USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 989 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 64 SER OG : rot -78:sc= 1.2 USER MOD Set 1.2: A 135 HIS : no HD1:sc= 0.827 K(o=2,f=-6.1!) USER MOD Set 2.1: A 16 THR OG1 : rot -90:sc= 1.12 USER MOD Set 2.2: A 27 SER OG : rot 180:sc= 2.16 USER MOD Set 2.3: A 30 ASN : amide:sc= 1.19 K(o=4.5,f=-0.81) USER MOD Set 3.1: A 18 LYS NZ :NH3+ 178:sc= 0.945 (180deg=0) USER MOD Set 3.2: A 24 THR OG1 : rot -153:sc= 0.765 USER MOD Single : A 2 SER OG : rot 38:sc= -1.28! USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 SER OG : rot 29:sc= 0.177 USER MOD Single : A 8 ASN : amide:sc= 0.214 K(o=0.21,f=-0.41) USER MOD Single : A 9 SER OG : rot 74:sc= -1.68! USER MOD Single : A 14 HIS : no HE2:sc= -2.84! C(o=-2.8!,f=-9.1!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 133:sc= 0.244 USER MOD Single : A 31 ASN : amide:sc= -0.352 X(o=-0.35,f=-0.83) USER MOD Single : A 33 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0151) USER MOD Single : A 43 SER OG : rot 160:sc= -0.362 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -1.17 K(o=-1.2,f=-0.11) USER MOD Single : A 51 HIS : no HD1:sc= -0.202 X(o=-0.2,f=-0.018) USER MOD Single : A 56 LYS NZ :NH3+ -111:sc= 0.124 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -155:sc= -0.121 (180deg=-0.712) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -82:sc= 1.23 USER MOD Single : A 75 SER OG : rot 37:sc= 0.0579 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 31:sc= 0.131 USER MOD Single : A 88 MET CE :methyl -125:sc= -1.21 (180deg=-4.14!) USER MOD Single : A 99 MET CE :methyl 175:sc= -0.209 (180deg=-0.364) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 158:sc= -0.201 (180deg=-0.833) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 154:sc= -0.131 (180deg=-0.894) USER MOD Single : A 117 ASN : amide:sc= -2.54! K(o=-2.5!,f=-0.018) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 120:sc= 0.23 USER MOD Single : A 126 ASN : amide:sc= -1.24! K(o=-1.2!,f=-0.32) USER MOD Single : A 133 THR OG1 : rot 33:sc= 0.212 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 22.652 -4.773 8.186 1.00 0.00 N ATOM 21 CA SER A 2 22.219 -4.090 6.979 1.00 0.00 C ATOM 22 C SER A 2 22.119 -2.589 7.219 1.00 0.00 C ATOM 23 O SER A 2 21.228 -2.113 7.925 1.00 0.00 O ATOM 24 CB SER A 2 20.882 -4.654 6.507 1.00 0.00 C ATOM 25 OG SER A 2 20.976 -6.055 6.305 1.00 0.00 O ATOM 0 HA SER A 2 22.960 -4.258 6.197 1.00 0.00 H new ATOM 0 HB2 SER A 2 20.109 -4.438 7.245 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.582 -4.166 5.579 1.00 0.00 H new ATOM 0 HG SER A 2 21.548 -6.448 6.997 1.00 0.00 H new ATOM 31 N GLU A 3 23.051 -1.857 6.639 1.00 0.00 N ATOM 32 CA GLU A 3 23.118 -0.420 6.817 1.00 0.00 C ATOM 33 C GLU A 3 22.497 0.296 5.623 1.00 0.00 C ATOM 34 O GLU A 3 21.974 1.408 5.743 1.00 0.00 O ATOM 35 CB GLU A 3 24.574 -0.009 6.994 1.00 0.00 C ATOM 36 CG GLU A 3 24.769 1.457 7.290 1.00 0.00 C ATOM 37 CD GLU A 3 26.219 1.802 7.526 1.00 0.00 C ATOM 38 OE1 GLU A 3 26.706 1.593 8.654 1.00 0.00 O ATOM 39 OE2 GLU A 3 26.884 2.268 6.580 1.00 0.00 O ATOM 0 H GLU A 3 23.779 -2.239 6.035 1.00 0.00 H new ATOM 0 HA GLU A 3 22.553 -0.137 7.705 1.00 0.00 H new ATOM 0 HB2 GLU A 3 25.009 -0.593 7.805 1.00 0.00 H new ATOM 0 HB3 GLU A 3 25.124 -0.262 6.088 1.00 0.00 H new ATOM 0 HG2 GLU A 3 24.387 2.048 6.457 1.00 0.00 H new ATOM 0 HG3 GLU A 3 24.185 1.730 8.169 1.00 0.00 H new ATOM 46 N SER A 4 22.552 -0.358 4.480 1.00 0.00 N ATOM 47 CA SER A 4 21.978 0.174 3.262 1.00 0.00 C ATOM 48 C SER A 4 20.993 -0.831 2.666 1.00 0.00 C ATOM 49 O SER A 4 21.055 -2.027 2.964 1.00 0.00 O ATOM 50 CB SER A 4 23.091 0.512 2.267 1.00 0.00 C ATOM 51 OG SER A 4 24.043 -0.535 2.192 1.00 0.00 O ATOM 0 H SER A 4 22.995 -1.270 4.370 1.00 0.00 H new ATOM 0 HA SER A 4 21.432 1.090 3.488 1.00 0.00 H new ATOM 0 HB2 SER A 4 22.661 0.688 1.281 1.00 0.00 H new ATOM 0 HB3 SER A 4 23.585 1.436 2.569 1.00 0.00 H new ATOM 0 HG SER A 4 24.742 -0.296 1.549 1.00 0.00 H new ATOM 57 N VAL A 5 20.079 -0.344 1.837 1.00 0.00 N ATOM 58 CA VAL A 5 19.026 -1.184 1.285 1.00 0.00 C ATOM 59 C VAL A 5 19.519 -1.946 0.065 1.00 0.00 C ATOM 60 O VAL A 5 20.410 -1.492 -0.657 1.00 0.00 O ATOM 61 CB VAL A 5 17.779 -0.368 0.878 1.00 0.00 C ATOM 62 CG1 VAL A 5 17.379 0.606 1.964 1.00 0.00 C ATOM 63 CG2 VAL A 5 18.007 0.345 -0.430 1.00 0.00 C ATOM 0 H VAL A 5 20.046 0.629 1.532 1.00 0.00 H new ATOM 0 HA VAL A 5 18.749 -1.880 2.076 1.00 0.00 H new ATOM 0 HB VAL A 5 16.954 -1.068 0.743 1.00 0.00 H new ATOM 0 HG11 VAL A 5 16.498 1.164 1.646 1.00 0.00 H new ATOM 0 HG12 VAL A 5 17.151 0.058 2.878 1.00 0.00 H new ATOM 0 HG13 VAL A 5 18.199 1.299 2.152 1.00 0.00 H new ATOM 0 HG21 VAL A 5 17.115 0.913 -0.695 1.00 0.00 H new ATOM 0 HG22 VAL A 5 18.853 1.025 -0.331 1.00 0.00 H new ATOM 0 HG23 VAL A 5 18.218 -0.386 -1.211 1.00 0.00 H new ATOM 73 N GLN A 6 18.921 -3.095 -0.157 1.00 0.00 N ATOM 74 CA GLN A 6 19.212 -3.909 -1.321 1.00 0.00 C ATOM 75 C GLN A 6 17.925 -4.531 -1.817 1.00 0.00 C ATOM 76 O GLN A 6 16.902 -4.451 -1.137 1.00 0.00 O ATOM 77 CB GLN A 6 20.244 -4.981 -0.993 1.00 0.00 C ATOM 78 CG GLN A 6 19.781 -5.946 0.072 1.00 0.00 C ATOM 79 CD GLN A 6 20.878 -6.260 1.065 1.00 0.00 C ATOM 80 OE1 GLN A 6 21.631 -7.218 0.896 1.00 0.00 O ATOM 81 NE2 GLN A 6 20.991 -5.437 2.094 1.00 0.00 N ATOM 0 H GLN A 6 18.217 -3.494 0.464 1.00 0.00 H new ATOM 0 HA GLN A 6 19.637 -3.281 -2.104 1.00 0.00 H new ATOM 0 HB2 GLN A 6 20.481 -5.537 -1.900 1.00 0.00 H new ATOM 0 HB3 GLN A 6 21.165 -4.501 -0.663 1.00 0.00 H new ATOM 0 HG2 GLN A 6 18.925 -5.523 0.598 1.00 0.00 H new ATOM 0 HG3 GLN A 6 19.441 -6.869 -0.398 1.00 0.00 H new ATOM 0 HE21 GLN A 6 20.344 -4.655 2.195 1.00 0.00 H new ATOM 0 HE22 GLN A 6 21.725 -5.584 2.787 1.00 0.00 H new ATOM 90 N SER A 7 17.956 -5.112 -3.000 1.00 0.00 N ATOM 91 CA SER A 7 16.794 -5.807 -3.518 1.00 0.00 C ATOM 92 C SER A 7 16.309 -6.844 -2.500 1.00 0.00 C ATOM 93 O SER A 7 17.087 -7.701 -2.070 1.00 0.00 O ATOM 94 CB SER A 7 17.144 -6.468 -4.851 1.00 0.00 C ATOM 95 OG SER A 7 18.277 -7.312 -4.721 1.00 0.00 O ATOM 0 H SER A 7 18.768 -5.117 -3.618 1.00 0.00 H new ATOM 0 HA SER A 7 15.987 -5.095 -3.687 1.00 0.00 H new ATOM 0 HB2 SER A 7 16.293 -7.049 -5.207 1.00 0.00 H new ATOM 0 HB3 SER A 7 17.342 -5.701 -5.600 1.00 0.00 H new ATOM 0 HG SER A 7 18.324 -7.657 -3.805 1.00 0.00 H new ATOM 101 N ASN A 8 15.046 -6.706 -2.087 1.00 0.00 N ATOM 102 CA ASN A 8 14.398 -7.631 -1.138 1.00 0.00 C ATOM 103 C ASN A 8 14.788 -7.313 0.314 1.00 0.00 C ATOM 104 O ASN A 8 15.056 -8.211 1.114 1.00 0.00 O ATOM 105 CB ASN A 8 14.717 -9.100 -1.493 1.00 0.00 C ATOM 106 CG ASN A 8 13.938 -10.134 -0.683 1.00 0.00 C ATOM 107 OD1 ASN A 8 14.459 -11.208 -0.372 1.00 0.00 O ATOM 108 ND2 ASN A 8 12.688 -9.839 -0.356 1.00 0.00 N ATOM 0 H ASN A 8 14.438 -5.949 -2.399 1.00 0.00 H new ATOM 0 HA ASN A 8 13.320 -7.491 -1.224 1.00 0.00 H new ATOM 0 HB2 ASN A 8 14.511 -9.257 -2.552 1.00 0.00 H new ATOM 0 HB3 ASN A 8 15.783 -9.272 -1.347 1.00 0.00 H new ATOM 0 HD21 ASN A 8 12.126 -10.510 0.169 1.00 0.00 H new ATOM 0 HD22 ASN A 8 12.288 -8.941 -0.629 1.00 0.00 H new ATOM 115 N SER A 9 14.837 -6.026 0.655 1.00 0.00 N ATOM 116 CA SER A 9 15.073 -5.620 2.038 1.00 0.00 C ATOM 117 C SER A 9 13.779 -5.150 2.700 1.00 0.00 C ATOM 118 O SER A 9 12.801 -4.834 2.024 1.00 0.00 O ATOM 119 CB SER A 9 16.107 -4.494 2.099 1.00 0.00 C ATOM 120 OG SER A 9 17.324 -4.893 1.505 1.00 0.00 O ATOM 0 H SER A 9 14.718 -5.254 -0.001 1.00 0.00 H new ATOM 0 HA SER A 9 15.451 -6.489 2.576 1.00 0.00 H new ATOM 0 HB2 SER A 9 15.720 -3.612 1.588 1.00 0.00 H new ATOM 0 HB3 SER A 9 16.280 -4.210 3.137 1.00 0.00 H new ATOM 0 HG SER A 9 17.223 -4.908 0.530 1.00 0.00 H new ATOM 126 N ALA A 10 13.782 -5.138 4.022 1.00 0.00 N ATOM 127 CA ALA A 10 12.702 -4.562 4.799 1.00 0.00 C ATOM 128 C ALA A 10 13.199 -3.282 5.455 1.00 0.00 C ATOM 129 O ALA A 10 14.275 -3.274 6.051 1.00 0.00 O ATOM 130 CB ALA A 10 12.233 -5.558 5.845 1.00 0.00 C ATOM 0 H ALA A 10 14.536 -5.529 4.587 1.00 0.00 H new ATOM 0 HA ALA A 10 11.857 -4.327 4.152 1.00 0.00 H new ATOM 0 HB1 ALA A 10 11.421 -5.120 6.426 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.879 -6.464 5.352 1.00 0.00 H new ATOM 0 HB3 ALA A 10 13.061 -5.806 6.508 1.00 0.00 H new ATOM 136 N VAL A 11 12.438 -2.201 5.352 1.00 0.00 N ATOM 137 CA VAL A 11 12.910 -0.913 5.849 1.00 0.00 C ATOM 138 C VAL A 11 11.800 -0.151 6.564 1.00 0.00 C ATOM 139 O VAL A 11 10.656 -0.125 6.111 1.00 0.00 O ATOM 140 CB VAL A 11 13.513 -0.018 4.725 1.00 0.00 C ATOM 141 CG1 VAL A 11 14.543 -0.781 3.905 1.00 0.00 C ATOM 142 CG2 VAL A 11 12.438 0.560 3.816 1.00 0.00 C ATOM 0 H VAL A 11 11.507 -2.187 4.936 1.00 0.00 H new ATOM 0 HA VAL A 11 13.705 -1.142 6.558 1.00 0.00 H new ATOM 0 HB VAL A 11 14.011 0.815 5.221 1.00 0.00 H new ATOM 0 HG11 VAL A 11 14.945 -0.130 3.129 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.352 -1.113 4.555 1.00 0.00 H new ATOM 0 HG13 VAL A 11 14.070 -1.647 3.442 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.904 1.177 3.048 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.886 -0.252 3.344 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.753 1.170 4.405 1.00 0.00 H new ATOM 152 N LEU A 12 12.144 0.442 7.697 1.00 0.00 N ATOM 153 CA LEU A 12 11.234 1.321 8.412 1.00 0.00 C ATOM 154 C LEU A 12 11.377 2.715 7.843 1.00 0.00 C ATOM 155 O LEU A 12 12.492 3.228 7.736 1.00 0.00 O ATOM 156 CB LEU A 12 11.551 1.349 9.909 1.00 0.00 C ATOM 157 CG LEU A 12 11.243 0.066 10.677 1.00 0.00 C ATOM 158 CD1 LEU A 12 11.753 0.170 12.107 1.00 0.00 C ATOM 159 CD2 LEU A 12 9.748 -0.213 10.664 1.00 0.00 C ATOM 0 H LEU A 12 13.054 0.328 8.143 1.00 0.00 H new ATOM 0 HA LEU A 12 10.215 0.953 8.291 1.00 0.00 H new ATOM 0 HB2 LEU A 12 12.609 1.579 10.033 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.992 2.166 10.365 1.00 0.00 H new ATOM 0 HG LEU A 12 11.753 -0.763 10.187 1.00 0.00 H new ATOM 0 HD11 LEU A 12 11.526 -0.752 12.642 1.00 0.00 H new ATOM 0 HD12 LEU A 12 12.831 0.328 12.098 1.00 0.00 H new ATOM 0 HD13 LEU A 12 11.267 1.008 12.606 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.544 -1.131 11.216 1.00 0.00 H new ATOM 0 HD22 LEU A 12 9.219 0.617 11.133 1.00 0.00 H new ATOM 0 HD23 LEU A 12 9.408 -0.325 9.635 1.00 0.00 H new ATOM 171 N VAL A 13 10.273 3.330 7.475 1.00 0.00 N ATOM 172 CA VAL A 13 10.316 4.603 6.787 1.00 0.00 C ATOM 173 C VAL A 13 9.192 5.512 7.264 1.00 0.00 C ATOM 174 O VAL A 13 8.182 5.049 7.803 1.00 0.00 O ATOM 175 CB VAL A 13 10.228 4.388 5.250 1.00 0.00 C ATOM 176 CG1 VAL A 13 9.165 3.357 4.899 1.00 0.00 C ATOM 177 CG2 VAL A 13 9.952 5.680 4.499 1.00 0.00 C ATOM 0 H VAL A 13 9.334 2.969 7.641 1.00 0.00 H new ATOM 0 HA VAL A 13 11.265 5.087 7.017 1.00 0.00 H new ATOM 0 HB VAL A 13 11.205 4.019 4.937 1.00 0.00 H new ATOM 0 HG11 VAL A 13 9.127 3.228 3.817 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.412 2.405 5.370 1.00 0.00 H new ATOM 0 HG13 VAL A 13 8.194 3.698 5.258 1.00 0.00 H new ATOM 0 HG21 VAL A 13 9.900 5.475 3.430 1.00 0.00 H new ATOM 0 HG22 VAL A 13 9.004 6.100 4.834 1.00 0.00 H new ATOM 0 HG23 VAL A 13 10.754 6.392 4.693 1.00 0.00 H new ATOM 187 N HIS A 14 9.385 6.802 7.078 1.00 0.00 N ATOM 188 CA HIS A 14 8.343 7.787 7.287 1.00 0.00 C ATOM 189 C HIS A 14 8.229 8.571 5.993 1.00 0.00 C ATOM 190 O HIS A 14 9.177 9.238 5.588 1.00 0.00 O ATOM 191 CB HIS A 14 8.682 8.733 8.443 1.00 0.00 C ATOM 192 CG HIS A 14 7.880 8.502 9.686 1.00 0.00 C ATOM 193 ND1 HIS A 14 6.516 8.320 9.680 1.00 0.00 N ATOM 194 CD2 HIS A 14 8.255 8.461 10.986 1.00 0.00 C ATOM 195 CE1 HIS A 14 6.088 8.184 10.920 1.00 0.00 C ATOM 196 NE2 HIS A 14 7.122 8.263 11.733 1.00 0.00 N ATOM 0 H HIS A 14 10.275 7.199 6.776 1.00 0.00 H new ATOM 0 HA HIS A 14 7.406 7.295 7.549 1.00 0.00 H new ATOM 0 HB2 HIS A 14 9.740 8.629 8.683 1.00 0.00 H new ATOM 0 HB3 HIS A 14 8.530 9.760 8.112 1.00 0.00 H new ATOM 0 HD1 HIS A 14 5.928 8.294 8.847 1.00 0.00 H new ATOM 0 HD2 HIS A 14 9.261 8.565 11.365 1.00 0.00 H new ATOM 0 HE1 HIS A 14 5.061 8.033 11.219 1.00 0.00 H new ATOM 205 N PHE A 15 7.091 8.492 5.336 1.00 0.00 N ATOM 206 CA PHE A 15 6.984 9.014 3.983 1.00 0.00 C ATOM 207 C PHE A 15 5.606 9.581 3.735 1.00 0.00 C ATOM 208 O PHE A 15 4.658 9.231 4.430 1.00 0.00 O ATOM 209 CB PHE A 15 7.267 7.900 2.967 1.00 0.00 C ATOM 210 CG PHE A 15 6.155 6.890 2.827 1.00 0.00 C ATOM 211 CD1 PHE A 15 5.936 5.926 3.801 1.00 0.00 C ATOM 212 CD2 PHE A 15 5.322 6.912 1.717 1.00 0.00 C ATOM 213 CE1 PHE A 15 4.914 5.007 3.665 1.00 0.00 C ATOM 214 CE2 PHE A 15 4.299 5.995 1.580 1.00 0.00 C ATOM 215 CZ PHE A 15 4.096 5.041 2.555 1.00 0.00 C ATOM 0 H PHE A 15 6.236 8.078 5.707 1.00 0.00 H new ATOM 0 HA PHE A 15 7.718 9.811 3.866 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.456 8.352 1.993 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.179 7.380 3.260 1.00 0.00 H new ATOM 0 HD1 PHE A 15 6.571 5.894 4.674 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.476 7.657 0.950 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.755 4.260 4.429 1.00 0.00 H new ATOM 0 HE2 PHE A 15 3.659 6.025 0.711 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.298 4.321 2.450 1.00 0.00 H new ATOM 225 N THR A 16 5.487 10.450 2.751 1.00 0.00 N ATOM 226 CA THR A 16 4.191 10.961 2.355 1.00 0.00 C ATOM 227 C THR A 16 4.026 10.839 0.848 1.00 0.00 C ATOM 228 O THR A 16 4.907 11.234 0.080 1.00 0.00 O ATOM 229 CB THR A 16 4.006 12.431 2.784 1.00 0.00 C ATOM 230 OG1 THR A 16 4.138 12.549 4.208 1.00 0.00 O ATOM 231 CG2 THR A 16 2.647 12.964 2.354 1.00 0.00 C ATOM 0 H THR A 16 6.271 10.816 2.212 1.00 0.00 H new ATOM 0 HA THR A 16 3.428 10.366 2.858 1.00 0.00 H new ATOM 0 HB THR A 16 4.779 13.022 2.294 1.00 0.00 H new ATOM 0 HG1 THR A 16 3.260 12.434 4.629 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.547 14.002 2.671 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.560 12.906 1.269 1.00 0.00 H new ATOM 0 HG23 THR A 16 1.860 12.367 2.814 1.00 0.00 H new ATOM 239 N LEU A 17 2.908 10.276 0.427 1.00 0.00 N ATOM 240 CA LEU A 17 2.644 10.084 -0.981 1.00 0.00 C ATOM 241 C LEU A 17 1.805 11.209 -1.551 1.00 0.00 C ATOM 242 O LEU A 17 0.837 11.669 -0.941 1.00 0.00 O ATOM 243 CB LEU A 17 1.977 8.736 -1.237 1.00 0.00 C ATOM 244 CG LEU A 17 2.950 7.620 -1.600 1.00 0.00 C ATOM 245 CD1 LEU A 17 2.238 6.289 -1.708 1.00 0.00 C ATOM 246 CD2 LEU A 17 3.640 7.943 -2.909 1.00 0.00 C ATOM 0 H LEU A 17 2.168 9.944 1.045 1.00 0.00 H new ATOM 0 HA LEU A 17 3.606 10.094 -1.493 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.420 8.443 -0.347 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.252 8.848 -2.043 1.00 0.00 H new ATOM 0 HG LEU A 17 3.693 7.545 -0.806 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.957 5.512 -1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.772 6.047 -0.753 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.472 6.348 -2.481 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.334 7.141 -3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 17 2.895 8.041 -3.699 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.189 8.880 -2.810 1.00 0.00 H new ATOM 258 N LYS A 18 2.183 11.616 -2.742 1.00 0.00 N ATOM 259 CA LYS A 18 1.555 12.736 -3.419 1.00 0.00 C ATOM 260 C LYS A 18 1.009 12.292 -4.758 1.00 0.00 C ATOM 261 O LYS A 18 1.550 11.393 -5.387 1.00 0.00 O ATOM 262 CB LYS A 18 2.559 13.877 -3.628 1.00 0.00 C ATOM 263 CG LYS A 18 2.524 14.960 -2.555 1.00 0.00 C ATOM 264 CD LYS A 18 2.637 14.383 -1.164 1.00 0.00 C ATOM 265 CE LYS A 18 2.719 15.477 -0.115 1.00 0.00 C ATOM 266 NZ LYS A 18 1.403 16.119 0.144 1.00 0.00 N ATOM 0 H LYS A 18 2.937 11.180 -3.273 1.00 0.00 H new ATOM 0 HA LYS A 18 0.738 13.098 -2.795 1.00 0.00 H new ATOM 0 HB2 LYS A 18 3.564 13.456 -3.668 1.00 0.00 H new ATOM 0 HB3 LYS A 18 2.368 14.338 -4.597 1.00 0.00 H new ATOM 0 HG2 LYS A 18 3.340 15.663 -2.723 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.595 15.524 -2.639 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.776 13.747 -0.961 1.00 0.00 H new ATOM 0 HD3 LYS A 18 3.522 13.750 -1.102 1.00 0.00 H new ATOM 0 HE2 LYS A 18 3.103 15.056 0.814 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.431 16.235 -0.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 1.507 16.835 0.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.062 16.574 -0.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 0.719 15.397 0.449 1.00 0.00 H new ATOM 280 N LEU A 19 -0.079 12.902 -5.165 1.00 0.00 N ATOM 281 CA LEU A 19 -0.597 12.720 -6.507 1.00 0.00 C ATOM 282 C LEU A 19 0.138 13.655 -7.442 1.00 0.00 C ATOM 283 O LEU A 19 0.850 14.547 -6.983 1.00 0.00 O ATOM 284 CB LEU A 19 -2.104 13.006 -6.575 1.00 0.00 C ATOM 285 CG LEU A 19 -3.035 11.885 -6.105 1.00 0.00 C ATOM 286 CD1 LEU A 19 -2.751 10.606 -6.872 1.00 0.00 C ATOM 287 CD2 LEU A 19 -2.911 11.657 -4.611 1.00 0.00 C ATOM 0 H LEU A 19 -0.629 13.534 -4.583 1.00 0.00 H new ATOM 0 HA LEU A 19 -0.442 11.682 -6.801 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.310 13.894 -5.977 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.358 13.251 -7.606 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.062 12.190 -6.308 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -3.421 9.818 -6.527 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.911 10.777 -7.937 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.718 10.303 -6.704 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.584 10.855 -4.308 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.885 11.380 -4.369 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.174 12.572 -4.080 1.00 0.00 H new ATOM 299 N ASP A 20 -0.035 13.485 -8.737 1.00 0.00 N ATOM 300 CA ASP A 20 0.605 14.383 -9.686 1.00 0.00 C ATOM 301 C ASP A 20 -0.030 15.766 -9.590 1.00 0.00 C ATOM 302 O ASP A 20 0.602 16.782 -9.880 1.00 0.00 O ATOM 303 CB ASP A 20 0.503 13.838 -11.109 1.00 0.00 C ATOM 304 CG ASP A 20 1.421 14.572 -12.063 1.00 0.00 C ATOM 305 OD1 ASP A 20 2.652 14.529 -11.858 1.00 0.00 O ATOM 306 OD2 ASP A 20 0.920 15.188 -13.025 1.00 0.00 O ATOM 0 H ASP A 20 -0.603 12.748 -9.155 1.00 0.00 H new ATOM 0 HA ASP A 20 1.664 14.460 -9.438 1.00 0.00 H new ATOM 0 HB2 ASP A 20 0.752 12.777 -11.110 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.526 13.924 -11.458 1.00 0.00 H new ATOM 311 N ASP A 21 -1.279 15.788 -9.138 1.00 0.00 N ATOM 312 CA ASP A 21 -2.004 17.034 -8.904 1.00 0.00 C ATOM 313 C ASP A 21 -1.590 17.650 -7.563 1.00 0.00 C ATOM 314 O ASP A 21 -2.078 18.705 -7.168 1.00 0.00 O ATOM 315 CB ASP A 21 -3.515 16.771 -8.926 1.00 0.00 C ATOM 316 CG ASP A 21 -4.343 18.042 -8.992 1.00 0.00 C ATOM 317 OD1 ASP A 21 -4.616 18.521 -10.116 1.00 0.00 O ATOM 318 OD2 ASP A 21 -4.742 18.558 -7.927 1.00 0.00 O ATOM 0 H ASP A 21 -1.816 14.948 -8.924 1.00 0.00 H new ATOM 0 HA ASP A 21 -1.756 17.739 -9.697 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.755 16.144 -9.784 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.793 16.210 -8.033 1.00 0.00 H new ATOM 323 N GLY A 22 -0.665 16.988 -6.874 1.00 0.00 N ATOM 324 CA GLY A 22 -0.169 17.484 -5.605 1.00 0.00 C ATOM 325 C GLY A 22 -1.140 17.266 -4.458 1.00 0.00 C ATOM 326 O GLY A 22 -1.117 17.994 -3.465 1.00 0.00 O ATOM 0 H GLY A 22 -0.247 16.108 -7.177 1.00 0.00 H new ATOM 0 HA2 GLY A 22 0.775 16.990 -5.373 1.00 0.00 H new ATOM 0 HA3 GLY A 22 0.043 18.549 -5.696 1.00 0.00 H new ATOM 330 N THR A 23 -1.992 16.265 -4.599 1.00 0.00 N ATOM 331 CA THR A 23 -2.863 15.829 -3.515 1.00 0.00 C ATOM 332 C THR A 23 -2.151 14.749 -2.697 1.00 0.00 C ATOM 333 O THR A 23 -1.255 14.087 -3.204 1.00 0.00 O ATOM 334 CB THR A 23 -4.185 15.266 -4.078 1.00 0.00 C ATOM 335 OG1 THR A 23 -4.720 16.166 -5.053 1.00 0.00 O ATOM 336 CG2 THR A 23 -5.213 15.050 -2.976 1.00 0.00 C ATOM 0 H THR A 23 -2.101 15.733 -5.462 1.00 0.00 H new ATOM 0 HA THR A 23 -3.092 16.684 -2.879 1.00 0.00 H new ATOM 0 HB THR A 23 -3.967 14.302 -4.539 1.00 0.00 H new ATOM 0 HG1 THR A 23 -5.558 15.803 -5.408 1.00 0.00 H new ATOM 0 HG21 THR A 23 -6.132 14.653 -3.408 1.00 0.00 H new ATOM 0 HG22 THR A 23 -4.820 14.343 -2.246 1.00 0.00 H new ATOM 0 HG23 THR A 23 -5.424 16.000 -2.484 1.00 0.00 H new ATOM 344 N THR A 24 -2.507 14.586 -1.436 1.00 0.00 N ATOM 345 CA THR A 24 -1.913 13.541 -0.618 1.00 0.00 C ATOM 346 C THR A 24 -2.731 12.253 -0.716 1.00 0.00 C ATOM 347 O THR A 24 -3.912 12.228 -0.377 1.00 0.00 O ATOM 348 CB THR A 24 -1.802 13.988 0.852 1.00 0.00 C ATOM 349 OG1 THR A 24 -1.058 15.213 0.925 1.00 0.00 O ATOM 350 CG2 THR A 24 -1.116 12.929 1.701 1.00 0.00 C ATOM 0 H THR A 24 -3.201 15.160 -0.957 1.00 0.00 H new ATOM 0 HA THR A 24 -0.909 13.349 -0.996 1.00 0.00 H new ATOM 0 HB THR A 24 -2.810 14.137 1.240 1.00 0.00 H new ATOM 0 HG1 THR A 24 -0.622 15.279 1.800 1.00 0.00 H new ATOM 0 HG21 THR A 24 -1.053 13.275 2.733 1.00 0.00 H new ATOM 0 HG22 THR A 24 -1.691 12.004 1.663 1.00 0.00 H new ATOM 0 HG23 THR A 24 -0.112 12.749 1.317 1.00 0.00 H new ATOM 358 N ALA A 25 -2.098 11.197 -1.219 1.00 0.00 N ATOM 359 CA ALA A 25 -2.758 9.904 -1.354 1.00 0.00 C ATOM 360 C ALA A 25 -2.683 9.137 -0.048 1.00 0.00 C ATOM 361 O ALA A 25 -3.679 8.612 0.447 1.00 0.00 O ATOM 362 CB ALA A 25 -2.114 9.086 -2.464 1.00 0.00 C ATOM 0 H ALA A 25 -1.130 11.212 -1.539 1.00 0.00 H new ATOM 0 HA ALA A 25 -3.803 10.081 -1.608 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -2.621 8.125 -2.549 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -2.197 9.625 -3.408 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -1.062 8.922 -2.232 1.00 0.00 H new ATOM 368 N GLU A 26 -1.483 9.084 0.495 1.00 0.00 N ATOM 369 CA GLU A 26 -1.223 8.386 1.735 1.00 0.00 C ATOM 370 C GLU A 26 -0.055 9.046 2.439 1.00 0.00 C ATOM 371 O GLU A 26 1.040 9.117 1.889 1.00 0.00 O ATOM 372 CB GLU A 26 -0.895 6.918 1.448 1.00 0.00 C ATOM 373 CG GLU A 26 -0.440 6.137 2.669 1.00 0.00 C ATOM 374 CD GLU A 26 -1.519 6.020 3.720 1.00 0.00 C ATOM 375 OE1 GLU A 26 -2.315 5.063 3.650 1.00 0.00 O ATOM 376 OE2 GLU A 26 -1.580 6.883 4.620 1.00 0.00 O ATOM 0 H GLU A 26 -0.659 9.526 0.086 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.107 8.430 2.371 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.777 6.435 1.028 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.114 6.872 0.689 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -0.128 5.139 2.362 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.433 6.625 3.103 1.00 0.00 H new ATOM 383 N SER A 27 -0.273 9.542 3.637 1.00 0.00 N ATOM 384 CA SER A 27 0.811 10.135 4.381 1.00 0.00 C ATOM 385 C SER A 27 1.151 9.279 5.586 1.00 0.00 C ATOM 386 O SER A 27 0.481 9.330 6.611 1.00 0.00 O ATOM 387 CB SER A 27 0.460 11.550 4.829 1.00 0.00 C ATOM 388 OG SER A 27 1.610 12.208 5.337 1.00 0.00 O ATOM 0 H SER A 27 -1.177 9.546 4.109 1.00 0.00 H new ATOM 0 HA SER A 27 1.680 10.190 3.725 1.00 0.00 H new ATOM 0 HB2 SER A 27 0.052 12.113 3.990 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.314 11.514 5.595 1.00 0.00 H new ATOM 0 HG SER A 27 1.371 13.116 5.616 1.00 0.00 H new ATOM 394 N THR A 28 2.207 8.508 5.462 1.00 0.00 N ATOM 395 CA THR A 28 2.696 7.706 6.556 1.00 0.00 C ATOM 396 C THR A 28 3.846 8.439 7.245 1.00 0.00 C ATOM 397 O THR A 28 4.952 7.919 7.434 1.00 0.00 O ATOM 398 CB THR A 28 3.156 6.337 6.049 1.00 0.00 C ATOM 399 OG1 THR A 28 2.101 5.733 5.289 1.00 0.00 O ATOM 400 CG2 THR A 28 3.518 5.445 7.208 1.00 0.00 C ATOM 0 H THR A 28 2.749 8.420 4.602 1.00 0.00 H new ATOM 0 HA THR A 28 1.892 7.547 7.275 1.00 0.00 H new ATOM 0 HB THR A 28 4.036 6.468 5.419 1.00 0.00 H new ATOM 0 HG1 THR A 28 2.462 5.385 4.447 1.00 0.00 H new ATOM 0 HG21 THR A 28 3.843 4.475 6.833 1.00 0.00 H new ATOM 0 HG22 THR A 28 4.325 5.902 7.780 1.00 0.00 H new ATOM 0 HG23 THR A 28 2.648 5.312 7.851 1.00 0.00 H new ATOM 408 N ARG A 29 3.582 9.680 7.587 1.00 0.00 N ATOM 409 CA ARG A 29 4.584 10.535 8.193 1.00 0.00 C ATOM 410 C ARG A 29 3.951 11.445 9.241 1.00 0.00 C ATOM 411 O ARG A 29 4.165 11.252 10.434 1.00 0.00 O ATOM 412 CB ARG A 29 5.306 11.340 7.105 1.00 0.00 C ATOM 413 CG ARG A 29 6.489 12.151 7.607 1.00 0.00 C ATOM 414 CD ARG A 29 7.521 12.372 6.509 1.00 0.00 C ATOM 415 NE ARG A 29 6.948 12.996 5.316 1.00 0.00 N ATOM 416 CZ ARG A 29 7.534 12.983 4.115 1.00 0.00 C ATOM 417 NH1 ARG A 29 8.683 12.344 3.937 1.00 0.00 N ATOM 418 NH2 ARG A 29 6.964 13.602 3.090 1.00 0.00 N ATOM 0 H ARG A 29 2.674 10.125 7.455 1.00 0.00 H new ATOM 0 HA ARG A 29 5.322 9.917 8.704 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.653 10.654 6.332 1.00 0.00 H new ATOM 0 HB3 ARG A 29 4.591 12.015 6.635 1.00 0.00 H new ATOM 0 HG2 ARG A 29 6.140 13.114 7.978 1.00 0.00 H new ATOM 0 HG3 ARG A 29 6.955 11.635 8.447 1.00 0.00 H new ATOM 0 HD2 ARG A 29 8.325 13.000 6.892 1.00 0.00 H new ATOM 0 HD3 ARG A 29 7.966 11.415 6.236 1.00 0.00 H new ATOM 0 HE ARG A 29 6.049 13.469 5.406 1.00 0.00 H new ATOM 0 HH11 ARG A 29 9.124 11.859 4.719 1.00 0.00 H new ATOM 0 HH12 ARG A 29 9.126 12.337 3.018 1.00 0.00 H new ATOM 0 HH21 ARG A 29 6.077 14.089 3.218 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.413 13.591 2.174 1.00 0.00 H new ATOM 432 N ASN A 30 3.117 12.389 8.806 1.00 0.00 N ATOM 433 CA ASN A 30 2.499 13.340 9.736 1.00 0.00 C ATOM 434 C ASN A 30 1.288 12.738 10.449 1.00 0.00 C ATOM 435 O ASN A 30 0.317 13.438 10.745 1.00 0.00 O ATOM 436 CB ASN A 30 2.098 14.645 9.033 1.00 0.00 C ATOM 437 CG ASN A 30 1.217 14.436 7.814 1.00 0.00 C ATOM 438 OD1 ASN A 30 1.712 14.371 6.692 1.00 0.00 O ATOM 439 ND2 ASN A 30 -0.086 14.323 8.022 1.00 0.00 N ATOM 0 H ASN A 30 2.855 12.517 7.829 1.00 0.00 H new ATOM 0 HA ASN A 30 3.256 13.570 10.485 1.00 0.00 H new ATOM 0 HB2 ASN A 30 1.574 15.284 9.744 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.000 15.177 8.731 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -0.717 14.176 7.234 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -0.458 14.383 8.970 1.00 0.00 H new ATOM 446 N ASN A 31 1.347 11.442 10.719 1.00 0.00 N ATOM 447 CA ASN A 31 0.328 10.778 11.524 1.00 0.00 C ATOM 448 C ASN A 31 0.963 10.182 12.771 1.00 0.00 C ATOM 449 O ASN A 31 0.270 9.686 13.657 1.00 0.00 O ATOM 450 CB ASN A 31 -0.383 9.663 10.746 1.00 0.00 C ATOM 451 CG ASN A 31 -1.207 10.165 9.580 1.00 0.00 C ATOM 452 OD1 ASN A 31 -1.658 11.309 9.557 1.00 0.00 O ATOM 453 ND2 ASN A 31 -1.429 9.294 8.612 1.00 0.00 N ATOM 0 H ASN A 31 2.092 10.826 10.392 1.00 0.00 H new ATOM 0 HA ASN A 31 -0.412 11.530 11.795 1.00 0.00 H new ATOM 0 HB2 ASN A 31 0.362 8.958 10.376 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -1.032 9.113 11.428 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -1.994 9.561 7.806 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -1.036 8.355 8.671 1.00 0.00 H new ATOM 460 N GLY A 32 2.291 10.219 12.827 1.00 0.00 N ATOM 461 CA GLY A 32 3.008 9.631 13.938 1.00 0.00 C ATOM 462 C GLY A 32 3.129 8.129 13.792 1.00 0.00 C ATOM 463 O GLY A 32 3.605 7.441 14.692 1.00 0.00 O ATOM 0 H GLY A 32 2.884 10.649 12.117 1.00 0.00 H new ATOM 0 HA2 GLY A 32 4.003 10.072 14.004 1.00 0.00 H new ATOM 0 HA3 GLY A 32 2.493 9.866 14.869 1.00 0.00 H new ATOM 467 N LYS A 33 2.693 7.622 12.648 1.00 0.00 N ATOM 468 CA LYS A 33 2.713 6.193 12.385 1.00 0.00 C ATOM 469 C LYS A 33 3.681 5.867 11.255 1.00 0.00 C ATOM 470 O LYS A 33 3.472 6.292 10.121 1.00 0.00 O ATOM 471 CB LYS A 33 1.311 5.699 12.013 1.00 0.00 C ATOM 472 CG LYS A 33 0.285 5.842 13.126 1.00 0.00 C ATOM 473 CD LYS A 33 0.685 5.038 14.356 1.00 0.00 C ATOM 474 CE LYS A 33 -0.393 5.071 15.430 1.00 0.00 C ATOM 475 NZ LYS A 33 -0.576 6.430 16.001 1.00 0.00 N ATOM 0 H LYS A 33 2.319 8.184 11.884 1.00 0.00 H new ATOM 0 HA LYS A 33 3.044 5.688 13.293 1.00 0.00 H new ATOM 0 HB2 LYS A 33 0.963 6.251 11.140 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.372 4.650 11.723 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.181 6.893 13.394 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.689 5.506 12.771 1.00 0.00 H new ATOM 0 HD2 LYS A 33 0.879 4.005 14.067 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.615 5.435 14.763 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.336 4.727 15.006 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.130 4.376 16.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.283 6.394 16.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.329 6.770 16.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.902 7.078 15.256 1.00 0.00 H new ATOM 489 N PRO A 34 4.782 5.163 11.554 1.00 0.00 N ATOM 490 CA PRO A 34 5.698 4.654 10.537 1.00 0.00 C ATOM 491 C PRO A 34 5.184 3.387 9.876 1.00 0.00 C ATOM 492 O PRO A 34 4.207 2.780 10.321 1.00 0.00 O ATOM 493 CB PRO A 34 6.984 4.344 11.310 1.00 0.00 C ATOM 494 CG PRO A 34 6.761 4.878 12.682 1.00 0.00 C ATOM 495 CD PRO A 34 5.276 4.853 12.898 1.00 0.00 C ATOM 0 HA PRO A 34 5.831 5.377 9.732 1.00 0.00 H new ATOM 0 HB2 PRO A 34 7.179 3.272 11.333 1.00 0.00 H new ATOM 0 HB3 PRO A 34 7.847 4.815 10.841 1.00 0.00 H new ATOM 0 HG2 PRO A 34 7.274 4.269 13.426 1.00 0.00 H new ATOM 0 HG3 PRO A 34 7.152 5.891 12.775 1.00 0.00 H new ATOM 0 HD2 PRO A 34 4.929 3.881 13.249 1.00 0.00 H new ATOM 0 HD3 PRO A 34 4.956 5.591 13.633 1.00 0.00 H new ATOM 503 N ALA A 35 5.857 3.000 8.815 1.00 0.00 N ATOM 504 CA ALA A 35 5.511 1.797 8.077 1.00 0.00 C ATOM 505 C ALA A 35 6.773 1.132 7.563 1.00 0.00 C ATOM 506 O ALA A 35 7.818 1.777 7.463 1.00 0.00 O ATOM 507 CB ALA A 35 4.580 2.134 6.922 1.00 0.00 C ATOM 0 H ALA A 35 6.658 3.506 8.437 1.00 0.00 H new ATOM 0 HA ALA A 35 4.993 1.107 8.744 1.00 0.00 H new ATOM 0 HB1 ALA A 35 4.330 1.223 6.379 1.00 0.00 H new ATOM 0 HB2 ALA A 35 3.668 2.587 7.310 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.074 2.834 6.248 1.00 0.00 H new ATOM 513 N LEU A 36 6.689 -0.152 7.261 1.00 0.00 N ATOM 514 CA LEU A 36 7.819 -0.863 6.707 1.00 0.00 C ATOM 515 C LEU A 36 7.575 -1.183 5.247 1.00 0.00 C ATOM 516 O LEU A 36 6.490 -1.626 4.873 1.00 0.00 O ATOM 517 CB LEU A 36 8.084 -2.155 7.475 1.00 0.00 C ATOM 518 CG LEU A 36 9.328 -2.911 7.015 1.00 0.00 C ATOM 519 CD1 LEU A 36 10.306 -3.044 8.163 1.00 0.00 C ATOM 520 CD2 LEU A 36 8.955 -4.275 6.456 1.00 0.00 C ATOM 0 H LEU A 36 5.851 -0.719 7.391 1.00 0.00 H new ATOM 0 HA LEU A 36 8.694 -0.219 6.795 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.186 -1.921 8.535 1.00 0.00 H new ATOM 0 HB3 LEU A 36 7.217 -2.809 7.375 1.00 0.00 H new ATOM 0 HG LEU A 36 9.806 -2.345 6.216 1.00 0.00 H new ATOM 0 HD11 LEU A 36 11.191 -3.585 7.827 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.597 -2.052 8.510 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.836 -3.591 8.980 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.857 -4.796 6.135 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.454 -4.860 7.227 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.286 -4.149 5.605 1.00 0.00 H new ATOM 532 N PHE A 37 8.578 -0.942 4.426 1.00 0.00 N ATOM 533 CA PHE A 37 8.518 -1.320 3.025 1.00 0.00 C ATOM 534 C PHE A 37 9.204 -2.656 2.821 1.00 0.00 C ATOM 535 O PHE A 37 10.321 -2.871 3.295 1.00 0.00 O ATOM 536 CB PHE A 37 9.161 -0.251 2.139 1.00 0.00 C ATOM 537 CG PHE A 37 8.242 0.888 1.799 1.00 0.00 C ATOM 538 CD1 PHE A 37 7.147 1.184 2.596 1.00 0.00 C ATOM 539 CD2 PHE A 37 8.471 1.659 0.673 1.00 0.00 C ATOM 540 CE1 PHE A 37 6.302 2.226 2.275 1.00 0.00 C ATOM 541 CE2 PHE A 37 7.629 2.704 0.349 1.00 0.00 C ATOM 542 CZ PHE A 37 6.544 2.987 1.150 1.00 0.00 C ATOM 0 H PHE A 37 9.447 -0.485 4.704 1.00 0.00 H new ATOM 0 HA PHE A 37 7.470 -1.409 2.737 1.00 0.00 H new ATOM 0 HB2 PHE A 37 10.043 0.144 2.644 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.505 -0.717 1.215 1.00 0.00 H new ATOM 0 HD1 PHE A 37 6.953 0.592 3.478 1.00 0.00 H new ATOM 0 HD2 PHE A 37 9.318 1.441 0.040 1.00 0.00 H new ATOM 0 HE1 PHE A 37 5.452 2.446 2.904 1.00 0.00 H new ATOM 0 HE2 PHE A 37 7.821 3.299 -0.532 1.00 0.00 H new ATOM 0 HZ PHE A 37 5.884 3.804 0.897 1.00 0.00 H new ATOM 552 N ARG A 38 8.526 -3.558 2.134 1.00 0.00 N ATOM 553 CA ARG A 38 9.052 -4.892 1.919 1.00 0.00 C ATOM 554 C ARG A 38 9.393 -5.079 0.451 1.00 0.00 C ATOM 555 O ARG A 38 8.504 -5.188 -0.396 1.00 0.00 O ATOM 556 CB ARG A 38 8.034 -5.946 2.359 1.00 0.00 C ATOM 557 CG ARG A 38 8.669 -7.238 2.837 1.00 0.00 C ATOM 558 CD ARG A 38 9.175 -7.097 4.260 1.00 0.00 C ATOM 559 NE ARG A 38 8.082 -7.060 5.228 1.00 0.00 N ATOM 560 CZ ARG A 38 8.142 -7.606 6.439 1.00 0.00 C ATOM 561 NH1 ARG A 38 9.239 -8.240 6.836 1.00 0.00 N ATOM 562 NH2 ARG A 38 7.098 -7.515 7.252 1.00 0.00 N ATOM 0 H ARG A 38 7.611 -3.390 1.716 1.00 0.00 H new ATOM 0 HA ARG A 38 9.956 -5.013 2.516 1.00 0.00 H new ATOM 0 HB2 ARG A 38 7.420 -5.534 3.160 1.00 0.00 H new ATOM 0 HB3 ARG A 38 7.366 -6.165 1.526 1.00 0.00 H new ATOM 0 HG2 ARG A 38 7.941 -8.047 2.784 1.00 0.00 H new ATOM 0 HG3 ARG A 38 9.494 -7.508 2.178 1.00 0.00 H new ATOM 0 HD2 ARG A 38 9.838 -7.930 4.493 1.00 0.00 H new ATOM 0 HD3 ARG A 38 9.766 -6.185 4.346 1.00 0.00 H new ATOM 0 HE ARG A 38 7.220 -6.586 4.959 1.00 0.00 H new ATOM 0 HH11 ARG A 38 10.042 -8.310 6.211 1.00 0.00 H new ATOM 0 HH12 ARG A 38 9.279 -8.657 7.766 1.00 0.00 H new ATOM 0 HH21 ARG A 38 6.255 -7.028 6.947 1.00 0.00 H new ATOM 0 HH22 ARG A 38 7.138 -7.932 8.182 1.00 0.00 H new ATOM 576 N LEU A 39 10.677 -5.112 0.151 1.00 0.00 N ATOM 577 CA LEU A 39 11.126 -5.245 -1.225 1.00 0.00 C ATOM 578 C LEU A 39 11.132 -6.708 -1.627 1.00 0.00 C ATOM 579 O LEU A 39 11.239 -7.595 -0.780 1.00 0.00 O ATOM 580 CB LEU A 39 12.523 -4.655 -1.421 1.00 0.00 C ATOM 581 CG LEU A 39 12.816 -3.387 -0.626 1.00 0.00 C ATOM 582 CD1 LEU A 39 14.206 -2.858 -0.934 1.00 0.00 C ATOM 583 CD2 LEU A 39 11.776 -2.316 -0.885 1.00 0.00 C ATOM 0 H LEU A 39 11.428 -5.049 0.839 1.00 0.00 H new ATOM 0 HA LEU A 39 10.432 -4.690 -1.856 1.00 0.00 H new ATOM 0 HB2 LEU A 39 13.259 -5.411 -1.150 1.00 0.00 H new ATOM 0 HB3 LEU A 39 12.662 -4.439 -2.480 1.00 0.00 H new ATOM 0 HG LEU A 39 12.773 -3.651 0.431 1.00 0.00 H new ATOM 0 HD11 LEU A 39 14.388 -1.954 -0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 39 14.948 -3.612 -0.673 1.00 0.00 H new ATOM 0 HD13 LEU A 39 14.281 -2.628 -1.997 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.016 -1.427 -0.302 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.770 -2.064 -1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.793 -2.686 -0.594 1.00 0.00 H new ATOM 595 N GLY A 40 11.010 -6.948 -2.911 1.00 0.00 N ATOM 596 CA GLY A 40 10.982 -8.301 -3.427 1.00 0.00 C ATOM 597 C GLY A 40 9.577 -8.775 -3.734 1.00 0.00 C ATOM 598 O GLY A 40 9.267 -9.959 -3.564 1.00 0.00 O ATOM 0 H GLY A 40 10.928 -6.222 -3.623 1.00 0.00 H new ATOM 0 HA2 GLY A 40 11.586 -8.354 -4.333 1.00 0.00 H new ATOM 0 HA3 GLY A 40 11.438 -8.973 -2.700 1.00 0.00 H new ATOM 602 N ASP A 41 8.726 -7.844 -4.171 1.00 0.00 N ATOM 603 CA ASP A 41 7.334 -8.141 -4.551 1.00 0.00 C ATOM 604 C ASP A 41 6.502 -8.645 -3.376 1.00 0.00 C ATOM 605 O ASP A 41 5.365 -9.079 -3.559 1.00 0.00 O ATOM 606 CB ASP A 41 7.269 -9.172 -5.685 1.00 0.00 C ATOM 607 CG ASP A 41 7.644 -8.613 -7.040 1.00 0.00 C ATOM 608 OD1 ASP A 41 6.755 -8.087 -7.739 1.00 0.00 O ATOM 609 OD2 ASP A 41 8.823 -8.734 -7.429 1.00 0.00 O ATOM 0 H ASP A 41 8.978 -6.861 -4.273 1.00 0.00 H new ATOM 0 HA ASP A 41 6.912 -7.195 -4.892 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.935 -10.002 -5.448 1.00 0.00 H new ATOM 0 HB3 ASP A 41 6.259 -9.578 -5.737 1.00 0.00 H new ATOM 614 N ALA A 42 7.061 -8.587 -2.175 1.00 0.00 N ATOM 615 CA ALA A 42 6.387 -9.104 -0.991 1.00 0.00 C ATOM 616 C ALA A 42 5.153 -8.281 -0.642 1.00 0.00 C ATOM 617 O ALA A 42 4.173 -8.807 -0.113 1.00 0.00 O ATOM 618 CB ALA A 42 7.351 -9.138 0.182 1.00 0.00 C ATOM 0 H ALA A 42 7.981 -8.186 -1.994 1.00 0.00 H new ATOM 0 HA ALA A 42 6.053 -10.118 -1.211 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.839 -9.526 1.063 1.00 0.00 H new ATOM 0 HB2 ALA A 42 8.196 -9.783 -0.060 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.711 -8.130 0.386 1.00 0.00 H new ATOM 624 N SER A 43 5.199 -6.995 -0.942 1.00 0.00 N ATOM 625 CA SER A 43 4.088 -6.112 -0.633 1.00 0.00 C ATOM 626 C SER A 43 3.806 -5.162 -1.790 1.00 0.00 C ATOM 627 O SER A 43 2.754 -5.238 -2.423 1.00 0.00 O ATOM 628 CB SER A 43 4.401 -5.331 0.638 1.00 0.00 C ATOM 629 OG SER A 43 5.707 -4.788 0.585 1.00 0.00 O ATOM 0 H SER A 43 5.990 -6.540 -1.397 1.00 0.00 H new ATOM 0 HA SER A 43 3.193 -6.714 -0.475 1.00 0.00 H new ATOM 0 HB2 SER A 43 3.674 -4.529 0.766 1.00 0.00 H new ATOM 0 HB3 SER A 43 4.309 -5.986 1.505 1.00 0.00 H new ATOM 0 HG SER A 43 5.780 -4.050 1.225 1.00 0.00 H new ATOM 635 N LEU A 44 4.754 -4.276 -2.063 1.00 0.00 N ATOM 636 CA LEU A 44 4.609 -3.303 -3.133 1.00 0.00 C ATOM 637 C LEU A 44 5.057 -3.902 -4.459 1.00 0.00 C ATOM 638 O LEU A 44 5.445 -5.072 -4.525 1.00 0.00 O ATOM 639 CB LEU A 44 5.407 -2.028 -2.825 1.00 0.00 C ATOM 640 CG LEU A 44 4.831 -1.129 -1.718 1.00 0.00 C ATOM 641 CD1 LEU A 44 4.974 -1.771 -0.347 1.00 0.00 C ATOM 642 CD2 LEU A 44 5.512 0.225 -1.729 1.00 0.00 C ATOM 0 H LEU A 44 5.636 -4.212 -1.554 1.00 0.00 H new ATOM 0 HA LEU A 44 3.555 -3.035 -3.209 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.420 -2.315 -2.543 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.485 -1.441 -3.740 1.00 0.00 H new ATOM 0 HG LEU A 44 3.768 -0.998 -1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.556 -1.108 0.411 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.439 -2.721 -0.332 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.029 -1.945 -0.135 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.093 0.849 -0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.581 0.096 -1.561 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.352 0.705 -2.695 1.00 0.00 H new ATOM 654 N SER A 45 4.998 -3.104 -5.513 1.00 0.00 N ATOM 655 CA SER A 45 5.329 -3.583 -6.842 1.00 0.00 C ATOM 656 C SER A 45 6.780 -3.268 -7.207 1.00 0.00 C ATOM 657 O SER A 45 7.417 -2.436 -6.551 1.00 0.00 O ATOM 658 CB SER A 45 4.366 -2.981 -7.865 1.00 0.00 C ATOM 659 OG SER A 45 3.024 -3.274 -7.514 1.00 0.00 O ATOM 0 H SER A 45 4.724 -2.122 -5.472 1.00 0.00 H new ATOM 0 HA SER A 45 5.223 -4.668 -6.851 1.00 0.00 H new ATOM 0 HB2 SER A 45 4.508 -1.901 -7.916 1.00 0.00 H new ATOM 0 HB3 SER A 45 4.584 -3.378 -8.856 1.00 0.00 H new ATOM 0 HG SER A 45 2.419 -2.881 -8.177 1.00 0.00 H new ATOM 665 N GLU A 46 7.293 -3.929 -8.240 1.00 0.00 N ATOM 666 CA GLU A 46 8.711 -3.843 -8.597 1.00 0.00 C ATOM 667 C GLU A 46 9.199 -2.403 -8.749 1.00 0.00 C ATOM 668 O GLU A 46 10.282 -2.059 -8.269 1.00 0.00 O ATOM 669 CB GLU A 46 8.984 -4.604 -9.895 1.00 0.00 C ATOM 670 CG GLU A 46 8.707 -6.091 -9.799 1.00 0.00 C ATOM 671 CD GLU A 46 9.146 -6.839 -11.036 1.00 0.00 C ATOM 672 OE1 GLU A 46 10.335 -7.210 -11.118 1.00 0.00 O ATOM 673 OE2 GLU A 46 8.307 -7.071 -11.929 1.00 0.00 O ATOM 0 H GLU A 46 6.746 -4.535 -8.851 1.00 0.00 H new ATOM 0 HA GLU A 46 9.262 -4.295 -7.772 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.371 -4.180 -10.690 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.025 -4.455 -10.181 1.00 0.00 H new ATOM 0 HG2 GLU A 46 9.222 -6.498 -8.929 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.640 -6.250 -9.641 1.00 0.00 H new ATOM 680 N GLY A 47 8.383 -1.558 -9.365 1.00 0.00 N ATOM 681 CA GLY A 47 8.840 -0.236 -9.744 1.00 0.00 C ATOM 682 C GLY A 47 9.246 0.595 -8.548 1.00 0.00 C ATOM 683 O GLY A 47 10.265 1.286 -8.580 1.00 0.00 O ATOM 0 H GLY A 47 7.414 -1.764 -9.609 1.00 0.00 H new ATOM 0 HA2 GLY A 47 9.687 -0.328 -10.424 1.00 0.00 H new ATOM 0 HA3 GLY A 47 8.048 0.278 -10.289 1.00 0.00 H new ATOM 687 N LEU A 48 8.457 0.517 -7.485 1.00 0.00 N ATOM 688 CA LEU A 48 8.731 1.275 -6.279 1.00 0.00 C ATOM 689 C LEU A 48 10.082 0.887 -5.679 1.00 0.00 C ATOM 690 O LEU A 48 10.940 1.746 -5.461 1.00 0.00 O ATOM 691 CB LEU A 48 7.598 1.060 -5.261 1.00 0.00 C ATOM 692 CG LEU A 48 7.692 1.874 -3.960 1.00 0.00 C ATOM 693 CD1 LEU A 48 8.649 1.227 -2.975 1.00 0.00 C ATOM 694 CD2 LEU A 48 8.147 3.288 -4.257 1.00 0.00 C ATOM 0 H LEU A 48 7.621 -0.066 -7.437 1.00 0.00 H new ATOM 0 HA LEU A 48 8.779 2.333 -6.536 1.00 0.00 H new ATOM 0 HB2 LEU A 48 6.651 1.298 -5.746 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.566 0.002 -5.002 1.00 0.00 H new ATOM 0 HG LEU A 48 6.699 1.899 -3.511 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.694 1.825 -2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 48 8.298 0.224 -2.732 1.00 0.00 H new ATOM 0 HD13 LEU A 48 9.643 1.166 -3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.209 3.853 -3.327 1.00 0.00 H new ATOM 0 HD22 LEU A 48 9.128 3.262 -4.732 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.432 3.767 -4.926 1.00 0.00 H new ATOM 706 N GLU A 49 10.286 -0.401 -5.442 1.00 0.00 N ATOM 707 CA GLU A 49 11.480 -0.858 -4.748 1.00 0.00 C ATOM 708 C GLU A 49 12.728 -0.663 -5.593 1.00 0.00 C ATOM 709 O GLU A 49 13.773 -0.288 -5.072 1.00 0.00 O ATOM 710 CB GLU A 49 11.343 -2.328 -4.341 1.00 0.00 C ATOM 711 CG GLU A 49 11.092 -3.271 -5.504 1.00 0.00 C ATOM 712 CD GLU A 49 11.229 -4.723 -5.108 1.00 0.00 C ATOM 713 OE1 GLU A 49 12.368 -5.172 -4.882 1.00 0.00 O ATOM 714 OE2 GLU A 49 10.201 -5.425 -5.012 1.00 0.00 O ATOM 0 H GLU A 49 9.644 -1.144 -5.718 1.00 0.00 H new ATOM 0 HA GLU A 49 11.584 -0.251 -3.848 1.00 0.00 H new ATOM 0 HB2 GLU A 49 12.252 -2.638 -3.825 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.524 -2.422 -3.628 1.00 0.00 H new ATOM 0 HG2 GLU A 49 10.091 -3.098 -5.899 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.795 -3.048 -6.307 1.00 0.00 H new ATOM 721 N GLN A 50 12.615 -0.875 -6.899 1.00 0.00 N ATOM 722 CA GLN A 50 13.767 -0.790 -7.781 1.00 0.00 C ATOM 723 C GLN A 50 14.308 0.638 -7.854 1.00 0.00 C ATOM 724 O GLN A 50 15.405 0.871 -8.355 1.00 0.00 O ATOM 725 CB GLN A 50 13.410 -1.290 -9.176 1.00 0.00 C ATOM 726 CG GLN A 50 13.038 -2.765 -9.231 1.00 0.00 C ATOM 727 CD GLN A 50 14.147 -3.681 -8.754 1.00 0.00 C ATOM 728 OE1 GLN A 50 15.010 -4.091 -9.531 1.00 0.00 O ATOM 729 NE2 GLN A 50 14.114 -4.040 -7.480 1.00 0.00 N ATOM 0 H GLN A 50 11.739 -1.106 -7.367 1.00 0.00 H new ATOM 0 HA GLN A 50 14.549 -1.426 -7.367 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.576 -0.701 -9.559 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.256 -1.115 -9.841 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.151 -2.932 -8.620 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.774 -3.028 -10.255 1.00 0.00 H new ATOM 0 HE21 GLN A 50 13.383 -3.679 -6.867 1.00 0.00 H new ATOM 0 HE22 GLN A 50 14.820 -4.678 -7.111 1.00 0.00 H new ATOM 738 N HIS A 51 13.535 1.591 -7.346 1.00 0.00 N ATOM 739 CA HIS A 51 13.962 2.985 -7.310 1.00 0.00 C ATOM 740 C HIS A 51 14.400 3.372 -5.904 1.00 0.00 C ATOM 741 O HIS A 51 14.864 4.485 -5.665 1.00 0.00 O ATOM 742 CB HIS A 51 12.841 3.908 -7.791 1.00 0.00 C ATOM 743 CG HIS A 51 12.586 3.809 -9.263 1.00 0.00 C ATOM 744 ND1 HIS A 51 12.414 4.908 -10.079 1.00 0.00 N ATOM 745 CD2 HIS A 51 12.468 2.727 -10.066 1.00 0.00 C ATOM 746 CE1 HIS A 51 12.198 4.502 -11.316 1.00 0.00 C ATOM 747 NE2 HIS A 51 12.227 3.186 -11.333 1.00 0.00 N ATOM 0 H HIS A 51 12.609 1.424 -6.953 1.00 0.00 H new ATOM 0 HA HIS A 51 14.812 3.098 -7.983 1.00 0.00 H new ATOM 0 HB2 HIS A 51 11.924 3.666 -7.253 1.00 0.00 H new ATOM 0 HB3 HIS A 51 13.095 4.938 -7.541 1.00 0.00 H new ATOM 0 HD2 HIS A 51 12.549 1.693 -9.764 1.00 0.00 H new ATOM 0 HE1 HIS A 51 12.027 5.141 -12.170 1.00 0.00 H new ATOM 0 HE2 HIS A 51 12.092 2.602 -12.158 1.00 0.00 H new ATOM 756 N LEU A 52 14.244 2.442 -4.977 1.00 0.00 N ATOM 757 CA LEU A 52 14.661 2.650 -3.601 1.00 0.00 C ATOM 758 C LEU A 52 15.975 1.934 -3.310 1.00 0.00 C ATOM 759 O LEU A 52 16.604 2.178 -2.287 1.00 0.00 O ATOM 760 CB LEU A 52 13.566 2.179 -2.641 1.00 0.00 C ATOM 761 CG LEU A 52 12.553 3.249 -2.239 1.00 0.00 C ATOM 762 CD1 LEU A 52 11.453 2.632 -1.400 1.00 0.00 C ATOM 763 CD2 LEU A 52 13.237 4.367 -1.467 1.00 0.00 C ATOM 0 H LEU A 52 13.828 1.528 -5.155 1.00 0.00 H new ATOM 0 HA LEU A 52 14.824 3.717 -3.451 1.00 0.00 H new ATOM 0 HB2 LEU A 52 13.031 1.350 -3.104 1.00 0.00 H new ATOM 0 HB3 LEU A 52 14.038 1.790 -1.739 1.00 0.00 H new ATOM 0 HG LEU A 52 12.115 3.671 -3.143 1.00 0.00 H new ATOM 0 HD11 LEU A 52 10.735 3.402 -1.118 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.947 1.858 -1.976 1.00 0.00 H new ATOM 0 HD13 LEU A 52 11.885 2.191 -0.501 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.500 5.121 -1.189 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.697 3.959 -0.567 1.00 0.00 H new ATOM 0 HD23 LEU A 52 14.005 4.824 -2.092 1.00 0.00 H new ATOM 775 N LEU A 53 16.392 1.068 -4.228 1.00 0.00 N ATOM 776 CA LEU A 53 17.645 0.351 -4.106 1.00 0.00 C ATOM 777 C LEU A 53 18.827 1.307 -4.005 1.00 0.00 C ATOM 778 O LEU A 53 18.909 2.299 -4.734 1.00 0.00 O ATOM 779 CB LEU A 53 17.807 -0.550 -5.325 1.00 0.00 C ATOM 780 CG LEU A 53 17.259 -1.971 -5.183 1.00 0.00 C ATOM 781 CD1 LEU A 53 16.016 -2.031 -4.313 1.00 0.00 C ATOM 782 CD2 LEU A 53 16.969 -2.564 -6.550 1.00 0.00 C ATOM 0 H LEU A 53 15.868 0.847 -5.075 1.00 0.00 H new ATOM 0 HA LEU A 53 17.626 -0.243 -3.192 1.00 0.00 H new ATOM 0 HB2 LEU A 53 17.314 -0.074 -6.173 1.00 0.00 H new ATOM 0 HB3 LEU A 53 18.868 -0.613 -5.568 1.00 0.00 H new ATOM 0 HG LEU A 53 18.029 -2.561 -4.686 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.669 -3.062 -4.246 1.00 0.00 H new ATOM 0 HD12 LEU A 53 16.252 -1.662 -3.315 1.00 0.00 H new ATOM 0 HD13 LEU A 53 15.234 -1.413 -4.753 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.580 -3.575 -6.433 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.231 -1.948 -7.065 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.888 -2.595 -7.136 1.00 0.00 H new ATOM 794 N GLY A 54 19.738 0.997 -3.093 1.00 0.00 N ATOM 795 CA GLY A 54 20.907 1.826 -2.890 1.00 0.00 C ATOM 796 C GLY A 54 20.727 2.848 -1.782 1.00 0.00 C ATOM 797 O GLY A 54 21.669 3.564 -1.443 1.00 0.00 O ATOM 0 H GLY A 54 19.686 0.179 -2.486 1.00 0.00 H new ATOM 0 HA2 GLY A 54 21.760 1.190 -2.654 1.00 0.00 H new ATOM 0 HA3 GLY A 54 21.143 2.344 -3.819 1.00 0.00 H new ATOM 801 N LEU A 55 19.526 2.927 -1.210 1.00 0.00 N ATOM 802 CA LEU A 55 19.276 3.848 -0.107 1.00 0.00 C ATOM 803 C LEU A 55 19.957 3.369 1.166 1.00 0.00 C ATOM 804 O LEU A 55 20.378 2.220 1.263 1.00 0.00 O ATOM 805 CB LEU A 55 17.775 4.029 0.127 1.00 0.00 C ATOM 806 CG LEU A 55 17.162 5.295 -0.483 1.00 0.00 C ATOM 807 CD1 LEU A 55 17.741 6.539 0.177 1.00 0.00 C ATOM 808 CD2 LEU A 55 17.392 5.335 -1.988 1.00 0.00 C ATOM 0 H LEU A 55 18.719 2.369 -1.490 1.00 0.00 H new ATOM 0 HA LEU A 55 19.699 4.815 -0.380 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.254 3.162 -0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.590 4.038 1.201 1.00 0.00 H new ATOM 0 HG LEU A 55 16.087 5.275 -0.302 1.00 0.00 H new ATOM 0 HD11 LEU A 55 17.295 7.428 -0.268 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.523 6.519 1.245 1.00 0.00 H new ATOM 0 HD13 LEU A 55 18.820 6.561 0.028 1.00 0.00 H new ATOM 0 HD21 LEU A 55 16.949 6.242 -2.400 1.00 0.00 H new ATOM 0 HD22 LEU A 55 18.463 5.329 -2.193 1.00 0.00 H new ATOM 0 HD23 LEU A 55 16.929 4.463 -2.450 1.00 0.00 H new ATOM 820 N LYS A 56 20.064 4.261 2.133 1.00 0.00 N ATOM 821 CA LYS A 56 20.779 3.990 3.363 1.00 0.00 C ATOM 822 C LYS A 56 20.004 4.612 4.529 1.00 0.00 C ATOM 823 O LYS A 56 19.223 5.542 4.327 1.00 0.00 O ATOM 824 CB LYS A 56 22.197 4.573 3.220 1.00 0.00 C ATOM 825 CG LYS A 56 23.199 4.140 4.277 1.00 0.00 C ATOM 826 CD LYS A 56 23.055 4.956 5.547 1.00 0.00 C ATOM 827 CE LYS A 56 24.290 4.884 6.424 1.00 0.00 C ATOM 828 NZ LYS A 56 24.141 5.709 7.651 1.00 0.00 N ATOM 0 H LYS A 56 19.656 5.195 2.086 1.00 0.00 H new ATOM 0 HA LYS A 56 20.865 2.922 3.562 1.00 0.00 H new ATOM 0 HB2 LYS A 56 22.587 4.295 2.241 1.00 0.00 H new ATOM 0 HB3 LYS A 56 22.126 5.661 3.237 1.00 0.00 H new ATOM 0 HG2 LYS A 56 23.056 3.084 4.504 1.00 0.00 H new ATOM 0 HG3 LYS A 56 24.211 4.248 3.887 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.858 5.996 5.287 1.00 0.00 H new ATOM 0 HD3 LYS A 56 22.192 4.599 6.109 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.478 3.847 6.703 1.00 0.00 H new ATOM 0 HE3 LYS A 56 25.158 5.225 5.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 24.783 6.526 7.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 23.159 6.044 7.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.376 5.135 8.486 1.00 0.00 H new ATOM 842 N VAL A 57 20.184 4.072 5.731 1.00 0.00 N ATOM 843 CA VAL A 57 19.502 4.586 6.918 1.00 0.00 C ATOM 844 C VAL A 57 19.855 6.050 7.173 1.00 0.00 C ATOM 845 O VAL A 57 21.024 6.413 7.294 1.00 0.00 O ATOM 846 CB VAL A 57 19.841 3.748 8.173 1.00 0.00 C ATOM 847 CG1 VAL A 57 19.447 4.478 9.446 1.00 0.00 C ATOM 848 CG2 VAL A 57 19.155 2.401 8.120 1.00 0.00 C ATOM 0 H VAL A 57 20.797 3.277 5.910 1.00 0.00 H new ATOM 0 HA VAL A 57 18.432 4.510 6.724 1.00 0.00 H new ATOM 0 HB VAL A 57 20.920 3.595 8.183 1.00 0.00 H new ATOM 0 HG11 VAL A 57 19.698 3.863 10.310 1.00 0.00 H new ATOM 0 HG12 VAL A 57 19.986 5.424 9.505 1.00 0.00 H new ATOM 0 HG13 VAL A 57 18.374 4.671 9.437 1.00 0.00 H new ATOM 0 HG21 VAL A 57 19.408 1.829 9.013 1.00 0.00 H new ATOM 0 HG22 VAL A 57 18.075 2.544 8.074 1.00 0.00 H new ATOM 0 HG23 VAL A 57 19.487 1.858 7.235 1.00 0.00 H new ATOM 858 N GLY A 58 18.825 6.875 7.279 1.00 0.00 N ATOM 859 CA GLY A 58 19.022 8.296 7.465 1.00 0.00 C ATOM 860 C GLY A 58 19.321 9.012 6.165 1.00 0.00 C ATOM 861 O GLY A 58 19.873 10.112 6.166 1.00 0.00 O ATOM 0 H GLY A 58 17.849 6.582 7.239 1.00 0.00 H new ATOM 0 HA2 GLY A 58 18.129 8.728 7.917 1.00 0.00 H new ATOM 0 HA3 GLY A 58 19.843 8.458 8.163 1.00 0.00 H new ATOM 865 N ASP A 59 18.974 8.388 5.053 1.00 0.00 N ATOM 866 CA ASP A 59 19.135 9.018 3.755 1.00 0.00 C ATOM 867 C ASP A 59 17.781 9.352 3.156 1.00 0.00 C ATOM 868 O ASP A 59 16.786 8.674 3.418 1.00 0.00 O ATOM 869 CB ASP A 59 19.953 8.140 2.803 1.00 0.00 C ATOM 870 CG ASP A 59 21.447 8.298 3.017 1.00 0.00 C ATOM 871 OD1 ASP A 59 22.005 7.629 3.907 1.00 0.00 O ATOM 872 OD2 ASP A 59 22.073 9.105 2.298 1.00 0.00 O ATOM 0 H ASP A 59 18.580 7.448 5.023 1.00 0.00 H new ATOM 0 HA ASP A 59 19.688 9.946 3.899 1.00 0.00 H new ATOM 0 HB2 ASP A 59 19.676 7.096 2.946 1.00 0.00 H new ATOM 0 HB3 ASP A 59 19.706 8.397 1.773 1.00 0.00 H new ATOM 877 N LYS A 60 17.756 10.406 2.356 1.00 0.00 N ATOM 878 CA LYS A 60 16.513 10.967 1.849 1.00 0.00 C ATOM 879 C LYS A 60 16.456 10.818 0.334 1.00 0.00 C ATOM 880 O LYS A 60 17.436 11.116 -0.356 1.00 0.00 O ATOM 881 CB LYS A 60 16.441 12.452 2.220 1.00 0.00 C ATOM 882 CG LYS A 60 17.285 12.815 3.441 1.00 0.00 C ATOM 883 CD LYS A 60 16.560 12.562 4.750 1.00 0.00 C ATOM 884 CE LYS A 60 15.582 13.682 5.064 1.00 0.00 C ATOM 885 NZ LYS A 60 16.265 14.995 5.224 1.00 0.00 N ATOM 0 H LYS A 60 18.593 10.896 2.040 1.00 0.00 H new ATOM 0 HA LYS A 60 15.670 10.435 2.291 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.772 13.048 1.369 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.402 12.721 2.413 1.00 0.00 H new ATOM 0 HG2 LYS A 60 18.209 12.236 3.424 1.00 0.00 H new ATOM 0 HG3 LYS A 60 17.566 13.866 3.384 1.00 0.00 H new ATOM 0 HD2 LYS A 60 16.025 11.614 4.695 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.285 12.472 5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 60 14.844 13.753 4.265 1.00 0.00 H new ATOM 0 HE3 LYS A 60 15.039 13.443 5.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 15.687 15.616 5.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 17.195 14.851 5.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 16.391 15.437 4.291 1.00 0.00 H new ATOM 899 N THR A 61 15.333 10.353 -0.188 1.00 0.00 N ATOM 900 CA THR A 61 15.182 10.207 -1.624 1.00 0.00 C ATOM 901 C THR A 61 13.763 10.544 -2.069 1.00 0.00 C ATOM 902 O THR A 61 12.777 10.122 -1.458 1.00 0.00 O ATOM 903 CB THR A 61 15.566 8.785 -2.098 1.00 0.00 C ATOM 904 OG1 THR A 61 15.542 8.716 -3.532 1.00 0.00 O ATOM 905 CG2 THR A 61 14.625 7.735 -1.519 1.00 0.00 C ATOM 0 H THR A 61 14.518 10.072 0.358 1.00 0.00 H new ATOM 0 HA THR A 61 15.868 10.916 -2.088 1.00 0.00 H new ATOM 0 HB THR A 61 16.575 8.577 -1.741 1.00 0.00 H new ATOM 0 HG1 THR A 61 15.788 7.812 -3.820 1.00 0.00 H new ATOM 0 HG21 THR A 61 14.922 6.747 -1.871 1.00 0.00 H new ATOM 0 HG22 THR A 61 14.675 7.762 -0.430 1.00 0.00 H new ATOM 0 HG23 THR A 61 13.605 7.944 -1.841 1.00 0.00 H new ATOM 913 N THR A 62 13.666 11.316 -3.134 1.00 0.00 N ATOM 914 CA THR A 62 12.383 11.648 -3.710 1.00 0.00 C ATOM 915 C THR A 62 12.371 11.235 -5.178 1.00 0.00 C ATOM 916 O THR A 62 13.320 11.505 -5.915 1.00 0.00 O ATOM 917 CB THR A 62 12.107 13.157 -3.586 1.00 0.00 C ATOM 918 OG1 THR A 62 12.466 13.616 -2.272 1.00 0.00 O ATOM 919 CG2 THR A 62 10.641 13.460 -3.836 1.00 0.00 C ATOM 0 H THR A 62 14.465 11.725 -3.618 1.00 0.00 H new ATOM 0 HA THR A 62 11.601 11.113 -3.171 1.00 0.00 H new ATOM 0 HB THR A 62 12.708 13.674 -4.335 1.00 0.00 H new ATOM 0 HG1 THR A 62 11.736 13.423 -1.647 1.00 0.00 H new ATOM 0 HG21 THR A 62 10.470 14.532 -3.743 1.00 0.00 H new ATOM 0 HG22 THR A 62 10.368 13.135 -4.840 1.00 0.00 H new ATOM 0 HG23 THR A 62 10.030 12.930 -3.105 1.00 0.00 H new ATOM 927 N PHE A 63 11.312 10.558 -5.591 1.00 0.00 N ATOM 928 CA PHE A 63 11.205 10.074 -6.960 1.00 0.00 C ATOM 929 C PHE A 63 9.751 9.951 -7.392 1.00 0.00 C ATOM 930 O PHE A 63 8.869 9.694 -6.578 1.00 0.00 O ATOM 931 CB PHE A 63 11.927 8.722 -7.110 1.00 0.00 C ATOM 932 CG PHE A 63 11.529 7.669 -6.105 1.00 0.00 C ATOM 933 CD1 PHE A 63 12.150 7.600 -4.864 1.00 0.00 C ATOM 934 CD2 PHE A 63 10.544 6.742 -6.403 1.00 0.00 C ATOM 935 CE1 PHE A 63 11.792 6.635 -3.946 1.00 0.00 C ATOM 936 CE2 PHE A 63 10.185 5.772 -5.485 1.00 0.00 C ATOM 937 CZ PHE A 63 10.809 5.720 -4.258 1.00 0.00 C ATOM 0 H PHE A 63 10.513 10.330 -4.999 1.00 0.00 H new ATOM 0 HA PHE A 63 11.686 10.804 -7.611 1.00 0.00 H new ATOM 0 HB2 PHE A 63 11.738 8.336 -8.112 1.00 0.00 H new ATOM 0 HB3 PHE A 63 13.001 8.890 -7.031 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.923 8.312 -4.615 1.00 0.00 H new ATOM 0 HD2 PHE A 63 10.051 6.777 -7.363 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.281 6.596 -2.984 1.00 0.00 H new ATOM 0 HE2 PHE A 63 9.415 5.055 -5.730 1.00 0.00 H new ATOM 0 HZ PHE A 63 10.528 4.963 -3.541 1.00 0.00 H new ATOM 947 N SER A 64 9.508 10.145 -8.676 1.00 0.00 N ATOM 948 CA SER A 64 8.171 10.011 -9.226 1.00 0.00 C ATOM 949 C SER A 64 7.995 8.622 -9.826 1.00 0.00 C ATOM 950 O SER A 64 8.974 7.981 -10.213 1.00 0.00 O ATOM 951 CB SER A 64 7.921 11.083 -10.287 1.00 0.00 C ATOM 952 OG SER A 64 8.244 12.371 -9.787 1.00 0.00 O ATOM 0 H SER A 64 10.222 10.397 -9.359 1.00 0.00 H new ATOM 0 HA SER A 64 7.445 10.145 -8.424 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.520 10.871 -11.173 1.00 0.00 H new ATOM 0 HB3 SER A 64 6.876 11.059 -10.595 1.00 0.00 H new ATOM 0 HG SER A 64 7.521 12.687 -9.206 1.00 0.00 H new ATOM 958 N LEU A 65 6.755 8.171 -9.917 1.00 0.00 N ATOM 959 CA LEU A 65 6.462 6.837 -10.415 1.00 0.00 C ATOM 960 C LEU A 65 5.101 6.800 -11.084 1.00 0.00 C ATOM 961 O LEU A 65 4.127 7.362 -10.575 1.00 0.00 O ATOM 962 CB LEU A 65 6.507 5.801 -9.287 1.00 0.00 C ATOM 963 CG LEU A 65 7.905 5.357 -8.848 1.00 0.00 C ATOM 964 CD1 LEU A 65 7.802 4.379 -7.697 1.00 0.00 C ATOM 965 CD2 LEU A 65 8.666 4.719 -10.005 1.00 0.00 C ATOM 0 H LEU A 65 5.932 8.712 -9.651 1.00 0.00 H new ATOM 0 HA LEU A 65 7.228 6.587 -11.149 1.00 0.00 H new ATOM 0 HB2 LEU A 65 5.988 6.211 -8.421 1.00 0.00 H new ATOM 0 HB3 LEU A 65 5.949 4.920 -9.605 1.00 0.00 H new ATOM 0 HG LEU A 65 8.455 6.240 -8.523 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.802 4.069 -7.392 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.298 4.857 -6.857 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.232 3.505 -8.012 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.655 4.413 -9.665 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.119 3.846 -10.363 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.768 5.441 -10.815 1.00 0.00 H new ATOM 977 N GLU A 66 5.049 6.167 -12.244 1.00 0.00 N ATOM 978 CA GLU A 66 3.796 5.933 -12.934 1.00 0.00 C ATOM 979 C GLU A 66 2.999 4.892 -12.168 1.00 0.00 C ATOM 980 O GLU A 66 3.597 4.042 -11.515 1.00 0.00 O ATOM 981 CB GLU A 66 4.080 5.445 -14.352 1.00 0.00 C ATOM 982 CG GLU A 66 5.084 6.310 -15.093 1.00 0.00 C ATOM 983 CD GLU A 66 4.628 7.746 -15.230 1.00 0.00 C ATOM 984 OE1 GLU A 66 3.691 8.002 -16.014 1.00 0.00 O ATOM 985 OE2 GLU A 66 5.196 8.621 -14.542 1.00 0.00 O ATOM 0 H GLU A 66 5.869 5.804 -12.730 1.00 0.00 H new ATOM 0 HA GLU A 66 3.220 6.857 -12.990 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.454 4.422 -14.309 1.00 0.00 H new ATOM 0 HB3 GLU A 66 3.147 5.420 -14.914 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.038 6.285 -14.566 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.256 5.891 -16.085 1.00 0.00 H new ATOM 992 N PRO A 67 1.656 4.935 -12.216 1.00 0.00 N ATOM 993 CA PRO A 67 0.815 4.028 -11.436 1.00 0.00 C ATOM 994 C PRO A 67 1.251 2.572 -11.564 1.00 0.00 C ATOM 995 O PRO A 67 1.438 1.889 -10.556 1.00 0.00 O ATOM 996 CB PRO A 67 -0.593 4.221 -12.010 1.00 0.00 C ATOM 997 CG PRO A 67 -0.432 5.093 -13.216 1.00 0.00 C ATOM 998 CD PRO A 67 0.852 5.855 -13.025 1.00 0.00 C ATOM 0 HA PRO A 67 0.877 4.252 -10.371 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -1.040 3.263 -12.278 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -1.252 4.686 -11.277 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -0.396 4.494 -14.126 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -1.276 5.775 -13.317 1.00 0.00 H new ATOM 0 HD2 PRO A 67 1.333 6.083 -13.976 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.687 6.804 -12.515 1.00 0.00 H new ATOM 1006 N ASP A 68 1.453 2.119 -12.800 1.00 0.00 N ATOM 1007 CA ASP A 68 1.863 0.740 -13.062 1.00 0.00 C ATOM 1008 C ASP A 68 3.231 0.448 -12.453 1.00 0.00 C ATOM 1009 O ASP A 68 3.497 -0.666 -12.007 1.00 0.00 O ATOM 1010 CB ASP A 68 1.895 0.469 -14.570 1.00 0.00 C ATOM 1011 CG ASP A 68 2.344 -0.943 -14.905 1.00 0.00 C ATOM 1012 OD1 ASP A 68 1.502 -1.863 -14.876 1.00 0.00 O ATOM 1013 OD2 ASP A 68 3.544 -1.138 -15.204 1.00 0.00 O ATOM 0 H ASP A 68 1.339 2.689 -13.638 1.00 0.00 H new ATOM 0 HA ASP A 68 1.131 0.080 -12.596 1.00 0.00 H new ATOM 0 HB2 ASP A 68 0.902 0.638 -14.986 1.00 0.00 H new ATOM 0 HB3 ASP A 68 2.566 1.182 -15.048 1.00 0.00 H new ATOM 1018 N ALA A 69 4.080 1.465 -12.407 1.00 0.00 N ATOM 1019 CA ALA A 69 5.432 1.317 -11.886 1.00 0.00 C ATOM 1020 C ALA A 69 5.500 1.716 -10.415 1.00 0.00 C ATOM 1021 O ALA A 69 6.580 1.903 -9.857 1.00 0.00 O ATOM 1022 CB ALA A 69 6.404 2.151 -12.705 1.00 0.00 C ATOM 0 H ALA A 69 3.855 2.407 -12.726 1.00 0.00 H new ATOM 0 HA ALA A 69 5.713 0.267 -11.964 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.411 2.032 -12.306 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.383 1.819 -13.743 1.00 0.00 H new ATOM 0 HB3 ALA A 69 6.115 3.201 -12.654 1.00 0.00 H new ATOM 1028 N ALA A 70 4.340 1.854 -9.795 1.00 0.00 N ATOM 1029 CA ALA A 70 4.253 2.211 -8.390 1.00 0.00 C ATOM 1030 C ALA A 70 3.501 1.128 -7.629 1.00 0.00 C ATOM 1031 O ALA A 70 4.099 0.220 -7.054 1.00 0.00 O ATOM 1032 CB ALA A 70 3.577 3.568 -8.220 1.00 0.00 C ATOM 0 H ALA A 70 3.436 1.722 -10.249 1.00 0.00 H new ATOM 0 HA ALA A 70 5.260 2.289 -7.981 1.00 0.00 H new ATOM 0 HB1 ALA A 70 3.522 3.817 -7.160 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.155 4.330 -8.742 1.00 0.00 H new ATOM 0 HB3 ALA A 70 2.570 3.528 -8.636 1.00 0.00 H new ATOM 1095 N SER A 75 -6.731 -4.676 -12.244 1.00 0.00 N ATOM 1096 CA SER A 75 -8.011 -5.306 -12.040 1.00 0.00 C ATOM 1097 C SER A 75 -8.545 -5.723 -13.419 1.00 0.00 C ATOM 1098 O SER A 75 -9.581 -5.231 -13.860 1.00 0.00 O ATOM 1099 CB SER A 75 -8.975 -4.357 -11.331 1.00 0.00 C ATOM 1100 OG SER A 75 -8.450 -3.894 -10.099 1.00 0.00 O ATOM 0 HA SER A 75 -7.910 -6.182 -11.400 1.00 0.00 H new ATOM 0 HB2 SER A 75 -9.188 -3.506 -11.978 1.00 0.00 H new ATOM 0 HB3 SER A 75 -9.922 -4.867 -11.153 1.00 0.00 H new ATOM 0 HG SER A 75 -7.485 -3.749 -10.188 1.00 0.00 H new ATOM 1106 N PRO A 76 -7.853 -6.635 -14.122 1.00 0.00 N ATOM 1107 CA PRO A 76 -8.174 -6.959 -15.516 1.00 0.00 C ATOM 1108 C PRO A 76 -9.440 -7.784 -15.657 1.00 0.00 C ATOM 1109 O PRO A 76 -10.319 -7.479 -16.460 1.00 0.00 O ATOM 1110 CB PRO A 76 -6.970 -7.756 -16.005 1.00 0.00 C ATOM 1111 CG PRO A 76 -5.967 -7.738 -14.893 1.00 0.00 C ATOM 1112 CD PRO A 76 -6.727 -7.437 -13.634 1.00 0.00 C ATOM 0 HA PRO A 76 -8.361 -6.052 -16.092 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -7.256 -8.778 -16.253 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.554 -7.314 -16.910 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -5.456 -8.698 -14.817 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -5.202 -6.983 -15.074 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -7.063 -8.347 -13.137 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -6.119 -6.887 -12.916 1.00 0.00 H new ATOM 1120 N ASP A 77 -9.517 -8.835 -14.860 1.00 0.00 N ATOM 1121 CA ASP A 77 -10.639 -9.766 -14.898 1.00 0.00 C ATOM 1122 C ASP A 77 -11.911 -9.118 -14.365 1.00 0.00 C ATOM 1123 O ASP A 77 -12.984 -9.715 -14.391 1.00 0.00 O ATOM 1124 CB ASP A 77 -10.310 -11.029 -14.098 1.00 0.00 C ATOM 1125 CG ASP A 77 -10.005 -10.744 -12.640 1.00 0.00 C ATOM 1126 OD1 ASP A 77 -8.929 -10.171 -12.357 1.00 0.00 O ATOM 1127 OD2 ASP A 77 -10.831 -11.098 -11.772 1.00 0.00 O ATOM 0 H ASP A 77 -8.806 -9.070 -14.168 1.00 0.00 H new ATOM 0 HA ASP A 77 -10.812 -10.042 -15.938 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -11.150 -11.720 -14.159 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -9.453 -11.527 -14.552 1.00 0.00 H new ATOM 1132 N LEU A 78 -11.787 -7.889 -13.886 1.00 0.00 N ATOM 1133 CA LEU A 78 -12.934 -7.153 -13.383 1.00 0.00 C ATOM 1134 C LEU A 78 -13.528 -6.308 -14.500 1.00 0.00 C ATOM 1135 O LEU A 78 -14.494 -5.589 -14.301 1.00 0.00 O ATOM 1136 CB LEU A 78 -12.566 -6.236 -12.204 1.00 0.00 C ATOM 1137 CG LEU A 78 -11.901 -6.880 -10.991 1.00 0.00 C ATOM 1138 CD1 LEU A 78 -12.785 -7.977 -10.424 1.00 0.00 C ATOM 1139 CD2 LEU A 78 -10.530 -7.405 -11.338 1.00 0.00 C ATOM 0 H LEU A 78 -10.903 -7.382 -13.836 1.00 0.00 H new ATOM 0 HA LEU A 78 -13.659 -7.885 -13.027 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.901 -5.458 -12.578 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.477 -5.742 -11.865 1.00 0.00 H new ATOM 0 HG LEU A 78 -11.773 -6.117 -10.224 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -12.297 -8.427 -9.559 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -13.742 -7.553 -10.121 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -12.951 -8.740 -11.185 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -10.080 -7.858 -10.455 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -10.616 -8.153 -12.126 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -9.903 -6.583 -11.684 1.00 0.00 H new ATOM 1151 N ILE A 79 -12.967 -6.437 -15.685 1.00 0.00 N ATOM 1152 CA ILE A 79 -13.357 -5.591 -16.802 1.00 0.00 C ATOM 1153 C ILE A 79 -14.363 -6.315 -17.677 1.00 0.00 C ATOM 1154 O ILE A 79 -14.042 -7.292 -18.355 1.00 0.00 O ATOM 1155 CB ILE A 79 -12.140 -5.136 -17.617 1.00 0.00 C ATOM 1156 CG1 ILE A 79 -11.195 -4.366 -16.695 1.00 0.00 C ATOM 1157 CG2 ILE A 79 -12.570 -4.276 -18.805 1.00 0.00 C ATOM 1158 CD1 ILE A 79 -9.936 -3.913 -17.376 1.00 0.00 C ATOM 0 H ILE A 79 -12.240 -7.118 -15.903 1.00 0.00 H new ATOM 0 HA ILE A 79 -13.827 -4.693 -16.401 1.00 0.00 H new ATOM 0 HB ILE A 79 -11.624 -6.007 -18.021 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -11.717 -3.496 -16.296 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -10.933 -4.997 -15.846 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -11.689 -3.966 -19.367 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -13.229 -4.854 -19.453 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -13.099 -3.394 -18.443 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.311 -3.373 -16.664 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -9.393 -4.780 -17.751 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -10.189 -3.256 -18.208 1.00 0.00 H new ATOM 1170 N GLN A 80 -15.588 -5.835 -17.620 1.00 0.00 N ATOM 1171 CA GLN A 80 -16.727 -6.547 -18.186 1.00 0.00 C ATOM 1172 C GLN A 80 -17.556 -5.652 -19.102 1.00 0.00 C ATOM 1173 O GLN A 80 -17.823 -4.497 -18.770 1.00 0.00 O ATOM 1174 CB GLN A 80 -17.603 -7.044 -17.041 1.00 0.00 C ATOM 1175 CG GLN A 80 -16.832 -7.814 -15.984 1.00 0.00 C ATOM 1176 CD GLN A 80 -17.580 -7.906 -14.668 1.00 0.00 C ATOM 1177 OE1 GLN A 80 -18.809 -7.945 -14.642 1.00 0.00 O ATOM 1178 NE2 GLN A 80 -16.847 -7.927 -13.562 1.00 0.00 N ATOM 0 H GLN A 80 -15.827 -4.945 -17.183 1.00 0.00 H new ATOM 0 HA GLN A 80 -16.354 -7.378 -18.784 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -18.095 -6.191 -16.573 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -18.389 -7.683 -17.445 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -16.625 -8.819 -16.351 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -15.869 -7.331 -15.818 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -15.829 -7.893 -13.624 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -17.301 -7.977 -12.650 1.00 0.00 H new ATOM 1187 N TYR A 81 -17.943 -6.172 -20.261 1.00 0.00 N ATOM 1188 CA TYR A 81 -18.854 -5.449 -21.145 1.00 0.00 C ATOM 1189 C TYR A 81 -20.315 -5.793 -20.851 1.00 0.00 C ATOM 1190 O TYR A 81 -20.754 -6.934 -21.011 1.00 0.00 O ATOM 1191 CB TYR A 81 -18.541 -5.764 -22.610 1.00 0.00 C ATOM 1192 CG TYR A 81 -17.287 -5.098 -23.143 1.00 0.00 C ATOM 1193 CD1 TYR A 81 -16.106 -5.081 -22.411 1.00 0.00 C ATOM 1194 CD2 TYR A 81 -17.290 -4.485 -24.389 1.00 0.00 C ATOM 1195 CE1 TYR A 81 -14.967 -4.475 -22.904 1.00 0.00 C ATOM 1196 CE2 TYR A 81 -16.155 -3.878 -24.890 1.00 0.00 C ATOM 1197 CZ TYR A 81 -14.995 -3.876 -24.143 1.00 0.00 C ATOM 1198 OH TYR A 81 -13.859 -3.268 -24.635 1.00 0.00 O ATOM 0 H TYR A 81 -17.644 -7.083 -20.610 1.00 0.00 H new ATOM 0 HA TYR A 81 -18.708 -4.385 -20.961 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -18.440 -6.843 -22.723 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -19.388 -5.458 -23.223 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -16.078 -5.550 -21.439 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -18.196 -4.483 -24.977 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -14.059 -4.471 -22.320 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -16.175 -3.407 -25.862 1.00 0.00 H new ATOM 0 HH TYR A 81 -14.046 -2.894 -25.522 1.00 0.00 H new ATOM 1208 N PHE A 82 -21.041 -4.784 -20.395 1.00 0.00 N ATOM 1209 CA PHE A 82 -22.480 -4.886 -20.153 1.00 0.00 C ATOM 1210 C PHE A 82 -23.295 -4.225 -21.262 1.00 0.00 C ATOM 1211 O PHE A 82 -22.752 -3.559 -22.138 1.00 0.00 O ATOM 1212 CB PHE A 82 -22.833 -4.217 -18.830 1.00 0.00 C ATOM 1213 CG PHE A 82 -22.466 -5.000 -17.601 1.00 0.00 C ATOM 1214 CD1 PHE A 82 -21.141 -5.189 -17.238 1.00 0.00 C ATOM 1215 CD2 PHE A 82 -23.458 -5.524 -16.790 1.00 0.00 C ATOM 1216 CE1 PHE A 82 -20.818 -5.889 -16.092 1.00 0.00 C ATOM 1217 CE2 PHE A 82 -23.139 -6.228 -15.646 1.00 0.00 C ATOM 1218 CZ PHE A 82 -21.818 -6.409 -15.296 1.00 0.00 C ATOM 0 H PHE A 82 -20.651 -3.866 -20.180 1.00 0.00 H new ATOM 0 HA PHE A 82 -22.726 -5.948 -20.126 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -22.335 -3.248 -18.787 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -23.906 -4.025 -18.813 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -20.354 -4.785 -17.857 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -24.495 -5.380 -17.056 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -19.783 -6.029 -15.819 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -23.923 -6.636 -15.026 1.00 0.00 H new ATOM 0 HZ PHE A 82 -21.566 -6.957 -14.400 1.00 0.00 H new ATOM 1228 N SER A 83 -24.607 -4.439 -21.220 1.00 0.00 N ATOM 1229 CA SER A 83 -25.527 -3.825 -22.169 1.00 0.00 C ATOM 1230 C SER A 83 -26.002 -2.481 -21.633 1.00 0.00 C ATOM 1231 O SER A 83 -26.020 -2.257 -20.422 1.00 0.00 O ATOM 1232 CB SER A 83 -26.734 -4.737 -22.387 1.00 0.00 C ATOM 1233 OG SER A 83 -27.562 -4.259 -23.438 1.00 0.00 O ATOM 0 H SER A 83 -25.059 -5.040 -20.531 1.00 0.00 H new ATOM 0 HA SER A 83 -25.009 -3.676 -23.116 1.00 0.00 H new ATOM 0 HB2 SER A 83 -26.392 -5.745 -22.621 1.00 0.00 H new ATOM 0 HB3 SER A 83 -27.314 -4.802 -21.466 1.00 0.00 H new ATOM 0 HG SER A 83 -27.012 -3.792 -24.101 1.00 0.00 H new ATOM 1239 N ARG A 84 -26.417 -1.593 -22.538 1.00 0.00 N ATOM 1240 CA ARG A 84 -26.865 -0.255 -22.168 1.00 0.00 C ATOM 1241 C ARG A 84 -28.153 -0.285 -21.356 1.00 0.00 C ATOM 1242 O ARG A 84 -28.445 0.656 -20.625 1.00 0.00 O ATOM 1243 CB ARG A 84 -27.073 0.590 -23.429 1.00 0.00 C ATOM 1244 CG ARG A 84 -27.881 -0.125 -24.502 1.00 0.00 C ATOM 1245 CD ARG A 84 -28.218 0.784 -25.677 1.00 0.00 C ATOM 1246 NE ARG A 84 -29.362 1.654 -25.385 1.00 0.00 N ATOM 1247 CZ ARG A 84 -29.664 2.760 -26.068 1.00 0.00 C ATOM 1248 NH1 ARG A 84 -28.857 3.208 -27.022 1.00 0.00 N ATOM 1249 NH2 ARG A 84 -30.773 3.424 -25.786 1.00 0.00 N ATOM 0 H ARG A 84 -26.451 -1.782 -23.540 1.00 0.00 H new ATOM 0 HA ARG A 84 -26.090 0.188 -21.543 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -27.580 1.516 -23.158 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -26.101 0.866 -23.838 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -27.319 -0.987 -24.862 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -28.804 -0.506 -24.065 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -27.350 1.396 -25.923 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -28.439 0.176 -26.554 1.00 0.00 H new ATOM 0 HE ARG A 84 -29.968 1.396 -24.606 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -27.996 2.706 -27.239 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -29.098 4.054 -27.538 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -31.394 3.090 -25.049 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -31.007 4.270 -26.306 1.00 0.00 H new ATOM 1263 N ARG A 85 -28.910 -1.371 -21.461 1.00 0.00 N ATOM 1264 CA ARG A 85 -30.209 -1.454 -20.798 1.00 0.00 C ATOM 1265 C ARG A 85 -30.028 -1.595 -19.298 1.00 0.00 C ATOM 1266 O ARG A 85 -30.748 -0.986 -18.510 1.00 0.00 O ATOM 1267 CB ARG A 85 -31.032 -2.640 -21.318 1.00 0.00 C ATOM 1268 CG ARG A 85 -31.556 -2.470 -22.733 1.00 0.00 C ATOM 1269 CD ARG A 85 -30.495 -2.785 -23.768 1.00 0.00 C ATOM 1270 NE ARG A 85 -30.945 -2.485 -25.122 1.00 0.00 N ATOM 1271 CZ ARG A 85 -30.183 -2.634 -26.202 1.00 0.00 C ATOM 1272 NH1 ARG A 85 -28.960 -3.135 -26.091 1.00 0.00 N ATOM 1273 NH2 ARG A 85 -30.643 -2.297 -27.395 1.00 0.00 N ATOM 0 H ARG A 85 -28.651 -2.201 -21.994 1.00 0.00 H new ATOM 0 HA ARG A 85 -30.747 -0.532 -21.021 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -30.417 -3.539 -21.277 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -31.877 -2.802 -20.648 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -32.415 -3.123 -22.883 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -31.906 -1.447 -22.871 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -29.594 -2.211 -23.550 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -30.225 -3.839 -23.701 1.00 0.00 H new ATOM 0 HE ARG A 85 -31.897 -2.142 -25.248 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -28.602 -3.407 -25.176 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -28.378 -3.248 -26.921 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -31.586 -1.921 -27.490 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -30.055 -2.413 -28.220 1.00 0.00 H new ATOM 1287 N GLU A 86 -29.030 -2.381 -18.925 1.00 0.00 N ATOM 1288 CA GLU A 86 -28.777 -2.716 -17.531 1.00 0.00 C ATOM 1289 C GLU A 86 -28.393 -1.468 -16.746 1.00 0.00 C ATOM 1290 O GLU A 86 -28.683 -1.348 -15.555 1.00 0.00 O ATOM 1291 CB GLU A 86 -27.666 -3.769 -17.456 1.00 0.00 C ATOM 1292 CG GLU A 86 -27.941 -4.985 -18.330 1.00 0.00 C ATOM 1293 CD GLU A 86 -26.815 -6.001 -18.316 1.00 0.00 C ATOM 1294 OE1 GLU A 86 -26.808 -6.873 -17.422 1.00 0.00 O ATOM 1295 OE2 GLU A 86 -25.948 -5.948 -19.217 1.00 0.00 O ATOM 0 H GLU A 86 -28.372 -2.805 -19.579 1.00 0.00 H new ATOM 0 HA GLU A 86 -29.684 -3.125 -17.087 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -26.722 -3.316 -17.759 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -27.547 -4.091 -16.421 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -28.859 -5.466 -17.993 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -28.111 -4.656 -19.355 1.00 0.00 H new ATOM 1302 N PHE A 87 -27.761 -0.530 -17.436 1.00 0.00 N ATOM 1303 CA PHE A 87 -27.345 0.722 -16.828 1.00 0.00 C ATOM 1304 C PHE A 87 -28.431 1.768 -16.939 1.00 0.00 C ATOM 1305 O PHE A 87 -28.757 2.444 -15.970 1.00 0.00 O ATOM 1306 CB PHE A 87 -26.073 1.243 -17.494 1.00 0.00 C ATOM 1307 CG PHE A 87 -24.843 0.445 -17.181 1.00 0.00 C ATOM 1308 CD1 PHE A 87 -24.788 -0.913 -17.445 1.00 0.00 C ATOM 1309 CD2 PHE A 87 -23.735 1.060 -16.625 1.00 0.00 C ATOM 1310 CE1 PHE A 87 -23.653 -1.637 -17.159 1.00 0.00 C ATOM 1311 CE2 PHE A 87 -22.597 0.339 -16.339 1.00 0.00 C ATOM 1312 CZ PHE A 87 -22.556 -1.011 -16.608 1.00 0.00 C ATOM 0 H PHE A 87 -27.524 -0.615 -18.425 1.00 0.00 H new ATOM 0 HA PHE A 87 -27.150 0.528 -15.773 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -26.220 1.254 -18.574 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -25.911 2.275 -17.184 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -25.644 -1.409 -17.879 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -23.763 2.119 -16.413 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -23.622 -2.696 -17.367 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -21.739 0.831 -15.905 1.00 0.00 H new ATOM 0 HZ PHE A 87 -21.664 -1.579 -16.387 1.00 0.00 H new ATOM 1322 N MET A 88 -28.998 1.875 -18.127 1.00 0.00 N ATOM 1323 CA MET A 88 -29.988 2.903 -18.416 1.00 0.00 C ATOM 1324 C MET A 88 -31.217 2.744 -17.529 1.00 0.00 C ATOM 1325 O MET A 88 -31.915 3.718 -17.242 1.00 0.00 O ATOM 1326 CB MET A 88 -30.382 2.866 -19.888 1.00 0.00 C ATOM 1327 CG MET A 88 -31.330 3.979 -20.291 1.00 0.00 C ATOM 1328 SD MET A 88 -31.699 3.963 -22.055 1.00 0.00 S ATOM 1329 CE MET A 88 -30.077 4.306 -22.739 1.00 0.00 C ATOM 0 H MET A 88 -28.790 1.260 -18.913 1.00 0.00 H new ATOM 0 HA MET A 88 -29.540 3.873 -18.201 1.00 0.00 H new ATOM 0 HB2 MET A 88 -29.481 2.929 -20.498 1.00 0.00 H new ATOM 0 HB3 MET A 88 -30.849 1.906 -20.107 1.00 0.00 H new ATOM 0 HG2 MET A 88 -32.258 3.884 -19.728 1.00 0.00 H new ATOM 0 HG3 MET A 88 -30.892 4.940 -20.023 1.00 0.00 H new ATOM 0 HE1 MET A 88 -30.135 5.174 -23.396 1.00 0.00 H new ATOM 0 HE2 MET A 88 -29.376 4.510 -21.929 1.00 0.00 H new ATOM 0 HE3 MET A 88 -29.732 3.443 -23.309 1.00 0.00 H new ATOM 1339 N ASP A 89 -31.460 1.518 -17.080 1.00 0.00 N ATOM 1340 CA ASP A 89 -32.523 1.232 -16.121 1.00 0.00 C ATOM 1341 C ASP A 89 -32.360 2.086 -14.870 1.00 0.00 C ATOM 1342 O ASP A 89 -33.340 2.500 -14.248 1.00 0.00 O ATOM 1343 CB ASP A 89 -32.483 -0.251 -15.752 1.00 0.00 C ATOM 1344 CG ASP A 89 -33.459 -0.626 -14.653 1.00 0.00 C ATOM 1345 OD1 ASP A 89 -34.680 -0.445 -14.843 1.00 0.00 O ATOM 1346 OD2 ASP A 89 -33.006 -1.127 -13.600 1.00 0.00 O ATOM 0 H ASP A 89 -30.929 0.697 -17.368 1.00 0.00 H new ATOM 0 HA ASP A 89 -33.485 1.471 -16.574 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -32.702 -0.844 -16.640 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -31.473 -0.512 -15.435 1.00 0.00 H new ATOM 1351 N ALA A 90 -31.114 2.359 -14.522 1.00 0.00 N ATOM 1352 CA ALA A 90 -30.806 3.175 -13.360 1.00 0.00 C ATOM 1353 C ALA A 90 -30.242 4.533 -13.771 1.00 0.00 C ATOM 1354 O ALA A 90 -29.735 5.279 -12.934 1.00 0.00 O ATOM 1355 CB ALA A 90 -29.825 2.447 -12.455 1.00 0.00 C ATOM 0 H ALA A 90 -30.295 2.025 -15.031 1.00 0.00 H new ATOM 0 HA ALA A 90 -31.733 3.349 -12.813 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -29.601 3.068 -11.587 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -30.265 1.506 -12.124 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -28.905 2.245 -13.004 1.00 0.00 H new ATOM 1361 N GLY A 91 -30.337 4.854 -15.056 1.00 0.00 N ATOM 1362 CA GLY A 91 -29.815 6.114 -15.546 1.00 0.00 C ATOM 1363 C GLY A 91 -28.613 5.926 -16.446 1.00 0.00 C ATOM 1364 O GLY A 91 -27.735 5.113 -16.159 1.00 0.00 O ATOM 0 H GLY A 91 -30.767 4.263 -15.767 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -30.597 6.641 -16.093 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -29.538 6.744 -14.700 1.00 0.00 H new ATOM 1368 N GLU A 92 -28.577 6.687 -17.529 1.00 0.00 N ATOM 1369 CA GLU A 92 -27.515 6.575 -18.522 1.00 0.00 C ATOM 1370 C GLU A 92 -26.152 6.908 -17.920 1.00 0.00 C ATOM 1371 O GLU A 92 -25.976 7.953 -17.295 1.00 0.00 O ATOM 1372 CB GLU A 92 -27.807 7.490 -19.707 1.00 0.00 C ATOM 1373 CG GLU A 92 -29.089 7.128 -20.429 1.00 0.00 C ATOM 1374 CD GLU A 92 -29.292 7.925 -21.699 1.00 0.00 C ATOM 1375 OE1 GLU A 92 -28.825 7.475 -22.768 1.00 0.00 O ATOM 1376 OE2 GLU A 92 -29.919 9.004 -21.640 1.00 0.00 O ATOM 0 H GLU A 92 -29.278 7.396 -17.745 1.00 0.00 H new ATOM 0 HA GLU A 92 -27.484 5.541 -18.867 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -27.871 8.520 -19.357 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -26.975 7.444 -20.409 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -29.077 6.065 -20.671 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -29.935 7.294 -19.762 1.00 0.00 H new ATOM 1383 N PRO A 93 -25.169 6.014 -18.108 1.00 0.00 N ATOM 1384 CA PRO A 93 -23.834 6.179 -17.544 1.00 0.00 C ATOM 1385 C PRO A 93 -22.981 7.174 -18.333 1.00 0.00 C ATOM 1386 O PRO A 93 -23.319 7.537 -19.461 1.00 0.00 O ATOM 1387 CB PRO A 93 -23.230 4.777 -17.614 1.00 0.00 C ATOM 1388 CG PRO A 93 -24.052 3.991 -18.569 1.00 0.00 C ATOM 1389 CD PRO A 93 -25.286 4.788 -18.908 1.00 0.00 C ATOM 0 HA PRO A 93 -23.874 6.584 -16.533 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -22.193 4.821 -17.945 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -23.231 4.308 -16.630 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -23.481 3.775 -19.472 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -24.329 3.032 -18.130 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -25.332 5.013 -19.973 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -26.194 4.238 -18.659 1.00 0.00 H new ATOM 1397 N GLU A 94 -21.877 7.613 -17.736 1.00 0.00 N ATOM 1398 CA GLU A 94 -20.996 8.590 -18.370 1.00 0.00 C ATOM 1399 C GLU A 94 -19.616 7.998 -18.625 1.00 0.00 C ATOM 1400 O GLU A 94 -19.131 7.179 -17.849 1.00 0.00 O ATOM 1401 CB GLU A 94 -20.852 9.829 -17.487 1.00 0.00 C ATOM 1402 CG GLU A 94 -22.173 10.421 -17.042 1.00 0.00 C ATOM 1403 CD GLU A 94 -21.998 11.711 -16.273 1.00 0.00 C ATOM 1404 OE1 GLU A 94 -21.607 12.727 -16.887 1.00 0.00 O ATOM 1405 OE2 GLU A 94 -22.253 11.722 -15.052 1.00 0.00 O ATOM 0 H GLU A 94 -21.570 7.307 -16.812 1.00 0.00 H new ATOM 0 HA GLU A 94 -21.444 8.869 -19.324 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -20.266 9.569 -16.605 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -20.290 10.588 -18.031 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -22.798 10.604 -17.916 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -22.700 9.699 -16.419 1.00 0.00 H new ATOM 1412 N ILE A 95 -18.984 8.430 -19.708 1.00 0.00 N ATOM 1413 CA ILE A 95 -17.653 7.955 -20.058 1.00 0.00 C ATOM 1414 C ILE A 95 -16.613 8.512 -19.096 1.00 0.00 C ATOM 1415 O ILE A 95 -16.580 9.714 -18.829 1.00 0.00 O ATOM 1416 CB ILE A 95 -17.268 8.342 -21.501 1.00 0.00 C ATOM 1417 CG1 ILE A 95 -18.290 7.774 -22.477 1.00 0.00 C ATOM 1418 CG2 ILE A 95 -15.869 7.843 -21.841 1.00 0.00 C ATOM 1419 CD1 ILE A 95 -17.887 7.878 -23.927 1.00 0.00 C ATOM 0 H ILE A 95 -19.373 9.110 -20.361 1.00 0.00 H new ATOM 0 HA ILE A 95 -17.674 6.868 -19.985 1.00 0.00 H new ATOM 0 HB ILE A 95 -17.265 9.429 -21.583 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -18.463 6.726 -22.234 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -19.237 8.294 -22.337 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -15.620 8.128 -22.863 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -15.148 8.286 -21.155 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -15.838 6.757 -21.749 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -18.670 7.451 -24.554 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -17.743 8.926 -24.190 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -16.957 7.333 -24.086 1.00 0.00 H new ATOM 1431 N GLY A 96 -15.774 7.628 -18.579 1.00 0.00 N ATOM 1432 CA GLY A 96 -14.729 8.024 -17.662 1.00 0.00 C ATOM 1433 C GLY A 96 -15.254 8.412 -16.297 1.00 0.00 C ATOM 1434 O GLY A 96 -14.547 9.049 -15.517 1.00 0.00 O ATOM 0 H GLY A 96 -15.801 6.629 -18.783 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -14.020 7.204 -17.552 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -14.181 8.865 -18.086 1.00 0.00 H new ATOM 1438 N ALA A 97 -16.492 8.036 -16.002 1.00 0.00 N ATOM 1439 CA ALA A 97 -17.055 8.244 -14.680 1.00 0.00 C ATOM 1440 C ALA A 97 -16.998 6.937 -13.908 1.00 0.00 C ATOM 1441 O ALA A 97 -16.834 5.877 -14.500 1.00 0.00 O ATOM 1442 CB ALA A 97 -18.492 8.742 -14.780 1.00 0.00 C ATOM 0 H ALA A 97 -17.124 7.585 -16.664 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.475 9.003 -14.155 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -18.896 8.892 -13.779 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -18.513 9.686 -15.324 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.097 8.005 -15.309 1.00 0.00 H new ATOM 1448 N ILE A 98 -17.114 7.006 -12.599 1.00 0.00 N ATOM 1449 CA ILE A 98 -17.084 5.808 -11.778 1.00 0.00 C ATOM 1450 C ILE A 98 -18.473 5.507 -11.245 1.00 0.00 C ATOM 1451 O ILE A 98 -19.230 6.424 -10.927 1.00 0.00 O ATOM 1452 CB ILE A 98 -16.086 5.967 -10.610 1.00 0.00 C ATOM 1453 CG1 ILE A 98 -14.690 6.246 -11.167 1.00 0.00 C ATOM 1454 CG2 ILE A 98 -16.071 4.724 -9.729 1.00 0.00 C ATOM 1455 CD1 ILE A 98 -13.624 6.409 -10.106 1.00 0.00 C ATOM 0 H ILE A 98 -17.230 7.876 -12.079 1.00 0.00 H new ATOM 0 HA ILE A 98 -16.753 4.975 -12.398 1.00 0.00 H new ATOM 0 HB ILE A 98 -16.402 6.807 -9.991 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -14.405 5.430 -11.831 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -14.726 7.151 -11.773 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -15.360 4.864 -8.915 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -17.066 4.558 -9.317 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -15.776 3.860 -10.324 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -12.663 6.604 -10.582 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -13.883 7.244 -9.456 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -13.557 5.496 -9.514 1.00 0.00 H new ATOM 1467 N MET A 99 -18.814 4.229 -11.144 1.00 0.00 N ATOM 1468 CA MET A 99 -20.107 3.820 -10.636 1.00 0.00 C ATOM 1469 C MET A 99 -19.877 2.802 -9.540 1.00 0.00 C ATOM 1470 O MET A 99 -18.783 2.249 -9.422 1.00 0.00 O ATOM 1471 CB MET A 99 -20.979 3.165 -11.700 1.00 0.00 C ATOM 1472 CG MET A 99 -21.227 4.022 -12.916 1.00 0.00 C ATOM 1473 SD MET A 99 -22.147 3.152 -14.202 1.00 0.00 S ATOM 1474 CE MET A 99 -23.713 2.862 -13.387 1.00 0.00 C ATOM 0 H MET A 99 -18.204 3.456 -11.411 1.00 0.00 H new ATOM 0 HA MET A 99 -20.622 4.713 -10.282 1.00 0.00 H new ATOM 0 HB2 MET A 99 -20.508 2.234 -12.016 1.00 0.00 H new ATOM 0 HB3 MET A 99 -21.938 2.901 -11.255 1.00 0.00 H new ATOM 0 HG2 MET A 99 -21.778 4.915 -12.621 1.00 0.00 H new ATOM 0 HG3 MET A 99 -20.272 4.357 -13.321 1.00 0.00 H new ATOM 0 HE1 MET A 99 -24.412 2.411 -14.092 1.00 0.00 H new ATOM 0 HE2 MET A 99 -23.565 2.189 -12.543 1.00 0.00 H new ATOM 0 HE3 MET A 99 -24.118 3.809 -13.029 1.00 0.00 H new ATOM 1484 N LEU A 100 -20.885 2.567 -8.739 1.00 0.00 N ATOM 1485 CA LEU A 100 -20.819 1.524 -7.736 1.00 0.00 C ATOM 1486 C LEU A 100 -21.556 0.293 -8.220 1.00 0.00 C ATOM 1487 O LEU A 100 -22.649 0.395 -8.781 1.00 0.00 O ATOM 1488 CB LEU A 100 -21.384 2.015 -6.405 1.00 0.00 C ATOM 1489 CG LEU A 100 -20.337 2.563 -5.439 1.00 0.00 C ATOM 1490 CD1 LEU A 100 -19.482 1.433 -4.900 1.00 0.00 C ATOM 1491 CD2 LEU A 100 -19.458 3.572 -6.138 1.00 0.00 C ATOM 0 H LEU A 100 -21.765 3.083 -8.759 1.00 0.00 H new ATOM 0 HA LEU A 100 -19.774 1.259 -7.573 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -22.121 2.793 -6.602 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -21.911 1.192 -5.922 1.00 0.00 H new ATOM 0 HG LEU A 100 -20.852 3.051 -4.611 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -18.739 1.836 -4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -20.114 0.718 -4.374 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -18.978 0.932 -5.726 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -18.716 3.955 -5.438 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -18.953 3.095 -6.977 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -20.070 4.396 -6.504 1.00 0.00 H new ATOM 1503 N PHE A 101 -20.959 -0.862 -7.996 1.00 0.00 N ATOM 1504 CA PHE A 101 -21.492 -2.121 -8.508 1.00 0.00 C ATOM 1505 C PHE A 101 -21.248 -3.217 -7.480 1.00 0.00 C ATOM 1506 O PHE A 101 -20.161 -3.295 -6.905 1.00 0.00 O ATOM 1507 CB PHE A 101 -20.831 -2.519 -9.834 1.00 0.00 C ATOM 1508 CG PHE A 101 -21.109 -1.591 -10.986 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -22.406 -1.368 -11.424 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -20.068 -0.948 -11.639 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -22.656 -0.524 -12.486 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -20.314 -0.105 -12.700 1.00 0.00 C ATOM 1513 CZ PHE A 101 -21.607 0.106 -13.124 1.00 0.00 C ATOM 0 H PHE A 101 -20.097 -0.960 -7.459 1.00 0.00 H new ATOM 0 HA PHE A 101 -22.559 -1.990 -8.688 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -19.753 -2.574 -9.683 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -21.167 -3.520 -10.104 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -23.229 -1.861 -10.928 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -19.052 -1.110 -11.311 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -23.670 -0.357 -12.817 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -19.494 0.390 -13.199 1.00 0.00 H new ATOM 0 HZ PHE A 101 -21.800 0.766 -13.957 1.00 0.00 H new ATOM 1523 N THR A 102 -22.240 -4.057 -7.237 1.00 0.00 N ATOM 1524 CA THR A 102 -22.080 -5.146 -6.289 1.00 0.00 C ATOM 1525 C THR A 102 -21.716 -6.438 -7.014 1.00 0.00 C ATOM 1526 O THR A 102 -22.332 -6.796 -8.021 1.00 0.00 O ATOM 1527 CB THR A 102 -23.363 -5.360 -5.463 1.00 0.00 C ATOM 1528 OG1 THR A 102 -23.819 -4.103 -4.948 1.00 0.00 O ATOM 1529 CG2 THR A 102 -23.110 -6.319 -4.306 1.00 0.00 C ATOM 0 H THR A 102 -23.158 -4.007 -7.679 1.00 0.00 H new ATOM 0 HA THR A 102 -21.272 -4.875 -5.610 1.00 0.00 H new ATOM 0 HB THR A 102 -24.123 -5.792 -6.114 1.00 0.00 H new ATOM 0 HG1 THR A 102 -24.636 -4.241 -4.424 1.00 0.00 H new ATOM 0 HG21 THR A 102 -24.030 -6.454 -3.738 1.00 0.00 H new ATOM 0 HG22 THR A 102 -22.780 -7.282 -4.697 1.00 0.00 H new ATOM 0 HG23 THR A 102 -22.338 -5.908 -3.655 1.00 0.00 H new ATOM 1537 N ALA A 103 -20.696 -7.114 -6.516 1.00 0.00 N ATOM 1538 CA ALA A 103 -20.279 -8.384 -7.070 1.00 0.00 C ATOM 1539 C ALA A 103 -20.911 -9.528 -6.290 1.00 0.00 C ATOM 1540 O ALA A 103 -21.331 -9.361 -5.145 1.00 0.00 O ATOM 1541 CB ALA A 103 -18.763 -8.484 -7.044 1.00 0.00 C ATOM 0 H ALA A 103 -20.139 -6.799 -5.722 1.00 0.00 H new ATOM 0 HA ALA A 103 -20.613 -8.452 -8.105 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -18.454 -9.442 -7.462 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -18.335 -7.675 -7.636 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -18.411 -8.407 -6.015 1.00 0.00 H new ATOM 1547 N MET A 104 -20.963 -10.692 -6.929 1.00 0.00 N ATOM 1548 CA MET A 104 -21.639 -11.864 -6.380 1.00 0.00 C ATOM 1549 C MET A 104 -20.947 -12.388 -5.124 1.00 0.00 C ATOM 1550 O MET A 104 -21.491 -13.234 -4.416 1.00 0.00 O ATOM 1551 CB MET A 104 -21.723 -12.974 -7.428 1.00 0.00 C ATOM 1552 CG MET A 104 -22.674 -12.671 -8.579 1.00 0.00 C ATOM 1553 SD MET A 104 -22.091 -11.346 -9.659 1.00 0.00 S ATOM 1554 CE MET A 104 -20.578 -12.062 -10.293 1.00 0.00 C ATOM 0 H MET A 104 -20.538 -10.850 -7.843 1.00 0.00 H new ATOM 0 HA MET A 104 -22.646 -11.552 -6.101 1.00 0.00 H new ATOM 0 HB2 MET A 104 -20.727 -13.154 -7.832 1.00 0.00 H new ATOM 0 HB3 MET A 104 -22.041 -13.896 -6.941 1.00 0.00 H new ATOM 0 HG2 MET A 104 -22.817 -13.575 -9.170 1.00 0.00 H new ATOM 0 HG3 MET A 104 -23.648 -12.398 -8.174 1.00 0.00 H new ATOM 0 HE1 MET A 104 -20.310 -11.575 -11.230 1.00 0.00 H new ATOM 0 HE2 MET A 104 -19.777 -11.920 -9.568 1.00 0.00 H new ATOM 0 HE3 MET A 104 -20.725 -13.128 -10.467 1.00 0.00 H new ATOM 1564 N ASP A 105 -19.744 -11.897 -4.861 1.00 0.00 N ATOM 1565 CA ASP A 105 -19.000 -12.277 -3.665 1.00 0.00 C ATOM 1566 C ASP A 105 -19.283 -11.307 -2.518 1.00 0.00 C ATOM 1567 O ASP A 105 -18.543 -11.248 -1.538 1.00 0.00 O ATOM 1568 CB ASP A 105 -17.501 -12.349 -3.953 1.00 0.00 C ATOM 1569 CG ASP A 105 -16.901 -11.007 -4.307 1.00 0.00 C ATOM 1570 OD1 ASP A 105 -17.112 -10.538 -5.441 1.00 0.00 O ATOM 1571 OD2 ASP A 105 -16.204 -10.424 -3.459 1.00 0.00 O ATOM 0 H ASP A 105 -19.259 -11.231 -5.462 1.00 0.00 H new ATOM 0 HA ASP A 105 -19.335 -13.269 -3.363 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -16.988 -12.751 -3.079 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -17.327 -13.046 -4.773 1.00 0.00 H new ATOM 1576 N GLY A 106 -20.374 -10.557 -2.648 1.00 0.00 N ATOM 1577 CA GLY A 106 -20.780 -9.624 -1.612 1.00 0.00 C ATOM 1578 C GLY A 106 -19.977 -8.337 -1.585 1.00 0.00 C ATOM 1579 O GLY A 106 -20.353 -7.386 -0.895 1.00 0.00 O ATOM 0 H GLY A 106 -20.989 -10.580 -3.461 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -21.833 -9.379 -1.751 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -20.692 -10.114 -0.642 1.00 0.00 H new ATOM 1583 N SER A 107 -18.877 -8.296 -2.317 1.00 0.00 N ATOM 1584 CA SER A 107 -18.054 -7.104 -2.367 1.00 0.00 C ATOM 1585 C SER A 107 -18.678 -6.081 -3.298 1.00 0.00 C ATOM 1586 O SER A 107 -19.402 -6.433 -4.231 1.00 0.00 O ATOM 1587 CB SER A 107 -16.632 -7.433 -2.819 1.00 0.00 C ATOM 1588 OG SER A 107 -15.766 -6.322 -2.648 1.00 0.00 O ATOM 0 H SER A 107 -18.535 -9.073 -2.883 1.00 0.00 H new ATOM 0 HA SER A 107 -17.998 -6.686 -1.362 1.00 0.00 H new ATOM 0 HB2 SER A 107 -16.254 -8.282 -2.249 1.00 0.00 H new ATOM 0 HB3 SER A 107 -16.641 -7.731 -3.867 1.00 0.00 H new ATOM 0 HG SER A 107 -14.863 -6.562 -2.944 1.00 0.00 H new ATOM 1594 N GLU A 108 -18.399 -4.822 -3.043 1.00 0.00 N ATOM 1595 CA GLU A 108 -18.944 -3.750 -3.849 1.00 0.00 C ATOM 1596 C GLU A 108 -17.803 -2.870 -4.333 1.00 0.00 C ATOM 1597 O GLU A 108 -17.251 -2.074 -3.567 1.00 0.00 O ATOM 1598 CB GLU A 108 -19.949 -2.932 -3.037 1.00 0.00 C ATOM 1599 CG GLU A 108 -20.660 -1.863 -3.845 1.00 0.00 C ATOM 1600 CD GLU A 108 -21.483 -0.929 -2.983 1.00 0.00 C ATOM 1601 OE1 GLU A 108 -20.902 0.003 -2.385 1.00 0.00 O ATOM 1602 OE2 GLU A 108 -22.713 -1.112 -2.907 1.00 0.00 O ATOM 0 H GLU A 108 -17.795 -4.514 -2.281 1.00 0.00 H new ATOM 0 HA GLU A 108 -19.469 -4.167 -4.708 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -20.692 -3.606 -2.610 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -19.430 -2.459 -2.203 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -19.923 -1.283 -4.401 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -21.309 -2.340 -4.579 1.00 0.00 H new ATOM 1609 N MET A 109 -17.434 -3.028 -5.591 1.00 0.00 N ATOM 1610 CA MET A 109 -16.296 -2.313 -6.137 1.00 0.00 C ATOM 1611 C MET A 109 -16.738 -1.108 -6.946 1.00 0.00 C ATOM 1612 O MET A 109 -17.677 -1.194 -7.737 1.00 0.00 O ATOM 1613 CB MET A 109 -15.451 -3.227 -7.031 1.00 0.00 C ATOM 1614 CG MET A 109 -14.822 -4.403 -6.307 1.00 0.00 C ATOM 1615 SD MET A 109 -15.787 -5.915 -6.468 1.00 0.00 S ATOM 1616 CE MET A 109 -15.580 -6.245 -8.218 1.00 0.00 C ATOM 0 H MET A 109 -17.905 -3.644 -6.253 1.00 0.00 H new ATOM 0 HA MET A 109 -15.697 -1.976 -5.291 1.00 0.00 H new ATOM 0 HB2 MET A 109 -16.078 -3.606 -7.838 1.00 0.00 H new ATOM 0 HB3 MET A 109 -14.661 -2.635 -7.492 1.00 0.00 H new ATOM 0 HG2 MET A 109 -13.820 -4.573 -6.701 1.00 0.00 H new ATOM 0 HG3 MET A 109 -14.712 -4.158 -5.251 1.00 0.00 H new ATOM 0 HE1 MET A 109 -15.693 -7.313 -8.403 1.00 0.00 H new ATOM 0 HE2 MET A 109 -16.334 -5.697 -8.783 1.00 0.00 H new ATOM 0 HE3 MET A 109 -14.587 -5.925 -8.534 1.00 0.00 H new ATOM 1626 N PRO A 110 -16.079 0.037 -6.741 1.00 0.00 N ATOM 1627 CA PRO A 110 -16.230 1.181 -7.628 1.00 0.00 C ATOM 1628 C PRO A 110 -15.633 0.854 -8.992 1.00 0.00 C ATOM 1629 O PRO A 110 -14.532 0.297 -9.080 1.00 0.00 O ATOM 1630 CB PRO A 110 -15.446 2.298 -6.932 1.00 0.00 C ATOM 1631 CG PRO A 110 -14.487 1.599 -6.030 1.00 0.00 C ATOM 1632 CD PRO A 110 -15.148 0.308 -5.631 1.00 0.00 C ATOM 0 HA PRO A 110 -17.269 1.461 -7.802 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -14.922 2.922 -7.656 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -16.110 2.953 -6.369 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -13.541 1.411 -6.538 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -14.262 2.208 -5.154 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -14.420 -0.495 -5.513 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -15.674 0.404 -4.681 1.00 0.00 H new ATOM 1640 N GLY A 111 -16.338 1.205 -10.046 1.00 0.00 N ATOM 1641 CA GLY A 111 -15.959 0.763 -11.366 1.00 0.00 C ATOM 1642 C GLY A 111 -16.017 1.898 -12.356 1.00 0.00 C ATOM 1643 O GLY A 111 -17.040 2.572 -12.466 1.00 0.00 O ATOM 0 H GLY A 111 -17.172 1.792 -10.013 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -14.950 0.351 -11.339 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.623 -0.039 -11.689 1.00 0.00 H new ATOM 1647 N VAL A 112 -14.923 2.127 -13.060 1.00 0.00 N ATOM 1648 CA VAL A 112 -14.867 3.193 -14.044 1.00 0.00 C ATOM 1649 C VAL A 112 -15.607 2.764 -15.294 1.00 0.00 C ATOM 1650 O VAL A 112 -15.399 1.666 -15.797 1.00 0.00 O ATOM 1651 CB VAL A 112 -13.416 3.549 -14.440 1.00 0.00 C ATOM 1652 CG1 VAL A 112 -13.395 4.765 -15.357 1.00 0.00 C ATOM 1653 CG2 VAL A 112 -12.554 3.784 -13.210 1.00 0.00 C ATOM 0 H VAL A 112 -14.061 1.589 -12.969 1.00 0.00 H new ATOM 0 HA VAL A 112 -15.327 4.072 -13.593 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.996 2.702 -14.983 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -12.365 5.001 -15.625 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -13.965 4.549 -16.261 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -13.840 5.617 -14.842 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -11.539 4.033 -13.519 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -12.968 4.607 -12.628 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -12.537 2.881 -12.600 1.00 0.00 H new ATOM 1663 N ILE A 113 -16.480 3.608 -15.790 1.00 0.00 N ATOM 1664 CA ILE A 113 -17.115 3.336 -17.055 1.00 0.00 C ATOM 1665 C ILE A 113 -16.174 3.781 -18.150 1.00 0.00 C ATOM 1666 O ILE A 113 -15.950 4.973 -18.348 1.00 0.00 O ATOM 1667 CB ILE A 113 -18.442 4.079 -17.216 1.00 0.00 C ATOM 1668 CG1 ILE A 113 -19.129 4.264 -15.875 1.00 0.00 C ATOM 1669 CG2 ILE A 113 -19.357 3.307 -18.150 1.00 0.00 C ATOM 1670 CD1 ILE A 113 -20.432 5.000 -15.997 1.00 0.00 C ATOM 0 H ILE A 113 -16.764 4.479 -15.342 1.00 0.00 H new ATOM 0 HA ILE A 113 -17.331 2.269 -17.107 1.00 0.00 H new ATOM 0 HB ILE A 113 -18.231 5.062 -17.637 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -19.307 3.288 -15.423 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -18.467 4.811 -15.203 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -20.300 3.842 -18.260 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -18.881 3.207 -19.125 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -19.548 2.317 -17.736 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -20.884 5.106 -15.011 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -20.254 5.987 -16.423 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -21.106 4.441 -16.646 1.00 0.00 H new ATOM 1682 N ARG A 114 -15.626 2.815 -18.855 1.00 0.00 N ATOM 1683 CA ARG A 114 -14.602 3.083 -19.842 1.00 0.00 C ATOM 1684 C ARG A 114 -15.172 3.916 -20.980 1.00 0.00 C ATOM 1685 O ARG A 114 -14.587 4.922 -21.369 1.00 0.00 O ATOM 1686 CB ARG A 114 -14.027 1.753 -20.344 1.00 0.00 C ATOM 1687 CG ARG A 114 -12.801 1.874 -21.256 1.00 0.00 C ATOM 1688 CD ARG A 114 -13.142 2.385 -22.651 1.00 0.00 C ATOM 1689 NE ARG A 114 -13.954 1.432 -23.403 1.00 0.00 N ATOM 1690 CZ ARG A 114 -14.067 1.429 -24.732 1.00 0.00 C ATOM 1691 NH1 ARG A 114 -13.359 2.280 -25.466 1.00 0.00 N ATOM 1692 NH2 ARG A 114 -14.886 0.570 -25.328 1.00 0.00 N ATOM 0 H ARG A 114 -15.875 1.830 -18.762 1.00 0.00 H new ATOM 0 HA ARG A 114 -13.794 3.660 -19.392 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -13.759 1.143 -19.481 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -14.809 1.218 -20.883 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -12.078 2.547 -20.796 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -12.320 0.899 -21.340 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -13.677 3.331 -22.569 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -12.221 2.586 -23.198 1.00 0.00 H new ATOM 0 HE ARG A 114 -14.467 0.724 -22.878 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -12.726 2.939 -25.014 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -13.449 2.274 -26.482 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -15.429 -0.088 -24.769 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -14.972 0.568 -26.344 1.00 0.00 H new ATOM 1706 N GLU A 115 -16.312 3.499 -21.513 1.00 0.00 N ATOM 1707 CA GLU A 115 -16.927 4.208 -22.619 1.00 0.00 C ATOM 1708 C GLU A 115 -18.405 3.858 -22.718 1.00 0.00 C ATOM 1709 O GLU A 115 -18.829 2.794 -22.257 1.00 0.00 O ATOM 1710 CB GLU A 115 -16.217 3.859 -23.926 1.00 0.00 C ATOM 1711 CG GLU A 115 -16.180 5.013 -24.912 1.00 0.00 C ATOM 1712 CD GLU A 115 -15.531 4.639 -26.225 1.00 0.00 C ATOM 1713 OE1 GLU A 115 -16.197 3.996 -27.065 1.00 0.00 O ATOM 1714 OE2 GLU A 115 -14.349 4.989 -26.423 1.00 0.00 O ATOM 0 H GLU A 115 -16.826 2.676 -21.197 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.834 5.279 -22.440 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.197 3.545 -23.705 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.719 3.009 -24.389 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -17.197 5.358 -25.099 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -15.637 5.847 -24.468 1.00 0.00 H new ATOM 1721 N ILE A 116 -19.179 4.757 -23.312 1.00 0.00 N ATOM 1722 CA ILE A 116 -20.591 4.511 -23.551 1.00 0.00 C ATOM 1723 C ILE A 116 -20.804 4.255 -25.030 1.00 0.00 C ATOM 1724 O ILE A 116 -20.653 5.154 -25.852 1.00 0.00 O ATOM 1725 CB ILE A 116 -21.495 5.695 -23.129 1.00 0.00 C ATOM 1726 CG1 ILE A 116 -21.176 6.178 -21.711 1.00 0.00 C ATOM 1727 CG2 ILE A 116 -22.958 5.289 -23.226 1.00 0.00 C ATOM 1728 CD1 ILE A 116 -21.282 5.108 -20.653 1.00 0.00 C ATOM 0 H ILE A 116 -18.849 5.666 -23.637 1.00 0.00 H new ATOM 0 HA ILE A 116 -20.870 3.649 -22.944 1.00 0.00 H new ATOM 0 HB ILE A 116 -21.299 6.523 -23.810 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -20.166 6.587 -21.698 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -21.853 6.993 -21.456 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -23.589 6.127 -22.928 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -23.190 5.008 -24.253 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -23.145 4.441 -22.567 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -21.040 5.534 -19.679 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -22.298 4.714 -20.635 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -20.584 4.302 -20.880 1.00 0.00 H new ATOM 1740 N ASN A 117 -21.134 3.027 -25.359 1.00 0.00 N ATOM 1741 CA ASN A 117 -21.328 2.629 -26.744 1.00 0.00 C ATOM 1742 C ASN A 117 -22.812 2.628 -27.071 1.00 0.00 C ATOM 1743 O ASN A 117 -23.638 2.540 -26.162 1.00 0.00 O ATOM 1744 CB ASN A 117 -20.709 1.253 -27.017 1.00 0.00 C ATOM 1745 CG ASN A 117 -19.192 1.281 -27.107 1.00 0.00 C ATOM 1746 OD1 ASN A 117 -18.584 0.434 -27.757 1.00 0.00 O ATOM 1747 ND2 ASN A 117 -18.572 2.261 -26.469 1.00 0.00 N ATOM 0 H ASN A 117 -21.276 2.277 -24.683 1.00 0.00 H new ATOM 0 HA ASN A 117 -20.822 3.348 -27.388 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -21.006 0.566 -26.225 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -21.114 0.859 -27.949 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -17.555 2.331 -26.507 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -19.111 2.946 -25.939 1.00 0.00 H new ATOM 1754 N GLY A 118 -23.154 2.739 -28.345 1.00 0.00 N ATOM 1755 CA GLY A 118 -24.544 2.931 -28.720 1.00 0.00 C ATOM 1756 C GLY A 118 -25.462 1.845 -28.189 1.00 0.00 C ATOM 1757 O GLY A 118 -26.533 2.140 -27.671 1.00 0.00 O ATOM 0 H GLY A 118 -22.499 2.700 -29.126 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -24.883 3.898 -28.349 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -24.619 2.962 -29.807 1.00 0.00 H new ATOM 1761 N ASP A 119 -25.047 0.596 -28.306 1.00 0.00 N ATOM 1762 CA ASP A 119 -25.839 -0.523 -27.814 1.00 0.00 C ATOM 1763 C ASP A 119 -25.141 -1.204 -26.640 1.00 0.00 C ATOM 1764 O ASP A 119 -25.730 -2.028 -25.939 1.00 0.00 O ATOM 1765 CB ASP A 119 -26.083 -1.536 -28.940 1.00 0.00 C ATOM 1766 CG ASP A 119 -27.166 -2.543 -28.601 1.00 0.00 C ATOM 1767 OD1 ASP A 119 -28.354 -2.246 -28.845 1.00 0.00 O ATOM 1768 OD2 ASP A 119 -26.844 -3.640 -28.093 1.00 0.00 O ATOM 0 H ASP A 119 -24.163 0.328 -28.739 1.00 0.00 H new ATOM 0 HA ASP A 119 -26.799 -0.138 -27.469 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -26.361 -1.002 -29.849 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -25.155 -2.066 -29.153 1.00 0.00 H new ATOM 1773 N SER A 120 -23.894 -0.823 -26.404 1.00 0.00 N ATOM 1774 CA SER A 120 -23.041 -1.556 -25.479 1.00 0.00 C ATOM 1775 C SER A 120 -22.441 -0.640 -24.410 1.00 0.00 C ATOM 1776 O SER A 120 -22.347 0.571 -24.582 1.00 0.00 O ATOM 1777 CB SER A 120 -21.927 -2.258 -26.265 1.00 0.00 C ATOM 1778 OG SER A 120 -21.176 -3.136 -25.442 1.00 0.00 O ATOM 0 H SER A 120 -23.451 -0.013 -26.838 1.00 0.00 H new ATOM 0 HA SER A 120 -23.653 -2.296 -24.963 1.00 0.00 H new ATOM 0 HB2 SER A 120 -22.363 -2.818 -27.092 1.00 0.00 H new ATOM 0 HB3 SER A 120 -21.263 -1.511 -26.701 1.00 0.00 H new ATOM 0 HG SER A 120 -20.477 -3.567 -25.976 1.00 0.00 H new ATOM 1784 N ILE A 121 -22.054 -1.239 -23.301 1.00 0.00 N ATOM 1785 CA ILE A 121 -21.396 -0.537 -22.212 1.00 0.00 C ATOM 1786 C ILE A 121 -20.024 -1.159 -21.975 1.00 0.00 C ATOM 1787 O ILE A 121 -19.813 -2.345 -22.220 1.00 0.00 O ATOM 1788 CB ILE A 121 -22.219 -0.549 -20.891 1.00 0.00 C ATOM 1789 CG1 ILE A 121 -23.607 0.060 -21.110 1.00 0.00 C ATOM 1790 CG2 ILE A 121 -21.494 0.221 -19.788 1.00 0.00 C ATOM 1791 CD1 ILE A 121 -23.590 1.554 -21.372 1.00 0.00 C ATOM 0 H ILE A 121 -22.188 -2.235 -23.127 1.00 0.00 H new ATOM 0 HA ILE A 121 -21.301 0.508 -22.508 1.00 0.00 H new ATOM 0 HB ILE A 121 -22.330 -1.589 -20.582 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -24.084 -0.441 -21.953 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -24.222 -0.138 -20.232 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -22.090 0.197 -18.876 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -20.524 -0.240 -19.600 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -21.350 1.255 -20.101 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -24.610 1.910 -21.517 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -23.144 2.068 -20.520 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -23.004 1.760 -22.267 1.00 0.00 H new ATOM 1803 N THR A 122 -19.100 -0.352 -21.509 1.00 0.00 N ATOM 1804 CA THR A 122 -17.770 -0.849 -21.245 1.00 0.00 C ATOM 1805 C THR A 122 -17.415 -0.473 -19.827 1.00 0.00 C ATOM 1806 O THR A 122 -17.506 0.697 -19.457 1.00 0.00 O ATOM 1807 CB THR A 122 -16.705 -0.307 -22.210 1.00 0.00 C ATOM 1808 OG1 THR A 122 -17.155 -0.424 -23.566 1.00 0.00 O ATOM 1809 CG2 THR A 122 -15.408 -1.088 -22.035 1.00 0.00 C ATOM 0 H THR A 122 -19.241 0.638 -21.307 1.00 0.00 H new ATOM 0 HA THR A 122 -17.779 -1.929 -21.392 1.00 0.00 H new ATOM 0 HB THR A 122 -16.531 0.745 -21.985 1.00 0.00 H new ATOM 0 HG1 THR A 122 -17.193 0.465 -23.976 1.00 0.00 H new ATOM 0 HG21 THR A 122 -14.655 -0.701 -22.721 1.00 0.00 H new ATOM 0 HG22 THR A 122 -15.054 -0.981 -21.010 1.00 0.00 H new ATOM 0 HG23 THR A 122 -15.586 -2.142 -22.249 1.00 0.00 H new ATOM 1817 N VAL A 123 -17.007 -1.441 -19.033 1.00 0.00 N ATOM 1818 CA VAL A 123 -16.835 -1.203 -17.621 1.00 0.00 C ATOM 1819 C VAL A 123 -15.452 -1.648 -17.212 1.00 0.00 C ATOM 1820 O VAL A 123 -15.048 -2.784 -17.459 1.00 0.00 O ATOM 1821 CB VAL A 123 -17.885 -1.918 -16.746 1.00 0.00 C ATOM 1822 CG1 VAL A 123 -17.944 -1.266 -15.371 1.00 0.00 C ATOM 1823 CG2 VAL A 123 -19.255 -1.902 -17.401 1.00 0.00 C ATOM 0 H VAL A 123 -16.791 -2.389 -19.340 1.00 0.00 H new ATOM 0 HA VAL A 123 -16.970 -0.134 -17.458 1.00 0.00 H new ATOM 0 HB VAL A 123 -17.585 -2.960 -16.635 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -18.687 -1.776 -14.758 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -16.968 -1.338 -14.892 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -18.219 -0.217 -15.477 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -19.971 -2.414 -16.759 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -19.574 -0.871 -17.551 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -19.204 -2.410 -18.364 1.00 0.00 H new ATOM 1833 N ASP A 124 -14.756 -0.745 -16.576 1.00 0.00 N ATOM 1834 CA ASP A 124 -13.395 -0.977 -16.160 1.00 0.00 C ATOM 1835 C ASP A 124 -13.346 -0.987 -14.656 1.00 0.00 C ATOM 1836 O ASP A 124 -13.274 0.074 -14.032 1.00 0.00 O ATOM 1837 CB ASP A 124 -12.468 0.127 -16.671 1.00 0.00 C ATOM 1838 CG ASP A 124 -11.669 -0.269 -17.900 1.00 0.00 C ATOM 1839 OD1 ASP A 124 -12.273 -0.648 -18.926 1.00 0.00 O ATOM 1840 OD2 ASP A 124 -10.424 -0.166 -17.854 1.00 0.00 O ATOM 0 H ASP A 124 -15.116 0.177 -16.330 1.00 0.00 H new ATOM 0 HA ASP A 124 -13.063 -1.931 -16.570 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -13.063 1.010 -16.904 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -11.778 0.408 -15.875 1.00 0.00 H new ATOM 1845 N PHE A 125 -13.398 -2.153 -14.047 1.00 0.00 N ATOM 1846 CA PHE A 125 -13.248 -2.210 -12.625 1.00 0.00 C ATOM 1847 C PHE A 125 -11.769 -2.183 -12.368 1.00 0.00 C ATOM 1848 O PHE A 125 -11.061 -3.138 -12.635 1.00 0.00 O ATOM 1849 CB PHE A 125 -13.885 -3.455 -12.048 1.00 0.00 C ATOM 1850 CG PHE A 125 -15.385 -3.463 -12.049 1.00 0.00 C ATOM 1851 CD1 PHE A 125 -16.085 -3.567 -13.235 1.00 0.00 C ATOM 1852 CD2 PHE A 125 -16.092 -3.402 -10.862 1.00 0.00 C ATOM 1853 CE1 PHE A 125 -17.460 -3.611 -13.245 1.00 0.00 C ATOM 1854 CE2 PHE A 125 -17.472 -3.438 -10.863 1.00 0.00 C ATOM 1855 CZ PHE A 125 -18.157 -3.544 -12.059 1.00 0.00 C ATOM 0 H PHE A 125 -13.540 -3.051 -14.510 1.00 0.00 H new ATOM 0 HA PHE A 125 -13.751 -1.372 -12.142 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -13.532 -4.319 -12.612 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -13.537 -3.580 -11.022 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -15.545 -3.615 -14.169 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -15.560 -3.325 -9.926 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -17.992 -3.698 -14.181 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -18.015 -3.383 -9.931 1.00 0.00 H new ATOM 0 HZ PHE A 125 -19.237 -3.574 -12.063 1.00 0.00 H new ATOM 1865 N ASN A 126 -11.330 -1.038 -11.951 1.00 0.00 N ATOM 1866 CA ASN A 126 -9.922 -0.765 -11.895 1.00 0.00 C ATOM 1867 C ASN A 126 -9.452 -0.377 -10.511 1.00 0.00 C ATOM 1868 O ASN A 126 -9.996 0.537 -9.895 1.00 0.00 O ATOM 1869 CB ASN A 126 -9.501 0.227 -12.971 1.00 0.00 C ATOM 1870 CG ASN A 126 -8.561 -0.394 -14.012 1.00 0.00 C ATOM 1871 OD1 ASN A 126 -7.767 0.319 -14.624 1.00 0.00 O ATOM 1872 ND2 ASN A 126 -8.613 -1.724 -14.227 1.00 0.00 N ATOM 0 H ASN A 126 -11.927 -0.271 -11.642 1.00 0.00 H new ATOM 0 HA ASN A 126 -9.409 -1.701 -12.116 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.389 0.612 -13.473 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -9.006 1.078 -12.502 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -7.987 -2.156 -14.907 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -9.278 -2.299 -13.710 1.00 0.00 H new ATOM 1964 N THR A 133 -1.282 8.243 -10.322 1.00 0.00 N ATOM 1965 CA THR A 133 0.020 8.824 -10.573 1.00 0.00 C ATOM 1966 C THR A 133 0.539 9.447 -9.289 1.00 0.00 C ATOM 1967 O THR A 133 0.000 10.448 -8.814 1.00 0.00 O ATOM 1968 CB THR A 133 -0.056 9.895 -11.679 1.00 0.00 C ATOM 1969 OG1 THR A 133 -0.763 9.378 -12.818 1.00 0.00 O ATOM 1970 CG2 THR A 133 1.339 10.331 -12.102 1.00 0.00 C ATOM 0 HA THR A 133 0.697 8.039 -10.909 1.00 0.00 H new ATOM 0 HB THR A 133 -0.589 10.759 -11.282 1.00 0.00 H new ATOM 0 HG1 THR A 133 -1.450 8.747 -12.518 1.00 0.00 H new ATOM 0 HG21 THR A 133 1.263 11.087 -12.883 1.00 0.00 H new ATOM 0 HG22 THR A 133 1.866 10.748 -11.244 1.00 0.00 H new ATOM 0 HG23 THR A 133 1.889 9.471 -12.482 1.00 0.00 H new ATOM 1978 N VAL A 134 1.584 8.859 -8.734 1.00 0.00 N ATOM 1979 CA VAL A 134 2.063 9.269 -7.432 1.00 0.00 C ATOM 1980 C VAL A 134 3.453 9.873 -7.485 1.00 0.00 C ATOM 1981 O VAL A 134 4.161 9.797 -8.492 1.00 0.00 O ATOM 1982 CB VAL A 134 2.056 8.110 -6.413 1.00 0.00 C ATOM 1983 CG1 VAL A 134 0.637 7.729 -6.041 1.00 0.00 C ATOM 1984 CG2 VAL A 134 2.808 6.906 -6.948 1.00 0.00 C ATOM 0 H VAL A 134 2.113 8.100 -9.164 1.00 0.00 H new ATOM 0 HA VAL A 134 1.363 10.036 -7.101 1.00 0.00 H new ATOM 0 HB VAL A 134 2.567 8.454 -5.514 1.00 0.00 H new ATOM 0 HG11 VAL A 134 0.657 6.910 -5.322 1.00 0.00 H new ATOM 0 HG12 VAL A 134 0.134 8.589 -5.599 1.00 0.00 H new ATOM 0 HG13 VAL A 134 0.099 7.414 -6.935 1.00 0.00 H new ATOM 0 HG21 VAL A 134 2.786 6.105 -6.209 1.00 0.00 H new ATOM 0 HG22 VAL A 134 2.337 6.562 -7.869 1.00 0.00 H new ATOM 0 HG23 VAL A 134 3.842 7.184 -7.152 1.00 0.00 H new ATOM 1994 N HIS A 135 3.816 10.479 -6.377 1.00 0.00 N ATOM 1995 CA HIS A 135 5.115 11.079 -6.189 1.00 0.00 C ATOM 1996 C HIS A 135 5.637 10.615 -4.844 1.00 0.00 C ATOM 1997 O HIS A 135 4.946 10.736 -3.828 1.00 0.00 O ATOM 1998 CB HIS A 135 5.041 12.611 -6.247 1.00 0.00 C ATOM 1999 CG HIS A 135 4.850 13.160 -7.629 1.00 0.00 C ATOM 2000 ND1 HIS A 135 5.899 13.450 -8.475 1.00 0.00 N ATOM 2001 CD2 HIS A 135 3.724 13.479 -8.313 1.00 0.00 C ATOM 2002 CE1 HIS A 135 5.430 13.921 -9.615 1.00 0.00 C ATOM 2003 NE2 HIS A 135 4.114 13.947 -9.543 1.00 0.00 N ATOM 0 H HIS A 135 3.204 10.570 -5.566 1.00 0.00 H new ATOM 0 HA HIS A 135 5.787 10.771 -6.990 1.00 0.00 H new ATOM 0 HB2 HIS A 135 4.219 12.949 -5.616 1.00 0.00 H new ATOM 0 HB3 HIS A 135 5.957 13.025 -5.826 1.00 0.00 H new ATOM 0 HD2 HIS A 135 2.709 13.383 -7.957 1.00 0.00 H new ATOM 0 HE1 HIS A 135 6.023 14.232 -10.462 1.00 0.00 H new ATOM 0 HE2 HIS A 135 3.487 14.264 -10.282 1.00 0.00 H new ATOM 2012 N PHE A 136 6.839 10.087 -4.838 1.00 0.00 N ATOM 2013 CA PHE A 136 7.372 9.444 -3.649 1.00 0.00 C ATOM 2014 C PHE A 136 8.409 10.299 -2.971 1.00 0.00 C ATOM 2015 O PHE A 136 9.420 10.659 -3.565 1.00 0.00 O ATOM 2016 CB PHE A 136 7.982 8.082 -3.969 1.00 0.00 C ATOM 2017 CG PHE A 136 6.993 6.960 -3.945 1.00 0.00 C ATOM 2018 CD1 PHE A 136 6.715 6.315 -2.754 1.00 0.00 C ATOM 2019 CD2 PHE A 136 6.346 6.548 -5.097 1.00 0.00 C ATOM 2020 CE1 PHE A 136 5.806 5.275 -2.709 1.00 0.00 C ATOM 2021 CE2 PHE A 136 5.437 5.508 -5.061 1.00 0.00 C ATOM 2022 CZ PHE A 136 5.166 4.869 -3.865 1.00 0.00 C ATOM 0 H PHE A 136 7.469 10.088 -5.640 1.00 0.00 H new ATOM 0 HA PHE A 136 6.528 9.306 -2.973 1.00 0.00 H new ATOM 0 HB2 PHE A 136 8.447 8.124 -4.954 1.00 0.00 H new ATOM 0 HB3 PHE A 136 8.775 7.871 -3.251 1.00 0.00 H new ATOM 0 HD1 PHE A 136 7.214 6.627 -1.849 1.00 0.00 H new ATOM 0 HD2 PHE A 136 6.554 7.044 -6.033 1.00 0.00 H new ATOM 0 HE1 PHE A 136 5.596 4.780 -1.772 1.00 0.00 H new ATOM 0 HE2 PHE A 136 4.939 5.194 -5.966 1.00 0.00 H new ATOM 0 HZ PHE A 136 4.457 4.055 -3.834 1.00 0.00 H new ATOM 2032 N ASP A 137 8.159 10.594 -1.714 1.00 0.00 N ATOM 2033 CA ASP A 137 9.133 11.276 -0.888 1.00 0.00 C ATOM 2034 C ASP A 137 9.403 10.409 0.324 1.00 0.00 C ATOM 2035 O ASP A 137 8.616 10.395 1.275 1.00 0.00 O ATOM 2036 CB ASP A 137 8.601 12.648 -0.471 1.00 0.00 C ATOM 2037 CG ASP A 137 9.614 13.463 0.300 1.00 0.00 C ATOM 2038 OD1 ASP A 137 10.666 13.813 -0.278 1.00 0.00 O ATOM 2039 OD2 ASP A 137 9.350 13.796 1.474 1.00 0.00 O ATOM 0 H ASP A 137 7.284 10.371 -1.239 1.00 0.00 H new ATOM 0 HA ASP A 137 10.059 11.437 -1.440 1.00 0.00 H new ATOM 0 HB2 ASP A 137 8.299 13.201 -1.361 1.00 0.00 H new ATOM 0 HB3 ASP A 137 7.708 12.515 0.140 1.00 0.00 H new ATOM 2044 N ILE A 138 10.493 9.661 0.270 1.00 0.00 N ATOM 2045 CA ILE A 138 10.790 8.659 1.281 1.00 0.00 C ATOM 2046 C ILE A 138 12.156 8.879 1.931 1.00 0.00 C ATOM 2047 O ILE A 138 13.139 9.188 1.254 1.00 0.00 O ATOM 2048 CB ILE A 138 10.736 7.254 0.634 1.00 0.00 C ATOM 2049 CG1 ILE A 138 9.282 6.858 0.382 1.00 0.00 C ATOM 2050 CG2 ILE A 138 11.452 6.208 1.480 1.00 0.00 C ATOM 2051 CD1 ILE A 138 9.127 5.593 -0.423 1.00 0.00 C ATOM 0 H ILE A 138 11.192 9.730 -0.470 1.00 0.00 H new ATOM 0 HA ILE A 138 10.041 8.745 2.068 1.00 0.00 H new ATOM 0 HB ILE A 138 11.263 7.299 -0.319 1.00 0.00 H new ATOM 0 HG12 ILE A 138 8.778 6.732 1.340 1.00 0.00 H new ATOM 0 HG13 ILE A 138 8.778 7.673 -0.138 1.00 0.00 H new ATOM 0 HG21 ILE A 138 11.389 5.237 0.988 1.00 0.00 H new ATOM 0 HG22 ILE A 138 12.499 6.489 1.597 1.00 0.00 H new ATOM 0 HG23 ILE A 138 10.981 6.149 2.461 1.00 0.00 H new ATOM 0 HD11 ILE A 138 8.068 5.377 -0.561 1.00 0.00 H new ATOM 0 HD12 ILE A 138 9.601 5.721 -1.396 1.00 0.00 H new ATOM 0 HD13 ILE A 138 9.601 4.765 0.105 1.00 0.00 H new ATOM 2063 N GLU A 139 12.209 8.705 3.248 1.00 0.00 N ATOM 2064 CA GLU A 139 13.456 8.775 3.988 1.00 0.00 C ATOM 2065 C GLU A 139 13.580 7.525 4.845 1.00 0.00 C ATOM 2066 O GLU A 139 12.632 7.166 5.552 1.00 0.00 O ATOM 2067 CB GLU A 139 13.497 10.017 4.881 1.00 0.00 C ATOM 2068 CG GLU A 139 13.350 11.332 4.130 1.00 0.00 C ATOM 2069 CD GLU A 139 11.916 11.801 4.014 1.00 0.00 C ATOM 2070 OE1 GLU A 139 11.398 12.377 4.993 1.00 0.00 O ATOM 2071 OE2 GLU A 139 11.314 11.636 2.938 1.00 0.00 O ATOM 0 H GLU A 139 11.391 8.513 3.826 1.00 0.00 H new ATOM 0 HA GLU A 139 14.285 8.840 3.284 1.00 0.00 H new ATOM 0 HB2 GLU A 139 12.701 9.944 5.622 1.00 0.00 H new ATOM 0 HB3 GLU A 139 14.440 10.027 5.427 1.00 0.00 H new ATOM 0 HG2 GLU A 139 13.935 12.099 4.637 1.00 0.00 H new ATOM 0 HG3 GLU A 139 13.770 11.220 3.130 1.00 0.00 H new ATOM 2078 N VAL A 140 14.722 6.848 4.792 1.00 0.00 N ATOM 2079 CA VAL A 140 14.895 5.600 5.522 1.00 0.00 C ATOM 2080 C VAL A 140 15.143 5.878 6.997 1.00 0.00 C ATOM 2081 O VAL A 140 16.038 6.647 7.348 1.00 0.00 O ATOM 2082 CB VAL A 140 16.094 4.800 4.967 1.00 0.00 C ATOM 2083 CG1 VAL A 140 16.289 3.503 5.736 1.00 0.00 C ATOM 2084 CG2 VAL A 140 15.919 4.526 3.483 1.00 0.00 C ATOM 0 H VAL A 140 15.537 7.141 4.254 1.00 0.00 H new ATOM 0 HA VAL A 140 13.981 5.019 5.401 1.00 0.00 H new ATOM 0 HB VAL A 140 16.991 5.406 5.098 1.00 0.00 H new ATOM 0 HG11 VAL A 140 17.140 2.960 5.324 1.00 0.00 H new ATOM 0 HG12 VAL A 140 16.476 3.727 6.786 1.00 0.00 H new ATOM 0 HG13 VAL A 140 15.392 2.890 5.650 1.00 0.00 H new ATOM 0 HG21 VAL A 140 16.775 3.962 3.114 1.00 0.00 H new ATOM 0 HG22 VAL A 140 15.008 3.949 3.325 1.00 0.00 H new ATOM 0 HG23 VAL A 140 15.848 5.471 2.944 1.00 0.00 H new ATOM 2094 N LEU A 141 14.353 5.261 7.858 1.00 0.00 N ATOM 2095 CA LEU A 141 14.541 5.413 9.288 1.00 0.00 C ATOM 2096 C LEU A 141 15.395 4.272 9.823 1.00 0.00 C ATOM 2097 O LEU A 141 16.362 4.494 10.550 1.00 0.00 O ATOM 2098 CB LEU A 141 13.190 5.430 10.006 1.00 0.00 C ATOM 2099 CG LEU A 141 12.173 6.444 9.486 1.00 0.00 C ATOM 2100 CD1 LEU A 141 10.949 6.448 10.380 1.00 0.00 C ATOM 2101 CD2 LEU A 141 12.780 7.835 9.394 1.00 0.00 C ATOM 0 H LEU A 141 13.579 4.653 7.592 1.00 0.00 H new ATOM 0 HA LEU A 141 15.048 6.360 9.474 1.00 0.00 H new ATOM 0 HB2 LEU A 141 12.751 4.435 9.937 1.00 0.00 H new ATOM 0 HB3 LEU A 141 13.364 5.628 11.063 1.00 0.00 H new ATOM 0 HG LEU A 141 11.875 6.151 8.479 1.00 0.00 H new ATOM 0 HD11 LEU A 141 10.227 7.173 10.005 1.00 0.00 H new ATOM 0 HD12 LEU A 141 10.498 5.456 10.384 1.00 0.00 H new ATOM 0 HD13 LEU A 141 11.241 6.718 11.395 1.00 0.00 H new ATOM 0 HD21 LEU A 141 12.032 8.534 9.021 1.00 0.00 H new ATOM 0 HD22 LEU A 141 13.113 8.153 10.382 1.00 0.00 H new ATOM 0 HD23 LEU A 141 13.631 7.816 8.713 1.00 0.00 H new ATOM 2113 N GLU A 142 15.033 3.052 9.448 1.00 0.00 N ATOM 2114 CA GLU A 142 15.785 1.862 9.826 1.00 0.00 C ATOM 2115 C GLU A 142 15.720 0.819 8.728 1.00 0.00 C ATOM 2116 O GLU A 142 14.853 0.875 7.858 1.00 0.00 O ATOM 2117 CB GLU A 142 15.232 1.258 11.112 1.00 0.00 C ATOM 2118 CG GLU A 142 16.018 1.634 12.349 1.00 0.00 C ATOM 2119 CD GLU A 142 17.424 1.071 12.337 1.00 0.00 C ATOM 2120 OE1 GLU A 142 17.573 -0.162 12.206 1.00 0.00 O ATOM 2121 OE2 GLU A 142 18.385 1.853 12.485 1.00 0.00 O ATOM 0 H GLU A 142 14.212 2.859 8.875 1.00 0.00 H new ATOM 0 HA GLU A 142 16.821 2.163 9.984 1.00 0.00 H new ATOM 0 HB2 GLU A 142 14.198 1.579 11.238 1.00 0.00 H new ATOM 0 HB3 GLU A 142 15.219 0.172 11.017 1.00 0.00 H new ATOM 0 HG2 GLU A 142 16.066 2.720 12.429 1.00 0.00 H new ATOM 0 HG3 GLU A 142 15.493 1.272 13.233 1.00 0.00 H new ATOM 2128 N ILE A 143 16.633 -0.134 8.781 1.00 0.00 N ATOM 2129 CA ILE A 143 16.658 -1.229 7.824 1.00 0.00 C ATOM 2130 C ILE A 143 16.780 -2.563 8.549 1.00 0.00 C ATOM 2131 O ILE A 143 17.717 -2.778 9.325 1.00 0.00 O ATOM 2132 CB ILE A 143 17.827 -1.082 6.825 1.00 0.00 C ATOM 2133 CG1 ILE A 143 17.666 0.199 6.008 1.00 0.00 C ATOM 2134 CG2 ILE A 143 17.906 -2.292 5.902 1.00 0.00 C ATOM 2135 CD1 ILE A 143 18.876 0.543 5.176 1.00 0.00 C ATOM 0 H ILE A 143 17.373 -0.173 9.482 1.00 0.00 H new ATOM 0 HA ILE A 143 15.721 -1.197 7.267 1.00 0.00 H new ATOM 0 HB ILE A 143 18.757 -1.024 7.391 1.00 0.00 H new ATOM 0 HG12 ILE A 143 16.802 0.095 5.351 1.00 0.00 H new ATOM 0 HG13 ILE A 143 17.454 1.027 6.685 1.00 0.00 H new ATOM 0 HG21 ILE A 143 18.736 -2.166 5.207 1.00 0.00 H new ATOM 0 HG22 ILE A 143 18.063 -3.193 6.495 1.00 0.00 H new ATOM 0 HG23 ILE A 143 16.975 -2.384 5.342 1.00 0.00 H new ATOM 0 HD11 ILE A 143 18.688 1.464 4.624 1.00 0.00 H new ATOM 0 HD12 ILE A 143 19.739 0.680 5.828 1.00 0.00 H new ATOM 0 HD13 ILE A 143 19.077 -0.266 4.474 1.00 0.00 H new ATOM 2147 N ASP A 144 15.820 -3.445 8.310 1.00 0.00 N ATOM 2148 CA ASP A 144 15.855 -4.786 8.869 1.00 0.00 C ATOM 2149 C ASP A 144 16.875 -5.622 8.128 1.00 0.00 C ATOM 2150 O ASP A 144 16.907 -5.614 6.896 1.00 0.00 O ATOM 2151 CB ASP A 144 14.481 -5.452 8.782 1.00 0.00 C ATOM 2152 CG ASP A 144 13.650 -5.231 10.024 1.00 0.00 C ATOM 2153 OD1 ASP A 144 13.878 -5.933 11.031 1.00 0.00 O ATOM 2154 OD2 ASP A 144 12.757 -4.361 10.005 1.00 0.00 O ATOM 0 H ASP A 144 15.004 -3.253 7.729 1.00 0.00 H new ATOM 0 HA ASP A 144 16.135 -4.712 9.920 1.00 0.00 H new ATOM 0 HB2 ASP A 144 13.946 -5.061 7.917 1.00 0.00 H new ATOM 0 HB3 ASP A 144 14.609 -6.522 8.621 1.00 0.00 H new ATOM 2159 N PRO A 145 17.732 -6.340 8.873 1.00 0.00 N ATOM 2160 CA PRO A 145 18.795 -7.166 8.303 1.00 0.00 C ATOM 2161 C PRO A 145 18.328 -8.022 7.147 1.00 0.00 C ATOM 2162 O PRO A 145 17.454 -8.878 7.293 1.00 0.00 O ATOM 2163 CB PRO A 145 19.218 -8.039 9.471 1.00 0.00 C ATOM 2164 CG PRO A 145 19.001 -7.166 10.646 1.00 0.00 C ATOM 2165 CD PRO A 145 17.742 -6.399 10.347 1.00 0.00 C ATOM 0 HA PRO A 145 19.596 -6.557 7.885 1.00 0.00 H new ATOM 0 HB2 PRO A 145 18.620 -8.949 9.530 1.00 0.00 H new ATOM 0 HB3 PRO A 145 20.260 -8.347 9.386 1.00 0.00 H new ATOM 0 HG2 PRO A 145 18.896 -7.754 11.558 1.00 0.00 H new ATOM 0 HG3 PRO A 145 19.845 -6.493 10.796 1.00 0.00 H new ATOM 0 HD2 PRO A 145 16.859 -6.905 10.737 1.00 0.00 H new ATOM 0 HD3 PRO A 145 17.761 -5.404 10.791 1.00 0.00 H new