USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 836 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 Single : A 1 GLY N :NH3+ -121:sc= 0.0985 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0256) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0.02) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 22 ASN : amide:sc= -0.309 X(o=-0.31,f=-0.13) USER MOD Single : A 25 CYS SG : rot 55:sc= 0.0803 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot -83:sc= 0.13 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0531 K(o=-0.053,f=-1.4) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= -0.263 USER MOD Single : A 43 HIS : no HE2:sc= 0.51 K(o=0.51,f=-2.3!) USER MOD Single : A 46 THR OG1 : rot -72:sc= 0.441 USER MOD Single : A 48 SER OG : rot -150:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.00259 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot -75:sc= 0.191 USER MOD Single : A 67 SER OG : rot 180:sc= -0.12 USER MOD Single : A 75 LYS NZ :NH3+ -124:sc= 1.02 (180deg=-0.0657) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.257 K(o=-0.26,f=-1.7!) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.737 12.318 1.832 1.00 0.00 N ATOM 2 CA GLY A 1 4.458 11.805 1.374 1.00 0.00 C ATOM 3 C GLY A 1 4.565 10.401 0.812 1.00 0.00 C ATOM 4 O GLY A 1 5.634 9.793 0.842 1.00 0.00 O ATOM 0 H1 GLY A 1 5.674 12.556 2.843 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.471 11.595 1.692 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.983 13.171 1.290 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.751 11.808 2.203 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.056 12.470 0.609 1.00 0.00 H new ATOM 8 N SER A 2 3.453 9.885 0.299 1.00 0.00 N ATOM 9 CA SER A 2 3.424 8.541 -0.267 1.00 0.00 C ATOM 10 C SER A 2 2.654 8.524 -1.584 1.00 0.00 C ATOM 11 O SER A 2 2.154 9.553 -2.038 1.00 0.00 O ATOM 12 CB SER A 2 2.789 7.562 0.721 1.00 0.00 C ATOM 13 OG SER A 2 3.611 7.383 1.861 1.00 0.00 O ATOM 0 H SER A 2 2.560 10.377 0.263 1.00 0.00 H new ATOM 0 HA SER A 2 4.451 8.233 -0.462 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.811 7.933 1.028 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.626 6.602 0.232 1.00 0.00 H new ATOM 0 HG SER A 2 3.182 6.754 2.478 1.00 0.00 H new ATOM 19 N SER A 3 2.563 7.346 -2.193 1.00 0.00 N ATOM 20 CA SER A 3 1.858 7.193 -3.461 1.00 0.00 C ATOM 21 C SER A 3 1.780 5.724 -3.865 1.00 0.00 C ATOM 22 O SER A 3 2.800 5.047 -3.986 1.00 0.00 O ATOM 23 CB SER A 3 2.556 7.999 -4.558 1.00 0.00 C ATOM 24 OG SER A 3 1.703 9.009 -5.069 1.00 0.00 O ATOM 0 H SER A 3 2.968 6.484 -1.829 1.00 0.00 H new ATOM 0 HA SER A 3 0.844 7.571 -3.332 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.463 8.452 -4.159 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.861 7.333 -5.365 1.00 0.00 H new ATOM 0 HG SER A 3 2.173 9.511 -5.767 1.00 0.00 H new ATOM 30 N GLY A 4 0.560 5.237 -4.072 1.00 0.00 N ATOM 31 CA GLY A 4 0.370 3.852 -4.460 1.00 0.00 C ATOM 32 C GLY A 4 0.694 3.609 -5.921 1.00 0.00 C ATOM 33 O GLY A 4 1.633 4.193 -6.461 1.00 0.00 O ATOM 0 H GLY A 4 -0.300 5.777 -3.978 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.001 3.215 -3.840 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -0.663 3.562 -4.267 1.00 0.00 H new ATOM 37 N SER A 5 -0.086 2.745 -6.563 1.00 0.00 N ATOM 38 CA SER A 5 0.126 2.422 -7.969 1.00 0.00 C ATOM 39 C SER A 5 -1.204 2.321 -8.710 1.00 0.00 C ATOM 40 O SER A 5 -2.271 2.459 -8.113 1.00 0.00 O ATOM 41 CB SER A 5 0.898 1.108 -8.102 1.00 0.00 C ATOM 42 OG SER A 5 2.289 1.314 -7.926 1.00 0.00 O ATOM 0 H SER A 5 -0.870 2.256 -6.132 1.00 0.00 H new ATOM 0 HA SER A 5 0.711 3.226 -8.416 1.00 0.00 H new ATOM 0 HB2 SER A 5 0.536 0.394 -7.362 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.713 0.672 -9.084 1.00 0.00 H new ATOM 0 HG SER A 5 2.760 0.459 -8.014 1.00 0.00 H new ATOM 48 N SER A 6 -1.130 2.079 -10.015 1.00 0.00 N ATOM 49 CA SER A 6 -2.327 1.964 -10.839 1.00 0.00 C ATOM 50 C SER A 6 -2.569 0.513 -11.245 1.00 0.00 C ATOM 51 O SER A 6 -1.683 -0.333 -11.126 1.00 0.00 O ATOM 52 CB SER A 6 -2.200 2.839 -12.087 1.00 0.00 C ATOM 53 OG SER A 6 -2.603 4.171 -11.820 1.00 0.00 O ATOM 0 H SER A 6 -0.254 1.959 -10.524 1.00 0.00 H new ATOM 0 HA SER A 6 -3.178 2.306 -10.249 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.168 2.831 -12.437 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.811 2.425 -12.889 1.00 0.00 H new ATOM 0 HG SER A 6 -2.511 4.710 -12.633 1.00 0.00 H new ATOM 59 N GLY A 7 -3.777 0.232 -11.725 1.00 0.00 N ATOM 60 CA GLY A 7 -4.115 -1.116 -12.140 1.00 0.00 C ATOM 61 C GLY A 7 -4.199 -1.255 -13.648 1.00 0.00 C ATOM 62 O GLY A 7 -3.449 -0.610 -14.380 1.00 0.00 O ATOM 0 H GLY A 7 -4.527 0.915 -11.834 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.367 -1.809 -11.755 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -5.070 -1.400 -11.698 1.00 0.00 H new ATOM 66 N LYS A 8 -5.113 -2.099 -14.113 1.00 0.00 N ATOM 67 CA LYS A 8 -5.292 -2.322 -15.543 1.00 0.00 C ATOM 68 C LYS A 8 -3.996 -2.805 -16.185 1.00 0.00 C ATOM 69 O LYS A 8 -2.993 -3.014 -15.501 1.00 0.00 O ATOM 70 CB LYS A 8 -5.763 -1.035 -16.225 1.00 0.00 C ATOM 71 CG LYS A 8 -7.176 -0.627 -15.845 1.00 0.00 C ATOM 72 CD LYS A 8 -8.120 -0.715 -17.033 1.00 0.00 C ATOM 73 CE LYS A 8 -9.420 0.028 -16.767 1.00 0.00 C ATOM 74 NZ LYS A 8 -10.150 -0.532 -15.597 1.00 0.00 N ATOM 0 H LYS A 8 -5.742 -2.641 -13.520 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.050 -3.094 -15.673 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.079 -0.226 -15.968 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.710 -1.166 -17.306 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.538 -1.270 -15.043 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -7.170 0.392 -15.458 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.635 -0.298 -17.916 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.335 -1.761 -17.251 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.206 1.082 -16.591 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -10.056 -0.025 -17.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -11.076 -0.067 -15.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -10.287 -1.554 -15.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.597 -0.367 -14.732 1.00 0.00 H new ATOM 88 N TYR A 9 -4.023 -2.981 -17.501 1.00 0.00 N ATOM 89 CA TYR A 9 -2.850 -3.441 -18.235 1.00 0.00 C ATOM 90 C TYR A 9 -2.482 -2.459 -19.344 1.00 0.00 C ATOM 91 O TYR A 9 -3.351 -1.825 -19.943 1.00 0.00 O ATOM 92 CB TYR A 9 -3.106 -4.827 -18.830 1.00 0.00 C ATOM 93 CG TYR A 9 -4.044 -4.813 -20.016 1.00 0.00 C ATOM 94 CD1 TYR A 9 -5.420 -4.883 -19.838 1.00 0.00 C ATOM 95 CD2 TYR A 9 -3.554 -4.731 -21.313 1.00 0.00 C ATOM 96 CE1 TYR A 9 -6.281 -4.872 -20.918 1.00 0.00 C ATOM 97 CE2 TYR A 9 -4.408 -4.718 -22.399 1.00 0.00 C ATOM 98 CZ TYR A 9 -5.771 -4.789 -22.197 1.00 0.00 C ATOM 99 OH TYR A 9 -6.624 -4.777 -23.276 1.00 0.00 O ATOM 0 H TYR A 9 -4.844 -2.812 -18.082 1.00 0.00 H new ATOM 0 HA TYR A 9 -2.016 -3.501 -17.536 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -2.155 -5.264 -19.135 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -3.521 -5.474 -18.057 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -5.823 -4.947 -18.838 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -2.488 -4.676 -21.475 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -7.348 -4.928 -20.762 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -4.011 -4.653 -23.401 1.00 0.00 H new ATOM 0 HH TYR A 9 -6.103 -4.714 -24.104 1.00 0.00 H new ATOM 109 N THR A 10 -1.185 -2.340 -19.612 1.00 0.00 N ATOM 110 CA THR A 10 -0.700 -1.436 -20.648 1.00 0.00 C ATOM 111 C THR A 10 0.733 -1.773 -21.044 1.00 0.00 C ATOM 112 O THR A 10 1.539 -2.178 -20.206 1.00 0.00 O ATOM 113 CB THR A 10 -0.761 0.032 -20.186 1.00 0.00 C ATOM 114 OG1 THR A 10 -0.341 0.897 -21.247 1.00 0.00 O ATOM 115 CG2 THR A 10 0.121 0.253 -18.966 1.00 0.00 C ATOM 0 H THR A 10 -0.452 -2.858 -19.127 1.00 0.00 H new ATOM 0 HA THR A 10 -1.353 -1.565 -21.511 1.00 0.00 H new ATOM 0 HB THR A 10 -1.792 0.262 -19.916 1.00 0.00 H new ATOM 0 HG1 THR A 10 -0.384 1.829 -20.946 1.00 0.00 H new ATOM 0 HG21 THR A 10 0.061 1.297 -18.658 1.00 0.00 H new ATOM 0 HG22 THR A 10 -0.219 -0.386 -18.151 1.00 0.00 H new ATOM 0 HG23 THR A 10 1.153 0.006 -19.214 1.00 0.00 H new ATOM 123 N GLN A 11 1.044 -1.603 -22.325 1.00 0.00 N ATOM 124 CA GLN A 11 2.381 -1.890 -22.831 1.00 0.00 C ATOM 125 C GLN A 11 3.095 -0.606 -23.241 1.00 0.00 C ATOM 126 O GLN A 11 2.508 0.264 -23.883 1.00 0.00 O ATOM 127 CB GLN A 11 2.305 -2.847 -24.021 1.00 0.00 C ATOM 128 CG GLN A 11 1.840 -4.246 -23.648 1.00 0.00 C ATOM 129 CD GLN A 11 2.955 -5.097 -23.072 1.00 0.00 C ATOM 130 OE1 GLN A 11 3.108 -5.199 -21.855 1.00 0.00 O ATOM 131 NE2 GLN A 11 3.742 -5.713 -23.947 1.00 0.00 N ATOM 0 H GLN A 11 0.389 -1.268 -23.031 1.00 0.00 H new ATOM 0 HA GLN A 11 2.951 -2.362 -22.031 1.00 0.00 H new ATOM 0 HB2 GLN A 11 1.625 -2.434 -24.766 1.00 0.00 H new ATOM 0 HB3 GLN A 11 3.288 -2.912 -24.488 1.00 0.00 H new ATOM 0 HG2 GLN A 11 1.031 -4.174 -22.922 1.00 0.00 H new ATOM 0 HG3 GLN A 11 1.433 -4.737 -24.532 1.00 0.00 H new ATOM 0 HE21 GLN A 11 3.579 -5.600 -24.948 1.00 0.00 H new ATOM 0 HE22 GLN A 11 4.510 -6.299 -23.618 1.00 0.00 H new ATOM 140 N ASN A 12 4.365 -0.495 -22.864 1.00 0.00 N ATOM 141 CA ASN A 12 5.159 0.684 -23.192 1.00 0.00 C ATOM 142 C ASN A 12 6.616 0.306 -23.442 1.00 0.00 C ATOM 143 O ASN A 12 6.988 -0.863 -23.357 1.00 0.00 O ATOM 144 CB ASN A 12 5.074 1.713 -22.063 1.00 0.00 C ATOM 145 CG ASN A 12 4.400 2.998 -22.502 1.00 0.00 C ATOM 146 OD1 ASN A 12 3.188 3.036 -22.717 1.00 0.00 O ATOM 147 ND2 ASN A 12 5.185 4.061 -22.637 1.00 0.00 N ATOM 0 H ASN A 12 4.866 -1.206 -22.332 1.00 0.00 H new ATOM 0 HA ASN A 12 4.754 1.122 -24.104 1.00 0.00 H new ATOM 0 HB2 ASN A 12 4.523 1.285 -21.225 1.00 0.00 H new ATOM 0 HB3 ASN A 12 6.078 1.937 -21.703 1.00 0.00 H new ATOM 0 HD21 ASN A 12 4.788 4.954 -22.929 1.00 0.00 H new ATOM 0 HD22 ASN A 12 6.184 3.984 -22.448 1.00 0.00 H new ATOM 154 N ASN A 13 7.436 1.306 -23.751 1.00 0.00 N ATOM 155 CA ASN A 13 8.853 1.078 -24.013 1.00 0.00 C ATOM 156 C ASN A 13 9.519 0.378 -22.832 1.00 0.00 C ATOM 157 O ASN A 13 10.506 -0.338 -22.998 1.00 0.00 O ATOM 158 CB ASN A 13 9.559 2.405 -24.299 1.00 0.00 C ATOM 159 CG ASN A 13 9.514 2.780 -25.767 1.00 0.00 C ATOM 160 OD1 ASN A 13 8.459 3.130 -26.298 1.00 0.00 O ATOM 161 ND2 ASN A 13 10.661 2.708 -26.432 1.00 0.00 N ATOM 0 H ASN A 13 7.144 2.280 -23.826 1.00 0.00 H new ATOM 0 HA ASN A 13 8.937 0.433 -24.888 1.00 0.00 H new ATOM 0 HB2 ASN A 13 9.093 3.195 -23.711 1.00 0.00 H new ATOM 0 HB3 ASN A 13 10.598 2.338 -23.976 1.00 0.00 H new ATOM 0 HD21 ASN A 13 10.692 2.948 -27.423 1.00 0.00 H new ATOM 0 HD22 ASN A 13 11.511 2.413 -25.952 1.00 0.00 H new ATOM 168 N PHE A 14 8.972 0.591 -21.640 1.00 0.00 N ATOM 169 CA PHE A 14 9.513 -0.019 -20.431 1.00 0.00 C ATOM 170 C PHE A 14 8.476 -0.920 -19.765 1.00 0.00 C ATOM 171 O PHE A 14 7.277 -0.644 -19.814 1.00 0.00 O ATOM 172 CB PHE A 14 9.971 1.062 -19.450 1.00 0.00 C ATOM 173 CG PHE A 14 11.155 1.848 -19.935 1.00 0.00 C ATOM 174 CD1 PHE A 14 11.003 2.830 -20.901 1.00 0.00 C ATOM 175 CD2 PHE A 14 12.421 1.605 -19.426 1.00 0.00 C ATOM 176 CE1 PHE A 14 12.091 3.555 -21.350 1.00 0.00 C ATOM 177 CE2 PHE A 14 13.512 2.328 -19.870 1.00 0.00 C ATOM 178 CZ PHE A 14 13.347 3.304 -20.834 1.00 0.00 C ATOM 0 H PHE A 14 8.155 1.181 -21.485 1.00 0.00 H new ATOM 0 HA PHE A 14 10.370 -0.629 -20.715 1.00 0.00 H new ATOM 0 HB2 PHE A 14 9.143 1.746 -19.263 1.00 0.00 H new ATOM 0 HB3 PHE A 14 10.221 0.595 -18.497 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.023 3.031 -21.308 1.00 0.00 H new ATOM 0 HD2 PHE A 14 12.557 0.842 -18.674 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.959 4.317 -22.104 1.00 0.00 H new ATOM 0 HE2 PHE A 14 14.493 2.130 -19.464 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.198 3.869 -21.183 1.00 0.00 H new ATOM 188 N ILE A 15 8.947 -1.996 -19.145 1.00 0.00 N ATOM 189 CA ILE A 15 8.062 -2.937 -18.470 1.00 0.00 C ATOM 190 C ILE A 15 8.455 -3.106 -17.006 1.00 0.00 C ATOM 191 O ILE A 15 9.636 -3.224 -16.677 1.00 0.00 O ATOM 192 CB ILE A 15 8.076 -4.315 -19.156 1.00 0.00 C ATOM 193 CG1 ILE A 15 7.097 -5.264 -18.462 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.482 -4.897 -19.148 1.00 0.00 C ATOM 195 CD1 ILE A 15 6.991 -6.618 -19.130 1.00 0.00 C ATOM 0 H ILE A 15 9.937 -2.238 -19.096 1.00 0.00 H new ATOM 0 HA ILE A 15 7.056 -2.522 -18.529 1.00 0.00 H new ATOM 0 HB ILE A 15 7.761 -4.192 -20.192 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.409 -5.402 -17.427 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.110 -4.801 -18.438 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.475 -5.871 -19.637 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.156 -4.228 -19.683 1.00 0.00 H new ATOM 0 HG23 ILE A 15 9.823 -5.009 -18.119 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.280 -7.238 -18.585 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.649 -6.491 -20.157 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.968 -7.101 -19.130 1.00 0.00 H new ATOM 207 N THR A 16 7.455 -3.119 -16.129 1.00 0.00 N ATOM 208 CA THR A 16 7.695 -3.275 -14.700 1.00 0.00 C ATOM 209 C THR A 16 8.380 -4.604 -14.399 1.00 0.00 C ATOM 210 O THR A 16 8.355 -5.524 -15.214 1.00 0.00 O ATOM 211 CB THR A 16 6.383 -3.193 -13.898 1.00 0.00 C ATOM 212 OG1 THR A 16 5.280 -2.972 -14.784 1.00 0.00 O ATOM 213 CG2 THR A 16 6.446 -2.075 -12.869 1.00 0.00 C ATOM 0 H THR A 16 6.472 -3.023 -16.384 1.00 0.00 H new ATOM 0 HA THR A 16 8.348 -2.456 -14.398 1.00 0.00 H new ATOM 0 HB THR A 16 6.244 -4.139 -13.374 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.449 -2.923 -14.266 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.508 -2.037 -12.315 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.268 -2.262 -12.178 1.00 0.00 H new ATOM 0 HG23 THR A 16 6.607 -1.123 -13.375 1.00 0.00 H new ATOM 221 N GLY A 17 8.989 -4.697 -13.221 1.00 0.00 N ATOM 222 CA GLY A 17 9.672 -5.917 -12.833 1.00 0.00 C ATOM 223 C GLY A 17 8.714 -7.071 -12.609 1.00 0.00 C ATOM 224 O GLY A 17 8.730 -8.053 -13.351 1.00 0.00 O ATOM 0 H GLY A 17 9.022 -3.949 -12.528 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.390 -6.190 -13.606 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.240 -5.737 -11.920 1.00 0.00 H new ATOM 228 N VAL A 18 7.877 -6.953 -11.583 1.00 0.00 N ATOM 229 CA VAL A 18 6.908 -7.994 -11.264 1.00 0.00 C ATOM 230 C VAL A 18 6.053 -8.340 -12.477 1.00 0.00 C ATOM 231 O VAL A 18 5.566 -9.464 -12.607 1.00 0.00 O ATOM 232 CB VAL A 18 5.987 -7.567 -10.105 1.00 0.00 C ATOM 233 CG1 VAL A 18 5.123 -6.385 -10.518 1.00 0.00 C ATOM 234 CG2 VAL A 18 5.125 -8.736 -9.652 1.00 0.00 C ATOM 0 H VAL A 18 7.851 -6.147 -10.959 1.00 0.00 H new ATOM 0 HA VAL A 18 7.477 -8.874 -10.962 1.00 0.00 H new ATOM 0 HB VAL A 18 6.608 -7.256 -9.265 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.479 -6.097 -9.687 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.762 -5.545 -10.790 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.508 -6.665 -11.373 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.481 -8.417 -8.833 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.511 -9.079 -10.484 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.765 -9.551 -9.314 1.00 0.00 H new ATOM 244 N ARG A 19 5.873 -7.368 -13.365 1.00 0.00 N ATOM 245 CA ARG A 19 5.076 -7.569 -14.569 1.00 0.00 C ATOM 246 C ARG A 19 5.777 -8.523 -15.532 1.00 0.00 C ATOM 247 O ARG A 19 5.128 -9.279 -16.254 1.00 0.00 O ATOM 248 CB ARG A 19 4.811 -6.231 -15.261 1.00 0.00 C ATOM 249 CG ARG A 19 3.370 -5.761 -15.149 1.00 0.00 C ATOM 250 CD ARG A 19 2.490 -6.406 -16.209 1.00 0.00 C ATOM 251 NE ARG A 19 2.071 -7.752 -15.828 1.00 0.00 N ATOM 252 CZ ARG A 19 1.181 -8.002 -14.874 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.619 -7.003 -14.208 1.00 0.00 N ATOM 254 NH2 ARG A 19 0.851 -9.254 -14.584 1.00 0.00 N ATOM 0 H ARG A 19 6.269 -6.432 -13.273 1.00 0.00 H new ATOM 0 HA ARG A 19 4.124 -8.012 -14.275 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.466 -5.473 -14.830 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.075 -6.318 -16.315 1.00 0.00 H new ATOM 0 HG2 ARG A 19 2.984 -6.001 -14.158 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.331 -4.677 -15.252 1.00 0.00 H new ATOM 0 HD2 ARG A 19 1.609 -5.786 -16.375 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.033 -6.449 -17.153 1.00 0.00 H new ATOM 0 HE ARG A 19 2.484 -8.543 -16.321 1.00 0.00 H new ATOM 0 HH11 ARG A 19 0.870 -6.039 -14.428 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.064 -7.198 -13.476 1.00 0.00 H new ATOM 0 HH21 ARG A 19 1.281 -10.026 -15.094 1.00 0.00 H new ATOM 0 HH22 ARG A 19 0.168 -9.445 -13.851 1.00 0.00 H new ATOM 268 N ALA A 20 7.105 -8.480 -15.537 1.00 0.00 N ATOM 269 CA ALA A 20 7.894 -9.340 -16.410 1.00 0.00 C ATOM 270 C ALA A 20 8.120 -10.708 -15.774 1.00 0.00 C ATOM 271 O ALA A 20 8.221 -11.717 -16.472 1.00 0.00 O ATOM 272 CB ALA A 20 9.226 -8.681 -16.736 1.00 0.00 C ATOM 0 H ALA A 20 7.657 -7.859 -14.946 1.00 0.00 H new ATOM 0 HA ALA A 20 7.337 -9.486 -17.336 1.00 0.00 H new ATOM 0 HB1 ALA A 20 9.805 -9.334 -17.389 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.048 -7.731 -17.239 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.780 -8.505 -15.814 1.00 0.00 H new ATOM 278 N ILE A 21 8.199 -10.733 -14.448 1.00 0.00 N ATOM 279 CA ILE A 21 8.412 -11.977 -13.720 1.00 0.00 C ATOM 280 C ILE A 21 7.179 -12.871 -13.786 1.00 0.00 C ATOM 281 O ILE A 21 7.279 -14.093 -13.675 1.00 0.00 O ATOM 282 CB ILE A 21 8.762 -11.713 -12.243 1.00 0.00 C ATOM 283 CG1 ILE A 21 10.017 -10.844 -12.142 1.00 0.00 C ATOM 284 CG2 ILE A 21 8.960 -13.026 -11.502 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.266 -10.300 -10.752 1.00 0.00 C ATOM 0 H ILE A 21 8.119 -9.906 -13.856 1.00 0.00 H new ATOM 0 HA ILE A 21 9.251 -12.482 -14.199 1.00 0.00 H new ATOM 0 HB ILE A 21 7.933 -11.178 -11.779 1.00 0.00 H new ATOM 0 HG12 ILE A 21 10.881 -11.431 -12.454 1.00 0.00 H new ATOM 0 HG13 ILE A 21 9.929 -10.011 -12.839 1.00 0.00 H new ATOM 0 HG21 ILE A 21 9.207 -12.822 -10.460 1.00 0.00 H new ATOM 0 HG22 ILE A 21 8.043 -13.613 -11.550 1.00 0.00 H new ATOM 0 HG23 ILE A 21 9.773 -13.586 -11.964 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.172 -9.694 -10.755 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.419 -9.686 -10.444 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.386 -11.128 -10.053 1.00 0.00 H new ATOM 297 N ASN A 22 6.016 -12.254 -13.968 1.00 0.00 N ATOM 298 CA ASN A 22 4.762 -12.994 -14.050 1.00 0.00 C ATOM 299 C ASN A 22 4.428 -13.339 -15.498 1.00 0.00 C ATOM 300 O ASN A 22 3.794 -14.357 -15.774 1.00 0.00 O ATOM 301 CB ASN A 22 3.624 -12.180 -13.432 1.00 0.00 C ATOM 302 CG ASN A 22 3.406 -12.510 -11.968 1.00 0.00 C ATOM 303 OD1 ASN A 22 3.197 -13.668 -11.605 1.00 0.00 O ATOM 304 ND2 ASN A 22 3.455 -11.490 -11.118 1.00 0.00 N ATOM 0 H ASN A 22 5.916 -11.243 -14.062 1.00 0.00 H new ATOM 0 HA ASN A 22 4.880 -13.923 -13.492 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.844 -11.117 -13.533 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.704 -12.369 -13.985 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.317 -11.650 -10.120 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.631 -10.546 -11.463 1.00 0.00 H new ATOM 311 N GLU A 23 4.860 -12.483 -16.419 1.00 0.00 N ATOM 312 CA GLU A 23 4.606 -12.697 -17.839 1.00 0.00 C ATOM 313 C GLU A 23 5.641 -13.643 -18.440 1.00 0.00 C ATOM 314 O GLU A 23 5.298 -14.700 -18.972 1.00 0.00 O ATOM 315 CB GLU A 23 4.621 -11.364 -18.590 1.00 0.00 C ATOM 316 CG GLU A 23 3.389 -10.511 -18.339 1.00 0.00 C ATOM 317 CD GLU A 23 2.210 -10.921 -19.200 1.00 0.00 C ATOM 318 OE1 GLU A 23 2.356 -10.927 -20.441 1.00 0.00 O ATOM 319 OE2 GLU A 23 1.143 -11.236 -18.634 1.00 0.00 O ATOM 0 H GLU A 23 5.387 -11.636 -16.207 1.00 0.00 H new ATOM 0 HA GLU A 23 3.621 -13.152 -17.941 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.508 -10.802 -18.298 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.706 -11.560 -19.659 1.00 0.00 H new ATOM 0 HG2 GLU A 23 3.109 -10.584 -17.288 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.630 -9.466 -18.533 1.00 0.00 H new ATOM 326 N PHE A 24 6.909 -13.256 -18.353 1.00 0.00 N ATOM 327 CA PHE A 24 7.995 -14.068 -18.889 1.00 0.00 C ATOM 328 C PHE A 24 8.253 -15.284 -18.005 1.00 0.00 C ATOM 329 O PHE A 24 8.909 -16.240 -18.421 1.00 0.00 O ATOM 330 CB PHE A 24 9.272 -13.233 -19.012 1.00 0.00 C ATOM 331 CG PHE A 24 9.167 -12.123 -20.018 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.704 -10.872 -19.642 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.532 -12.329 -21.339 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.605 -9.848 -20.566 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.436 -11.309 -22.267 1.00 0.00 C ATOM 336 CZ PHE A 24 8.973 -10.067 -21.879 1.00 0.00 C ATOM 0 H PHE A 24 7.210 -12.385 -17.916 1.00 0.00 H new ATOM 0 HA PHE A 24 7.700 -14.416 -19.879 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.514 -12.808 -18.038 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.099 -13.887 -19.289 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.417 -10.695 -18.616 1.00 0.00 H new ATOM 0 HD2 PHE A 24 9.896 -13.298 -21.647 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.240 -8.878 -20.261 1.00 0.00 H new ATOM 0 HE2 PHE A 24 9.723 -11.483 -23.294 1.00 0.00 H new ATOM 0 HZ PHE A 24 8.899 -9.268 -22.602 1.00 0.00 H new ATOM 346 N CYS A 25 7.733 -15.241 -16.783 1.00 0.00 N ATOM 347 CA CYS A 25 7.908 -16.338 -15.838 1.00 0.00 C ATOM 348 C CYS A 25 9.387 -16.588 -15.563 1.00 0.00 C ATOM 349 O CYS A 25 9.917 -17.653 -15.883 1.00 0.00 O ATOM 350 CB CYS A 25 7.254 -17.611 -16.376 1.00 0.00 C ATOM 351 SG CYS A 25 5.491 -17.438 -16.742 1.00 0.00 S ATOM 0 H CYS A 25 7.187 -14.458 -16.424 1.00 0.00 H new ATOM 0 HA CYS A 25 7.426 -16.059 -14.901 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.774 -17.918 -17.283 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.386 -18.410 -15.647 1.00 0.00 H new ATOM 0 HG CYS A 25 5.313 -16.445 -17.562 1.00 0.00 H new ATOM 357 N LEU A 26 10.048 -15.601 -14.969 1.00 0.00 N ATOM 358 CA LEU A 26 11.468 -15.713 -14.652 1.00 0.00 C ATOM 359 C LEU A 26 11.694 -15.663 -13.144 1.00 0.00 C ATOM 360 O LEU A 26 10.745 -15.700 -12.361 1.00 0.00 O ATOM 361 CB LEU A 26 12.253 -14.593 -15.335 1.00 0.00 C ATOM 362 CG LEU A 26 11.988 -14.402 -16.829 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.266 -12.964 -17.240 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.834 -15.366 -17.648 1.00 0.00 C ATOM 0 H LEU A 26 9.624 -14.714 -14.697 1.00 0.00 H new ATOM 0 HA LEU A 26 11.824 -16.674 -15.022 1.00 0.00 H new ATOM 0 HB2 LEU A 26 12.030 -13.656 -14.824 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.317 -14.786 -15.197 1.00 0.00 H new ATOM 0 HG LEU A 26 10.937 -14.617 -17.023 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.072 -12.846 -18.306 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.617 -12.293 -16.677 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.308 -12.721 -17.032 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.633 -15.216 -18.709 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.890 -15.182 -17.450 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.586 -16.391 -17.373 1.00 0.00 H new ATOM 376 N LYS A 27 12.958 -15.576 -12.744 1.00 0.00 N ATOM 377 CA LYS A 27 13.311 -15.516 -11.330 1.00 0.00 C ATOM 378 C LYS A 27 13.649 -14.088 -10.914 1.00 0.00 C ATOM 379 O LYS A 27 14.060 -13.272 -11.738 1.00 0.00 O ATOM 380 CB LYS A 27 14.498 -16.438 -11.040 1.00 0.00 C ATOM 381 CG LYS A 27 14.092 -17.839 -10.618 1.00 0.00 C ATOM 382 CD LYS A 27 14.371 -18.854 -11.714 1.00 0.00 C ATOM 383 CE LYS A 27 13.145 -19.088 -12.583 1.00 0.00 C ATOM 384 NZ LYS A 27 13.491 -19.772 -13.859 1.00 0.00 N ATOM 0 H LYS A 27 13.756 -15.545 -13.379 1.00 0.00 H new ATOM 0 HA LYS A 27 12.450 -15.850 -10.751 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.123 -16.503 -11.931 1.00 0.00 H new ATOM 0 HB3 LYS A 27 15.109 -15.994 -10.254 1.00 0.00 H new ATOM 0 HG2 LYS A 27 14.634 -18.119 -9.715 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.031 -17.852 -10.370 1.00 0.00 H new ATOM 0 HD2 LYS A 27 15.196 -18.504 -12.334 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.686 -19.797 -11.267 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.420 -19.689 -12.034 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.667 -18.133 -12.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 12.628 -19.913 -14.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.163 -19.187 -14.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 13.924 -20.695 -13.652 1.00 0.00 H new ATOM 398 N SER A 28 13.475 -13.794 -9.629 1.00 0.00 N ATOM 399 CA SER A 28 13.759 -12.464 -9.104 1.00 0.00 C ATOM 400 C SER A 28 15.244 -12.137 -9.229 1.00 0.00 C ATOM 401 O SER A 28 15.629 -10.971 -9.318 1.00 0.00 O ATOM 402 CB SER A 28 13.325 -12.367 -7.640 1.00 0.00 C ATOM 403 OG SER A 28 13.084 -13.652 -7.093 1.00 0.00 O ATOM 0 H SER A 28 13.139 -14.459 -8.933 1.00 0.00 H new ATOM 0 HA SER A 28 13.194 -11.740 -9.691 1.00 0.00 H new ATOM 0 HB2 SER A 28 14.098 -11.861 -7.061 1.00 0.00 H new ATOM 0 HB3 SER A 28 12.422 -11.761 -7.565 1.00 0.00 H new ATOM 0 HG SER A 28 12.178 -13.943 -7.327 1.00 0.00 H new ATOM 409 N SER A 29 16.074 -13.175 -9.234 1.00 0.00 N ATOM 410 CA SER A 29 17.517 -12.999 -9.344 1.00 0.00 C ATOM 411 C SER A 29 17.916 -12.662 -10.777 1.00 0.00 C ATOM 412 O SER A 29 18.922 -11.992 -11.012 1.00 0.00 O ATOM 413 CB SER A 29 18.243 -14.265 -8.885 1.00 0.00 C ATOM 414 OG SER A 29 17.863 -14.622 -7.568 1.00 0.00 O ATOM 0 H SER A 29 15.772 -14.147 -9.163 1.00 0.00 H new ATOM 0 HA SER A 29 17.807 -12.169 -8.700 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.017 -15.085 -9.567 1.00 0.00 H new ATOM 0 HB3 SER A 29 19.320 -14.105 -8.925 1.00 0.00 H new ATOM 0 HG SER A 29 18.340 -15.435 -7.299 1.00 0.00 H new ATOM 420 N ASP A 30 17.120 -13.131 -11.732 1.00 0.00 N ATOM 421 CA ASP A 30 17.388 -12.880 -13.143 1.00 0.00 C ATOM 422 C ASP A 30 17.110 -11.422 -13.497 1.00 0.00 C ATOM 423 O ASP A 30 17.960 -10.738 -14.070 1.00 0.00 O ATOM 424 CB ASP A 30 16.537 -13.801 -14.018 1.00 0.00 C ATOM 425 CG ASP A 30 17.095 -15.209 -14.090 1.00 0.00 C ATOM 426 OD1 ASP A 30 18.163 -15.454 -13.493 1.00 0.00 O ATOM 427 OD2 ASP A 30 16.463 -16.065 -14.744 1.00 0.00 O ATOM 0 H ASP A 30 16.284 -13.687 -11.554 1.00 0.00 H new ATOM 0 HA ASP A 30 18.442 -13.087 -13.330 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.521 -13.835 -13.624 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.475 -13.386 -15.024 1.00 0.00 H new ATOM 432 N LEU A 31 15.916 -10.953 -13.154 1.00 0.00 N ATOM 433 CA LEU A 31 15.525 -9.576 -13.437 1.00 0.00 C ATOM 434 C LEU A 31 16.542 -8.593 -12.866 1.00 0.00 C ATOM 435 O LEU A 31 17.043 -7.722 -13.576 1.00 0.00 O ATOM 436 CB LEU A 31 14.139 -9.289 -12.856 1.00 0.00 C ATOM 437 CG LEU A 31 12.950 -9.672 -13.737 1.00 0.00 C ATOM 438 CD1 LEU A 31 12.886 -8.779 -14.966 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.036 -11.136 -14.143 1.00 0.00 C ATOM 0 H LEU A 31 15.202 -11.505 -12.680 1.00 0.00 H new ATOM 0 HA LEU A 31 15.492 -9.449 -14.519 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.048 -9.818 -11.907 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.073 -8.224 -12.635 1.00 0.00 H new ATOM 0 HG LEU A 31 12.036 -9.529 -13.161 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.033 -9.067 -15.581 1.00 0.00 H new ATOM 0 HD12 LEU A 31 12.775 -7.740 -14.655 1.00 0.00 H new ATOM 0 HD13 LEU A 31 13.804 -8.889 -15.544 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.181 -11.391 -14.770 1.00 0.00 H new ATOM 0 HD22 LEU A 31 13.958 -11.306 -14.700 1.00 0.00 H new ATOM 0 HD23 LEU A 31 13.031 -11.762 -13.251 1.00 0.00 H new ATOM 451 N GLU A 32 16.843 -8.741 -11.579 1.00 0.00 N ATOM 452 CA GLU A 32 17.802 -7.867 -10.914 1.00 0.00 C ATOM 453 C GLU A 32 19.151 -7.897 -11.626 1.00 0.00 C ATOM 454 O GLU A 32 19.913 -6.932 -11.574 1.00 0.00 O ATOM 455 CB GLU A 32 17.975 -8.282 -9.452 1.00 0.00 C ATOM 456 CG GLU A 32 18.635 -9.639 -9.278 1.00 0.00 C ATOM 457 CD GLU A 32 19.009 -9.927 -7.837 1.00 0.00 C ATOM 458 OE1 GLU A 32 18.334 -9.392 -6.932 1.00 0.00 O ATOM 459 OE2 GLU A 32 19.975 -10.685 -7.614 1.00 0.00 O ATOM 0 H GLU A 32 16.437 -9.457 -10.977 1.00 0.00 H new ATOM 0 HA GLU A 32 17.414 -6.849 -10.952 1.00 0.00 H new ATOM 0 HB2 GLU A 32 18.572 -7.529 -8.938 1.00 0.00 H new ATOM 0 HB3 GLU A 32 16.998 -8.298 -8.970 1.00 0.00 H new ATOM 0 HG2 GLU A 32 17.959 -10.416 -9.636 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.530 -9.685 -9.898 1.00 0.00 H new ATOM 466 N GLN A 33 19.438 -9.012 -12.290 1.00 0.00 N ATOM 467 CA GLN A 33 20.696 -9.169 -13.011 1.00 0.00 C ATOM 468 C GLN A 33 20.772 -8.203 -14.189 1.00 0.00 C ATOM 469 O GLN A 33 21.854 -7.752 -14.566 1.00 0.00 O ATOM 470 CB GLN A 33 20.848 -10.608 -13.506 1.00 0.00 C ATOM 471 CG GLN A 33 22.293 -11.076 -13.580 1.00 0.00 C ATOM 472 CD GLN A 33 22.895 -11.329 -12.212 1.00 0.00 C ATOM 473 OE1 GLN A 33 22.220 -11.200 -11.191 1.00 0.00 O ATOM 474 NE2 GLN A 33 24.172 -11.692 -12.185 1.00 0.00 N ATOM 0 H GLN A 33 18.817 -9.819 -12.344 1.00 0.00 H new ATOM 0 HA GLN A 33 21.511 -8.941 -12.324 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.293 -11.272 -12.843 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.396 -10.693 -14.494 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.345 -11.991 -14.170 1.00 0.00 H new ATOM 0 HG3 GLN A 33 22.888 -10.326 -14.101 1.00 0.00 H new ATOM 0 HE21 GLN A 33 24.694 -11.787 -13.056 1.00 0.00 H new ATOM 0 HE22 GLN A 33 24.631 -11.876 -11.293 1.00 0.00 H new ATOM 483 N LEU A 34 19.617 -7.889 -14.766 1.00 0.00 N ATOM 484 CA LEU A 34 19.553 -6.976 -15.901 1.00 0.00 C ATOM 485 C LEU A 34 19.854 -5.545 -15.467 1.00 0.00 C ATOM 486 O LEU A 34 19.925 -5.250 -14.274 1.00 0.00 O ATOM 487 CB LEU A 34 18.172 -7.043 -16.557 1.00 0.00 C ATOM 488 CG LEU A 34 17.733 -8.419 -17.059 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.221 -8.473 -17.215 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.420 -8.750 -18.376 1.00 0.00 C ATOM 0 H LEU A 34 18.713 -8.253 -14.466 1.00 0.00 H new ATOM 0 HA LEU A 34 20.308 -7.282 -16.625 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.433 -6.688 -15.839 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.158 -6.350 -17.398 1.00 0.00 H new ATOM 0 HG LEU A 34 18.028 -9.165 -16.321 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.927 -9.460 -17.573 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.749 -8.281 -16.252 1.00 0.00 H new ATOM 0 HD13 LEU A 34 15.902 -7.717 -17.932 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.096 -9.733 -18.719 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.156 -8.001 -19.122 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.500 -8.754 -18.232 1.00 0.00 H new ATOM 502 N ARG A 35 20.027 -4.660 -16.444 1.00 0.00 N ATOM 503 CA ARG A 35 20.319 -3.259 -16.163 1.00 0.00 C ATOM 504 C ARG A 35 19.166 -2.605 -15.408 1.00 0.00 C ATOM 505 O ARG A 35 18.002 -2.748 -15.783 1.00 0.00 O ATOM 506 CB ARG A 35 20.586 -2.501 -17.464 1.00 0.00 C ATOM 507 CG ARG A 35 21.000 -1.054 -17.252 1.00 0.00 C ATOM 508 CD ARG A 35 21.895 -0.560 -18.377 1.00 0.00 C ATOM 509 NE ARG A 35 22.650 0.630 -17.994 1.00 0.00 N ATOM 510 CZ ARG A 35 22.124 1.849 -17.940 1.00 0.00 C ATOM 511 NH1 ARG A 35 20.847 2.037 -18.243 1.00 0.00 N ATOM 512 NH2 ARG A 35 22.875 2.882 -17.582 1.00 0.00 N ATOM 0 H ARG A 35 19.970 -4.888 -17.436 1.00 0.00 H new ATOM 0 HA ARG A 35 21.211 -3.218 -15.537 1.00 0.00 H new ATOM 0 HB2 ARG A 35 21.369 -3.016 -18.021 1.00 0.00 H new ATOM 0 HB3 ARG A 35 19.687 -2.526 -18.080 1.00 0.00 H new ATOM 0 HG2 ARG A 35 20.112 -0.426 -17.190 1.00 0.00 H new ATOM 0 HG3 ARG A 35 21.524 -0.960 -16.301 1.00 0.00 H new ATOM 0 HD2 ARG A 35 22.587 -1.352 -18.664 1.00 0.00 H new ATOM 0 HD3 ARG A 35 21.286 -0.336 -19.253 1.00 0.00 H new ATOM 0 HE ARG A 35 23.635 0.519 -17.755 1.00 0.00 H new ATOM 0 HH11 ARG A 35 20.266 1.245 -18.518 1.00 0.00 H new ATOM 0 HH12 ARG A 35 20.445 2.974 -18.201 1.00 0.00 H new ATOM 0 HH21 ARG A 35 23.858 2.741 -17.348 1.00 0.00 H new ATOM 0 HH22 ARG A 35 22.470 3.817 -17.541 1.00 0.00 H new ATOM 526 N LYS A 36 19.497 -1.886 -14.340 1.00 0.00 N ATOM 527 CA LYS A 36 18.491 -1.208 -13.531 1.00 0.00 C ATOM 528 C LYS A 36 18.366 0.257 -13.934 1.00 0.00 C ATOM 529 O LYS A 36 19.255 1.064 -13.660 1.00 0.00 O ATOM 530 CB LYS A 36 18.846 -1.312 -12.046 1.00 0.00 C ATOM 531 CG LYS A 36 18.358 -2.592 -11.392 1.00 0.00 C ATOM 532 CD LYS A 36 18.655 -2.606 -9.902 1.00 0.00 C ATOM 533 CE LYS A 36 19.193 -3.956 -9.453 1.00 0.00 C ATOM 534 NZ LYS A 36 19.026 -4.160 -7.987 1.00 0.00 N ATOM 0 H LYS A 36 20.455 -1.758 -14.015 1.00 0.00 H new ATOM 0 HA LYS A 36 17.532 -1.697 -13.704 1.00 0.00 H new ATOM 0 HB2 LYS A 36 19.928 -1.247 -11.934 1.00 0.00 H new ATOM 0 HB3 LYS A 36 18.419 -0.459 -11.519 1.00 0.00 H new ATOM 0 HG2 LYS A 36 17.285 -2.696 -11.551 1.00 0.00 H new ATOM 0 HG3 LYS A 36 18.835 -3.449 -11.867 1.00 0.00 H new ATOM 0 HD2 LYS A 36 19.381 -1.828 -9.667 1.00 0.00 H new ATOM 0 HD3 LYS A 36 17.747 -2.372 -9.347 1.00 0.00 H new ATOM 0 HE2 LYS A 36 18.676 -4.750 -9.991 1.00 0.00 H new ATOM 0 HE3 LYS A 36 20.249 -4.030 -9.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 19.405 -5.091 -7.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 19.540 -3.417 -7.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 18.016 -4.114 -7.743 1.00 0.00 H new ATOM 548 N ILE A 37 17.257 0.595 -14.584 1.00 0.00 N ATOM 549 CA ILE A 37 17.016 1.965 -15.021 1.00 0.00 C ATOM 550 C ILE A 37 15.946 2.635 -14.166 1.00 0.00 C ATOM 551 O ILE A 37 14.912 2.037 -13.866 1.00 0.00 O ATOM 552 CB ILE A 37 16.583 2.016 -16.498 1.00 0.00 C ATOM 553 CG1 ILE A 37 17.594 1.274 -17.375 1.00 0.00 C ATOM 554 CG2 ILE A 37 16.433 3.459 -16.957 1.00 0.00 C ATOM 555 CD1 ILE A 37 17.266 -0.190 -17.570 1.00 0.00 C ATOM 0 H ILE A 37 16.512 -0.060 -14.819 1.00 0.00 H new ATOM 0 HA ILE A 37 17.957 2.503 -14.907 1.00 0.00 H new ATOM 0 HB ILE A 37 15.616 1.522 -16.595 1.00 0.00 H new ATOM 0 HG12 ILE A 37 17.643 1.760 -18.349 1.00 0.00 H new ATOM 0 HG13 ILE A 37 18.584 1.360 -16.926 1.00 0.00 H new ATOM 0 HG21 ILE A 37 16.127 3.478 -18.003 1.00 0.00 H new ATOM 0 HG22 ILE A 37 15.679 3.958 -16.349 1.00 0.00 H new ATOM 0 HG23 ILE A 37 17.386 3.976 -16.849 1.00 0.00 H new ATOM 0 HD11 ILE A 37 18.025 -0.652 -18.202 1.00 0.00 H new ATOM 0 HD12 ILE A 37 17.246 -0.690 -16.602 1.00 0.00 H new ATOM 0 HD13 ILE A 37 16.291 -0.284 -18.047 1.00 0.00 H new ATOM 567 N ARG A 38 16.201 3.880 -13.777 1.00 0.00 N ATOM 568 CA ARG A 38 15.260 4.632 -12.957 1.00 0.00 C ATOM 569 C ARG A 38 14.759 5.868 -13.698 1.00 0.00 C ATOM 570 O ARG A 38 14.415 6.877 -13.082 1.00 0.00 O ATOM 571 CB ARG A 38 15.917 5.047 -11.639 1.00 0.00 C ATOM 572 CG ARG A 38 14.926 5.276 -10.510 1.00 0.00 C ATOM 573 CD ARG A 38 15.616 5.279 -9.155 1.00 0.00 C ATOM 574 NE ARG A 38 15.753 6.628 -8.613 1.00 0.00 N ATOM 575 CZ ARG A 38 16.246 6.889 -7.407 1.00 0.00 C ATOM 576 NH1 ARG A 38 16.648 5.899 -6.623 1.00 0.00 N ATOM 577 NH2 ARG A 38 16.339 8.144 -6.985 1.00 0.00 N ATOM 0 H ARG A 38 17.052 4.389 -14.017 1.00 0.00 H new ATOM 0 HA ARG A 38 14.408 3.987 -12.744 1.00 0.00 H new ATOM 0 HB2 ARG A 38 16.626 4.276 -11.338 1.00 0.00 H new ATOM 0 HB3 ARG A 38 16.489 5.961 -11.800 1.00 0.00 H new ATOM 0 HG2 ARG A 38 14.414 6.226 -10.661 1.00 0.00 H new ATOM 0 HG3 ARG A 38 14.164 4.497 -10.530 1.00 0.00 H new ATOM 0 HD2 ARG A 38 15.047 4.664 -8.457 1.00 0.00 H new ATOM 0 HD3 ARG A 38 16.602 4.825 -9.250 1.00 0.00 H new ATOM 0 HE ARG A 38 15.454 7.413 -9.192 1.00 0.00 H new ATOM 0 HH11 ARG A 38 16.579 4.934 -6.945 1.00 0.00 H new ATOM 0 HH12 ARG A 38 17.026 6.103 -5.698 1.00 0.00 H new ATOM 0 HH21 ARG A 38 16.032 8.908 -7.587 1.00 0.00 H new ATOM 0 HH22 ARG A 38 16.717 8.344 -6.059 1.00 0.00 H new ATOM 591 N ARG A 39 14.720 5.781 -15.024 1.00 0.00 N ATOM 592 CA ARG A 39 14.263 6.892 -15.850 1.00 0.00 C ATOM 593 C ARG A 39 15.042 8.165 -15.528 1.00 0.00 C ATOM 594 O ARG A 39 14.533 9.273 -15.692 1.00 0.00 O ATOM 595 CB ARG A 39 12.767 7.130 -15.639 1.00 0.00 C ATOM 596 CG ARG A 39 11.887 6.045 -16.239 1.00 0.00 C ATOM 597 CD ARG A 39 10.892 5.509 -15.222 1.00 0.00 C ATOM 598 NE ARG A 39 9.683 4.994 -15.858 1.00 0.00 N ATOM 599 CZ ARG A 39 8.771 5.766 -16.438 1.00 0.00 C ATOM 600 NH1 ARG A 39 8.931 7.082 -16.461 1.00 0.00 N ATOM 601 NH2 ARG A 39 7.697 5.223 -16.996 1.00 0.00 N ATOM 0 H ARG A 39 14.999 4.952 -15.549 1.00 0.00 H new ATOM 0 HA ARG A 39 14.439 6.633 -16.894 1.00 0.00 H new ATOM 0 HB2 ARG A 39 12.566 7.199 -14.570 1.00 0.00 H new ATOM 0 HB3 ARG A 39 12.495 8.090 -16.077 1.00 0.00 H new ATOM 0 HG2 ARG A 39 11.350 6.445 -17.099 1.00 0.00 H new ATOM 0 HG3 ARG A 39 12.511 5.229 -16.604 1.00 0.00 H new ATOM 0 HD2 ARG A 39 11.361 4.716 -14.639 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.625 6.302 -14.524 1.00 0.00 H new ATOM 0 HE ARG A 39 9.530 3.986 -15.857 1.00 0.00 H new ATOM 0 HH11 ARG A 39 9.755 7.503 -16.033 1.00 0.00 H new ATOM 0 HH12 ARG A 39 8.230 7.673 -16.907 1.00 0.00 H new ATOM 0 HH21 ARG A 39 7.570 4.211 -16.980 1.00 0.00 H new ATOM 0 HH22 ARG A 39 6.998 5.817 -17.441 1.00 0.00 H new ATOM 615 N ARG A 40 16.277 7.996 -15.069 1.00 0.00 N ATOM 616 CA ARG A 40 17.125 9.130 -14.723 1.00 0.00 C ATOM 617 C ARG A 40 16.478 9.980 -13.633 1.00 0.00 C ATOM 618 O ARG A 40 16.618 11.203 -13.621 1.00 0.00 O ATOM 619 CB ARG A 40 17.396 9.988 -15.960 1.00 0.00 C ATOM 620 CG ARG A 40 18.811 10.542 -16.020 1.00 0.00 C ATOM 621 CD ARG A 40 18.811 12.044 -16.257 1.00 0.00 C ATOM 622 NE ARG A 40 17.999 12.415 -17.413 1.00 0.00 N ATOM 623 CZ ARG A 40 17.831 13.668 -17.821 1.00 0.00 C ATOM 624 NH1 ARG A 40 18.417 14.665 -17.171 1.00 0.00 N ATOM 625 NH2 ARG A 40 17.077 13.927 -18.882 1.00 0.00 N ATOM 0 H ARG A 40 16.713 7.085 -14.928 1.00 0.00 H new ATOM 0 HA ARG A 40 18.071 8.742 -14.344 1.00 0.00 H new ATOM 0 HB2 ARG A 40 17.210 9.391 -16.853 1.00 0.00 H new ATOM 0 HB3 ARG A 40 16.689 10.818 -15.978 1.00 0.00 H new ATOM 0 HG2 ARG A 40 19.330 10.320 -15.088 1.00 0.00 H new ATOM 0 HG3 ARG A 40 19.363 10.046 -16.818 1.00 0.00 H new ATOM 0 HD2 ARG A 40 18.432 12.551 -15.370 1.00 0.00 H new ATOM 0 HD3 ARG A 40 19.834 12.387 -16.408 1.00 0.00 H new ATOM 0 HE ARG A 40 17.536 11.672 -17.935 1.00 0.00 H new ATOM 0 HH11 ARG A 40 18.998 14.470 -16.356 1.00 0.00 H new ATOM 0 HH12 ARG A 40 18.286 15.626 -17.487 1.00 0.00 H new ATOM 0 HH21 ARG A 40 16.625 13.163 -19.385 1.00 0.00 H new ATOM 0 HH22 ARG A 40 16.949 14.890 -19.194 1.00 0.00 H new ATOM 639 N SER A 41 15.768 9.324 -12.721 1.00 0.00 N ATOM 640 CA SER A 41 15.096 10.019 -11.630 1.00 0.00 C ATOM 641 C SER A 41 14.193 11.126 -12.166 1.00 0.00 C ATOM 642 O SER A 41 14.471 12.316 -12.018 1.00 0.00 O ATOM 643 CB SER A 41 16.124 10.608 -10.662 1.00 0.00 C ATOM 644 OG SER A 41 15.507 11.030 -9.458 1.00 0.00 O ATOM 0 H SER A 41 15.643 8.312 -12.716 1.00 0.00 H new ATOM 0 HA SER A 41 14.479 9.296 -11.097 1.00 0.00 H new ATOM 0 HB2 SER A 41 16.889 9.863 -10.441 1.00 0.00 H new ATOM 0 HB3 SER A 41 16.628 11.453 -11.132 1.00 0.00 H new ATOM 0 HG SER A 41 16.185 11.401 -8.856 1.00 0.00 H new ATOM 650 N PRO A 42 13.083 10.725 -12.805 1.00 0.00 N ATOM 651 CA PRO A 42 12.115 11.666 -13.376 1.00 0.00 C ATOM 652 C PRO A 42 11.342 12.425 -12.303 1.00 0.00 C ATOM 653 O PRO A 42 10.763 13.479 -12.569 1.00 0.00 O ATOM 654 CB PRO A 42 11.173 10.764 -14.177 1.00 0.00 C ATOM 655 CG PRO A 42 11.274 9.432 -13.518 1.00 0.00 C ATOM 656 CD PRO A 42 12.688 9.323 -13.018 1.00 0.00 C ATOM 0 HA PRO A 42 12.600 12.437 -13.975 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.150 11.140 -14.155 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.471 10.711 -15.224 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.562 9.348 -12.697 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.046 8.631 -14.221 1.00 0.00 H new ATOM 0 HD2 PRO A 42 12.745 8.745 -12.096 1.00 0.00 H new ATOM 0 HD3 PRO A 42 13.334 8.829 -13.744 1.00 0.00 H new ATOM 664 N HIS A 43 11.336 11.883 -11.089 1.00 0.00 N ATOM 665 CA HIS A 43 10.634 12.510 -9.975 1.00 0.00 C ATOM 666 C HIS A 43 11.285 12.141 -8.646 1.00 0.00 C ATOM 667 O HIS A 43 11.359 10.967 -8.285 1.00 0.00 O ATOM 668 CB HIS A 43 9.164 12.090 -9.970 1.00 0.00 C ATOM 669 CG HIS A 43 8.214 13.232 -10.159 1.00 0.00 C ATOM 670 ND1 HIS A 43 8.438 14.257 -11.054 1.00 0.00 N ATOM 671 CD2 HIS A 43 7.029 13.507 -9.564 1.00 0.00 C ATOM 672 CE1 HIS A 43 7.434 15.114 -11.000 1.00 0.00 C ATOM 673 NE2 HIS A 43 6.565 14.681 -10.104 1.00 0.00 N ATOM 0 H HIS A 43 11.809 11.011 -10.852 1.00 0.00 H new ATOM 0 HA HIS A 43 10.695 13.591 -10.102 1.00 0.00 H new ATOM 0 HB2 HIS A 43 9.001 11.358 -10.761 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.940 11.594 -9.026 1.00 0.00 H new ATOM 0 HD1 HIS A 43 9.252 14.340 -11.663 1.00 0.00 H new ATOM 0 HD2 HIS A 43 6.540 12.913 -8.806 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.340 16.015 -11.588 1.00 0.00 H new ATOM 681 N GLU A 44 11.757 13.152 -7.923 1.00 0.00 N ATOM 682 CA GLU A 44 12.404 12.932 -6.634 1.00 0.00 C ATOM 683 C GLU A 44 11.420 13.148 -5.488 1.00 0.00 C ATOM 684 O GLU A 44 10.280 13.561 -5.703 1.00 0.00 O ATOM 685 CB GLU A 44 13.603 13.869 -6.474 1.00 0.00 C ATOM 686 CG GLU A 44 14.746 13.563 -7.428 1.00 0.00 C ATOM 687 CD GLU A 44 14.902 14.616 -8.508 1.00 0.00 C ATOM 688 OE1 GLU A 44 13.901 15.293 -8.825 1.00 0.00 O ATOM 689 OE2 GLU A 44 16.023 14.763 -9.036 1.00 0.00 O ATOM 0 H GLU A 44 11.704 14.130 -8.207 1.00 0.00 H new ATOM 0 HA GLU A 44 12.752 11.899 -6.602 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.274 14.896 -6.632 1.00 0.00 H new ATOM 0 HB3 GLU A 44 13.969 13.805 -5.449 1.00 0.00 H new ATOM 0 HG2 GLU A 44 15.675 13.487 -6.863 1.00 0.00 H new ATOM 0 HG3 GLU A 44 14.576 12.592 -7.894 1.00 0.00 H new ATOM 696 N ASP A 45 11.868 12.864 -4.270 1.00 0.00 N ATOM 697 CA ASP A 45 11.029 13.027 -3.089 1.00 0.00 C ATOM 698 C ASP A 45 9.765 12.179 -3.199 1.00 0.00 C ATOM 699 O ASP A 45 8.728 12.513 -2.626 1.00 0.00 O ATOM 700 CB ASP A 45 10.655 14.498 -2.901 1.00 0.00 C ATOM 701 CG ASP A 45 11.746 15.288 -2.205 1.00 0.00 C ATOM 702 OD1 ASP A 45 12.848 14.734 -2.012 1.00 0.00 O ATOM 703 OD2 ASP A 45 11.498 16.460 -1.853 1.00 0.00 O ATOM 0 H ASP A 45 12.808 12.520 -4.075 1.00 0.00 H new ATOM 0 HA ASP A 45 11.597 12.691 -2.222 1.00 0.00 H new ATOM 0 HB2 ASP A 45 10.451 14.945 -3.874 1.00 0.00 H new ATOM 0 HB3 ASP A 45 9.735 14.565 -2.320 1.00 0.00 H new ATOM 708 N THR A 46 9.859 11.080 -3.941 1.00 0.00 N ATOM 709 CA THR A 46 8.724 10.185 -4.129 1.00 0.00 C ATOM 710 C THR A 46 9.187 8.754 -4.373 1.00 0.00 C ATOM 711 O THR A 46 10.160 8.520 -5.090 1.00 0.00 O ATOM 712 CB THR A 46 7.843 10.636 -5.309 1.00 0.00 C ATOM 713 OG1 THR A 46 8.663 11.140 -6.369 1.00 0.00 O ATOM 714 CG2 THR A 46 6.858 11.709 -4.870 1.00 0.00 C ATOM 0 H THR A 46 10.710 10.788 -4.422 1.00 0.00 H new ATOM 0 HA THR A 46 8.137 10.222 -3.212 1.00 0.00 H new ATOM 0 HB THR A 46 7.281 9.772 -5.664 1.00 0.00 H new ATOM 0 HG1 THR A 46 9.039 12.007 -6.108 1.00 0.00 H new ATOM 0 HG21 THR A 46 6.247 12.012 -5.720 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.215 11.313 -4.084 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.405 12.572 -4.491 1.00 0.00 H new ATOM 722 N GLU A 47 8.484 7.798 -3.773 1.00 0.00 N ATOM 723 CA GLU A 47 8.825 6.389 -3.927 1.00 0.00 C ATOM 724 C GLU A 47 8.888 6.002 -5.401 1.00 0.00 C ATOM 725 O GLU A 47 7.872 5.992 -6.096 1.00 0.00 O ATOM 726 CB GLU A 47 7.801 5.512 -3.201 1.00 0.00 C ATOM 727 CG GLU A 47 8.417 4.317 -2.494 1.00 0.00 C ATOM 728 CD GLU A 47 7.715 3.015 -2.828 1.00 0.00 C ATOM 729 OE1 GLU A 47 7.942 2.487 -3.936 1.00 0.00 O ATOM 730 OE2 GLU A 47 6.937 2.526 -1.982 1.00 0.00 O ATOM 0 H GLU A 47 7.676 7.974 -3.176 1.00 0.00 H new ATOM 0 HA GLU A 47 9.809 6.229 -3.485 1.00 0.00 H new ATOM 0 HB2 GLU A 47 7.267 6.120 -2.471 1.00 0.00 H new ATOM 0 HB3 GLU A 47 7.063 5.157 -3.921 1.00 0.00 H new ATOM 0 HG2 GLU A 47 9.469 4.239 -2.770 1.00 0.00 H new ATOM 0 HG3 GLU A 47 8.381 4.479 -1.417 1.00 0.00 H new ATOM 737 N SER A 48 10.090 5.684 -5.872 1.00 0.00 N ATOM 738 CA SER A 48 10.287 5.300 -7.265 1.00 0.00 C ATOM 739 C SER A 48 10.435 3.787 -7.396 1.00 0.00 C ATOM 740 O SER A 48 10.319 3.053 -6.415 1.00 0.00 O ATOM 741 CB SER A 48 11.524 5.996 -7.837 1.00 0.00 C ATOM 742 OG SER A 48 12.693 5.230 -7.606 1.00 0.00 O ATOM 0 H SER A 48 10.941 5.685 -5.310 1.00 0.00 H new ATOM 0 HA SER A 48 9.409 5.612 -7.830 1.00 0.00 H new ATOM 0 HB2 SER A 48 11.394 6.153 -8.908 1.00 0.00 H new ATOM 0 HB3 SER A 48 11.635 6.980 -7.382 1.00 0.00 H new ATOM 0 HG SER A 48 13.465 5.828 -7.523 1.00 0.00 H new ATOM 748 N PHE A 49 10.694 3.328 -8.616 1.00 0.00 N ATOM 749 CA PHE A 49 10.857 1.903 -8.878 1.00 0.00 C ATOM 750 C PHE A 49 11.867 1.667 -9.997 1.00 0.00 C ATOM 751 O PHE A 49 12.309 2.607 -10.659 1.00 0.00 O ATOM 752 CB PHE A 49 9.512 1.273 -9.248 1.00 0.00 C ATOM 753 CG PHE A 49 8.747 2.055 -10.276 1.00 0.00 C ATOM 754 CD1 PHE A 49 9.052 1.939 -11.623 1.00 0.00 C ATOM 755 CD2 PHE A 49 7.723 2.908 -9.896 1.00 0.00 C ATOM 756 CE1 PHE A 49 8.349 2.657 -12.572 1.00 0.00 C ATOM 757 CE2 PHE A 49 7.016 3.628 -10.841 1.00 0.00 C ATOM 758 CZ PHE A 49 7.331 3.504 -12.180 1.00 0.00 C ATOM 0 H PHE A 49 10.795 3.922 -9.439 1.00 0.00 H new ATOM 0 HA PHE A 49 11.232 1.433 -7.969 1.00 0.00 H new ATOM 0 HB2 PHE A 49 9.683 0.264 -9.624 1.00 0.00 H new ATOM 0 HB3 PHE A 49 8.904 1.179 -8.348 1.00 0.00 H new ATOM 0 HD1 PHE A 49 9.849 1.280 -11.935 1.00 0.00 H new ATOM 0 HD2 PHE A 49 7.475 3.011 -8.850 1.00 0.00 H new ATOM 0 HE1 PHE A 49 8.595 2.556 -13.619 1.00 0.00 H new ATOM 0 HE2 PHE A 49 6.218 4.287 -10.532 1.00 0.00 H new ATOM 0 HZ PHE A 49 6.782 4.068 -12.919 1.00 0.00 H new ATOM 768 N THR A 50 12.229 0.405 -10.204 1.00 0.00 N ATOM 769 CA THR A 50 13.187 0.044 -11.241 1.00 0.00 C ATOM 770 C THR A 50 12.485 -0.555 -12.454 1.00 0.00 C ATOM 771 O THR A 50 11.620 -1.421 -12.318 1.00 0.00 O ATOM 772 CB THR A 50 14.231 -0.960 -10.717 1.00 0.00 C ATOM 773 OG1 THR A 50 14.002 -1.225 -9.329 1.00 0.00 O ATOM 774 CG2 THR A 50 15.642 -0.425 -10.911 1.00 0.00 C ATOM 0 H THR A 50 11.873 -0.385 -9.666 1.00 0.00 H new ATOM 0 HA THR A 50 13.694 0.963 -11.536 1.00 0.00 H new ATOM 0 HB THR A 50 14.130 -1.885 -11.284 1.00 0.00 H new ATOM 0 HG1 THR A 50 14.669 -1.865 -9.004 1.00 0.00 H new ATOM 0 HG21 THR A 50 16.362 -1.151 -10.533 1.00 0.00 H new ATOM 0 HG22 THR A 50 15.823 -0.253 -11.972 1.00 0.00 H new ATOM 0 HG23 THR A 50 15.754 0.513 -10.367 1.00 0.00 H new ATOM 782 N VAL A 51 12.863 -0.091 -13.641 1.00 0.00 N ATOM 783 CA VAL A 51 12.270 -0.583 -14.879 1.00 0.00 C ATOM 784 C VAL A 51 13.310 -1.287 -15.743 1.00 0.00 C ATOM 785 O VAL A 51 14.488 -0.931 -15.730 1.00 0.00 O ATOM 786 CB VAL A 51 11.634 0.561 -15.690 1.00 0.00 C ATOM 787 CG1 VAL A 51 10.352 1.039 -15.024 1.00 0.00 C ATOM 788 CG2 VAL A 51 12.619 1.708 -15.856 1.00 0.00 C ATOM 0 H VAL A 51 13.577 0.625 -13.771 1.00 0.00 H new ATOM 0 HA VAL A 51 11.493 -1.294 -14.598 1.00 0.00 H new ATOM 0 HB VAL A 51 11.381 0.184 -16.681 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.917 1.848 -15.611 1.00 0.00 H new ATOM 0 HG12 VAL A 51 9.644 0.213 -14.963 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.576 1.400 -14.020 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.153 2.508 -16.432 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.905 2.087 -14.875 1.00 0.00 H new ATOM 0 HG23 VAL A 51 13.506 1.353 -16.381 1.00 0.00 H new ATOM 798 N TYR A 52 12.866 -2.289 -16.495 1.00 0.00 N ATOM 799 CA TYR A 52 13.758 -3.045 -17.365 1.00 0.00 C ATOM 800 C TYR A 52 13.408 -2.819 -18.833 1.00 0.00 C ATOM 801 O TYR A 52 12.316 -2.351 -19.158 1.00 0.00 O ATOM 802 CB TYR A 52 13.682 -4.537 -17.035 1.00 0.00 C ATOM 803 CG TYR A 52 13.889 -4.844 -15.569 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.058 -4.472 -14.919 1.00 0.00 C ATOM 805 CD2 TYR A 52 12.912 -5.505 -14.834 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.251 -4.752 -13.579 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.095 -5.788 -13.494 1.00 0.00 C ATOM 808 CZ TYR A 52 14.267 -5.409 -12.872 1.00 0.00 C ATOM 809 OH TYR A 52 14.454 -5.688 -11.537 1.00 0.00 O ATOM 0 H TYR A 52 11.894 -2.596 -16.519 1.00 0.00 H new ATOM 0 HA TYR A 52 14.775 -2.693 -17.194 1.00 0.00 H new ATOM 0 HB2 TYR A 52 12.709 -4.920 -17.344 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.434 -5.068 -17.619 1.00 0.00 H new ATOM 0 HD1 TYR A 52 15.830 -3.955 -15.470 1.00 0.00 H new ATOM 0 HD2 TYR A 52 11.994 -5.803 -15.319 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.167 -4.458 -13.089 1.00 0.00 H new ATOM 0 HE2 TYR A 52 12.326 -6.302 -12.937 1.00 0.00 H new ATOM 0 HH TYR A 52 13.666 -6.154 -11.187 1.00 0.00 H new ATOM 819 N LEU A 53 14.343 -3.155 -19.715 1.00 0.00 N ATOM 820 CA LEU A 53 14.135 -2.990 -21.149 1.00 0.00 C ATOM 821 C LEU A 53 13.453 -4.218 -21.745 1.00 0.00 C ATOM 822 O LEU A 53 13.882 -5.349 -21.520 1.00 0.00 O ATOM 823 CB LEU A 53 15.471 -2.743 -21.853 1.00 0.00 C ATOM 824 CG LEU A 53 15.760 -1.297 -22.255 1.00 0.00 C ATOM 825 CD1 LEU A 53 14.726 -0.803 -23.254 1.00 0.00 C ATOM 826 CD2 LEU A 53 15.790 -0.398 -21.027 1.00 0.00 C ATOM 0 H LEU A 53 15.252 -3.543 -19.462 1.00 0.00 H new ATOM 0 HA LEU A 53 13.486 -2.127 -21.300 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.273 -3.084 -21.198 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.507 -3.362 -22.749 1.00 0.00 H new ATOM 0 HG LEU A 53 16.740 -1.262 -22.731 1.00 0.00 H new ATOM 0 HD11 LEU A 53 14.949 0.228 -23.528 1.00 0.00 H new ATOM 0 HD12 LEU A 53 14.753 -1.429 -24.146 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.734 -0.853 -22.806 1.00 0.00 H new ATOM 0 HD21 LEU A 53 15.997 0.628 -21.332 1.00 0.00 H new ATOM 0 HD22 LEU A 53 14.825 -0.439 -20.523 1.00 0.00 H new ATOM 0 HD23 LEU A 53 16.570 -0.738 -20.346 1.00 0.00 H new ATOM 838 N ARG A 54 12.390 -3.985 -22.508 1.00 0.00 N ATOM 839 CA ARG A 54 11.649 -5.071 -23.138 1.00 0.00 C ATOM 840 C ARG A 54 12.582 -5.970 -23.944 1.00 0.00 C ATOM 841 O ARG A 54 12.427 -7.191 -23.955 1.00 0.00 O ATOM 842 CB ARG A 54 10.553 -4.511 -24.046 1.00 0.00 C ATOM 843 CG ARG A 54 9.614 -5.572 -24.594 1.00 0.00 C ATOM 844 CD ARG A 54 8.312 -4.963 -25.089 1.00 0.00 C ATOM 845 NE ARG A 54 8.191 -5.034 -26.543 1.00 0.00 N ATOM 846 CZ ARG A 54 7.075 -4.747 -27.203 1.00 0.00 C ATOM 847 NH1 ARG A 54 5.988 -4.371 -26.543 1.00 0.00 N ATOM 848 NH2 ARG A 54 7.044 -4.835 -28.527 1.00 0.00 N ATOM 0 H ARG A 54 12.023 -3.054 -22.705 1.00 0.00 H new ATOM 0 HA ARG A 54 11.189 -5.667 -22.350 1.00 0.00 H new ATOM 0 HB2 ARG A 54 9.972 -3.776 -23.489 1.00 0.00 H new ATOM 0 HB3 ARG A 54 11.018 -3.984 -24.879 1.00 0.00 H new ATOM 0 HG2 ARG A 54 10.102 -6.104 -25.411 1.00 0.00 H new ATOM 0 HG3 ARG A 54 9.401 -6.307 -23.818 1.00 0.00 H new ATOM 0 HD2 ARG A 54 7.471 -5.483 -24.630 1.00 0.00 H new ATOM 0 HD3 ARG A 54 8.255 -3.922 -24.771 1.00 0.00 H new ATOM 0 HE ARG A 54 9.009 -5.320 -27.081 1.00 0.00 H new ATOM 0 HH11 ARG A 54 6.008 -4.302 -25.526 1.00 0.00 H new ATOM 0 HH12 ARG A 54 5.132 -4.151 -27.053 1.00 0.00 H new ATOM 0 HH21 ARG A 54 7.878 -5.123 -29.039 1.00 0.00 H new ATOM 0 HH22 ARG A 54 6.186 -4.614 -29.033 1.00 0.00 H new ATOM 862 N SER A 55 13.550 -5.357 -24.618 1.00 0.00 N ATOM 863 CA SER A 55 14.505 -6.101 -25.430 1.00 0.00 C ATOM 864 C SER A 55 15.422 -6.947 -24.552 1.00 0.00 C ATOM 865 O SER A 55 15.855 -8.029 -24.949 1.00 0.00 O ATOM 866 CB SER A 55 15.338 -5.142 -26.282 1.00 0.00 C ATOM 867 OG SER A 55 16.011 -5.834 -27.320 1.00 0.00 O ATOM 0 H SER A 55 13.693 -4.347 -24.618 1.00 0.00 H new ATOM 0 HA SER A 55 13.945 -6.766 -26.087 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.691 -4.377 -26.711 1.00 0.00 H new ATOM 0 HB3 SER A 55 16.065 -4.629 -25.652 1.00 0.00 H new ATOM 0 HG SER A 55 16.535 -5.198 -27.851 1.00 0.00 H new ATOM 873 N ASP A 56 15.714 -6.445 -23.357 1.00 0.00 N ATOM 874 CA ASP A 56 16.579 -7.154 -22.421 1.00 0.00 C ATOM 875 C ASP A 56 15.846 -8.333 -21.790 1.00 0.00 C ATOM 876 O ASP A 56 16.346 -9.458 -21.786 1.00 0.00 O ATOM 877 CB ASP A 56 17.074 -6.202 -21.331 1.00 0.00 C ATOM 878 CG ASP A 56 18.523 -5.800 -21.527 1.00 0.00 C ATOM 879 OD1 ASP A 56 18.782 -4.894 -22.346 1.00 0.00 O ATOM 880 OD2 ASP A 56 19.397 -6.392 -20.860 1.00 0.00 O ATOM 0 H ASP A 56 15.365 -5.550 -23.014 1.00 0.00 H new ATOM 0 HA ASP A 56 17.436 -7.537 -22.975 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.450 -5.308 -21.323 1.00 0.00 H new ATOM 0 HB3 ASP A 56 16.961 -6.679 -20.357 1.00 0.00 H new ATOM 885 N VAL A 57 14.658 -8.068 -21.255 1.00 0.00 N ATOM 886 CA VAL A 57 13.856 -9.107 -20.621 1.00 0.00 C ATOM 887 C VAL A 57 13.536 -10.230 -21.601 1.00 0.00 C ATOM 888 O VAL A 57 13.448 -11.395 -21.217 1.00 0.00 O ATOM 889 CB VAL A 57 12.538 -8.536 -20.063 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.738 -9.625 -19.366 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.817 -7.379 -19.117 1.00 0.00 C ATOM 0 H VAL A 57 14.230 -7.142 -21.248 1.00 0.00 H new ATOM 0 HA VAL A 57 14.449 -9.506 -19.798 1.00 0.00 H new ATOM 0 HB VAL A 57 11.944 -8.159 -20.895 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.811 -9.204 -18.978 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.507 -10.418 -20.077 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.322 -10.035 -18.542 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.875 -6.988 -18.733 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.431 -7.728 -18.287 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.345 -6.590 -19.653 1.00 0.00 H new ATOM 901 N GLU A 58 13.364 -9.870 -22.869 1.00 0.00 N ATOM 902 CA GLU A 58 13.053 -10.848 -23.905 1.00 0.00 C ATOM 903 C GLU A 58 14.142 -11.914 -23.991 1.00 0.00 C ATOM 904 O GLU A 58 13.863 -13.109 -23.908 1.00 0.00 O ATOM 905 CB GLU A 58 12.894 -10.156 -25.261 1.00 0.00 C ATOM 906 CG GLU A 58 12.367 -11.071 -26.353 1.00 0.00 C ATOM 907 CD GLU A 58 12.243 -10.369 -27.692 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.227 -9.674 -27.904 1.00 0.00 O ATOM 909 OE2 GLU A 58 13.160 -10.515 -28.526 1.00 0.00 O ATOM 0 H GLU A 58 13.435 -8.909 -23.203 1.00 0.00 H new ATOM 0 HA GLU A 58 12.113 -11.333 -23.640 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.217 -9.309 -25.150 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.859 -9.754 -25.570 1.00 0.00 H new ATOM 0 HG2 GLU A 58 13.032 -11.928 -26.456 1.00 0.00 H new ATOM 0 HG3 GLU A 58 11.392 -11.458 -26.058 1.00 0.00 H new ATOM 916 N ALA A 59 15.384 -11.471 -24.158 1.00 0.00 N ATOM 917 CA ALA A 59 16.515 -12.385 -24.253 1.00 0.00 C ATOM 918 C ALA A 59 16.661 -13.213 -22.981 1.00 0.00 C ATOM 919 O ALA A 59 17.020 -14.389 -23.030 1.00 0.00 O ATOM 920 CB ALA A 59 17.796 -11.613 -24.532 1.00 0.00 C ATOM 0 H ALA A 59 15.632 -10.484 -24.230 1.00 0.00 H new ATOM 0 HA ALA A 59 16.328 -13.069 -25.081 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.632 -12.309 -24.600 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.697 -11.071 -25.473 1.00 0.00 H new ATOM 0 HB3 ALA A 59 17.978 -10.905 -23.723 1.00 0.00 H new ATOM 926 N LYS A 60 16.380 -12.591 -21.841 1.00 0.00 N ATOM 927 CA LYS A 60 16.479 -13.269 -20.554 1.00 0.00 C ATOM 928 C LYS A 60 15.569 -14.492 -20.512 1.00 0.00 C ATOM 929 O LYS A 60 15.830 -15.448 -19.782 1.00 0.00 O ATOM 930 CB LYS A 60 16.114 -12.310 -19.419 1.00 0.00 C ATOM 931 CG LYS A 60 16.221 -12.933 -18.038 1.00 0.00 C ATOM 932 CD LYS A 60 17.629 -13.432 -17.759 1.00 0.00 C ATOM 933 CE LYS A 60 18.628 -12.286 -17.715 1.00 0.00 C ATOM 934 NZ LYS A 60 19.856 -12.649 -16.954 1.00 0.00 N ATOM 0 H LYS A 60 16.082 -11.617 -21.782 1.00 0.00 H new ATOM 0 HA LYS A 60 17.510 -13.600 -20.425 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.767 -11.439 -19.467 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.095 -11.953 -19.570 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.938 -12.199 -17.284 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.517 -13.761 -17.956 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.645 -13.967 -16.809 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.924 -14.143 -18.530 1.00 0.00 H new ATOM 0 HE2 LYS A 60 18.901 -12.003 -18.732 1.00 0.00 H new ATOM 0 HE3 LYS A 60 18.161 -11.414 -17.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 20.512 -11.842 -16.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 19.599 -12.894 -15.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 20.316 -13.465 -17.406 1.00 0.00 H new ATOM 948 N SER A 61 14.499 -14.456 -21.301 1.00 0.00 N ATOM 949 CA SER A 61 13.549 -15.560 -21.352 1.00 0.00 C ATOM 950 C SER A 61 14.044 -16.660 -22.287 1.00 0.00 C ATOM 951 O SER A 61 13.692 -17.830 -22.130 1.00 0.00 O ATOM 952 CB SER A 61 12.179 -15.061 -21.814 1.00 0.00 C ATOM 953 OG SER A 61 11.955 -15.373 -23.178 1.00 0.00 O ATOM 0 H SER A 61 14.269 -13.673 -21.914 1.00 0.00 H new ATOM 0 HA SER A 61 13.457 -15.974 -20.348 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.399 -15.513 -21.202 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.114 -13.983 -21.669 1.00 0.00 H new ATOM 0 HG SER A 61 12.476 -14.764 -23.743 1.00 0.00 H new ATOM 959 N LEU A 62 14.862 -16.276 -23.260 1.00 0.00 N ATOM 960 CA LEU A 62 15.407 -17.228 -24.222 1.00 0.00 C ATOM 961 C LEU A 62 16.649 -17.916 -23.664 1.00 0.00 C ATOM 962 O LEU A 62 16.907 -19.083 -23.956 1.00 0.00 O ATOM 963 CB LEU A 62 15.749 -16.519 -25.534 1.00 0.00 C ATOM 964 CG LEU A 62 14.683 -15.569 -26.081 1.00 0.00 C ATOM 965 CD1 LEU A 62 15.101 -15.022 -27.437 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.339 -16.276 -26.180 1.00 0.00 C ATOM 0 H LEU A 62 15.163 -15.312 -23.404 1.00 0.00 H new ATOM 0 HA LEU A 62 14.649 -17.987 -24.413 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.670 -15.955 -25.389 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.955 -17.277 -26.290 1.00 0.00 H new ATOM 0 HG LEU A 62 14.581 -14.732 -25.390 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.330 -14.348 -27.811 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.041 -14.479 -27.336 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.232 -15.847 -28.137 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.592 -15.585 -26.571 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.427 -17.132 -26.849 1.00 0.00 H new ATOM 0 HD23 LEU A 62 13.034 -16.618 -25.191 1.00 0.00 H new ATOM 978 N GLU A 63 17.412 -17.184 -22.858 1.00 0.00 N ATOM 979 CA GLU A 63 18.626 -17.725 -22.258 1.00 0.00 C ATOM 980 C GLU A 63 18.289 -18.703 -21.136 1.00 0.00 C ATOM 981 O GLU A 63 19.078 -19.592 -20.814 1.00 0.00 O ATOM 982 CB GLU A 63 19.503 -16.593 -21.717 1.00 0.00 C ATOM 983 CG GLU A 63 18.969 -15.967 -20.440 1.00 0.00 C ATOM 984 CD GLU A 63 19.708 -16.441 -19.204 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.562 -17.627 -18.843 1.00 0.00 O ATOM 986 OE2 GLU A 63 20.434 -15.625 -18.599 1.00 0.00 O ATOM 0 H GLU A 63 17.211 -16.216 -22.606 1.00 0.00 H new ATOM 0 HA GLU A 63 19.175 -18.262 -23.032 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.505 -16.978 -21.531 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.595 -15.820 -22.480 1.00 0.00 H new ATOM 0 HG2 GLU A 63 19.047 -14.882 -20.512 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.910 -16.204 -20.339 1.00 0.00 H new ATOM 993 N VAL A 64 17.112 -18.531 -20.543 1.00 0.00 N ATOM 994 CA VAL A 64 16.669 -19.398 -19.457 1.00 0.00 C ATOM 995 C VAL A 64 15.870 -20.581 -19.989 1.00 0.00 C ATOM 996 O VAL A 64 16.354 -21.713 -20.006 1.00 0.00 O ATOM 997 CB VAL A 64 15.808 -18.626 -18.439 1.00 0.00 C ATOM 998 CG1 VAL A 64 15.310 -19.559 -17.346 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.594 -17.467 -17.846 1.00 0.00 C ATOM 0 H VAL A 64 16.448 -17.799 -20.796 1.00 0.00 H new ATOM 0 HA VAL A 64 17.566 -19.765 -18.959 1.00 0.00 H new ATOM 0 HB VAL A 64 14.941 -18.218 -18.958 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.704 -18.997 -16.636 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.707 -20.351 -17.790 1.00 0.00 H new ATOM 0 HG13 VAL A 64 16.162 -19.999 -16.827 1.00 0.00 H new ATOM 0 HG21 VAL A 64 15.970 -16.933 -17.129 1.00 0.00 H new ATOM 0 HG22 VAL A 64 17.481 -17.850 -17.341 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.895 -16.786 -18.642 1.00 0.00 H new ATOM 1009 N TRP A 65 14.644 -20.312 -20.424 1.00 0.00 N ATOM 1010 CA TRP A 65 13.776 -21.356 -20.958 1.00 0.00 C ATOM 1011 C TRP A 65 14.408 -22.018 -22.178 1.00 0.00 C ATOM 1012 O TRP A 65 14.118 -23.172 -22.490 1.00 0.00 O ATOM 1013 CB TRP A 65 12.411 -20.773 -21.328 1.00 0.00 C ATOM 1014 CG TRP A 65 11.490 -20.627 -20.155 1.00 0.00 C ATOM 1015 CD1 TRP A 65 11.275 -19.497 -19.418 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.662 -21.645 -19.583 1.00 0.00 C ATOM 1017 NE1 TRP A 65 10.363 -19.753 -18.423 1.00 0.00 N ATOM 1018 CE2 TRP A 65 9.971 -21.063 -18.503 1.00 0.00 C ATOM 1019 CE3 TRP A 65 10.436 -22.992 -19.880 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 9.072 -21.782 -17.720 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 9.543 -23.704 -19.102 1.00 0.00 C ATOM 1022 CH2 TRP A 65 8.869 -23.098 -18.033 1.00 0.00 C ATOM 0 H TRP A 65 14.229 -19.380 -20.418 1.00 0.00 H new ATOM 0 HA TRP A 65 13.642 -22.113 -20.186 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.554 -19.797 -21.792 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.940 -21.414 -22.073 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.751 -18.544 -19.592 1.00 0.00 H new ATOM 0 HE1 TRP A 65 10.031 -19.077 -17.735 1.00 0.00 H new ATOM 0 HE3 TRP A 65 10.950 -23.468 -20.702 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 8.553 -21.317 -16.895 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 9.361 -24.746 -19.322 1.00 0.00 H new ATOM 0 HH2 TRP A 65 8.176 -23.681 -17.445 1.00 0.00 H new ATOM 1033 N GLY A 66 15.275 -21.279 -22.864 1.00 0.00 N ATOM 1034 CA GLY A 66 15.934 -21.812 -24.042 1.00 0.00 C ATOM 1035 C GLY A 66 15.404 -21.206 -25.327 1.00 0.00 C ATOM 1036 O GLY A 66 16.171 -20.897 -26.238 1.00 0.00 O ATOM 0 H GLY A 66 15.532 -20.321 -22.625 1.00 0.00 H new ATOM 0 HA2 GLY A 66 17.006 -21.625 -23.971 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.800 -22.893 -24.072 1.00 0.00 H new ATOM 1040 N SER A 67 14.088 -21.038 -25.401 1.00 0.00 N ATOM 1041 CA SER A 67 13.455 -20.471 -26.586 1.00 0.00 C ATOM 1042 C SER A 67 12.159 -19.753 -26.219 1.00 0.00 C ATOM 1043 O SER A 67 11.572 -19.980 -25.161 1.00 0.00 O ATOM 1044 CB SER A 67 13.170 -21.568 -27.613 1.00 0.00 C ATOM 1045 OG SER A 67 13.801 -22.784 -27.248 1.00 0.00 O ATOM 0 H SER A 67 13.439 -21.286 -24.654 1.00 0.00 H new ATOM 0 HA SER A 67 14.142 -19.745 -27.022 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.094 -21.723 -27.695 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.522 -21.252 -28.595 1.00 0.00 H new ATOM 0 HG SER A 67 13.603 -23.470 -27.919 1.00 0.00 H new ATOM 1051 N PRO A 68 11.702 -18.865 -27.115 1.00 0.00 N ATOM 1052 CA PRO A 68 10.471 -18.096 -26.909 1.00 0.00 C ATOM 1053 C PRO A 68 9.222 -18.968 -26.989 1.00 0.00 C ATOM 1054 O PRO A 68 8.156 -18.586 -26.508 1.00 0.00 O ATOM 1055 CB PRO A 68 10.490 -17.083 -28.056 1.00 0.00 C ATOM 1056 CG PRO A 68 11.314 -17.727 -29.117 1.00 0.00 C ATOM 1057 CD PRO A 68 12.350 -18.545 -28.397 1.00 0.00 C ATOM 0 HA PRO A 68 10.436 -17.640 -25.920 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.482 -16.870 -28.412 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.924 -16.134 -27.739 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.699 -18.355 -29.761 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.783 -16.978 -29.756 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.608 -19.446 -28.953 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.274 -17.985 -28.251 1.00 0.00 H new ATOM 1065 N GLU A 69 9.363 -20.141 -27.599 1.00 0.00 N ATOM 1066 CA GLU A 69 8.245 -21.066 -27.742 1.00 0.00 C ATOM 1067 C GLU A 69 7.909 -21.723 -26.406 1.00 0.00 C ATOM 1068 O GLU A 69 6.740 -21.936 -26.084 1.00 0.00 O ATOM 1069 CB GLU A 69 8.571 -22.139 -28.782 1.00 0.00 C ATOM 1070 CG GLU A 69 7.639 -22.128 -29.982 1.00 0.00 C ATOM 1071 CD GLU A 69 8.150 -22.981 -31.127 1.00 0.00 C ATOM 1072 OE1 GLU A 69 9.222 -22.654 -31.677 1.00 0.00 O ATOM 1073 OE2 GLU A 69 7.478 -23.975 -31.472 1.00 0.00 O ATOM 0 H GLU A 69 10.240 -20.473 -28.002 1.00 0.00 H new ATOM 0 HA GLU A 69 7.377 -20.498 -28.077 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.595 -21.999 -29.127 1.00 0.00 H new ATOM 0 HB3 GLU A 69 8.526 -23.119 -28.307 1.00 0.00 H new ATOM 0 HG2 GLU A 69 6.656 -22.487 -29.677 1.00 0.00 H new ATOM 0 HG3 GLU A 69 7.510 -21.102 -30.328 1.00 0.00 H new ATOM 1080 N ALA A 70 8.942 -22.041 -25.633 1.00 0.00 N ATOM 1081 CA ALA A 70 8.757 -22.672 -24.332 1.00 0.00 C ATOM 1082 C ALA A 70 7.888 -21.810 -23.423 1.00 0.00 C ATOM 1083 O ALA A 70 7.049 -22.323 -22.680 1.00 0.00 O ATOM 1084 CB ALA A 70 10.105 -22.939 -23.679 1.00 0.00 C ATOM 0 H ALA A 70 9.916 -21.872 -25.885 1.00 0.00 H new ATOM 0 HA ALA A 70 8.245 -23.622 -24.486 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.952 -23.410 -22.708 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.693 -23.601 -24.315 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.637 -21.997 -23.545 1.00 0.00 H new ATOM 1090 N LEU A 71 8.093 -20.499 -23.485 1.00 0.00 N ATOM 1091 CA LEU A 71 7.327 -19.565 -22.666 1.00 0.00 C ATOM 1092 C LEU A 71 5.939 -19.336 -23.255 1.00 0.00 C ATOM 1093 O LEU A 71 4.954 -19.233 -22.525 1.00 0.00 O ATOM 1094 CB LEU A 71 8.070 -18.233 -22.547 1.00 0.00 C ATOM 1095 CG LEU A 71 7.290 -17.084 -21.908 1.00 0.00 C ATOM 1096 CD1 LEU A 71 7.010 -17.378 -20.443 1.00 0.00 C ATOM 1097 CD2 LEU A 71 8.051 -15.775 -22.056 1.00 0.00 C ATOM 0 H LEU A 71 8.783 -20.058 -24.094 1.00 0.00 H new ATOM 0 HA LEU A 71 7.212 -20.000 -21.673 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.978 -18.397 -21.966 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.382 -17.923 -23.545 1.00 0.00 H new ATOM 0 HG LEU A 71 6.336 -16.986 -22.426 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.454 -16.549 -20.005 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.422 -18.292 -20.361 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.953 -17.504 -19.911 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.481 -14.968 -21.595 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.020 -15.860 -21.565 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.198 -15.557 -23.114 1.00 0.00 H new ATOM 1109 N ALA A 72 5.870 -19.258 -24.580 1.00 0.00 N ATOM 1110 CA ALA A 72 4.602 -19.046 -25.267 1.00 0.00 C ATOM 1111 C ALA A 72 3.574 -20.096 -24.861 1.00 0.00 C ATOM 1112 O ALA A 72 2.370 -19.841 -24.882 1.00 0.00 O ATOM 1113 CB ALA A 72 4.809 -19.062 -26.774 1.00 0.00 C ATOM 0 H ALA A 72 6.677 -19.338 -25.199 1.00 0.00 H new ATOM 0 HA ALA A 72 4.218 -18.069 -24.974 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.854 -18.903 -27.274 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.502 -18.269 -27.054 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.219 -20.026 -27.075 1.00 0.00 H new ATOM 1119 N ARG A 73 4.057 -21.278 -24.492 1.00 0.00 N ATOM 1120 CA ARG A 73 3.179 -22.368 -24.083 1.00 0.00 C ATOM 1121 C ARG A 73 2.338 -21.965 -22.876 1.00 0.00 C ATOM 1122 O ARG A 73 1.176 -22.354 -22.760 1.00 0.00 O ATOM 1123 CB ARG A 73 4.001 -23.616 -23.752 1.00 0.00 C ATOM 1124 CG ARG A 73 4.908 -24.066 -24.884 1.00 0.00 C ATOM 1125 CD ARG A 73 4.461 -25.401 -25.459 1.00 0.00 C ATOM 1126 NE ARG A 73 4.757 -25.510 -26.885 1.00 0.00 N ATOM 1127 CZ ARG A 73 4.054 -24.897 -27.831 1.00 0.00 C ATOM 1128 NH1 ARG A 73 3.019 -24.135 -27.503 1.00 0.00 N ATOM 1129 NH2 ARG A 73 4.385 -25.045 -29.107 1.00 0.00 N ATOM 0 H ARG A 73 5.051 -21.505 -24.468 1.00 0.00 H new ATOM 0 HA ARG A 73 2.508 -22.592 -24.913 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.608 -23.417 -22.869 1.00 0.00 H new ATOM 0 HB3 ARG A 73 3.323 -24.430 -23.496 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.911 -23.312 -25.671 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.932 -24.150 -24.520 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.957 -26.211 -24.923 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.389 -25.523 -25.301 1.00 0.00 H new ATOM 0 HE ARG A 73 5.547 -26.089 -27.170 1.00 0.00 H new ATOM 0 HH11 ARG A 73 2.762 -24.019 -26.523 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.481 -23.665 -28.231 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.180 -25.630 -29.363 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.844 -24.574 -29.832 1.00 0.00 H new ATOM 1143 N GLU A 74 2.933 -21.183 -21.980 1.00 0.00 N ATOM 1144 CA GLU A 74 2.238 -20.729 -20.782 1.00 0.00 C ATOM 1145 C GLU A 74 1.455 -19.448 -21.059 1.00 0.00 C ATOM 1146 O GLU A 74 0.399 -19.212 -20.472 1.00 0.00 O ATOM 1147 CB GLU A 74 3.235 -20.494 -19.645 1.00 0.00 C ATOM 1148 CG GLU A 74 3.476 -21.723 -18.784 1.00 0.00 C ATOM 1149 CD GLU A 74 2.976 -21.548 -17.364 1.00 0.00 C ATOM 1150 OE1 GLU A 74 3.380 -20.564 -16.709 1.00 0.00 O ATOM 1151 OE2 GLU A 74 2.181 -22.395 -16.907 1.00 0.00 O ATOM 0 H GLU A 74 3.894 -20.851 -22.062 1.00 0.00 H new ATOM 0 HA GLU A 74 1.535 -21.507 -20.485 1.00 0.00 H new ATOM 0 HB2 GLU A 74 4.184 -20.165 -20.068 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.869 -19.684 -19.014 1.00 0.00 H new ATOM 0 HG2 GLU A 74 2.980 -22.582 -19.236 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.543 -21.945 -18.765 1.00 0.00 H new ATOM 1158 N LYS A 75 1.982 -18.623 -21.958 1.00 0.00 N ATOM 1159 CA LYS A 75 1.335 -17.366 -22.316 1.00 0.00 C ATOM 1160 C LYS A 75 -0.019 -17.619 -22.972 1.00 0.00 C ATOM 1161 O LYS A 75 -0.984 -16.894 -22.729 1.00 0.00 O ATOM 1162 CB LYS A 75 2.229 -16.559 -23.259 1.00 0.00 C ATOM 1163 CG LYS A 75 3.614 -16.286 -22.700 1.00 0.00 C ATOM 1164 CD LYS A 75 3.876 -14.796 -22.560 1.00 0.00 C ATOM 1165 CE LYS A 75 3.317 -14.252 -21.254 1.00 0.00 C ATOM 1166 NZ LYS A 75 1.997 -13.591 -21.449 1.00 0.00 N ATOM 0 H LYS A 75 2.856 -18.803 -22.452 1.00 0.00 H new ATOM 0 HA LYS A 75 1.174 -16.795 -21.402 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.327 -17.097 -24.202 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.743 -15.609 -23.482 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.716 -16.767 -21.727 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.365 -16.728 -23.355 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.949 -14.608 -22.604 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.425 -14.266 -23.399 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.213 -15.066 -20.536 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.021 -13.538 -20.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 2.042 -12.615 -21.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.760 -13.580 -22.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.266 -14.116 -20.928 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.083 -18.652 -23.805 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.319 -19.003 -24.495 1.00 0.00 C ATOM 1182 C LYS A 76 -2.459 -19.206 -23.502 1.00 0.00 C ATOM 1183 O LYS A 76 -3.529 -18.612 -23.640 1.00 0.00 O ATOM 1184 CB LYS A 76 -1.121 -20.273 -25.326 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.396 -20.780 -25.976 1.00 0.00 C ATOM 1186 CD LYS A 76 -2.097 -21.689 -27.156 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.537 -23.028 -26.700 1.00 0.00 C ATOM 1188 NZ LYS A 76 -1.553 -24.038 -27.795 1.00 0.00 N ATOM 0 H LYS A 76 0.707 -19.261 -24.019 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.581 -18.179 -25.158 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.381 -20.078 -26.102 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.713 -21.056 -24.686 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.990 -21.321 -25.240 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.996 -19.934 -26.310 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.008 -21.851 -27.732 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.383 -21.202 -27.820 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.515 -22.893 -26.346 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.120 -23.397 -25.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.164 -24.936 -27.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.531 -24.186 -28.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.976 -23.697 -28.590 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.222 -20.045 -22.500 1.00 0.00 N ATOM 1203 CA LEU A 77 -3.228 -20.325 -21.482 1.00 0.00 C ATOM 1204 C LEU A 77 -3.726 -19.034 -20.839 1.00 0.00 C ATOM 1205 O LEU A 77 -4.918 -18.728 -20.880 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.654 -21.253 -20.410 1.00 0.00 C ATOM 1207 CG LEU A 77 -2.738 -22.751 -20.704 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -4.190 -23.197 -20.794 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -1.996 -23.085 -21.990 1.00 0.00 C ATOM 0 H LEU A 77 -1.342 -20.543 -22.371 1.00 0.00 H new ATOM 0 HA LEU A 77 -4.071 -20.817 -21.966 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.607 -20.992 -20.254 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.174 -21.057 -19.472 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.264 -23.289 -19.884 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.230 -24.266 -21.004 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.692 -22.994 -19.848 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -4.689 -22.651 -21.595 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.066 -24.155 -22.183 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -2.441 -22.536 -22.820 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.948 -22.803 -21.889 1.00 0.00 H new ATOM 1221 N ARG A 78 -2.804 -18.280 -20.248 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.149 -17.021 -19.598 1.00 0.00 C ATOM 1223 C ARG A 78 -3.907 -16.105 -20.555 1.00 0.00 C ATOM 1224 O ARG A 78 -4.766 -15.328 -20.138 1.00 0.00 O ATOM 1225 CB ARG A 78 -1.886 -16.320 -19.096 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.031 -17.184 -18.185 1.00 0.00 C ATOM 1227 CD ARG A 78 -0.418 -16.369 -17.056 1.00 0.00 C ATOM 1228 NE ARG A 78 -0.310 -17.140 -15.820 1.00 0.00 N ATOM 1229 CZ ARG A 78 0.466 -16.789 -14.801 1.00 0.00 C ATOM 1230 NH1 ARG A 78 1.198 -15.686 -14.870 1.00 0.00 N ATOM 1231 NH2 ARG A 78 0.510 -17.542 -13.710 1.00 0.00 N ATOM 0 H ARG A 78 -1.813 -18.519 -20.206 1.00 0.00 H new ATOM 0 HA ARG A 78 -3.795 -17.244 -18.749 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.289 -16.009 -19.953 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.172 -15.415 -18.561 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -1.639 -17.986 -17.767 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -0.239 -17.655 -18.767 1.00 0.00 H new ATOM 0 HD2 ARG A 78 0.571 -16.023 -17.355 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -1.026 -15.482 -16.878 1.00 0.00 H new ATOM 0 HE ARG A 78 -0.861 -17.994 -15.735 1.00 0.00 H new ATOM 0 HH11 ARG A 78 1.166 -15.104 -15.707 1.00 0.00 H new ATOM 0 HH12 ARG A 78 1.793 -15.419 -14.086 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -0.052 -18.391 -13.653 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.106 -17.272 -12.928 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.583 -16.202 -21.840 1.00 0.00 N ATOM 1246 CA LYS A 79 -4.232 -15.383 -22.857 1.00 0.00 C ATOM 1247 C LYS A 79 -5.678 -15.821 -23.066 1.00 0.00 C ATOM 1248 O LYS A 79 -6.605 -15.026 -22.911 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.465 -15.471 -24.178 1.00 0.00 C ATOM 1250 CG LYS A 79 -3.970 -14.509 -25.239 1.00 0.00 C ATOM 1251 CD LYS A 79 -3.146 -14.602 -26.513 1.00 0.00 C ATOM 1252 CE LYS A 79 -3.730 -13.736 -27.619 1.00 0.00 C ATOM 1253 NZ LYS A 79 -2.698 -13.341 -28.617 1.00 0.00 N ATOM 0 H LYS A 79 -2.874 -16.840 -22.202 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.230 -14.349 -22.511 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.410 -15.271 -23.990 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.533 -16.489 -24.561 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.014 -14.728 -25.463 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.934 -13.490 -24.854 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.122 -14.291 -26.308 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -3.104 -15.639 -26.845 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -4.531 -14.279 -28.120 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.175 -12.841 -27.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.135 -12.752 -29.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -1.946 -12.801 -28.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -2.291 -14.194 -29.052 1.00 0.00 H new ATOM 1267 N GLU A 80 -5.863 -17.090 -23.417 1.00 0.00 N ATOM 1268 CA GLU A 80 -7.197 -17.632 -23.647 1.00 0.00 C ATOM 1269 C GLU A 80 -8.072 -17.465 -22.408 1.00 0.00 C ATOM 1270 O GLU A 80 -9.294 -17.352 -22.509 1.00 0.00 O ATOM 1271 CB GLU A 80 -7.112 -19.111 -24.029 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.262 -19.373 -25.261 1.00 0.00 C ATOM 1273 CD GLU A 80 -7.096 -19.602 -26.507 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -7.615 -18.612 -27.064 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -7.230 -20.771 -26.924 1.00 0.00 O ATOM 0 H GLU A 80 -5.106 -17.761 -23.548 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.650 -17.078 -24.469 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.702 -19.672 -23.189 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.118 -19.491 -24.205 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.596 -18.526 -25.425 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.632 -20.245 -25.085 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.438 -17.451 -21.240 1.00 0.00 N ATOM 1283 CA ALA A 81 -8.158 -17.297 -19.982 1.00 0.00 C ATOM 1284 C ALA A 81 -9.048 -16.059 -20.007 1.00 0.00 C ATOM 1285 O ALA A 81 -10.261 -16.152 -19.819 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.179 -17.222 -18.820 1.00 0.00 C ATOM 0 H ALA A 81 -6.427 -17.544 -21.139 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.798 -18.169 -19.848 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.730 -17.107 -17.887 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -6.588 -18.137 -18.782 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.516 -16.368 -18.957 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.438 -14.901 -20.239 1.00 0.00 N ATOM 1293 CA GLU A 82 -9.177 -13.645 -20.287 1.00 0.00 C ATOM 1294 C GLU A 82 -10.251 -13.686 -21.369 1.00 0.00 C ATOM 1295 O GLU A 82 -11.370 -13.212 -21.167 1.00 0.00 O ATOM 1296 CB GLU A 82 -8.223 -12.476 -20.543 1.00 0.00 C ATOM 1297 CG GLU A 82 -7.788 -11.756 -19.278 1.00 0.00 C ATOM 1298 CD GLU A 82 -7.585 -10.269 -19.493 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -8.590 -9.552 -19.675 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -6.418 -9.823 -19.480 1.00 0.00 O ATOM 0 H GLU A 82 -7.435 -14.807 -20.397 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.664 -13.503 -19.322 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -7.339 -12.847 -21.062 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -8.708 -11.762 -21.209 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.538 -11.908 -18.502 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.860 -12.197 -18.915 1.00 0.00 H new ATOM 1307 N ILE A 83 -9.903 -14.255 -22.518 1.00 0.00 N ATOM 1308 CA ILE A 83 -10.837 -14.359 -23.633 1.00 0.00 C ATOM 1309 C ILE A 83 -12.079 -15.150 -23.237 1.00 0.00 C ATOM 1310 O ILE A 83 -13.202 -14.761 -23.557 1.00 0.00 O ATOM 1311 CB ILE A 83 -10.183 -15.030 -24.855 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -8.933 -14.257 -25.281 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.175 -15.120 -26.004 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -8.088 -14.989 -26.300 1.00 0.00 C ATOM 0 H ILE A 83 -8.981 -14.651 -22.702 1.00 0.00 H new ATOM 0 HA ILE A 83 -11.126 -13.342 -23.899 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.885 -16.041 -24.579 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.234 -13.295 -25.695 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.326 -14.049 -24.400 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -10.698 -15.597 -26.860 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -12.038 -15.710 -25.695 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -11.502 -14.118 -26.282 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.219 -14.382 -26.556 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.756 -15.940 -25.882 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.679 -15.173 -27.197 1.00 0.00 H new ATOM 1326 N GLU A 84 -11.869 -16.261 -22.537 1.00 0.00 N ATOM 1327 CA GLU A 84 -12.973 -17.105 -22.096 1.00 0.00 C ATOM 1328 C GLU A 84 -13.903 -16.340 -21.159 1.00 0.00 C ATOM 1329 O GLU A 84 -15.095 -16.638 -21.070 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.439 -18.355 -21.394 1.00 0.00 C ATOM 1331 CG GLU A 84 -11.586 -19.238 -22.289 1.00 0.00 C ATOM 1332 CD GLU A 84 -12.146 -20.641 -22.430 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -13.090 -20.824 -23.226 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -11.640 -21.554 -21.745 1.00 0.00 O ATOM 0 H GLU A 84 -10.945 -16.597 -22.264 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.541 -17.406 -22.977 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.849 -18.052 -20.529 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.280 -18.938 -21.018 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.508 -18.781 -23.276 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.576 -19.293 -21.882 1.00 0.00 H new ATOM 1341 N TYR A 85 -13.350 -15.354 -20.462 1.00 0.00 N ATOM 1342 CA TYR A 85 -14.129 -14.548 -19.529 1.00 0.00 C ATOM 1343 C TYR A 85 -14.970 -13.515 -20.272 1.00 0.00 C ATOM 1344 O TYR A 85 -16.200 -13.544 -20.217 1.00 0.00 O ATOM 1345 CB TYR A 85 -13.203 -13.847 -18.533 1.00 0.00 C ATOM 1346 CG TYR A 85 -13.922 -12.895 -17.605 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -14.879 -13.357 -16.709 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -13.647 -11.533 -17.625 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -15.539 -12.490 -15.859 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -14.302 -10.659 -16.778 1.00 0.00 C ATOM 1351 CZ TYR A 85 -15.247 -11.143 -15.897 1.00 0.00 C ATOM 1352 OH TYR A 85 -15.902 -10.276 -15.053 1.00 0.00 O ATOM 0 H TYR A 85 -12.366 -15.093 -20.525 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.800 -15.213 -18.986 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.686 -14.600 -17.938 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -12.440 -13.297 -19.084 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.111 -14.411 -16.677 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.909 -11.151 -18.314 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -16.280 -12.866 -15.169 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.075 -9.603 -16.806 1.00 0.00 H new ATOM 0 HH TYR A 85 -15.579 -9.364 -15.206 1.00 0.00 H new ATOM 1362 N ARG A 86 -14.298 -12.604 -20.968 1.00 0.00 N ATOM 1363 CA ARG A 86 -14.983 -11.561 -21.723 1.00 0.00 C ATOM 1364 C ARG A 86 -15.942 -12.168 -22.742 1.00 0.00 C ATOM 1365 O ARG A 86 -16.929 -11.543 -23.128 1.00 0.00 O ATOM 1366 CB ARG A 86 -13.966 -10.665 -22.433 1.00 0.00 C ATOM 1367 CG ARG A 86 -13.019 -11.425 -23.347 1.00 0.00 C ATOM 1368 CD ARG A 86 -13.053 -10.878 -24.765 1.00 0.00 C ATOM 1369 NE ARG A 86 -11.999 -9.895 -24.998 1.00 0.00 N ATOM 1370 CZ ARG A 86 -11.841 -9.244 -26.146 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -12.665 -9.471 -27.159 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -10.857 -8.364 -26.281 1.00 0.00 N ATOM 0 H ARG A 86 -13.280 -12.567 -21.025 1.00 0.00 H new ATOM 0 HA ARG A 86 -15.560 -10.959 -21.021 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -14.500 -9.917 -23.018 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -13.383 -10.128 -21.685 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -12.004 -11.360 -22.955 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -13.290 -12.481 -23.357 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -12.945 -11.700 -25.473 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.024 -10.420 -24.954 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.348 -9.697 -24.238 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -13.423 -10.147 -27.059 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -12.542 -8.970 -28.039 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.221 -8.187 -25.503 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -10.737 -7.865 -27.162 1.00 0.00 H new ATOM 1386 N GLU A 87 -15.643 -13.389 -23.174 1.00 0.00 N ATOM 1387 CA GLU A 87 -16.479 -14.079 -24.150 1.00 0.00 C ATOM 1388 C GLU A 87 -17.919 -14.184 -23.656 1.00 0.00 C ATOM 1389 O GLU A 87 -18.829 -13.591 -24.235 1.00 0.00 O ATOM 1390 CB GLU A 87 -15.923 -15.477 -24.433 1.00 0.00 C ATOM 1391 CG GLU A 87 -15.123 -15.563 -25.722 1.00 0.00 C ATOM 1392 CD GLU A 87 -15.945 -16.082 -26.886 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -16.150 -17.312 -26.965 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -16.385 -15.259 -27.716 1.00 0.00 O ATOM 0 H GLU A 87 -14.829 -13.920 -22.864 1.00 0.00 H new ATOM 0 HA GLU A 87 -16.471 -13.498 -25.072 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.289 -15.782 -23.601 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -16.750 -16.185 -24.480 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.733 -14.576 -25.969 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.264 -16.216 -25.569 1.00 0.00 H new ATOM 1401 N ARG A 88 -18.117 -14.942 -22.583 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.445 -15.126 -22.011 1.00 0.00 C ATOM 1403 C ARG A 88 -20.080 -13.782 -21.667 1.00 0.00 C ATOM 1404 O ARG A 88 -21.304 -13.648 -21.651 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.368 -16.002 -20.759 1.00 0.00 C ATOM 1406 CG ARG A 88 -18.500 -15.414 -19.658 1.00 0.00 C ATOM 1407 CD ARG A 88 -18.648 -16.190 -18.358 1.00 0.00 C ATOM 1408 NE ARG A 88 -17.670 -17.269 -18.250 1.00 0.00 N ATOM 1409 CZ ARG A 88 -17.334 -17.844 -17.101 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -17.896 -17.447 -15.968 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -16.436 -18.820 -17.084 1.00 0.00 N ATOM 0 H ARG A 88 -17.374 -15.439 -22.092 1.00 0.00 H new ATOM 0 HA ARG A 88 -20.068 -15.622 -22.755 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -20.375 -16.158 -20.372 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -18.977 -16.982 -21.034 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -17.456 -15.423 -19.972 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -18.774 -14.372 -19.494 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -18.532 -15.510 -17.514 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -19.654 -16.605 -18.296 1.00 0.00 H new ATOM 0 HE ARG A 88 -17.220 -17.599 -19.104 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -18.588 -16.698 -15.977 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -17.636 -17.890 -15.087 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -16.003 -19.130 -17.954 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -16.179 -19.261 -16.201 1.00 0.00 H new ATOM 1425 N LEU A 89 -19.240 -12.790 -21.392 1.00 0.00 N ATOM 1426 CA LEU A 89 -19.719 -11.456 -21.048 1.00 0.00 C ATOM 1427 C LEU A 89 -20.279 -10.745 -22.276 1.00 0.00 C ATOM 1428 O LEU A 89 -21.262 -10.008 -22.185 1.00 0.00 O ATOM 1429 CB LEU A 89 -18.586 -10.628 -20.438 1.00 0.00 C ATOM 1430 CG LEU A 89 -18.153 -11.022 -19.025 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -16.973 -10.176 -18.574 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -19.315 -10.882 -18.053 1.00 0.00 C ATOM 0 H LEU A 89 -18.224 -12.884 -21.401 1.00 0.00 H new ATOM 0 HA LEU A 89 -20.519 -11.562 -20.316 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.719 -10.696 -21.095 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.894 -9.582 -20.424 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.841 -12.066 -19.038 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.678 -10.470 -17.567 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -16.136 -10.327 -19.255 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -17.258 -9.124 -18.576 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -18.989 -11.166 -17.053 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.658 -9.847 -18.042 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -20.132 -11.532 -18.367 1.00 0.00 H new ATOM 1444 N PHE A 90 -19.650 -10.972 -23.424 1.00 0.00 N ATOM 1445 CA PHE A 90 -20.086 -10.354 -24.670 1.00 0.00 C ATOM 1446 C PHE A 90 -21.555 -10.663 -24.945 1.00 0.00 C ATOM 1447 O PHE A 90 -22.363 -9.758 -25.152 1.00 0.00 O ATOM 1448 CB PHE A 90 -19.223 -10.843 -25.836 1.00 0.00 C ATOM 1449 CG PHE A 90 -18.623 -9.729 -26.645 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -19.300 -9.201 -27.732 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -17.380 -9.210 -26.318 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -18.751 -8.176 -28.479 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -16.826 -8.184 -27.061 1.00 0.00 C ATOM 1454 CZ PHE A 90 -17.511 -7.668 -28.143 1.00 0.00 C ATOM 0 H PHE A 90 -18.836 -11.580 -23.517 1.00 0.00 H new ATOM 0 HA PHE A 90 -19.972 -9.275 -24.571 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -18.422 -11.471 -25.446 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -19.830 -11.470 -26.489 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -20.269 -9.595 -27.999 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -16.839 -9.611 -25.474 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -19.290 -7.773 -29.324 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -15.858 -7.786 -26.795 1.00 0.00 H new ATOM 0 HZ PHE A 90 -17.078 -6.868 -28.726 1.00 0.00 H new ATOM 1464 N ARG A 91 -21.892 -11.949 -24.947 1.00 0.00 N ATOM 1465 CA ARG A 91 -23.263 -12.379 -25.198 1.00 0.00 C ATOM 1466 C ARG A 91 -24.200 -11.873 -24.105 1.00 0.00 C ATOM 1467 O ARG A 91 -25.382 -11.634 -24.350 1.00 0.00 O ATOM 1468 CB ARG A 91 -23.334 -13.905 -25.280 1.00 0.00 C ATOM 1469 CG ARG A 91 -23.136 -14.448 -26.686 1.00 0.00 C ATOM 1470 CD ARG A 91 -22.892 -15.949 -26.673 1.00 0.00 C ATOM 1471 NE ARG A 91 -22.119 -16.388 -27.832 1.00 0.00 N ATOM 1472 CZ ARG A 91 -22.642 -16.565 -29.040 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -23.932 -16.342 -29.247 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -21.873 -16.966 -30.044 1.00 0.00 N ATOM 0 H ARG A 91 -21.235 -12.711 -24.778 1.00 0.00 H new ATOM 0 HA ARG A 91 -23.582 -11.956 -26.150 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -22.575 -14.332 -24.624 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -24.302 -14.236 -24.904 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -24.016 -14.226 -27.290 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -22.291 -13.945 -27.156 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -22.363 -16.222 -25.760 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -23.848 -16.472 -26.656 1.00 0.00 H new ATOM 0 HE ARG A 91 -21.123 -16.569 -27.707 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -24.526 -16.034 -28.477 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -24.331 -16.479 -30.176 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -20.880 -17.138 -29.888 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -22.275 -17.102 -30.972 1.00 0.00 H new ATOM 1488 N ASN A 92 -23.664 -11.713 -22.900 1.00 0.00 N ATOM 1489 CA ASN A 92 -24.453 -11.237 -21.769 1.00 0.00 C ATOM 1490 C ASN A 92 -24.806 -9.762 -21.935 1.00 0.00 C ATOM 1491 O ASN A 92 -25.813 -9.293 -21.407 1.00 0.00 O ATOM 1492 CB ASN A 92 -23.686 -11.446 -20.462 1.00 0.00 C ATOM 1493 CG ASN A 92 -24.572 -11.976 -19.351 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -25.546 -12.684 -19.603 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -24.235 -11.634 -18.112 1.00 0.00 N ATOM 0 H ASN A 92 -22.687 -11.906 -22.681 1.00 0.00 H new ATOM 0 HA ASN A 92 -25.378 -11.812 -21.735 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -22.866 -12.143 -20.633 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -23.242 -10.501 -20.149 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -24.793 -11.961 -17.323 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -23.418 -11.045 -17.950 1.00 0.00 H new ATOM 1502 N GLN A 93 -23.970 -9.039 -22.672 1.00 0.00 N ATOM 1503 CA GLN A 93 -24.194 -7.617 -22.907 1.00 0.00 C ATOM 1504 C GLN A 93 -25.148 -7.403 -24.077 1.00 0.00 C ATOM 1505 O GLN A 93 -25.991 -6.505 -24.048 1.00 0.00 O ATOM 1506 CB GLN A 93 -22.866 -6.908 -23.180 1.00 0.00 C ATOM 1507 CG GLN A 93 -22.436 -5.971 -22.063 1.00 0.00 C ATOM 1508 CD GLN A 93 -22.622 -4.510 -22.422 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -23.658 -3.914 -22.126 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -21.617 -3.925 -23.063 1.00 0.00 N ATOM 0 H GLN A 93 -23.132 -9.414 -23.117 1.00 0.00 H new ATOM 0 HA GLN A 93 -24.646 -7.193 -22.011 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -22.089 -7.657 -23.334 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -22.950 -6.340 -24.107 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -23.010 -6.196 -21.164 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -21.388 -6.152 -21.826 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -20.777 -4.458 -23.288 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -21.685 -2.943 -23.330 1.00 0.00 H new ATOM 1519 N LYS A 94 -25.011 -8.232 -25.106 1.00 0.00 N ATOM 1520 CA LYS A 94 -25.862 -8.135 -26.286 1.00 0.00 C ATOM 1521 C LYS A 94 -25.661 -6.798 -26.993 1.00 0.00 C ATOM 1522 O LYS A 94 -25.082 -5.869 -26.429 1.00 0.00 O ATOM 1523 CB LYS A 94 -27.332 -8.302 -25.896 1.00 0.00 C ATOM 1524 CG LYS A 94 -27.962 -9.576 -26.430 1.00 0.00 C ATOM 1525 CD LYS A 94 -29.364 -9.779 -25.880 1.00 0.00 C ATOM 1526 CE LYS A 94 -29.854 -11.199 -26.113 1.00 0.00 C ATOM 1527 NZ LYS A 94 -31.204 -11.224 -26.742 1.00 0.00 N ATOM 0 H LYS A 94 -24.318 -8.979 -25.147 1.00 0.00 H new ATOM 0 HA LYS A 94 -25.582 -8.935 -26.972 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -27.414 -8.294 -24.809 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -27.896 -7.445 -26.264 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -28.000 -9.535 -27.519 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -27.339 -10.430 -26.164 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -29.372 -9.561 -24.812 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -30.047 -9.075 -26.354 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -29.146 -11.727 -26.752 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -29.886 -11.733 -25.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -31.502 -12.210 -26.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -31.885 -10.742 -26.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -31.168 -10.737 -27.660 1.00 0.00 H new ATOM 1541 N ILE A 95 -26.143 -6.708 -28.228 1.00 0.00 N ATOM 1542 CA ILE A 95 -26.018 -5.484 -29.009 1.00 0.00 C ATOM 1543 C ILE A 95 -27.074 -4.462 -28.601 1.00 0.00 C ATOM 1544 O ILE A 95 -26.858 -3.254 -28.708 1.00 0.00 O ATOM 1545 CB ILE A 95 -26.147 -5.764 -30.518 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -25.798 -4.510 -31.323 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -27.553 -6.239 -30.851 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -24.351 -4.090 -31.190 1.00 0.00 C ATOM 0 H ILE A 95 -26.624 -7.468 -28.709 1.00 0.00 H new ATOM 0 HA ILE A 95 -25.026 -5.079 -28.806 1.00 0.00 H new ATOM 0 HB ILE A 95 -25.445 -6.553 -30.787 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -26.021 -4.690 -32.375 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -26.437 -3.689 -30.998 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -27.628 -6.433 -31.921 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -27.767 -7.155 -30.301 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -28.273 -5.470 -30.570 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -24.176 -3.195 -31.787 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -24.128 -3.878 -30.144 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -23.705 -4.894 -31.543 1.00 0.00 H new ATOM 1560 N LEU A 96 -28.216 -4.954 -28.132 1.00 0.00 N ATOM 1561 CA LEU A 96 -29.306 -4.083 -27.706 1.00 0.00 C ATOM 1562 C LEU A 96 -30.465 -4.898 -27.141 1.00 0.00 C ATOM 1563 O LEU A 96 -30.371 -6.118 -27.008 1.00 0.00 O ATOM 1564 CB LEU A 96 -29.791 -3.229 -28.879 1.00 0.00 C ATOM 1565 CG LEU A 96 -30.034 -1.750 -28.577 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -28.755 -0.950 -28.766 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -31.145 -1.201 -29.461 1.00 0.00 C ATOM 0 H LEU A 96 -28.411 -5.951 -28.037 1.00 0.00 H new ATOM 0 HA LEU A 96 -28.930 -3.428 -26.920 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -29.057 -3.299 -29.682 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -30.719 -3.659 -29.257 1.00 0.00 H new ATOM 0 HG LEU A 96 -30.346 -1.657 -27.537 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -28.947 0.100 -28.547 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -27.987 -1.327 -28.091 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -28.413 -1.049 -29.796 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -31.305 -0.147 -29.233 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -30.862 -1.306 -30.508 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -32.065 -1.756 -29.276 1.00 0.00 H new ATOM 1579 N ARG A 97 -31.557 -4.216 -26.813 1.00 0.00 N ATOM 1580 CA ARG A 97 -32.734 -4.877 -26.264 1.00 0.00 C ATOM 1581 C ARG A 97 -33.762 -5.153 -27.357 1.00 0.00 C ATOM 1582 O ARG A 97 -34.190 -4.242 -28.064 1.00 0.00 O ATOM 1583 CB ARG A 97 -33.362 -4.017 -25.165 1.00 0.00 C ATOM 1584 CG ARG A 97 -32.760 -4.253 -23.789 1.00 0.00 C ATOM 1585 CD ARG A 97 -33.033 -5.666 -23.296 1.00 0.00 C ATOM 1586 NE ARG A 97 -32.752 -5.812 -21.870 1.00 0.00 N ATOM 1587 CZ ARG A 97 -31.528 -5.944 -21.372 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -30.477 -5.947 -22.180 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -31.353 -6.072 -20.063 1.00 0.00 N ATOM 0 H ARG A 97 -31.651 -3.206 -26.918 1.00 0.00 H new ATOM 0 HA ARG A 97 -32.419 -5.829 -25.836 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -33.246 -2.965 -25.427 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -34.432 -4.219 -25.124 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -31.684 -4.081 -23.827 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -33.173 -3.534 -23.082 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -34.075 -5.922 -23.488 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -32.422 -6.371 -23.860 1.00 0.00 H new ATOM 0 HE ARG A 97 -33.539 -5.813 -21.221 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -30.607 -5.848 -23.187 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -29.538 -6.049 -21.795 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -32.159 -6.069 -19.438 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -30.412 -6.173 -19.682 1.00 0.00 H new ATOM 1603 N GLU A 98 -34.153 -6.417 -27.489 1.00 0.00 N ATOM 1604 CA GLU A 98 -35.129 -6.813 -28.497 1.00 0.00 C ATOM 1605 C GLU A 98 -36.136 -7.804 -27.920 1.00 0.00 C ATOM 1606 O GLU A 98 -35.758 -8.826 -27.347 1.00 0.00 O ATOM 1607 CB GLU A 98 -34.425 -7.431 -29.707 1.00 0.00 C ATOM 1608 CG GLU A 98 -34.231 -6.460 -30.859 1.00 0.00 C ATOM 1609 CD GLU A 98 -35.445 -6.377 -31.764 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -36.375 -5.609 -31.441 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -35.465 -7.082 -32.795 1.00 0.00 O ATOM 0 H GLU A 98 -33.809 -7.184 -26.911 1.00 0.00 H new ATOM 0 HA GLU A 98 -35.666 -5.920 -28.816 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -33.452 -7.811 -29.396 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -35.004 -8.286 -30.057 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -34.011 -5.469 -30.461 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -33.365 -6.767 -31.446 1.00 0.00 H new ATOM 1618 N TYR A 99 -37.418 -7.493 -28.075 1.00 0.00 N ATOM 1619 CA TYR A 99 -38.480 -8.354 -27.568 1.00 0.00 C ATOM 1620 C TYR A 99 -38.343 -8.557 -26.062 1.00 0.00 C ATOM 1621 O TYR A 99 -37.443 -8.005 -25.429 1.00 0.00 O ATOM 1622 CB TYR A 99 -38.453 -9.707 -28.281 1.00 0.00 C ATOM 1623 CG TYR A 99 -38.882 -9.637 -29.729 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -38.083 -9.017 -30.681 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -40.086 -10.192 -30.145 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -38.472 -8.950 -32.005 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -40.482 -10.131 -31.467 1.00 0.00 C ATOM 1628 CZ TYR A 99 -39.672 -9.508 -32.393 1.00 0.00 C ATOM 1629 OH TYR A 99 -40.062 -9.445 -33.711 1.00 0.00 O ATOM 0 H TYR A 99 -37.747 -6.651 -28.548 1.00 0.00 H new ATOM 0 HA TYR A 99 -39.434 -7.866 -27.766 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -37.444 -10.115 -28.229 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -39.105 -10.401 -27.751 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -37.142 -8.580 -30.381 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -40.723 -10.680 -29.422 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -37.840 -8.463 -32.732 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -41.421 -10.569 -31.774 1.00 0.00 H new ATOM 0 HH TYR A 99 -40.931 -9.886 -33.817 1.00 0.00 H new ATOM 1639 N ARG A 100 -39.243 -9.355 -25.495 1.00 0.00 N ATOM 1640 CA ARG A 100 -39.224 -9.632 -24.064 1.00 0.00 C ATOM 1641 C ARG A 100 -37.924 -10.320 -23.660 1.00 0.00 C ATOM 1642 O ARG A 100 -37.225 -10.890 -24.498 1.00 0.00 O ATOM 1643 CB ARG A 100 -40.418 -10.506 -23.676 1.00 0.00 C ATOM 1644 CG ARG A 100 -40.484 -11.819 -24.438 1.00 0.00 C ATOM 1645 CD ARG A 100 -40.211 -13.006 -23.528 1.00 0.00 C ATOM 1646 NE ARG A 100 -40.161 -14.264 -24.268 1.00 0.00 N ATOM 1647 CZ ARG A 100 -41.231 -14.854 -24.788 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -42.429 -14.303 -24.649 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -41.105 -15.998 -25.449 1.00 0.00 N ATOM 0 H ARG A 100 -39.994 -9.821 -26.005 1.00 0.00 H new ATOM 0 HA ARG A 100 -39.291 -8.681 -23.535 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -40.371 -10.718 -22.608 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -41.338 -9.948 -23.850 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -41.468 -11.927 -24.894 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -39.757 -11.807 -25.250 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -39.265 -12.854 -23.008 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -40.988 -13.065 -22.766 1.00 0.00 H new ATOM 0 HE ARG A 100 -39.254 -14.714 -24.392 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -42.530 -13.424 -24.142 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -43.249 -14.758 -25.049 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -40.185 -16.425 -25.558 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -41.928 -16.450 -25.848 1.00 0.00 H new ATOM 1663 N ASP A 101 -37.605 -10.262 -22.372 1.00 0.00 N ATOM 1664 CA ASP A 101 -36.389 -10.880 -21.856 1.00 0.00 C ATOM 1665 C ASP A 101 -36.527 -11.196 -20.370 1.00 0.00 C ATOM 1666 O ASP A 101 -36.817 -12.332 -19.992 1.00 0.00 O ATOM 1667 CB ASP A 101 -35.188 -9.961 -22.085 1.00 0.00 C ATOM 1668 CG ASP A 101 -34.127 -10.601 -22.959 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -33.456 -11.541 -22.484 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -33.967 -10.162 -24.117 1.00 0.00 O ATOM 0 H ASP A 101 -38.172 -9.793 -21.665 1.00 0.00 H new ATOM 0 HA ASP A 101 -36.230 -11.815 -22.394 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -35.526 -9.035 -22.549 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -34.750 -9.694 -21.123 1.00 0.00 H new TER 1675 ASP A 101