 1.00 0.00 C ATOM 974 O LYS A 60 -27.013 -12.299 15.466 1.00 0.00 O ATOM 975 CB LYS A 60 -27.356 -11.375 18.435 1.00 0.00 C ATOM 976 CG LYS A 60 -27.903 -10.308 19.411 1.00 0.00 C ATOM 977 CD LYS A 60 -28.238 -8.973 18.704 1.00 0.00 C ATOM 978 CE LYS A 60 -28.890 -7.946 19.645 1.00 0.00 C ATOM 979 NZ LYS A 60 -28.057 -7.683 20.848 1.00 0.00 N ATOM 0 H LYS A 60 -29.324 -12.806 18.979 1.00 0.00 H new ATOM 0 HA LYS A 60 -28.744 -10.967 16.830 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -27.024 -12.241 19.008 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -26.479 -10.973 17.927 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -28.799 -10.692 19.899 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -27.167 -10.126 20.194 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -27.324 -8.549 18.288 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -28.908 -9.169 17.867 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -29.052 -7.013 19.106 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -29.870 -8.310 19.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -28.482 -6.913 21.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -28.007 -8.543 21.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -27.098 -7.408 20.553 1.00 0.00 H new ATOM 993 N ARG A 61 -27.947 -14.097 16.461 1.00 0.00 N ATOM 994 CA ARG A 61 -27.519 -15.071 15.427 1.00 0.00 C ATOM 995 C ARG A 61 -28.317 -14.838 14.138 1.00 0.00 C ATOM 996 O ARG A 61 -27.760 -14.894 13.043 1.00 0.00 O ATOM 997 CB ARG A 61 -27.696 -16.542 15.899 1.00 0.00 C ATOM 998 CG ARG A 61 -26.855 -16.922 17.138 1.00 0.00 C ATOM 999 CD ARG A 61 -27.071 -18.381 17.581 1.00 0.00 C ATOM 1000 NE ARG A 61 -26.487 -18.648 18.911 1.00 0.00 N ATOM 1001 CZ ARG A 61 -25.967 -19.812 19.311 1.00 0.00 C ATOM 1002 NH1 ARG A 61 -25.859 -20.835 18.475 1.00 0.00 N ATOM 1003 NH2 ARG A 61 -25.542 -19.943 20.558 1.00 0.00 N ATOM 0 H ARG A 61 -28.419 -14.520 17.260 1.00 0.00 H new ATOM 0 HA ARG A 61 -26.456 -14.913 15.243 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -28.749 -16.714 16.123 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -27.432 -17.208 15.078 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -25.799 -16.767 16.916 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -27.109 -16.255 17.962 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -28.139 -18.599 17.604 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -26.624 -19.052 16.848 1.00 0.00 H new ATOM 0 HE ARG A 61 -26.480 -17.879 19.581 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -26.175 -20.741 17.510 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -25.460 -21.717 18.797 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -25.613 -19.158 21.206 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -25.144 -20.828 20.871 1.00 0.00 H new ATOM 1017 N ILE A 62 -29.628 -14.577 14.297 1.00 0.00 N ATOM 1018 CA ILE A 62 -30.531 -14.260 13.168 1.00 0.00 C ATOM 1019 C ILE A 62 -30.134 -12.919 12.507 1.00 0.00 C ATOM 1020 O ILE A 62 -30.097 -12.800 11.272 1.00 0.00 O ATOM 1021 CB ILE A 62 -32.036 -14.199 13.639 1.00 0.00 C ATOM 1022 CG1 ILE A 62 -32.452 -15.544 14.319 1.00 0.00 C ATOM 1023 CG2 ILE A 62 -32.988 -13.857 12.466 1.00 0.00 C ATOM 1024 CD1 ILE A 62 -33.890 -15.597 14.818 1.00 0.00 C ATOM 0 H ILE A 62 -30.092 -14.579 15.205 1.00 0.00 H new ATOM 0 HA ILE A 62 -30.430 -15.060 12.434 1.00 0.00 H new ATOM 0 HB ILE A 62 -32.122 -13.398 14.373 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -32.301 -16.355 13.607 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -31.785 -15.730 15.161 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -34.015 -13.824 12.829 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -32.719 -12.886 12.050 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -32.901 -14.620 11.692 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -34.082 -16.569 15.273 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -34.047 -14.812 15.558 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -34.571 -15.448 13.980 1.00 0.00 H new ATOM 1036 N GLU A 63 -29.837 -11.927 13.352 1.00 0.00 N ATOM 1037 CA GLU A 63 -29.455 -10.570 12.914 1.00 0.00 C ATOM 1038 C GLU A 63 -28.087 -10.573 12.207 1.00 0.00 C ATOM 1039 O GLU A 63 -27.914 -9.945 11.156 1.00 0.00 O ATOM 1040 CB GLU A 63 -29.451 -9.614 14.134 1.00 0.00 C ATOM 1041 CG GLU A 63 -30.856 -9.363 14.728 1.00 0.00 C ATOM 1042 CD GLU A 63 -30.846 -8.535 16.025 1.00 0.00 C ATOM 1043 OE1 GLU A 63 -30.334 -7.391 16.006 1.00 0.00 O ATOM 1044 OE2 GLU A 63 -31.347 -9.019 17.067 1.00 0.00 O ATOM 0 H GLU A 63 -29.853 -12.038 14.366 1.00 0.00 H new ATOM 0 HA GLU A 63 -30.188 -10.217 12.189 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -28.807 -10.030 14.909 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -29.016 -8.660 13.836 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -31.467 -8.850 13.986 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -31.333 -10.323 14.925 1.00 0.00 H new ATOM 1051 N PHE A 64 -27.136 -11.325 12.767 1.00 0.00 N ATOM 1052 CA PHE A 64 -25.757 -11.413 12.251 1.00 0.00 C ATOM 1053 C PHE A 64 -25.565 -12.704 11.426 1.00 0.00 C ATOM 1054 O PHE A 64 -24.437 -13.160 11.245 1.00 0.00 O ATOM 1055 CB PHE A 64 -24.734 -11.342 13.426 1.00 0.00 C ATOM 1056 CG PHE A 64 -24.782 -10.053 14.262 1.00 0.00 C ATOM 1057 CD1 PHE A 64 -24.770 -8.799 13.653 1.00 0.00 C ATOM 1058 CD2 PHE A 64 -24.814 -10.097 15.659 1.00 0.00 C ATOM 1059 CE1 PHE A 64 -24.796 -7.637 14.406 1.00 0.00 C ATOM 1060 CE2 PHE A 64 -24.841 -8.935 16.412 1.00 0.00 C ATOM 1061 CZ PHE A 64 -24.832 -7.705 15.785 1.00 0.00 C ATOM 0 H PHE A 64 -27.297 -11.896 13.597 1.00 0.00 H new ATOM 0 HA PHE A 64 -25.578 -10.565 11.591 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -24.906 -12.191 14.087 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -23.729 -11.454 13.018 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -24.740 -8.733 12.575 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -24.818 -11.054 16.160 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -24.788 -6.676 13.914 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -24.869 -8.991 17.490 1.00 0.00 H new ATOM 0 HZ PHE A 64 -24.853 -6.798 16.371 1.00 0.00 H new ATOM 1071 N ALA A 65 -26.681 -13.260 10.895 1.00 0.00 N ATOM 1072 CA ALA A 65 -26.657 -14.442 9.990 1.00 0.00 C ATOM 1073 C ALA A 65 -25.982 -14.106 8.643 1.00 0.00 C ATOM 1074 O ALA A 65 -25.420 -14.980 7.972 1.00 0.00 O ATOM 1075 CB ALA A 65 -28.085 -14.956 9.750 1.00 0.00 C ATOM 0 H ALA A 65 -27.620 -12.906 11.079 1.00 0.00 H new ATOM 0 HA ALA A 65 -26.071 -15.223 10.475 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -28.054 -15.820 9.087 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -28.533 -15.244 10.701 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -28.683 -14.168 9.292 1.00 0.00 H new ATOM 1081 N ASN A 66 -26.060 -12.819 8.265 1.00 0.00 N ATOM 1082 CA ASN A 66 -25.442 -12.281 7.033 1.00 0.00 C ATOM 1083 C ASN A 66 -23.907 -12.225 7.157 1.00 0.00 C ATOM 1084 O ASN A 66 -23.196 -12.146 6.148 1.00 0.00 O ATOM 1085 CB ASN A 66 -26.014 -10.868 6.741 1.00 0.00 C ATOM 1086 CG ASN A 66 -27.530 -10.852 6.495 1.00 0.00 C ATOM 1087 OD1 ASN A 66 -28.227 -9.924 6.921 1.00 0.00 O ATOM 1088 ND2 ASN A 66 -28.053 -11.837 5.766 1.00 0.00 N ATOM 0 H ASN A 66 -26.557 -12.113 8.808 1.00 0.00 H new ATOM 0 HA ASN A 66 -25.682 -12.947 6.204 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -25.785 -10.213 7.581 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -25.509 -10.455 5.868 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -29.049 -11.836 5.548 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -27.457 -12.592 5.426 1.00 0.00 H new ATOM 1095 N TYR A 67 -23.410 -12.261 8.408 1.00 0.00 N ATOM 1096 CA TYR A 67 -21.972 -12.228 8.721 1.00 0.00 C ATOM 1097 C TYR A 67 -21.535 -13.606 9.229 1.00 0.00 C ATOM 1098 O TYR A 67 -22.302 -14.301 9.909 1.00 0.00 O ATOM 1099 CB TYR A 67 -21.685 -11.152 9.802 1.00 0.00 C ATOM 1100 CG TYR A 67 -22.341 -9.790 9.507 1.00 0.00 C ATOM 1101 CD1 TYR A 67 -21.990 -9.046 8.377 1.00 0.00 C ATOM 1102 CD2 TYR A 67 -23.323 -9.264 10.347 1.00 0.00 C ATOM 1103 CE1 TYR A 67 -22.590 -7.833 8.106 1.00 0.00 C ATOM 1104 CE2 TYR A 67 -23.922 -8.049 10.078 1.00 0.00 C ATOM 1105 CZ TYR A 67 -23.553 -7.341 8.956 1.00 0.00 C ATOM 1106 OH TYR A 67 -24.149 -6.136 8.681 1.00 0.00 O ATOM 0 H TYR A 67 -24.003 -12.314 9.236 1.00 0.00 H new ATOM 0 HA TYR A 67 -21.412 -11.976 7.820 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -22.039 -11.515 10.767 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -20.607 -11.015 9.889 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -21.236 -9.427 7.704 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -23.621 -9.818 11.225 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -22.304 -7.272 7.229 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -24.676 -7.656 10.744 1.00 0.00 H new ATOM 0 HH TYR A 67 -24.039 -5.534 9.447 1.00 0.00 H new ATOM 1116 N LYS A 68 -20.314 -14.016 8.874 1.00 0.00 N ATOM 1117 CA LYS A 68 -19.719 -15.257 9.386 1.00 0.00 C ATOM 1118 C LYS A 68 -19.211 -14.998 10.814 1.00 0.00 C ATOM 1119 O LYS A 68 -18.049 -14.610 11.019 1.00 0.00 O ATOM 1120 CB LYS A 68 -18.564 -15.752 8.455 1.00 0.00 C ATOM 1121 CG LYS A 68 -18.963 -16.399 7.086 1.00 0.00 C ATOM 1122 CD LYS A 68 -19.753 -15.469 6.115 1.00 0.00 C ATOM 1123 CE LYS A 68 -21.287 -15.633 6.227 1.00 0.00 C ATOM 1124 NZ LYS A 68 -22.018 -14.642 5.404 1.00 0.00 N ATOM 0 H LYS A 68 -19.713 -13.503 8.229 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.471 -16.046 9.403 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -17.912 -14.903 8.248 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -17.973 -16.480 9.011 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -18.056 -16.735 6.584 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.565 -17.286 7.284 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -19.489 -14.432 6.321 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -19.446 -15.679 5.091 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -21.567 -16.639 5.915 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -21.587 -15.528 7.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -22.914 -15.056 5.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -22.215 -13.795 5.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -21.438 -14.378 4.582 1.00 0.00 H new ATOM 1138 N VAL A 69 -20.113 -15.154 11.797 1.00 0.00 N ATOM 1139 CA VAL A 69 -19.748 -15.038 13.207 1.00 0.00 C ATOM 1140 C VAL A 69 -19.067 -16.352 13.603 1.00 0.00 C ATOM 1141 O VAL A 69 -19.577 -17.434 13.306 1.00 0.00 O ATOM 1142 CB VAL A 69 -20.979 -14.679 14.140 1.00 0.00 C ATOM 1143 CG1 VAL A 69 -21.740 -13.453 13.582 1.00 0.00 C ATOM 1144 CG2 VAL A 69 -21.955 -15.856 14.366 1.00 0.00 C ATOM 0 H VAL A 69 -21.099 -15.361 11.635 1.00 0.00 H new ATOM 0 HA VAL A 69 -19.063 -14.201 13.346 1.00 0.00 H new ATOM 0 HB VAL A 69 -20.557 -14.441 15.116 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -22.582 -13.220 14.234 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -21.067 -12.597 13.538 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -22.108 -13.678 12.581 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -22.770 -15.533 15.014 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -22.360 -16.182 13.408 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -21.424 -16.684 14.836 1.00 0.00 H new ATOM 1154 N VAL A 70 -17.875 -16.244 14.191 1.00 0.00 N ATOM 1155 CA VAL A 70 -17.003 -17.377 14.500 1.00 0.00 C ATOM 1156 C VAL A 70 -16.504 -17.265 15.946 1.00 0.00 C ATOM 1157 O VAL A 70 -16.723 -16.255 16.627 1.00 0.00 O ATOM 1158 CB VAL A 70 -15.757 -17.455 13.514 1.00 0.00 C ATOM 1159 CG1 VAL A 70 -16.192 -17.641 12.034 1.00 0.00 C ATOM 1160 CG2 VAL A 70 -14.833 -16.216 13.664 1.00 0.00 C ATOM 0 H VAL A 70 -17.480 -15.346 14.472 1.00 0.00 H new ATOM 0 HA VAL A 70 -17.588 -18.288 14.373 1.00 0.00 H new ATOM 0 HB VAL A 70 -15.188 -18.339 13.801 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -15.308 -17.689 11.398 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -16.760 -18.566 11.935 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -16.813 -16.799 11.729 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -13.993 -16.303 12.975 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -15.397 -15.312 13.435 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -14.460 -16.162 14.687 1.00 0.00 H new ATOM 1170 N SER A 71 -15.850 -18.329 16.393 1.00 0.00 N ATOM 1171 CA SER A 71 -15.121 -18.356 17.659 1.00 0.00 C ATOM 1172 C SER A 71 -13.760 -17.629 17.486 1.00 0.00 C ATOM 1173 O SER A 71 -13.203 -17.644 16.376 1.00 0.00 O ATOM 1174 CB SER A 71 -14.919 -19.831 18.066 1.00 0.00 C ATOM 1175 OG SER A 71 -16.166 -20.517 18.179 1.00 0.00 O ATOM 0 H SER A 71 -15.809 -19.210 15.881 1.00 0.00 H new ATOM 0 HA SER A 71 -15.678 -17.842 18.442 1.00 0.00 H new ATOM 0 HB2 SER A 71 -14.293 -20.331 17.327 1.00 0.00 H new ATOM 0 HB3 SER A 71 -14.389 -19.878 19.017 1.00 0.00 H new ATOM 0 HG SER A 71 -16.564 -20.621 17.290 1.00 0.00 H new ATOM 1181 N PRO A 72 -13.187 -16.986 18.569 1.00 0.00 N ATOM 1182 CA PRO A 72 -11.832 -16.362 18.502 1.00 0.00 C ATOM 1183 C PRO A 72 -10.754 -17.398 18.129 1.00 0.00 C ATOM 1184 O PRO A 72 -9.740 -17.051 17.525 1.00 0.00 O ATOM 1185 CB PRO A 72 -11.611 -15.791 19.935 1.00 0.00 C ATOM 1186 CG PRO A 72 -12.591 -16.536 20.798 1.00 0.00 C ATOM 1187 CD PRO A 72 -13.788 -16.815 19.921 1.00 0.00 C ATOM 0 HA PRO A 72 -11.762 -15.592 17.734 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -10.586 -15.950 20.271 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -11.793 -14.717 19.966 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -12.156 -17.463 21.171 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -12.874 -15.944 21.668 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -14.321 -17.710 20.241 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -14.503 -15.993 19.943 1.00 0.00 H new ATOM 1195 N ASP A 73 -11.048 -18.671 18.455 1.00 0.00 N ATOM 1196 CA ASP A 73 -10.192 -19.842 18.184 1.00 0.00 C ATOM 1197 C ASP A 73 -9.814 -19.958 16.690 1.00 0.00 C ATOM 1198 O ASP A 73 -8.752 -20.495 16.374 1.00 0.00 O ATOM 1199 CB ASP A 73 -10.922 -21.133 18.618 1.00 0.00 C ATOM 1200 CG ASP A 73 -11.436 -21.098 20.068 1.00 0.00 C ATOM 1201 OD1 ASP A 73 -12.553 -20.570 20.300 1.00 0.00 O ATOM 1202 OD2 ASP A 73 -10.736 -21.593 20.981 1.00 0.00 O ATOM 0 H ASP A 73 -11.916 -18.921 18.929 1.00 0.00 H new ATOM 0 HA ASP A 73 -9.273 -19.709 18.755 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -11.764 -21.306 17.948 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -10.244 -21.979 18.503 1.00 0.00 H new ATOM 1207 N TRP A 74 -10.700 -19.464 15.782 1.00 0.00 N ATOM 1208 CA TRP A 74 -10.396 -19.401 14.332 1.00 0.00 C ATOM 1209 C TRP A 74 -9.161 -18.519 14.102 1.00 0.00 C ATOM 1210 O TRP A 74 -8.174 -18.968 13.523 1.00 0.00 O ATOM 1211 CB TRP A 74 -11.597 -18.868 13.484 1.00 0.00 C ATOM 1212 CG TRP A 74 -11.262 -18.709 12.003 1.00 0.00 C ATOM 1213 CD1 TRP A 74 -10.735 -19.663 11.176 1.00 0.00 C ATOM 1214 CD2 TRP A 74 -11.428 -17.533 11.183 1.00 0.00 C ATOM 1215 NE1 TRP A 74 -10.536 -19.147 9.923 1.00 0.00 N ATOM 1216 CE2 TRP A 74 -10.960 -17.852 9.898 1.00 0.00 C ATOM 1217 CE3 TRP A 74 -11.921 -16.245 11.415 1.00 0.00 C ATOM 1218 CZ2 TRP A 74 -10.966 -16.934 8.851 1.00 0.00 C ATOM 1219 CZ3 TRP A 74 -11.931 -15.334 10.378 1.00 0.00 C ATOM 1220 CH2 TRP A 74 -11.460 -15.685 9.107 1.00 0.00 C ATOM 0 H TRP A 74 -11.623 -19.107 16.030 1.00 0.00 H new ATOM 0 HA TRP A 74 -10.199 -20.420 13.998 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -12.439 -19.552 13.588 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -11.917 -17.905 13.883 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -10.508 -20.677 11.469 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -10.134 -19.652 9.133 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -12.289 -15.967 12.392 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.594 -17.199 7.872 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -12.307 -14.336 10.549 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -11.487 -14.954 8.312 1.00 0.00 H new ATOM 1231 N ILE A 75 -9.233 -17.287 14.624 1.00 0.00 N ATOM 1232 CA ILE A 75 -8.195 -16.262 14.428 1.00 0.00 C ATOM 1233 C ILE A 75 -6.882 -16.738 15.086 1.00 0.00 C ATOM 1234 O ILE A 75 -5.824 -16.758 14.449 1.00 0.00 O ATOM 1235 CB ILE A 75 -8.614 -14.843 15.013 1.00 0.00 C ATOM 1236 CG1 ILE A 75 -9.916 -14.272 14.335 1.00 0.00 C ATOM 1237 CG2 ILE A 75 -7.453 -13.818 14.892 1.00 0.00 C ATOM 1238 CD1 ILE A 75 -11.223 -14.938 14.744 1.00 0.00 C ATOM 0 H ILE A 75 -10.016 -16.971 15.197 1.00 0.00 H new ATOM 0 HA ILE A 75 -8.058 -16.131 13.355 1.00 0.00 H new ATOM 0 HB ILE A 75 -8.836 -15.000 16.069 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -9.985 -13.208 14.563 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -9.808 -14.360 13.254 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -7.771 -12.859 15.300 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -6.588 -14.180 15.448 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -7.184 -13.695 13.843 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -12.052 -14.466 14.217 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -11.187 -15.997 14.489 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -11.367 -14.828 15.819 1.00 0.00 H new ATOM 1250 N VAL A 76 -7.017 -17.203 16.340 1.00 0.00 N ATOM 1251 CA VAL A 76 -5.901 -17.627 17.206 1.00 0.00 C ATOM 1252 C VAL A 76 -5.103 -18.782 16.572 1.00 0.00 C ATOM 1253 O VAL A 76 -3.876 -18.688 16.421 1.00 0.00 O ATOM 1254 CB VAL A 76 -6.455 -18.058 18.622 1.00 0.00 C ATOM 1255 CG1 VAL A 76 -5.352 -18.642 19.536 1.00 0.00 C ATOM 1256 CG2 VAL A 76 -7.161 -16.868 19.310 1.00 0.00 C ATOM 0 H VAL A 76 -7.927 -17.297 16.791 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.223 -16.782 17.324 1.00 0.00 H new ATOM 0 HB VAL A 76 -7.181 -18.854 18.454 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.786 -18.922 20.496 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -4.917 -19.523 19.064 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.576 -17.893 19.693 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -7.537 -17.182 20.284 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -6.452 -16.050 19.441 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.993 -16.531 18.691 1.00 0.00 H new ATOM 1266 N ASP A 77 -5.817 -19.847 16.171 1.00 0.00 N ATOM 1267 CA ASP A 77 -5.187 -21.067 15.635 1.00 0.00 C ATOM 1268 C ASP A 77 -4.636 -20.819 14.218 1.00 0.00 C ATOM 1269 O ASP A 77 -3.620 -21.384 13.850 1.00 0.00 O ATOM 1270 CB ASP A 77 -6.161 -22.275 15.650 1.00 0.00 C ATOM 1271 CG ASP A 77 -5.420 -23.638 15.647 1.00 0.00 C ATOM 1272 OD1 ASP A 77 -5.073 -24.139 16.746 1.00 0.00 O ATOM 1273 OD2 ASP A 77 -5.189 -24.221 14.562 1.00 0.00 O ATOM 0 H ASP A 77 -6.835 -19.888 16.208 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.352 -21.319 16.289 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.797 -22.213 16.533 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -6.816 -22.220 14.781 1.00 0.00 H new ATOM 1278 N SER A 78 -5.320 -19.953 13.435 1.00 0.00 N ATOM 1279 CA SER A 78 -4.848 -19.535 12.088 1.00 0.00 C ATOM 1280 C SER A 78 -3.499 -18.792 12.171 1.00 0.00 C ATOM 1281 O SER A 78 -2.664 -18.910 11.273 1.00 0.00 O ATOM 1282 CB SER A 78 -5.904 -18.673 11.359 1.00 0.00 C ATOM 1283 OG SER A 78 -7.052 -19.440 11.020 1.00 0.00 O ATOM 0 H SER A 78 -6.204 -19.527 13.712 1.00 0.00 H new ATOM 0 HA SER A 78 -4.697 -20.443 11.504 1.00 0.00 H new ATOM 0 HB2 SER A 78 -6.197 -17.838 11.995 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.468 -18.248 10.455 1.00 0.00 H new ATOM 0 HG SER A 78 -7.673 -19.451 11.778 1.00 0.00 H new ATOM 1289 N VAL A 79 -3.314 -18.011 13.247 1.00 0.00 N ATOM 1290 CA VAL A 79 -2.042 -17.313 13.537 1.00 0.00 C ATOM 1291 C VAL A 79 -0.937 -18.322 13.930 1.00 0.00 C ATOM 1292 O VAL A 79 0.199 -18.219 13.442 1.00 0.00 O ATOM 1293 CB VAL A 79 -2.237 -16.225 14.661 1.00 0.00 C ATOM 1294 CG1 VAL A 79 -0.899 -15.605 15.144 1.00 0.00 C ATOM 1295 CG2 VAL A 79 -3.191 -15.114 14.175 1.00 0.00 C ATOM 0 H VAL A 79 -4.040 -17.843 13.944 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.725 -16.802 12.628 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.676 -16.738 15.517 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.100 -14.864 15.917 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -0.260 -16.389 15.550 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -0.396 -15.126 14.304 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -3.315 -14.371 14.963 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -2.773 -14.637 13.289 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -4.160 -15.548 13.930 1.00 0.00 H new ATOM 1305 N LYS A 80 -1.293 -19.297 14.799 1.00 0.00 N ATOM 1306 CA LYS A 80 -0.371 -20.384 15.232 1.00 0.00 C ATOM 1307 C LYS A 80 0.129 -21.190 14.024 1.00 0.00 C ATOM 1308 O LYS A 80 1.313 -21.528 13.918 1.00 0.00 O ATOM 1309 CB LYS A 80 -1.080 -21.358 16.214 1.00 0.00 C ATOM 1310 CG LYS A 80 -1.509 -20.741 17.558 1.00 0.00 C ATOM 1311 CD LYS A 80 -2.252 -21.759 18.453 1.00 0.00 C ATOM 1312 CE LYS A 80 -2.629 -21.187 19.827 1.00 0.00 C ATOM 1313 NZ LYS A 80 -3.365 -22.174 20.664 1.00 0.00 N ATOM 0 H LYS A 80 -2.220 -19.356 15.220 1.00 0.00 H new ATOM 0 HA LYS A 80 0.473 -19.909 15.733 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -1.963 -21.765 15.722 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -0.412 -22.196 16.414 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.629 -20.371 18.084 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.155 -19.882 17.373 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -3.157 -22.090 17.943 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.624 -22.639 18.592 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.725 -20.873 20.349 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -3.244 -20.297 19.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.599 -21.745 21.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -4.241 -22.455 20.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.769 -23.013 20.816 1.00 0.00 H new ATOM 1327 N GLU A 81 -0.808 -21.487 13.124 1.00 0.00 N ATOM 1328 CA GLU A 81 -0.569 -22.304 11.938 1.00 0.00 C ATOM 1329 C GLU A 81 0.034 -21.483 10.791 1.00 0.00 C ATOM 1330 O GLU A 81 0.633 -22.056 9.870 1.00 0.00 O ATOM 1331 CB GLU A 81 -1.897 -22.948 11.480 1.00 0.00 C ATOM 1332 CG GLU A 81 -2.471 -23.996 12.449 1.00 0.00 C ATOM 1333 CD GLU A 81 -1.491 -25.141 12.733 1.00 0.00 C ATOM 1334 OE1 GLU A 81 -1.142 -25.881 11.784 1.00 0.00 O ATOM 1335 OE2 GLU A 81 -1.054 -25.304 13.892 1.00 0.00 O ATOM 0 H GLU A 81 -1.771 -21.160 13.201 1.00 0.00 H new ATOM 0 HA GLU A 81 0.151 -23.079 12.203 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -2.637 -22.160 11.338 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -1.741 -23.418 10.509 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -2.737 -23.510 13.388 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -3.391 -24.406 12.031 1.00 0.00 H new ATOM 1342 N ALA A 82 -0.162 -20.150 10.849 1.00 0.00 N ATOM 1343 CA ALA A 82 0.212 -19.206 9.773 1.00 0.00 C ATOM 1344 C ALA A 82 -0.500 -19.563 8.442 1.00 0.00 C ATOM 1345 O ALA A 82 -0.053 -19.169 7.359 1.00 0.00 O ATOM 1346 CB ALA A 82 1.745 -19.128 9.614 1.00 0.00 C ATOM 0 H ALA A 82 -0.590 -19.692 11.654 1.00 0.00 H new ATOM 0 HA ALA A 82 -0.131 -18.211 10.058 1.00 0.00 H new ATOM 0 HB1 ALA A 82 1.993 -18.427 8.817 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.191 -18.787 10.548 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.136 -20.115 9.364 1.00 0.00 H new ATOM 1352 N ARG A 83 -1.661 -20.250 8.552 1.00 0.00 N ATOM 1353 CA ARG A 83 -2.426 -20.750 7.389 1.00 0.00 C ATOM 1354 C ARG A 83 -3.926 -20.434 7.579 1.00 0.00 C ATOM 1355 O ARG A 83 -4.354 -20.089 8.689 1.00 0.00 O ATOM 1356 CB ARG A 83 -2.179 -22.290 7.193 1.00 0.00 C ATOM 1357 CG ARG A 83 -3.084 -23.232 8.033 1.00 0.00 C ATOM 1358 CD ARG A 83 -2.716 -24.734 7.900 1.00 0.00 C ATOM 1359 NE ARG A 83 -1.560 -25.122 8.738 1.00 0.00 N ATOM 1360 CZ ARG A 83 -0.610 -26.016 8.412 1.00 0.00 C ATOM 1361 NH1 ARG A 83 -0.549 -26.546 7.198 1.00 0.00 N ATOM 1362 NH2 ARG A 83 0.280 -26.377 9.320 1.00 0.00 N ATOM 0 H ARG A 83 -2.092 -20.472 9.449 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.084 -20.246 6.485 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -2.317 -22.530 6.139 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -1.138 -22.506 7.435 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.019 -22.943 9.082 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.121 -23.093 7.727 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.579 -25.340 8.178 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -2.493 -24.957 6.857 1.00 0.00 H new ATOM 0 HE ARG A 83 -1.476 -24.669 9.648 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -1.232 -26.277 6.489 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.180 -27.222 6.973 1.00 0.00 H new ATOM 0 HH21 ARG A 83 0.242 -25.978 10.258 1.00 0.00 H new ATOM 0 HH22 ARG A 83 1.005 -27.054 9.083 1.00 0.00 H new ATOM 1376 N LEU A 84 -4.712 -20.558 6.499 1.00 0.00 N ATOM 1377 CA LEU A 84 -6.160 -20.293 6.518 1.00 0.00 C ATOM 1378 C LEU A 84 -6.910 -21.567 6.958 1.00 0.00 C ATOM 1379 O LEU A 84 -6.846 -22.602 6.282 1.00 0.00 O ATOM 1380 CB LEU A 84 -6.619 -19.772 5.109 1.00 0.00 C ATOM 1381 CG LEU A 84 -8.109 -19.286 4.924 1.00 0.00 C ATOM 1382 CD1 LEU A 84 -9.098 -20.451 4.726 1.00 0.00 C ATOM 1383 CD2 LEU A 84 -8.553 -18.372 6.086 1.00 0.00 C ATOM 0 H LEU A 84 -4.361 -20.845 5.585 1.00 0.00 H new ATOM 0 HA LEU A 84 -6.397 -19.513 7.241 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.966 -18.944 4.835 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.441 -20.570 4.388 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.127 -18.701 4.005 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -10.106 -20.056 4.604 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.820 -21.017 3.837 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -9.068 -21.106 5.597 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.584 -18.056 5.927 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.483 -18.919 7.026 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -7.907 -17.495 6.127 1.00 0.00 H new ATOM 1395 N LEU A 85 -7.589 -21.483 8.114 1.00 0.00 N ATOM 1396 CA LEU A 85 -8.491 -22.541 8.615 1.00 0.00 C ATOM 1397 C LEU A 85 -9.931 -22.303 8.101 1.00 0.00 C ATOM 1398 O LEU A 85 -10.287 -21.155 7.792 1.00 0.00 O ATOM 1399 CB LEU A 85 -8.471 -22.581 10.179 1.00 0.00 C ATOM 1400 CG LEU A 85 -7.303 -23.377 10.841 1.00 0.00 C ATOM 1401 CD1 LEU A 85 -5.917 -22.775 10.531 1.00 0.00 C ATOM 1402 CD2 LEU A 85 -7.530 -23.501 12.359 1.00 0.00 C ATOM 0 H LEU A 85 -7.529 -20.675 8.733 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.141 -23.503 8.241 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.436 -21.555 10.546 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -9.413 -23.010 10.521 1.00 0.00 H new ATOM 0 HG LEU A 85 -7.306 -24.375 10.402 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -5.145 -23.370 11.018 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -5.752 -22.777 9.454 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.874 -21.751 10.902 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -6.707 -24.059 12.806 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -7.577 -22.506 12.802 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -8.467 -24.026 12.545 1.00 0.00 H new ATOM 1414 N PRO A 86 -10.794 -23.376 7.997 1.00 0.00 N ATOM 1415 CA PRO A 86 -12.207 -23.209 7.616 1.00 0.00 C ATOM 1416 C PRO A 86 -13.008 -22.551 8.760 1.00 0.00 C ATOM 1417 O PRO A 86 -13.221 -23.153 9.821 1.00 0.00 O ATOM 1418 CB PRO A 86 -12.676 -24.657 7.308 1.00 0.00 C ATOM 1419 CG PRO A 86 -11.804 -25.526 8.155 1.00 0.00 C ATOM 1420 CD PRO A 86 -10.463 -24.817 8.230 1.00 0.00 C ATOM 0 HA PRO A 86 -12.355 -22.548 6.762 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -13.729 -24.793 7.554 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -12.563 -24.893 6.250 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -12.232 -25.660 9.149 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -11.698 -26.519 7.717 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -9.989 -24.964 9.200 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -9.771 -25.193 7.476 1.00 0.00 H new ATOM 1428 N TRP A 87 -13.406 -21.289 8.539 1.00 0.00 N ATOM 1429 CA TRP A 87 -14.206 -20.507 9.502 1.00 0.00 C ATOM 1430 C TRP A 87 -15.581 -21.150 9.755 1.00 0.00 C ATOM 1431 O TRP A 87 -16.164 -20.951 10.820 1.00 0.00 O ATOM 1432 CB TRP A 87 -14.356 -19.049 9.009 1.00 0.00 C ATOM 1433 CG TRP A 87 -14.880 -18.897 7.592 1.00 0.00 C ATOM 1434 CD1 TRP A 87 -16.178 -18.970 7.161 1.00 0.00 C ATOM 1435 CD2 TRP A 87 -14.096 -18.592 6.429 1.00 0.00 C ATOM 1436 NE1 TRP A 87 -16.240 -18.740 5.810 1.00 0.00 N ATOM 1437 CE2 TRP A 87 -14.977 -18.511 5.336 1.00 0.00 C ATOM 1438 CE3 TRP A 87 -12.733 -18.404 6.212 1.00 0.00 C ATOM 1439 CZ2 TRP A 87 -14.537 -18.227 4.049 1.00 0.00 C ATOM 1440 CZ3 TRP A 87 -12.293 -18.119 4.936 1.00 0.00 C ATOM 1441 CH2 TRP A 87 -13.192 -18.040 3.864 1.00 0.00 C ATOM 0 H TRP A 87 -13.183 -20.778 7.685 1.00 0.00 H new ATOM 0 HA TRP A 87 -13.676 -20.501 10.455 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -15.027 -18.520 9.686 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -13.385 -18.558 9.075 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -17.029 -19.178 7.793 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -17.092 -18.740 5.249 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -12.032 -18.480 7.030 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -15.230 -18.156 3.224 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -11.240 -17.954 4.761 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -12.818 -17.828 2.873 1.00 0.00 H new ATOM 1452 N GLN A 88 -16.066 -21.928 8.759 1.00 0.00 N ATOM 1453 CA GLN A 88 -17.343 -22.674 8.832 1.00 0.00 C ATOM 1454 C GLN A 88 -17.364 -23.652 10.028 1.00 0.00 C ATOM 1455 O GLN A 88 -18.426 -23.936 10.587 1.00 0.00 O ATOM 1456 CB GLN A 88 -17.585 -23.446 7.499 1.00 0.00 C ATOM 1457 CG GLN A 88 -16.535 -24.538 7.189 1.00 0.00 C ATOM 1458 CD GLN A 88 -16.795 -25.283 5.879 1.00 0.00 C ATOM 1459 OE1 GLN A 88 -16.315 -24.885 4.820 1.00 0.00 O ATOM 1460 NE2 GLN A 88 -17.565 -26.360 5.939 1.00 0.00 N ATOM 0 H GLN A 88 -15.576 -22.056 7.874 1.00 0.00 H new ATOM 0 HA GLN A 88 -18.145 -21.952 8.983 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -18.571 -23.909 7.536 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -17.599 -22.730 6.677 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -15.547 -24.079 7.146 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -16.517 -25.256 8.009 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -17.948 -26.664 6.834 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -17.775 -26.885 5.090 1.00 0.00 H new ATOM 1469 N ASN A 89 -16.169 -24.145 10.403 1.00 0.00 N ATOM 1470 CA ASN A 89 -15.985 -25.099 11.512 1.00 0.00 C ATOM 1471 C ASN A 89 -16.109 -24.391 12.879 1.00 0.00 C ATOM 1472 O ASN A 89 -16.610 -24.967 13.850 1.00 0.00 O ATOM 1473 CB ASN A 89 -14.607 -25.798 11.357 1.00 0.00 C ATOM 1474 CG ASN A 89 -14.249 -26.724 12.523 1.00 0.00 C ATOM 1475 OD1 ASN A 89 -14.619 -27.898 12.537 1.00 0.00 O ATOM 1476 ND2 ASN A 89 -13.506 -26.209 13.496 1.00 0.00 N ATOM 0 H ASN A 89 -15.296 -23.890 9.940 1.00 0.00 H new ATOM 0 HA ASN A 89 -16.771 -25.854 11.474 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -14.605 -26.376 10.433 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -13.833 -25.037 11.259 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -13.225 -26.791 14.285 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -13.216 -25.232 13.454 1.00 0.00 H new ATOM 1483 N TYR A 90 -15.649 -23.131 12.935 1.00 0.00 N ATOM 1484 CA TYR A 90 -15.667 -22.303 14.170 1.00 0.00 C ATOM 1485 C TYR A 90 -16.901 -21.385 14.208 1.00 0.00 C ATOM 1486 O TYR A 90 -17.106 -20.657 15.183 1.00 0.00 O ATOM 1487 CB TYR A 90 -14.356 -21.468 14.249 1.00 0.00 C ATOM 1488 CG TYR A 90 -13.090 -22.337 14.295 1.00 0.00 C ATOM 1489 CD1 TYR A 90 -12.601 -22.831 15.509 1.00 0.00 C ATOM 1490 CD2 TYR A 90 -12.406 -22.696 13.126 1.00 0.00 C ATOM 1491 CE1 TYR A 90 -11.488 -23.646 15.553 1.00 0.00 C ATOM 1492 CE2 TYR A 90 -11.285 -23.505 13.173 1.00 0.00 C ATOM 1493 CZ TYR A 90 -10.835 -23.979 14.388 1.00 0.00 C ATOM 1494 OH TYR A 90 -9.741 -24.812 14.440 1.00 0.00 O ATOM 0 H TYR A 90 -15.252 -22.649 12.128 1.00 0.00 H new ATOM 0 HA TYR A 90 -15.727 -22.963 15.035 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -14.303 -20.804 13.386 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -14.388 -20.836 15.136 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -13.104 -22.570 16.429 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -12.760 -22.335 12.172 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -11.130 -24.022 16.500 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -10.765 -23.764 12.263 1.00 0.00 H new ATOM 0 HH TYR A 90 -9.848 -25.534 13.786 1.00 0.00 H new ATOM 1504 N SER A 91 -17.727 -21.452 13.154 1.00 0.00 N ATOM 1505 CA SER A 91 -18.824 -20.509 12.927 1.00 0.00 C ATOM 1506 C SER A 91 -20.000 -20.737 13.909 1.00 0.00 C ATOM 1507 O SER A 91 -20.653 -21.785 13.880 1.00 0.00 O ATOM 1508 CB SER A 91 -19.295 -20.609 11.461 1.00 0.00 C ATOM 1509 OG SER A 91 -20.139 -19.533 11.102 1.00 0.00 O ATOM 0 H SER A 91 -17.649 -22.168 12.432 1.00 0.00 H new ATOM 0 HA SER A 91 -18.453 -19.502 13.117 1.00 0.00 H new ATOM 0 HB2 SER A 91 -18.427 -20.625 10.802 1.00 0.00 H new ATOM 0 HB3 SER A 91 -19.825 -21.550 11.314 1.00 0.00 H new ATOM 0 HG SER A 91 -19.954 -18.765 11.682 1.00 0.00 H new ATOM 1515 N LEU A 92 -20.254 -19.729 14.767 1.00 0.00 N ATOM 1516 CA LEU A 92 -21.357 -19.739 15.745 1.00 0.00 C ATOM 1517 C LEU A 92 -22.717 -19.386 15.087 1.00 0.00 C ATOM 1518 O LEU A 92 -23.733 -19.269 15.790 1.00 0.00 O ATOM 1519 CB LEU A 92 -21.043 -18.758 16.911 1.00 0.00 C ATOM 1520 CG LEU A 92 -19.726 -19.031 17.710 1.00 0.00 C ATOM 1521 CD1 LEU A 92 -19.512 -17.959 18.798 1.00 0.00 C ATOM 1522 CD2 LEU A 92 -19.712 -20.454 18.325 1.00 0.00 C ATOM 0 H LEU A 92 -19.693 -18.878 14.800 1.00 0.00 H new ATOM 0 HA LEU A 92 -21.443 -20.751 16.141 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -20.994 -17.748 16.504 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -21.878 -18.779 17.611 1.00 0.00 H new ATOM 0 HG LEU A 92 -18.898 -18.973 17.004 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -18.590 -18.170 19.340 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -19.442 -16.976 18.332 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -20.352 -17.972 19.492 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -18.781 -20.605 18.872 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -20.555 -20.564 19.007 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -19.790 -21.195 17.529 1.00 0.00 H new ATOM 1534 N THR A 93 -22.727 -19.227 13.739 1.00 0.00 N ATOM 1535 CA THR A 93 -23.952 -18.968 12.951 1.00 0.00 C ATOM 1536 C THR A 93 -24.956 -20.142 13.062 1.00 0.00 C ATOM 1537 O THR A 93 -26.150 -19.956 12.800 1.00 0.00 O ATOM 1538 CB THR A 93 -23.626 -18.725 11.437 1.00 0.00 C ATOM 1539 OG1 THR A 93 -22.991 -19.890 10.882 1.00 0.00 O ATOM 1540 CG2 THR A 93 -22.712 -17.502 11.220 1.00 0.00 C ATOM 0 H THR A 93 -21.882 -19.276 13.170 1.00 0.00 H new ATOM 0 HA THR A 93 -24.401 -18.067 13.369 1.00 0.00 H new ATOM 0 HB THR A 93 -24.573 -18.528 10.934 1.00 0.00 H new ATOM 0 HG1 THR A 93 -22.018 -19.793 10.944 1.00 0.00 H new ATOM 0 HG21 THR A 93 -22.517 -17.378 10.155 1.00 0.00 H new ATOM 0 HG22 THR A 93 -23.203 -16.608 11.606 1.00 0.00 H new ATOM 0 HG23 THR A 93 -21.770 -17.654 11.746 1.00 0.00 H new ATOM 1548 N SER A 94 -24.421 -21.339 13.422 1.00 0.00 N ATOM 1549 CA SER A 94 -25.176 -22.584 13.670 1.00 0.00 C ATOM 1550 C SER A 94 -25.628 -23.243 12.335 1.00 0.00 C ATOM 1551 O SER A 94 -26.694 -22.869 11.788 1.00 0.00 O ATOM 1552 CB SER A 94 -26.373 -22.349 14.636 1.00 0.00 C ATOM 1553 OG SER A 94 -25.961 -21.685 15.823 1.00 0.00 O ATOM 1554 OXT SER A 94 -24.902 -24.125 11.832 1.00 0.00 O ATOM 0 H SER A 94 -23.417 -21.461 13.550 1.00 0.00 H new ATOM 0 HA SER A 94 -24.503 -23.283 14.167 1.00 0.00 H new ATOM 0 HB2 SER A 94 -27.137 -21.757 14.133 1.00 0.00 H new ATOM 0 HB3 SER A 94 -26.829 -23.306 14.892 1.00 0.00 H new ATOM 0 HG SER A 94 -25.557 -22.333 16.437 1.00 0.00 H new TER 1560 SER A 94