USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 949 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 6 SER OG : rot 33:sc= 0.118 USER MOD Single : A 8 MET CE :methyl -172:sc= -0.295 (180deg=-0.358) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= -0.846 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 171:sc= -0.827 (180deg=-0.91) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ -108:sc= 0.504 (180deg=-1.57!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 140:sc= 1.62 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 161:sc= 0.382 (180deg=0.118) USER MOD Single : A 47 ASN : amide:sc= -0.174 K(o=-0.17,f=0.51) USER MOD Single : A 50 ASN : amide:sc= -2.41 K(o=-2.4,f=-0.4) USER MOD Single : A 54 ASN : amide:sc= -6.98! C(o=-7!,f=-8.8!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -160:sc= 0.288 USER MOD Single : A 71 SER OG : rot 180:sc= -0.111 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -50:sc= 0.957 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot -109:sc= 0.231 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.072) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 26:sc= 0.926 USER MOD Single : A 108 TYR OH : rot -120:sc= -0.412 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0.0628 USER MOD Single : A 115 ASN : amide:sc= -2.99! C(o=-3!,f=-21!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc=-0.00487 K(o=-0.0049,f=-1.3) USER MOD Single : A 121 THR OG1 : rot -61:sc= 1.27 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.281 -22.379 2.225 1.00 0.00 N ATOM 49 CA SER A 6 -7.930 -22.494 0.814 1.00 0.00 C ATOM 50 C SER A 6 -6.959 -21.391 0.404 1.00 0.00 C ATOM 51 O SER A 6 -7.120 -20.765 -0.643 1.00 0.00 O ATOM 52 CB SER A 6 -9.188 -22.431 -0.054 1.00 0.00 C ATOM 53 OG SER A 6 -10.138 -23.400 0.354 1.00 0.00 O ATOM 0 HA SER A 6 -7.443 -23.457 0.664 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.628 -21.436 0.010 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.922 -22.595 -1.098 1.00 0.00 H new ATOM 0 HG SER A 6 -10.075 -23.532 1.323 1.00 0.00 H new ATOM 59 N GLY A 7 -5.951 -21.158 1.239 1.00 0.00 N ATOM 60 CA GLY A 7 -4.969 -20.130 0.947 1.00 0.00 C ATOM 61 C GLY A 7 -5.587 -18.751 0.840 1.00 0.00 C ATOM 62 O GLY A 7 -6.578 -18.561 0.135 1.00 0.00 O ATOM 0 H GLY A 7 -5.797 -21.662 2.112 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.210 -20.125 1.729 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.462 -20.371 0.013 1.00 0.00 H new ATOM 66 N MET A 8 -5.003 -17.786 1.542 1.00 0.00 N ATOM 67 CA MET A 8 -5.504 -16.416 1.523 1.00 0.00 C ATOM 68 C MET A 8 -4.369 -15.419 1.737 1.00 0.00 C ATOM 69 O MET A 8 -3.607 -15.529 2.698 1.00 0.00 O ATOM 70 CB MET A 8 -6.575 -16.227 2.599 1.00 0.00 C ATOM 71 CG MET A 8 -6.869 -14.770 2.914 1.00 0.00 C ATOM 72 SD MET A 8 -8.525 -14.524 3.583 1.00 0.00 S ATOM 73 CE MET A 8 -9.472 -14.322 2.076 1.00 0.00 C ATOM 0 H MET A 8 -4.182 -17.927 2.131 1.00 0.00 H new ATOM 0 HA MET A 8 -5.946 -16.231 0.544 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.495 -16.713 2.274 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.255 -16.730 3.511 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.134 -14.402 3.630 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.756 -14.176 2.007 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.490 -14.020 2.324 1.00 0.00 H new ATOM 0 HE2 MET A 8 -9.008 -13.556 1.454 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.496 -15.266 1.532 1.00 0.00 H new ATOM 83 N LEU A 9 -4.263 -14.448 0.837 1.00 0.00 N ATOM 84 CA LEU A 9 -3.221 -13.431 0.928 1.00 0.00 C ATOM 85 C LEU A 9 -3.776 -12.134 1.508 1.00 0.00 C ATOM 86 O LEU A 9 -4.608 -11.471 0.888 1.00 0.00 O ATOM 87 CB LEU A 9 -2.616 -13.169 -0.452 1.00 0.00 C ATOM 88 CG LEU A 9 -1.477 -12.150 -0.502 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.165 -12.795 -0.082 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.356 -11.554 -1.897 1.00 0.00 C ATOM 0 H LEU A 9 -4.886 -14.343 0.036 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.442 -13.801 1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.249 -14.114 -0.851 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.410 -12.829 -1.117 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.704 -11.346 0.198 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.634 -12.055 -0.124 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.255 -13.174 0.936 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.068 -13.619 -0.757 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.541 -10.831 -1.914 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.152 -12.348 -2.615 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.288 -11.056 -2.162 1.00 0.00 H new ATOM 102 N ARG A 10 -3.307 -11.776 2.699 1.00 0.00 N ATOM 103 CA ARG A 10 -3.755 -10.558 3.362 1.00 0.00 C ATOM 104 C ARG A 10 -2.813 -9.396 3.058 1.00 0.00 C ATOM 105 O ARG A 10 -1.593 -9.534 3.142 1.00 0.00 O ATOM 106 CB ARG A 10 -3.841 -10.776 4.873 1.00 0.00 C ATOM 107 CG ARG A 10 -5.193 -11.295 5.337 1.00 0.00 C ATOM 108 CD ARG A 10 -5.386 -11.087 6.831 1.00 0.00 C ATOM 109 NE ARG A 10 -6.579 -11.766 7.328 1.00 0.00 N ATOM 110 CZ ARG A 10 -6.831 -11.961 8.618 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.976 -11.529 9.536 1.00 0.00 N ATOM 112 NH2 ARG A 10 -7.939 -12.588 8.992 1.00 0.00 N ATOM 0 H ARG A 10 -2.617 -12.313 3.224 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.746 -10.310 2.981 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.067 -11.482 5.174 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.629 -9.835 5.380 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.987 -10.784 4.792 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.277 -12.356 5.102 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.510 -11.456 7.365 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.462 -10.020 7.042 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.257 -12.110 6.647 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.124 -11.046 9.252 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.171 -11.680 10.526 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.599 -12.921 8.289 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.131 -12.737 9.983 1.00 0.00 H new ATOM 126 N VAL A 11 -3.388 -8.251 2.704 1.00 0.00 N ATOM 127 CA VAL A 11 -2.601 -7.065 2.388 1.00 0.00 C ATOM 128 C VAL A 11 -3.037 -5.875 3.235 1.00 0.00 C ATOM 129 O VAL A 11 -4.069 -5.257 2.971 1.00 0.00 O ATOM 130 CB VAL A 11 -2.720 -6.693 0.899 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.848 -5.489 0.578 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.350 -7.879 0.022 1.00 0.00 C ATOM 0 H VAL A 11 -4.397 -8.120 2.629 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.562 -7.305 2.612 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.756 -6.427 0.691 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.945 -5.241 -0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.166 -4.638 1.181 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.807 -5.724 0.801 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.440 -7.598 -1.027 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.323 -8.179 0.230 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -3.021 -8.711 0.233 1.00 0.00 H new ATOM 142 N ILE A 12 -2.244 -5.558 4.254 1.00 0.00 N ATOM 143 CA ILE A 12 -2.548 -4.441 5.138 1.00 0.00 C ATOM 144 C ILE A 12 -1.900 -3.153 4.640 1.00 0.00 C ATOM 145 O ILE A 12 -0.692 -3.104 4.407 1.00 0.00 O ATOM 146 CB ILE A 12 -2.074 -4.717 6.578 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.628 -6.055 7.072 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.501 -3.587 7.502 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.737 -6.741 8.083 1.00 0.00 C ATOM 0 H ILE A 12 -1.387 -6.059 4.487 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.632 -4.324 5.137 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.985 -4.772 6.583 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.609 -5.891 7.517 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.772 -6.717 6.218 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.159 -3.797 8.515 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.063 -2.650 7.158 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.588 -3.503 7.496 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.192 -7.683 8.389 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.763 -6.937 7.635 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.613 -6.098 8.954 1.00 0.00 H new ATOM 161 N VAL A 13 -2.710 -2.112 4.480 1.00 0.00 N ATOM 162 CA VAL A 13 -2.216 -0.823 4.013 1.00 0.00 C ATOM 163 C VAL A 13 -2.082 0.165 5.166 1.00 0.00 C ATOM 164 O VAL A 13 -3.051 0.817 5.552 1.00 0.00 O ATOM 165 CB VAL A 13 -3.144 -0.221 2.940 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.612 1.123 2.468 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.301 -1.183 1.772 1.00 0.00 C ATOM 0 H VAL A 13 -3.712 -2.136 4.667 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.234 -1.001 3.575 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.127 -0.060 3.382 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.280 1.533 1.711 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.557 1.809 3.313 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.618 0.991 2.042 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.959 -0.742 1.024 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.325 -1.378 1.327 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.731 -2.119 2.127 1.00 0.00 H new ATOM 177 N GLU A 14 -0.874 0.271 5.710 1.00 0.00 N ATOM 178 CA GLU A 14 -0.613 1.180 6.820 1.00 0.00 C ATOM 179 C GLU A 14 -0.925 2.621 6.427 1.00 0.00 C ATOM 180 O GLU A 14 -1.943 3.181 6.835 1.00 0.00 O ATOM 181 CB GLU A 14 0.845 1.067 7.270 1.00 0.00 C ATOM 182 CG GLU A 14 1.191 -0.283 7.876 1.00 0.00 C ATOM 183 CD GLU A 14 0.104 -0.807 8.794 1.00 0.00 C ATOM 184 OE1 GLU A 14 -0.455 -0.003 9.569 1.00 0.00 O ATOM 185 OE2 GLU A 14 -0.188 -2.020 8.737 1.00 0.00 O ATOM 0 H GLU A 14 -0.061 -0.261 5.400 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.264 0.898 7.648 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.496 1.250 6.415 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.053 1.848 8.001 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.363 -1.003 7.076 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.123 -0.198 8.435 1.00 0.00 H new ATOM 192 N SER A 15 -0.041 3.216 5.632 1.00 0.00 N ATOM 193 CA SER A 15 -0.219 4.594 5.187 1.00 0.00 C ATOM 194 C SER A 15 0.873 4.990 4.198 1.00 0.00 C ATOM 195 O SER A 15 1.812 4.232 3.957 1.00 0.00 O ATOM 196 CB SER A 15 -0.206 5.545 6.385 1.00 0.00 C ATOM 197 OG SER A 15 1.003 5.429 7.116 1.00 0.00 O ATOM 0 H SER A 15 0.805 2.766 5.283 1.00 0.00 H new ATOM 0 HA SER A 15 -1.184 4.666 4.685 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.329 6.572 6.040 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.051 5.325 7.037 1.00 0.00 H new ATOM 0 HG SER A 15 0.987 6.048 7.875 1.00 0.00 H new ATOM 203 N ALA A 16 0.741 6.183 3.627 1.00 0.00 N ATOM 204 CA ALA A 16 1.716 6.681 2.665 1.00 0.00 C ATOM 205 C ALA A 16 2.274 8.032 3.100 1.00 0.00 C ATOM 206 O ALA A 16 1.694 8.711 3.946 1.00 0.00 O ATOM 207 CB ALA A 16 1.087 6.788 1.284 1.00 0.00 C ATOM 0 H ALA A 16 -0.032 6.822 3.814 1.00 0.00 H new ATOM 0 HA ALA A 16 2.543 5.972 2.622 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.826 7.161 0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.742 5.805 0.964 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.241 7.475 1.322 1.00 0.00 H new ATOM 213 N SER A 17 3.405 8.415 2.516 1.00 0.00 N ATOM 214 CA SER A 17 4.045 9.683 2.847 1.00 0.00 C ATOM 215 C SER A 17 4.945 10.151 1.707 1.00 0.00 C ATOM 216 O SER A 17 5.316 9.369 0.833 1.00 0.00 O ATOM 217 CB SER A 17 4.862 9.546 4.133 1.00 0.00 C ATOM 218 OG SER A 17 4.020 9.534 5.273 1.00 0.00 O ATOM 0 H SER A 17 3.897 7.866 1.811 1.00 0.00 H new ATOM 0 HA SER A 17 3.263 10.427 2.999 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.447 8.627 4.100 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.569 10.372 4.208 1.00 0.00 H new ATOM 0 HG SER A 17 4.566 9.444 6.082 1.00 0.00 H new ATOM 224 N ASN A 18 5.291 11.435 1.724 1.00 0.00 N ATOM 225 CA ASN A 18 6.147 12.009 0.692 1.00 0.00 C ATOM 226 C ASN A 18 5.459 11.969 -0.669 1.00 0.00 C ATOM 227 O ASN A 18 6.038 11.510 -1.655 1.00 0.00 O ATOM 228 CB ASN A 18 7.477 11.256 0.626 1.00 0.00 C ATOM 229 CG ASN A 18 8.226 11.290 1.944 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.242 12.308 2.636 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.853 10.173 2.297 1.00 0.00 N ATOM 0 H ASN A 18 4.992 12.097 2.440 1.00 0.00 H new ATOM 0 HA ASN A 18 6.339 13.050 0.952 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.291 10.220 0.343 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.100 11.692 -0.154 1.00 0.00 H new ATOM 0 HD21 ASN A 18 9.375 10.136 3.173 1.00 0.00 H new ATOM 0 HD22 ASN A 18 8.813 9.353 1.692 1.00 0.00 H new ATOM 238 N ILE A 19 4.223 12.453 -0.716 1.00 0.00 N ATOM 239 CA ILE A 19 3.457 12.474 -1.956 1.00 0.00 C ATOM 240 C ILE A 19 3.581 13.823 -2.655 1.00 0.00 C ATOM 241 O ILE A 19 3.497 14.883 -2.034 1.00 0.00 O ATOM 242 CB ILE A 19 1.968 12.174 -1.704 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.799 10.765 -1.131 1.00 0.00 C ATOM 244 CG2 ILE A 19 1.171 12.327 -2.990 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.368 10.273 -1.148 1.00 0.00 C ATOM 0 H ILE A 19 3.730 12.836 0.091 1.00 0.00 H new ATOM 0 HA ILE A 19 3.872 11.696 -2.596 1.00 0.00 H new ATOM 0 HB ILE A 19 1.587 12.890 -0.976 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.419 10.073 -1.701 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.167 10.752 -0.105 1.00 0.00 H new ATOM 0 HG21 ILE A 19 0.120 12.111 -2.795 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.269 13.348 -3.360 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.551 11.632 -3.738 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.324 9.268 -0.727 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.254 10.943 -0.554 1.00 0.00 H new ATOM 0 HD13 ILE A 19 0.002 10.253 -2.175 1.00 0.00 H new ATOM 257 N PRO A 20 3.783 13.786 -3.981 1.00 0.00 N ATOM 258 CA PRO A 20 3.920 14.998 -4.795 1.00 0.00 C ATOM 259 C PRO A 20 2.608 15.765 -4.918 1.00 0.00 C ATOM 260 O PRO A 20 1.725 15.385 -5.687 1.00 0.00 O ATOM 261 CB PRO A 20 4.356 14.460 -6.160 1.00 0.00 C ATOM 262 CG PRO A 20 3.835 13.065 -6.202 1.00 0.00 C ATOM 263 CD PRO A 20 3.894 12.559 -4.787 1.00 0.00 C ATOM 0 HA PRO A 20 4.623 15.707 -4.357 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.945 15.060 -6.972 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.441 14.481 -6.266 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.814 13.041 -6.583 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.437 12.443 -6.864 1.00 0.00 H new ATOM 0 HD2 PRO A 20 3.082 11.864 -4.575 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.826 12.030 -4.588 1.00 0.00 H new ATOM 271 N LYS A 21 2.487 16.847 -4.156 1.00 0.00 N ATOM 272 CA LYS A 21 1.284 17.669 -4.181 1.00 0.00 C ATOM 273 C LYS A 21 1.210 18.487 -5.466 1.00 0.00 C ATOM 274 O LYS A 21 2.098 18.410 -6.316 1.00 0.00 O ATOM 275 CB LYS A 21 1.254 18.602 -2.968 1.00 0.00 C ATOM 276 CG LYS A 21 2.487 19.479 -2.845 1.00 0.00 C ATOM 277 CD LYS A 21 2.812 19.784 -1.392 1.00 0.00 C ATOM 278 CE LYS A 21 3.730 20.990 -1.267 1.00 0.00 C ATOM 279 NZ LYS A 21 5.162 20.616 -1.432 1.00 0.00 N ATOM 0 H LYS A 21 3.208 17.175 -3.513 1.00 0.00 H new ATOM 0 HA LYS A 21 0.420 17.005 -4.143 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.371 19.238 -3.031 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.152 18.004 -2.063 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.337 18.981 -3.312 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.327 20.411 -3.386 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.889 19.970 -0.843 1.00 0.00 H new ATOM 0 HD3 LYS A 21 3.286 18.916 -0.934 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.459 21.732 -2.018 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.586 21.456 -0.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 5.755 21.465 -1.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.428 19.927 -0.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.305 20.194 -2.372 1.00 0.00 H new ATOM 293 N THR A 22 0.146 19.273 -5.602 1.00 0.00 N ATOM 294 CA THR A 22 -0.043 20.106 -6.784 1.00 0.00 C ATOM 295 C THR A 22 -0.481 21.514 -6.399 1.00 0.00 C ATOM 296 O THR A 22 -1.101 21.720 -5.355 1.00 0.00 O ATOM 297 CB THR A 22 -1.089 19.498 -7.738 1.00 0.00 C ATOM 298 OG1 THR A 22 -1.471 20.463 -8.724 1.00 0.00 O ATOM 299 CG2 THR A 22 -2.318 19.035 -6.970 1.00 0.00 C ATOM 0 H THR A 22 -0.598 19.350 -4.908 1.00 0.00 H new ATOM 0 HA THR A 22 0.919 20.154 -7.294 1.00 0.00 H new ATOM 0 HB THR A 22 -0.642 18.634 -8.230 1.00 0.00 H new ATOM 0 HG1 THR A 22 -2.135 20.069 -9.328 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.042 18.610 -7.665 1.00 0.00 H new ATOM 0 HG22 THR A 22 -2.028 18.279 -6.240 1.00 0.00 H new ATOM 0 HG23 THR A 22 -2.766 19.884 -6.454 1.00 0.00 H new ATOM 356 N LYS A 26 -3.634 19.683 -2.007 1.00 0.00 N ATOM 357 CA LYS A 26 -3.309 18.268 -1.871 1.00 0.00 C ATOM 358 C LYS A 26 -4.366 17.400 -2.545 1.00 0.00 C ATOM 359 O LYS A 26 -5.563 17.516 -2.277 1.00 0.00 O ATOM 360 CB LYS A 26 -3.191 17.891 -0.392 1.00 0.00 C ATOM 361 CG LYS A 26 -2.375 18.878 0.424 1.00 0.00 C ATOM 362 CD LYS A 26 -2.183 18.396 1.852 1.00 0.00 C ATOM 363 CE LYS A 26 -0.887 18.922 2.449 1.00 0.00 C ATOM 364 NZ LYS A 26 -1.046 20.298 2.996 1.00 0.00 N ATOM 0 HA LYS A 26 -2.352 18.091 -2.362 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.191 17.817 0.036 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.736 16.903 -0.313 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.402 19.023 -0.046 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.874 19.847 0.430 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.025 18.722 2.463 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.178 17.306 1.872 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.554 18.252 3.242 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.109 18.923 1.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.141 20.620 3.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.339 20.943 2.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.770 20.293 3.743 1.00 0.00 H new ATOM 378 N PRO A 27 -3.918 16.508 -3.441 1.00 0.00 N ATOM 379 CA PRO A 27 -4.810 15.602 -4.170 1.00 0.00 C ATOM 380 C PRO A 27 -5.418 14.535 -3.266 1.00 0.00 C ATOM 381 O PRO A 27 -5.248 14.570 -2.047 1.00 0.00 O ATOM 382 CB PRO A 27 -3.889 14.959 -5.210 1.00 0.00 C ATOM 383 CG PRO A 27 -2.526 15.045 -4.615 1.00 0.00 C ATOM 384 CD PRO A 27 -2.505 16.315 -3.810 1.00 0.00 C ATOM 0 HA PRO A 27 -5.662 16.128 -4.601 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -4.172 13.924 -5.403 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.939 15.486 -6.163 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.320 14.180 -3.985 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.761 15.063 -5.392 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.869 16.222 -2.930 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.123 17.154 -4.392 1.00 0.00 H new ATOM 392 N ASP A 28 -6.126 13.587 -3.870 1.00 0.00 N ATOM 393 CA ASP A 28 -6.758 12.509 -3.119 1.00 0.00 C ATOM 394 C ASP A 28 -6.131 11.163 -3.469 1.00 0.00 C ATOM 395 O ASP A 28 -6.544 10.483 -4.408 1.00 0.00 O ATOM 396 CB ASP A 28 -8.261 12.474 -3.402 1.00 0.00 C ATOM 397 CG ASP A 28 -8.899 13.846 -3.310 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.188 14.809 -2.953 1.00 0.00 O ATOM 399 OD2 ASP A 28 -10.109 13.957 -3.595 1.00 0.00 O ATOM 0 H ASP A 28 -6.277 13.543 -4.878 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.600 12.698 -2.057 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.431 12.063 -4.397 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.746 11.803 -2.693 1.00 0.00 H new ATOM 404 N PRO A 29 -5.108 10.768 -2.696 1.00 0.00 N ATOM 405 CA PRO A 29 -4.401 9.500 -2.905 1.00 0.00 C ATOM 406 C PRO A 29 -5.262 8.292 -2.553 1.00 0.00 C ATOM 407 O PRO A 29 -6.136 8.372 -1.690 1.00 0.00 O ATOM 408 CB PRO A 29 -3.205 9.600 -1.955 1.00 0.00 C ATOM 409 CG PRO A 29 -3.646 10.542 -0.888 1.00 0.00 C ATOM 410 CD PRO A 29 -4.562 11.528 -1.559 1.00 0.00 C ATOM 0 HA PRO A 29 -4.122 9.356 -3.949 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.946 8.626 -1.541 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.320 9.972 -2.471 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.162 10.011 -0.088 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.792 11.047 -0.436 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.350 11.866 -0.886 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -4.023 12.416 -1.891 1.00 0.00 H new ATOM 418 N ILE A 30 -5.008 7.174 -3.225 1.00 0.00 N ATOM 419 CA ILE A 30 -5.759 5.949 -2.981 1.00 0.00 C ATOM 420 C ILE A 30 -4.963 4.722 -3.409 1.00 0.00 C ATOM 421 O ILE A 30 -4.439 4.665 -4.522 1.00 0.00 O ATOM 422 CB ILE A 30 -7.107 5.958 -3.725 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.891 4.679 -3.421 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.885 6.106 -5.223 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.383 4.823 -3.618 1.00 0.00 C ATOM 0 H ILE A 30 -4.288 7.091 -3.943 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.946 5.902 -1.908 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.691 6.811 -3.378 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.524 3.877 -4.061 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.696 4.379 -2.391 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.847 6.111 -5.735 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.363 7.042 -5.423 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.285 5.272 -5.586 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.874 3.878 -3.384 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.764 5.603 -2.958 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.589 5.092 -4.654 1.00 0.00 H new ATOM 437 N VAL A 31 -4.876 3.739 -2.519 1.00 0.00 N ATOM 438 CA VAL A 31 -4.146 2.510 -2.805 1.00 0.00 C ATOM 439 C VAL A 31 -5.012 1.524 -3.582 1.00 0.00 C ATOM 440 O VAL A 31 -6.195 1.356 -3.288 1.00 0.00 O ATOM 441 CB VAL A 31 -3.654 1.834 -1.511 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.907 0.548 -1.830 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.776 2.787 -0.713 1.00 0.00 C ATOM 0 H VAL A 31 -5.302 3.770 -1.593 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.284 2.789 -3.411 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.522 1.580 -0.902 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.567 0.085 -0.903 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.571 -0.138 -2.356 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.046 0.774 -2.460 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.437 2.293 0.198 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.912 3.074 -1.313 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.349 3.677 -0.452 1.00 0.00 H new ATOM 453 N SER A 32 -4.413 0.875 -4.575 1.00 0.00 N ATOM 454 CA SER A 32 -5.130 -0.093 -5.398 1.00 0.00 C ATOM 455 C SER A 32 -4.317 -1.372 -5.566 1.00 0.00 C ATOM 456 O SER A 32 -3.405 -1.438 -6.391 1.00 0.00 O ATOM 457 CB SER A 32 -5.447 0.508 -6.769 1.00 0.00 C ATOM 458 OG SER A 32 -6.183 1.712 -6.641 1.00 0.00 O ATOM 0 H SER A 32 -3.433 1.002 -4.829 1.00 0.00 H new ATOM 0 HA SER A 32 -6.064 -0.341 -4.893 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.519 0.701 -7.308 1.00 0.00 H new ATOM 0 HB3 SER A 32 -6.016 -0.209 -7.361 1.00 0.00 H new ATOM 0 HG SER A 32 -6.371 2.076 -7.531 1.00 0.00 H new ATOM 464 N VAL A 33 -4.653 -2.388 -4.777 1.00 0.00 N ATOM 465 CA VAL A 33 -3.956 -3.667 -4.837 1.00 0.00 C ATOM 466 C VAL A 33 -4.640 -4.620 -5.811 1.00 0.00 C ATOM 467 O VAL A 33 -5.867 -4.720 -5.838 1.00 0.00 O ATOM 468 CB VAL A 33 -3.882 -4.332 -3.450 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.035 -5.594 -3.508 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.331 -3.357 -2.421 1.00 0.00 C ATOM 0 H VAL A 33 -5.404 -2.350 -4.088 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.944 -3.460 -5.186 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.890 -4.613 -3.146 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.994 -6.050 -2.519 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.477 -6.297 -4.214 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.026 -5.340 -3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.286 -3.843 -1.447 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.330 -3.043 -2.717 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.982 -2.485 -2.361 1.00 0.00 H new ATOM 480 N ILE A 34 -3.839 -5.319 -6.607 1.00 0.00 N ATOM 481 CA ILE A 34 -4.367 -6.266 -7.581 1.00 0.00 C ATOM 482 C ILE A 34 -3.646 -7.607 -7.491 1.00 0.00 C ATOM 483 O ILE A 34 -2.422 -7.674 -7.604 1.00 0.00 O ATOM 484 CB ILE A 34 -4.243 -5.724 -9.018 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.152 -4.508 -9.208 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.586 -6.811 -10.025 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.496 -3.199 -8.830 1.00 0.00 C ATOM 0 H ILE A 34 -2.822 -5.248 -6.597 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.422 -6.407 -7.344 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.212 -5.413 -9.186 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.467 -4.459 -10.250 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.053 -4.640 -8.608 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.494 -6.413 -11.036 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -3.902 -7.650 -9.902 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.609 -7.150 -9.860 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.198 -2.381 -8.990 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.205 -3.228 -7.780 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.611 -3.044 -9.447 1.00 0.00 H new ATOM 499 N PHE A 35 -4.414 -8.673 -7.290 1.00 0.00 N ATOM 500 CA PHE A 35 -3.849 -10.013 -7.186 1.00 0.00 C ATOM 501 C PHE A 35 -4.920 -11.074 -7.420 1.00 0.00 C ATOM 502 O PHE A 35 -6.030 -10.980 -6.896 1.00 0.00 O ATOM 503 CB PHE A 35 -3.208 -10.214 -5.812 1.00 0.00 C ATOM 504 CG PHE A 35 -2.485 -11.523 -5.673 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.205 -11.680 -6.179 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.086 -12.597 -5.036 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.538 -12.883 -6.054 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.423 -13.804 -4.907 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.147 -13.946 -5.416 1.00 0.00 C ATOM 0 H PHE A 35 -5.429 -8.635 -7.196 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.084 -10.118 -7.955 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.508 -9.400 -5.624 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -3.982 -10.152 -5.047 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.723 -10.852 -6.677 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.083 -12.490 -4.636 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.459 -12.992 -6.455 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.902 -14.634 -4.409 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.626 -14.887 -5.315 1.00 0.00 H new ATOM 519 N LYS A 36 -4.580 -12.085 -8.213 1.00 0.00 N ATOM 520 CA LYS A 36 -5.510 -13.165 -8.518 1.00 0.00 C ATOM 521 C LYS A 36 -6.735 -12.637 -9.258 1.00 0.00 C ATOM 522 O LYS A 36 -7.868 -12.997 -8.938 1.00 0.00 O ATOM 523 CB LYS A 36 -5.944 -13.871 -7.231 1.00 0.00 C ATOM 524 CG LYS A 36 -4.833 -14.671 -6.573 1.00 0.00 C ATOM 525 CD LYS A 36 -4.811 -16.107 -7.068 1.00 0.00 C ATOM 526 CE LYS A 36 -3.415 -16.704 -6.986 1.00 0.00 C ATOM 527 NZ LYS A 36 -3.212 -17.782 -7.994 1.00 0.00 N ATOM 0 H LYS A 36 -3.666 -12.178 -8.656 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.998 -13.879 -9.163 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.312 -13.127 -6.525 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.777 -14.538 -7.455 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.872 -14.199 -6.780 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.967 -14.660 -5.491 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.500 -16.708 -6.475 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.163 -16.143 -8.099 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.675 -15.919 -7.140 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.250 -17.106 -5.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.209 -18.058 -8.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.794 -18.607 -7.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -3.491 -17.435 -8.934 1.00 0.00 H new ATOM 541 N ASP A 37 -6.499 -11.783 -10.248 1.00 0.00 N ATOM 542 CA ASP A 37 -7.584 -11.207 -11.035 1.00 0.00 C ATOM 543 C ASP A 37 -8.609 -10.528 -10.132 1.00 0.00 C ATOM 544 O ASP A 37 -9.807 -10.550 -10.412 1.00 0.00 O ATOM 545 CB ASP A 37 -8.263 -12.289 -11.875 1.00 0.00 C ATOM 546 CG ASP A 37 -7.317 -12.925 -12.874 1.00 0.00 C ATOM 547 OD1 ASP A 37 -6.769 -12.191 -13.723 1.00 0.00 O ATOM 548 OD2 ASP A 37 -7.125 -14.157 -12.807 1.00 0.00 O ATOM 0 H ASP A 37 -5.567 -11.474 -10.525 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.158 -10.456 -11.700 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -8.662 -13.060 -11.216 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.110 -11.854 -12.407 1.00 0.00 H new ATOM 553 N GLU A 38 -8.129 -9.925 -9.049 1.00 0.00 N ATOM 554 CA GLU A 38 -9.005 -9.242 -8.104 1.00 0.00 C ATOM 555 C GLU A 38 -8.502 -7.829 -7.820 1.00 0.00 C ATOM 556 O GLU A 38 -7.354 -7.635 -7.419 1.00 0.00 O ATOM 557 CB GLU A 38 -9.101 -10.033 -6.798 1.00 0.00 C ATOM 558 CG GLU A 38 -10.239 -11.040 -6.779 1.00 0.00 C ATOM 559 CD GLU A 38 -9.865 -12.355 -7.434 1.00 0.00 C ATOM 560 OE1 GLU A 38 -9.165 -13.163 -6.787 1.00 0.00 O ATOM 561 OE2 GLU A 38 -10.273 -12.578 -8.593 1.00 0.00 O ATOM 0 H GLU A 38 -7.139 -9.895 -8.804 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.996 -9.174 -8.552 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -8.160 -10.557 -6.631 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -9.230 -9.336 -5.970 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.539 -11.225 -5.747 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.103 -10.616 -7.291 1.00 0.00 H new ATOM 568 N LYS A 39 -9.369 -6.845 -8.032 1.00 0.00 N ATOM 569 CA LYS A 39 -9.015 -5.450 -7.798 1.00 0.00 C ATOM 570 C LYS A 39 -9.589 -4.957 -6.474 1.00 0.00 C ATOM 571 O LYS A 39 -10.799 -5.015 -6.250 1.00 0.00 O ATOM 572 CB LYS A 39 -9.526 -4.574 -8.945 1.00 0.00 C ATOM 573 CG LYS A 39 -8.808 -3.241 -9.058 1.00 0.00 C ATOM 574 CD LYS A 39 -9.051 -2.589 -10.409 1.00 0.00 C ATOM 575 CE LYS A 39 -8.354 -3.348 -11.528 1.00 0.00 C ATOM 576 NZ LYS A 39 -8.415 -2.610 -12.820 1.00 0.00 N ATOM 0 H LYS A 39 -10.322 -6.988 -8.366 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.928 -5.380 -7.751 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.415 -5.118 -9.883 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.592 -4.393 -8.806 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.149 -2.575 -8.265 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.738 -3.390 -8.912 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.122 -2.549 -10.607 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.692 -1.560 -10.387 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.312 -3.520 -11.257 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.818 -4.327 -11.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.929 -3.160 -13.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.409 -2.468 -13.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.950 -1.686 -12.714 1.00 0.00 H new ATOM 590 N LYS A 40 -8.715 -4.471 -5.600 1.00 0.00 N ATOM 591 CA LYS A 40 -9.134 -3.965 -4.298 1.00 0.00 C ATOM 592 C LYS A 40 -8.363 -2.701 -3.931 1.00 0.00 C ATOM 593 O LYS A 40 -7.132 -2.688 -3.939 1.00 0.00 O ATOM 594 CB LYS A 40 -8.926 -5.033 -3.222 1.00 0.00 C ATOM 595 CG LYS A 40 -9.891 -6.201 -3.328 1.00 0.00 C ATOM 596 CD LYS A 40 -9.577 -7.280 -2.305 1.00 0.00 C ATOM 597 CE LYS A 40 -10.427 -8.521 -2.525 1.00 0.00 C ATOM 598 NZ LYS A 40 -9.815 -9.445 -3.520 1.00 0.00 N ATOM 0 H LYS A 40 -7.711 -4.417 -5.770 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.194 -3.718 -4.356 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.905 -5.409 -3.288 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.033 -4.573 -2.240 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -10.911 -5.846 -3.182 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.842 -6.624 -4.331 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.522 -7.545 -2.367 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.750 -6.892 -1.301 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.558 -9.043 -1.577 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.419 -8.226 -2.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -10.363 -9.416 -4.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.836 -9.151 -3.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -9.819 -10.414 -3.142 1.00 0.00 H new ATOM 612 N LYS A 41 -9.095 -1.640 -3.609 1.00 0.00 N ATOM 613 CA LYS A 41 -8.481 -0.371 -3.236 1.00 0.00 C ATOM 614 C LYS A 41 -8.982 0.097 -1.874 1.00 0.00 C ATOM 615 O LYS A 41 -10.083 -0.258 -1.450 1.00 0.00 O ATOM 616 CB LYS A 41 -8.778 0.693 -4.295 1.00 0.00 C ATOM 617 CG LYS A 41 -10.221 0.691 -4.770 1.00 0.00 C ATOM 618 CD LYS A 41 -11.119 1.479 -3.831 1.00 0.00 C ATOM 619 CE LYS A 41 -12.554 0.978 -3.881 1.00 0.00 C ATOM 620 NZ LYS A 41 -13.202 1.283 -5.187 1.00 0.00 N ATOM 0 H LYS A 41 -10.115 -1.634 -3.599 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.403 -0.522 -3.174 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.539 1.676 -3.888 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.122 0.535 -5.151 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.276 1.118 -5.771 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.580 -0.336 -4.842 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.740 1.400 -2.812 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -11.092 2.535 -4.100 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.569 -0.098 -3.711 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -13.127 1.436 -3.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.179 0.926 -5.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -13.210 2.312 -5.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.670 0.825 -5.954 1.00 0.00 H new ATOM 634 N THR A 42 -8.169 0.896 -1.191 1.00 0.00 N ATOM 635 CA THR A 42 -8.530 1.413 0.123 1.00 0.00 C ATOM 636 C THR A 42 -9.340 2.699 0.004 1.00 0.00 C ATOM 637 O THR A 42 -9.395 3.314 -1.061 1.00 0.00 O ATOM 638 CB THR A 42 -7.281 1.684 0.983 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.544 2.786 0.443 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.390 0.453 1.045 1.00 0.00 C ATOM 0 H THR A 42 -7.255 1.200 -1.527 1.00 0.00 H new ATOM 0 HA THR A 42 -9.137 0.648 0.608 1.00 0.00 H new ATOM 0 HB THR A 42 -7.608 1.927 1.994 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.207 3.344 1.175 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.514 0.668 1.658 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.945 -0.376 1.484 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.071 0.184 0.038 1.00 0.00 H new ATOM 648 N LYS A 43 -9.967 3.101 1.104 1.00 0.00 N ATOM 649 CA LYS A 43 -10.773 4.316 1.125 1.00 0.00 C ATOM 650 C LYS A 43 -9.918 5.542 0.822 1.00 0.00 C ATOM 651 O LYS A 43 -8.973 5.848 1.550 1.00 0.00 O ATOM 652 CB LYS A 43 -11.453 4.479 2.487 1.00 0.00 C ATOM 653 CG LYS A 43 -10.477 4.686 3.632 1.00 0.00 C ATOM 654 CD LYS A 43 -11.185 4.673 4.977 1.00 0.00 C ATOM 655 CE LYS A 43 -10.246 5.072 6.105 1.00 0.00 C ATOM 656 NZ LYS A 43 -10.882 4.906 7.441 1.00 0.00 N ATOM 0 H LYS A 43 -9.933 2.603 1.993 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.537 4.228 0.353 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.135 5.328 2.444 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -12.057 3.595 2.691 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.719 3.903 3.611 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.958 5.636 3.502 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -12.033 5.357 4.949 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.584 3.677 5.170 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.341 4.466 6.056 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.942 6.110 5.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -10.210 5.188 8.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.731 5.503 7.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.149 3.910 7.577 1.00 0.00 H new ATOM 670 N LYS A 44 -10.256 6.242 -0.256 1.00 0.00 N ATOM 671 CA LYS A 44 -9.521 7.437 -0.654 1.00 0.00 C ATOM 672 C LYS A 44 -9.351 8.389 0.525 1.00 0.00 C ATOM 673 O LYS A 44 -10.131 8.359 1.477 1.00 0.00 O ATOM 674 CB LYS A 44 -10.246 8.148 -1.798 1.00 0.00 C ATOM 675 CG LYS A 44 -11.289 9.148 -1.329 1.00 0.00 C ATOM 676 CD LYS A 44 -11.878 9.927 -2.493 1.00 0.00 C ATOM 677 CE LYS A 44 -12.969 10.881 -2.030 1.00 0.00 C ATOM 678 NZ LYS A 44 -13.394 11.807 -3.116 1.00 0.00 N ATOM 0 H LYS A 44 -11.035 6.002 -0.870 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.532 7.129 -0.994 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.512 8.664 -2.417 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.728 7.403 -2.430 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.085 8.624 -0.801 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -10.837 9.840 -0.618 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.089 10.490 -2.992 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.288 9.233 -3.227 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.829 10.308 -1.684 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -12.608 11.460 -1.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.325 12.208 -2.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -12.699 12.576 -3.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -13.454 11.285 -4.014 1.00 0.00 H new ATOM 692 N VAL A 45 -8.328 9.235 0.454 1.00 0.00 N ATOM 693 CA VAL A 45 -8.058 10.198 1.515 1.00 0.00 C ATOM 694 C VAL A 45 -8.129 11.628 0.990 1.00 0.00 C ATOM 695 O VAL A 45 -7.515 11.959 -0.024 1.00 0.00 O ATOM 696 CB VAL A 45 -6.672 9.964 2.146 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.387 11.012 3.211 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.583 8.562 2.729 1.00 0.00 C ATOM 0 H VAL A 45 -7.673 9.273 -0.327 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.825 10.054 2.276 1.00 0.00 H new ATOM 0 HB VAL A 45 -5.916 10.058 1.366 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.404 10.831 3.646 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.407 12.004 2.760 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.145 10.953 3.992 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.598 8.413 3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.347 8.438 3.496 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.741 7.828 1.938 1.00 0.00 H new ATOM 708 N ASP A 46 -8.883 12.471 1.687 1.00 0.00 N ATOM 709 CA ASP A 46 -9.035 13.866 1.292 1.00 0.00 C ATOM 710 C ASP A 46 -7.674 14.542 1.151 1.00 0.00 C ATOM 711 O ASP A 46 -6.640 13.942 1.440 1.00 0.00 O ATOM 712 CB ASP A 46 -9.888 14.618 2.315 1.00 0.00 C ATOM 713 CG ASP A 46 -11.369 14.339 2.151 1.00 0.00 C ATOM 714 OD1 ASP A 46 -11.877 14.476 1.018 1.00 0.00 O ATOM 715 OD2 ASP A 46 -12.020 13.983 3.155 1.00 0.00 O ATOM 0 H ASP A 46 -9.398 12.212 2.528 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.536 13.892 0.324 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.577 14.335 3.321 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.710 15.689 2.215 1.00 0.00 H new ATOM 720 N ASN A 47 -7.684 15.794 0.704 1.00 0.00 N ATOM 721 CA ASN A 47 -6.451 16.550 0.523 1.00 0.00 C ATOM 722 C ASN A 47 -5.450 16.233 1.630 1.00 0.00 C ATOM 723 O ASN A 47 -5.530 16.782 2.728 1.00 0.00 O ATOM 724 CB ASN A 47 -6.747 18.051 0.503 1.00 0.00 C ATOM 725 CG ASN A 47 -7.953 18.414 1.349 1.00 0.00 C ATOM 726 OD1 ASN A 47 -7.938 18.261 2.570 1.00 0.00 O ATOM 727 ND2 ASN A 47 -9.006 18.897 0.700 1.00 0.00 N ATOM 0 H ASN A 47 -8.532 16.306 0.461 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.013 16.259 -0.432 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -5.875 18.595 0.866 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.918 18.371 -0.525 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -9.847 19.158 1.215 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -8.974 19.007 -0.314 1.00 0.00 H new ATOM 734 N GLU A 48 -4.509 15.342 1.332 1.00 0.00 N ATOM 735 CA GLU A 48 -3.493 14.952 2.303 1.00 0.00 C ATOM 736 C GLU A 48 -2.315 14.271 1.612 1.00 0.00 C ATOM 737 O GLU A 48 -2.491 13.311 0.861 1.00 0.00 O ATOM 738 CB GLU A 48 -4.093 14.016 3.354 1.00 0.00 C ATOM 739 CG GLU A 48 -3.084 13.523 4.377 1.00 0.00 C ATOM 740 CD GLU A 48 -2.371 14.658 5.086 1.00 0.00 C ATOM 741 OE1 GLU A 48 -3.049 15.443 5.781 1.00 0.00 O ATOM 742 OE2 GLU A 48 -1.134 14.761 4.946 1.00 0.00 O ATOM 0 H GLU A 48 -4.429 14.877 0.427 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.131 15.855 2.796 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.899 14.535 3.872 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.538 13.157 2.852 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.593 12.902 5.114 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.348 12.890 3.881 1.00 0.00 H new ATOM 749 N LEU A 49 -1.113 14.774 1.873 1.00 0.00 N ATOM 750 CA LEU A 49 0.096 14.216 1.277 1.00 0.00 C ATOM 751 C LEU A 49 0.388 12.828 1.838 1.00 0.00 C ATOM 752 O LEU A 49 0.684 11.896 1.092 1.00 0.00 O ATOM 753 CB LEU A 49 1.287 15.142 1.529 1.00 0.00 C ATOM 754 CG LEU A 49 1.564 16.187 0.448 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.261 16.760 -0.088 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.452 17.296 0.994 1.00 0.00 C ATOM 0 H LEU A 49 -0.950 15.567 2.493 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.065 14.127 0.203 1.00 0.00 H new ATOM 0 HB2 LEU A 49 1.125 15.660 2.474 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.180 14.528 1.650 1.00 0.00 H new ATOM 0 HG LEU A 49 2.088 15.701 -0.375 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.479 17.502 -0.856 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.340 15.958 -0.518 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.291 17.231 0.725 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.639 18.031 0.211 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.955 17.780 1.835 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.399 16.873 1.328 1.00 0.00 H new ATOM 768 N ASN A 50 0.302 12.699 3.158 1.00 0.00 N ATOM 769 CA ASN A 50 0.556 11.424 3.820 1.00 0.00 C ATOM 770 C ASN A 50 -0.744 10.804 4.323 1.00 0.00 C ATOM 771 O ASN A 50 -1.106 10.923 5.494 1.00 0.00 O ATOM 772 CB ASN A 50 1.527 11.616 4.986 1.00 0.00 C ATOM 773 CG ASN A 50 2.505 12.750 4.744 1.00 0.00 C ATOM 774 OD1 ASN A 50 2.860 13.485 5.665 1.00 0.00 O ATOM 775 ND2 ASN A 50 2.943 12.897 3.499 1.00 0.00 N ATOM 0 H ASN A 50 0.058 13.461 3.790 1.00 0.00 H new ATOM 0 HA ASN A 50 1.003 10.747 3.092 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.962 11.815 5.897 1.00 0.00 H new ATOM 0 HB3 ASN A 50 2.080 10.691 5.150 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.601 13.643 3.275 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.621 12.264 2.767 1.00 0.00 H new ATOM 782 N PRO A 51 -1.465 10.124 3.418 1.00 0.00 N ATOM 783 CA PRO A 51 -2.735 9.471 3.747 1.00 0.00 C ATOM 784 C PRO A 51 -2.545 8.258 4.652 1.00 0.00 C ATOM 785 O PRO A 51 -1.585 7.503 4.502 1.00 0.00 O ATOM 786 CB PRO A 51 -3.276 9.040 2.381 1.00 0.00 C ATOM 787 CG PRO A 51 -2.067 8.902 1.521 1.00 0.00 C ATOM 788 CD PRO A 51 -1.094 9.941 2.005 1.00 0.00 C ATOM 0 HA PRO A 51 -3.404 10.133 4.296 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.822 8.099 2.450 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -3.967 9.780 1.977 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.642 7.901 1.603 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.315 9.058 0.471 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.062 9.605 1.901 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.185 10.870 1.442 1.00 0.00 H new ATOM 796 N VAL A 52 -3.468 8.076 5.591 1.00 0.00 N ATOM 797 CA VAL A 52 -3.404 6.954 6.519 1.00 0.00 C ATOM 798 C VAL A 52 -4.661 6.096 6.433 1.00 0.00 C ATOM 799 O VAL A 52 -5.737 6.509 6.864 1.00 0.00 O ATOM 800 CB VAL A 52 -3.223 7.435 7.971 1.00 0.00 C ATOM 801 CG1 VAL A 52 -2.953 6.258 8.895 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.101 8.459 8.056 1.00 0.00 C ATOM 0 H VAL A 52 -4.269 8.692 5.729 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.539 6.356 6.232 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.147 7.914 8.294 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -2.828 6.618 9.916 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -3.793 5.564 8.855 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.044 5.747 8.577 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -1.986 8.788 9.089 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.170 8.008 7.714 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.342 9.316 7.427 1.00 0.00 H new ATOM 812 N TRP A 53 -4.517 4.900 5.874 1.00 0.00 N ATOM 813 CA TRP A 53 -5.642 3.983 5.731 1.00 0.00 C ATOM 814 C TRP A 53 -5.709 3.016 6.909 1.00 0.00 C ATOM 815 O TRP A 53 -6.731 2.920 7.587 1.00 0.00 O ATOM 816 CB TRP A 53 -5.527 3.202 4.421 1.00 0.00 C ATOM 817 CG TRP A 53 -5.499 4.081 3.207 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.575 4.595 2.542 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.336 4.547 2.513 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.152 5.352 1.476 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.783 5.339 1.437 1.00 0.00 C ATOM 822 CE3 TRP A 53 -2.962 4.374 2.697 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.903 5.954 0.551 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.090 4.984 1.816 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.563 5.767 0.755 1.00 0.00 C ATOM 0 H TRP A 53 -3.633 4.543 5.512 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.559 4.572 5.715 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.620 2.598 4.445 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.367 2.512 4.342 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.607 4.431 2.814 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.759 5.844 0.820 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.588 3.774 3.513 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.265 6.557 -0.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -1.026 4.855 1.947 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.856 6.232 0.085 1.00 0.00 H new ATOM 836 N ASN A 54 -4.613 2.302 7.146 1.00 0.00 N ATOM 837 CA ASN A 54 -4.549 1.342 8.242 1.00 0.00 C ATOM 838 C ASN A 54 -5.668 0.312 8.129 1.00 0.00 C ATOM 839 O ASN A 54 -6.260 -0.088 9.131 1.00 0.00 O ATOM 840 CB ASN A 54 -4.640 2.066 9.587 1.00 0.00 C ATOM 841 CG ASN A 54 -3.543 3.098 9.763 1.00 0.00 C ATOM 842 OD1 ASN A 54 -3.787 4.200 10.255 1.00 0.00 O ATOM 843 ND2 ASN A 54 -2.328 2.745 9.361 1.00 0.00 N ATOM 0 H ASN A 54 -3.758 2.370 6.594 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.593 0.821 8.181 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.611 2.554 9.669 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -4.581 1.336 10.394 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -1.550 3.398 9.454 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -2.172 1.821 8.959 1.00 0.00 H new ATOM 850 N GLU A 55 -5.952 -0.114 6.902 1.00 0.00 N ATOM 851 CA GLU A 55 -7.000 -1.098 6.659 1.00 0.00 C ATOM 852 C GLU A 55 -6.401 -2.465 6.344 1.00 0.00 C ATOM 853 O GLU A 55 -5.190 -2.598 6.168 1.00 0.00 O ATOM 854 CB GLU A 55 -7.899 -0.645 5.506 1.00 0.00 C ATOM 855 CG GLU A 55 -7.347 -0.990 4.133 1.00 0.00 C ATOM 856 CD GLU A 55 -8.309 -0.643 3.014 1.00 0.00 C ATOM 857 OE1 GLU A 55 -9.091 0.317 3.180 1.00 0.00 O ATOM 858 OE2 GLU A 55 -8.281 -1.330 1.972 1.00 0.00 O ATOM 0 H GLU A 55 -5.471 0.207 6.062 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.599 -1.183 7.566 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.881 -1.105 5.620 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.042 0.434 5.570 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.409 -0.458 3.979 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.119 -2.055 4.094 1.00 0.00 H new ATOM 865 N ILE A 56 -7.258 -3.479 6.275 1.00 0.00 N ATOM 866 CA ILE A 56 -6.813 -4.835 5.981 1.00 0.00 C ATOM 867 C ILE A 56 -7.539 -5.400 4.764 1.00 0.00 C ATOM 868 O ILE A 56 -8.764 -5.318 4.665 1.00 0.00 O ATOM 869 CB ILE A 56 -7.040 -5.774 7.181 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.378 -5.202 8.436 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.498 -7.163 6.876 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.637 -6.020 9.682 1.00 0.00 C ATOM 0 H ILE A 56 -8.264 -3.387 6.419 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.745 -4.778 5.771 1.00 0.00 H new ATOM 0 HB ILE A 56 -8.112 -5.855 7.363 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.302 -5.136 8.272 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.739 -4.186 8.597 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.666 -7.815 7.733 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -7.010 -7.570 6.004 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.429 -7.100 6.672 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.138 -5.556 10.532 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.710 -6.065 9.871 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.251 -7.029 9.541 1.00 0.00 H new ATOM 884 N LEU A 57 -6.776 -5.975 3.842 1.00 0.00 N ATOM 885 CA LEU A 57 -7.345 -6.556 2.631 1.00 0.00 C ATOM 886 C LEU A 57 -7.149 -8.068 2.608 1.00 0.00 C ATOM 887 O LEU A 57 -6.116 -8.576 3.045 1.00 0.00 O ATOM 888 CB LEU A 57 -6.706 -5.928 1.391 1.00 0.00 C ATOM 889 CG LEU A 57 -6.745 -4.401 1.316 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.544 -3.874 0.546 1.00 0.00 C ATOM 891 CD2 LEU A 57 -8.041 -3.931 0.673 1.00 0.00 C ATOM 0 H LEU A 57 -5.761 -6.052 3.910 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.415 -6.347 2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.665 -6.248 1.342 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.204 -6.328 0.508 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.703 -4.005 2.331 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.588 -2.786 0.503 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.627 -4.180 1.049 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.555 -4.278 -0.466 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.051 -2.842 0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.114 -4.336 -0.336 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.888 -4.277 1.266 1.00 0.00 H new ATOM 903 N GLU A 58 -8.145 -8.782 2.094 1.00 0.00 N ATOM 904 CA GLU A 58 -8.080 -10.236 2.013 1.00 0.00 C ATOM 905 C GLU A 58 -8.322 -10.713 0.583 1.00 0.00 C ATOM 906 O GLU A 58 -9.283 -10.302 -0.066 1.00 0.00 O ATOM 907 CB GLU A 58 -9.108 -10.868 2.953 1.00 0.00 C ATOM 908 CG GLU A 58 -9.199 -10.182 4.306 1.00 0.00 C ATOM 909 CD GLU A 58 -10.568 -10.324 4.942 1.00 0.00 C ATOM 910 OE1 GLU A 58 -11.243 -11.341 4.678 1.00 0.00 O ATOM 911 OE2 GLU A 58 -10.965 -9.417 5.703 1.00 0.00 O ATOM 0 H GLU A 58 -9.006 -8.377 1.727 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.080 -10.546 2.317 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -10.088 -10.843 2.476 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.853 -11.917 3.103 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.447 -10.603 4.974 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.965 -9.124 4.189 1.00 0.00 H new ATOM 918 N PHE A 59 -7.441 -11.582 0.099 1.00 0.00 N ATOM 919 CA PHE A 59 -7.556 -12.115 -1.253 1.00 0.00 C ATOM 920 C PHE A 59 -7.738 -13.629 -1.228 1.00 0.00 C ATOM 921 O PHE A 59 -7.276 -14.306 -0.309 1.00 0.00 O ATOM 922 CB PHE A 59 -6.317 -11.752 -2.074 1.00 0.00 C ATOM 923 CG PHE A 59 -6.260 -10.304 -2.467 1.00 0.00 C ATOM 924 CD1 PHE A 59 -6.983 -9.838 -3.554 1.00 0.00 C ATOM 925 CD2 PHE A 59 -5.485 -9.407 -1.749 1.00 0.00 C ATOM 926 CE1 PHE A 59 -6.933 -8.506 -3.918 1.00 0.00 C ATOM 927 CE2 PHE A 59 -5.431 -8.074 -2.108 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.156 -7.622 -3.193 1.00 0.00 C ATOM 0 H PHE A 59 -6.639 -11.932 0.623 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.435 -11.669 -1.718 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.425 -11.999 -1.499 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.296 -12.366 -2.975 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -7.593 -10.524 -4.123 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.917 -9.754 -0.899 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.500 -8.156 -4.768 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -4.822 -7.386 -1.540 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.116 -6.580 -3.474 1.00 0.00 H new ATOM 938 N ASP A 60 -8.416 -14.155 -2.243 1.00 0.00 N ATOM 939 CA ASP A 60 -8.659 -15.589 -2.339 1.00 0.00 C ATOM 940 C ASP A 60 -7.585 -16.268 -3.182 1.00 0.00 C ATOM 941 O ASP A 60 -7.187 -15.756 -4.230 1.00 0.00 O ATOM 942 CB ASP A 60 -10.041 -15.854 -2.940 1.00 0.00 C ATOM 943 CG ASP A 60 -10.018 -15.872 -4.456 1.00 0.00 C ATOM 944 OD1 ASP A 60 -9.274 -16.695 -5.030 1.00 0.00 O ATOM 945 OD2 ASP A 60 -10.745 -15.063 -5.069 1.00 0.00 O ATOM 0 H ASP A 60 -8.807 -13.609 -3.011 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.622 -16.007 -1.333 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.416 -16.809 -2.574 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.736 -15.087 -2.599 1.00 0.00 H new ATOM 950 N LEU A 61 -7.117 -17.422 -2.719 1.00 0.00 N ATOM 951 CA LEU A 61 -6.087 -18.171 -3.430 1.00 0.00 C ATOM 952 C LEU A 61 -6.671 -19.426 -4.070 1.00 0.00 C ATOM 953 O LEU A 61 -6.188 -19.890 -5.103 1.00 0.00 O ATOM 954 CB LEU A 61 -4.954 -18.551 -2.475 1.00 0.00 C ATOM 955 CG LEU A 61 -4.208 -17.387 -1.822 1.00 0.00 C ATOM 956 CD1 LEU A 61 -2.936 -17.879 -1.148 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.888 -16.313 -2.851 1.00 0.00 C ATOM 0 H LEU A 61 -7.435 -17.859 -1.854 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.689 -17.534 -4.220 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.366 -19.180 -1.686 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.232 -19.158 -3.022 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.853 -16.950 -1.060 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.418 -17.037 -0.689 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.190 -18.611 -0.381 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.287 -18.343 -1.891 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.357 -15.493 -2.368 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.263 -16.737 -3.637 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.814 -15.939 -3.287 1.00 0.00 H new ATOM 969 N ARG A 62 -7.713 -19.970 -3.450 1.00 0.00 N ATOM 970 CA ARG A 62 -8.363 -21.172 -3.960 1.00 0.00 C ATOM 971 C ARG A 62 -7.427 -22.374 -3.877 1.00 0.00 C ATOM 972 O ARG A 62 -7.411 -23.224 -4.766 1.00 0.00 O ATOM 973 CB ARG A 62 -8.811 -20.960 -5.407 1.00 0.00 C ATOM 974 CG ARG A 62 -9.399 -19.582 -5.667 1.00 0.00 C ATOM 975 CD ARG A 62 -9.280 -19.193 -7.132 1.00 0.00 C ATOM 976 NE ARG A 62 -10.145 -20.003 -7.986 1.00 0.00 N ATOM 977 CZ ARG A 62 -10.547 -19.625 -9.194 1.00 0.00 C ATOM 978 NH1 ARG A 62 -10.163 -18.457 -9.689 1.00 0.00 N ATOM 979 NH2 ARG A 62 -11.334 -20.417 -9.911 1.00 0.00 N ATOM 0 H ARG A 62 -8.125 -19.598 -2.594 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.238 -21.372 -3.341 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -7.958 -21.113 -6.069 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -9.553 -21.717 -5.663 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.448 -19.571 -5.371 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -8.886 -18.844 -5.051 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.538 -18.140 -7.250 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.245 -19.306 -7.454 1.00 0.00 H new ATOM 0 HE ARG A 62 -10.457 -20.908 -7.635 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.557 -17.846 -9.142 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.473 -18.170 -10.617 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -11.631 -21.317 -9.534 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.642 -20.126 -10.839 1.00 0.00 H new ATOM 993 N GLY A 63 -6.647 -22.437 -2.802 1.00 0.00 N ATOM 994 CA GLY A 63 -5.718 -23.537 -2.623 1.00 0.00 C ATOM 995 C GLY A 63 -4.434 -23.346 -3.406 1.00 0.00 C ATOM 996 O GLY A 63 -3.579 -24.232 -3.435 1.00 0.00 O ATOM 0 H GLY A 63 -6.642 -21.746 -2.052 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.482 -23.640 -1.564 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.195 -24.466 -2.935 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.298 -22.188 -4.042 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.110 -21.884 -4.830 1.00 0.00 C ATOM 1002 C ILE A 64 -2.075 -21.135 -3.996 1.00 0.00 C ATOM 1003 O ILE A 64 -2.262 -19.977 -3.623 1.00 0.00 O ATOM 1004 CB ILE A 64 -3.457 -21.043 -6.072 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -4.424 -21.808 -6.978 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.192 -20.672 -6.831 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -3.780 -22.967 -7.707 1.00 0.00 C ATOM 0 H ILE A 64 -4.996 -21.444 -4.027 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.693 -22.838 -5.153 1.00 0.00 H new ATOM 0 HB ILE A 64 -3.944 -20.124 -5.746 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.253 -22.183 -6.377 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -4.846 -21.119 -7.709 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.454 -20.078 -7.706 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.535 -20.093 -6.182 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -1.679 -21.580 -7.149 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.524 -23.463 -8.330 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.969 -22.597 -8.335 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.382 -23.677 -6.982 1.00 0.00 H new ATOM 1019 N PRO A 65 -0.955 -21.810 -3.698 1.00 0.00 N ATOM 1020 CA PRO A 65 0.134 -21.227 -2.908 1.00 0.00 C ATOM 1021 C PRO A 65 0.878 -20.132 -3.664 1.00 0.00 C ATOM 1022 O PRO A 65 0.572 -19.846 -4.823 1.00 0.00 O ATOM 1023 CB PRO A 65 1.058 -22.419 -2.645 1.00 0.00 C ATOM 1024 CG PRO A 65 0.790 -23.361 -3.768 1.00 0.00 C ATOM 1025 CD PRO A 65 -0.664 -23.193 -4.110 1.00 0.00 C ATOM 0 HA PRO A 65 -0.233 -20.746 -2.001 1.00 0.00 H new ATOM 0 HB2 PRO A 65 2.104 -22.113 -2.626 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.844 -22.881 -1.681 1.00 0.00 H new ATOM 0 HG2 PRO A 65 1.422 -23.134 -4.627 1.00 0.00 H new ATOM 0 HG3 PRO A 65 1.006 -24.389 -3.476 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -0.846 -23.342 -5.174 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.288 -23.911 -3.577 1.00 0.00 H new ATOM 1033 N LEU A 66 1.856 -19.523 -3.004 1.00 0.00 N ATOM 1034 CA LEU A 66 2.645 -18.459 -3.615 1.00 0.00 C ATOM 1035 C LEU A 66 3.961 -19.002 -4.161 1.00 0.00 C ATOM 1036 O LEU A 66 4.479 -20.008 -3.675 1.00 0.00 O ATOM 1037 CB LEU A 66 2.921 -17.352 -2.595 1.00 0.00 C ATOM 1038 CG LEU A 66 1.748 -16.423 -2.280 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.129 -15.433 -1.191 1.00 0.00 C ATOM 1040 CD2 LEU A 66 1.295 -15.691 -3.534 1.00 0.00 C ATOM 0 H LEU A 66 2.122 -19.748 -2.045 1.00 0.00 H new ATOM 0 HA LEU A 66 2.072 -18.046 -4.445 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.251 -17.816 -1.665 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.750 -16.746 -2.961 1.00 0.00 H new ATOM 0 HG LEU A 66 0.917 -17.029 -1.918 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.282 -14.780 -0.980 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.403 -15.975 -0.286 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.975 -14.833 -1.525 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.460 -15.035 -3.290 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.120 -15.097 -3.927 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.980 -16.416 -4.285 1.00 0.00 H new ATOM 1052 N ASP A 67 4.499 -18.329 -5.172 1.00 0.00 N ATOM 1053 CA ASP A 67 5.757 -18.742 -5.783 1.00 0.00 C ATOM 1054 C ASP A 67 6.696 -17.552 -5.951 1.00 0.00 C ATOM 1055 O ASP A 67 6.326 -16.412 -5.669 1.00 0.00 O ATOM 1056 CB ASP A 67 5.499 -19.399 -7.140 1.00 0.00 C ATOM 1057 CG ASP A 67 4.720 -20.694 -7.017 1.00 0.00 C ATOM 1058 OD1 ASP A 67 3.498 -20.631 -6.766 1.00 0.00 O ATOM 1059 OD2 ASP A 67 5.332 -21.771 -7.173 1.00 0.00 O ATOM 0 H ASP A 67 4.083 -17.495 -5.586 1.00 0.00 H new ATOM 0 HA ASP A 67 6.232 -19.467 -5.122 1.00 0.00 H new ATOM 0 HB2 ASP A 67 4.949 -18.706 -7.777 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.451 -19.597 -7.632 1.00 0.00 H new ATOM 1064 N PHE A 68 7.912 -17.825 -6.411 1.00 0.00 N ATOM 1065 CA PHE A 68 8.905 -16.776 -6.615 1.00 0.00 C ATOM 1066 C PHE A 68 8.447 -15.794 -7.688 1.00 0.00 C ATOM 1067 O PHE A 68 8.730 -14.598 -7.612 1.00 0.00 O ATOM 1068 CB PHE A 68 10.251 -17.389 -7.010 1.00 0.00 C ATOM 1069 CG PHE A 68 10.687 -18.509 -6.109 1.00 0.00 C ATOM 1070 CD1 PHE A 68 11.246 -18.243 -4.870 1.00 0.00 C ATOM 1071 CD2 PHE A 68 10.537 -19.830 -6.503 1.00 0.00 C ATOM 1072 CE1 PHE A 68 11.647 -19.272 -4.039 1.00 0.00 C ATOM 1073 CE2 PHE A 68 10.937 -20.863 -5.676 1.00 0.00 C ATOM 1074 CZ PHE A 68 11.493 -20.583 -4.443 1.00 0.00 C ATOM 0 H PHE A 68 8.234 -18.763 -6.650 1.00 0.00 H new ATOM 0 HA PHE A 68 9.021 -16.233 -5.677 1.00 0.00 H new ATOM 0 HB2 PHE A 68 10.186 -17.760 -8.033 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.013 -16.609 -7.002 1.00 0.00 H new ATOM 0 HD1 PHE A 68 11.370 -17.219 -4.549 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.103 -20.054 -7.466 1.00 0.00 H new ATOM 0 HE1 PHE A 68 12.080 -19.051 -3.075 1.00 0.00 H new ATOM 0 HE2 PHE A 68 10.815 -21.888 -5.994 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.807 -21.389 -3.796 1.00 0.00 H new ATOM 1084 N SER A 69 7.737 -16.307 -8.688 1.00 0.00 N ATOM 1085 CA SER A 69 7.242 -15.477 -9.780 1.00 0.00 C ATOM 1086 C SER A 69 5.991 -14.713 -9.357 1.00 0.00 C ATOM 1087 O SER A 69 5.539 -13.806 -10.056 1.00 0.00 O ATOM 1088 CB SER A 69 6.937 -16.339 -11.006 1.00 0.00 C ATOM 1089 OG SER A 69 8.078 -16.466 -11.837 1.00 0.00 O ATOM 0 H SER A 69 7.492 -17.294 -8.764 1.00 0.00 H new ATOM 0 HA SER A 69 8.018 -14.756 -10.036 1.00 0.00 H new ATOM 0 HB2 SER A 69 6.604 -17.327 -10.686 1.00 0.00 H new ATOM 0 HB3 SER A 69 6.118 -15.895 -11.572 1.00 0.00 H new ATOM 0 HG SER A 69 7.857 -17.023 -12.613 1.00 0.00 H new ATOM 1095 N SER A 70 5.438 -15.086 -8.208 1.00 0.00 N ATOM 1096 CA SER A 70 4.237 -14.439 -7.693 1.00 0.00 C ATOM 1097 C SER A 70 4.580 -13.116 -7.014 1.00 0.00 C ATOM 1098 O SER A 70 5.493 -13.047 -6.192 1.00 0.00 O ATOM 1099 CB SER A 70 3.519 -15.361 -6.705 1.00 0.00 C ATOM 1100 OG SER A 70 3.243 -16.621 -7.291 1.00 0.00 O ATOM 0 H SER A 70 5.802 -15.833 -7.616 1.00 0.00 H new ATOM 0 HA SER A 70 3.576 -14.234 -8.535 1.00 0.00 H new ATOM 0 HB2 SER A 70 4.135 -15.497 -5.816 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.588 -14.896 -6.380 1.00 0.00 H new ATOM 0 HG SER A 70 2.530 -17.067 -6.787 1.00 0.00 H new ATOM 1106 N SER A 71 3.842 -12.069 -7.366 1.00 0.00 N ATOM 1107 CA SER A 71 4.070 -10.747 -6.795 1.00 0.00 C ATOM 1108 C SER A 71 2.764 -9.963 -6.699 1.00 0.00 C ATOM 1109 O SER A 71 1.740 -10.371 -7.249 1.00 0.00 O ATOM 1110 CB SER A 71 5.082 -9.971 -7.639 1.00 0.00 C ATOM 1111 OG SER A 71 6.151 -10.806 -8.048 1.00 0.00 O ATOM 0 H SER A 71 3.081 -12.110 -8.044 1.00 0.00 H new ATOM 0 HA SER A 71 4.470 -10.878 -5.789 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.586 -9.554 -8.516 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.472 -9.131 -7.064 1.00 0.00 H new ATOM 0 HG SER A 71 6.784 -10.287 -8.587 1.00 0.00 H new ATOM 1117 N LEU A 72 2.807 -8.837 -5.997 1.00 0.00 N ATOM 1118 CA LEU A 72 1.628 -7.994 -5.828 1.00 0.00 C ATOM 1119 C LEU A 72 1.837 -6.629 -6.475 1.00 0.00 C ATOM 1120 O LEU A 72 2.902 -6.027 -6.348 1.00 0.00 O ATOM 1121 CB LEU A 72 1.308 -7.824 -4.342 1.00 0.00 C ATOM 1122 CG LEU A 72 0.080 -6.974 -4.013 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -1.187 -7.809 -4.105 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.214 -6.356 -2.629 1.00 0.00 C ATOM 0 H LEU A 72 3.646 -8.486 -5.535 1.00 0.00 H new ATOM 0 HA LEU A 72 0.788 -8.483 -6.321 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.168 -8.813 -3.906 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.175 -7.379 -3.853 1.00 0.00 H new ATOM 0 HG LEU A 72 0.014 -6.168 -4.744 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.050 -7.187 -3.868 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.290 -8.203 -5.116 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.130 -8.636 -3.397 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.669 -5.755 -2.412 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.306 -7.147 -1.885 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.101 -5.723 -2.597 1.00 0.00 H new ATOM 1136 N GLY A 73 0.811 -6.145 -7.168 1.00 0.00 N ATOM 1137 CA GLY A 73 0.901 -4.853 -7.823 1.00 0.00 C ATOM 1138 C GLY A 73 0.223 -3.753 -7.031 1.00 0.00 C ATOM 1139 O GLY A 73 -0.993 -3.774 -6.842 1.00 0.00 O ATOM 0 H GLY A 73 -0.081 -6.625 -7.288 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.950 -4.596 -7.971 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.446 -4.918 -8.812 1.00 0.00 H new ATOM 1143 N ILE A 74 1.012 -2.790 -6.565 1.00 0.00 N ATOM 1144 CA ILE A 74 0.480 -1.677 -5.788 1.00 0.00 C ATOM 1145 C ILE A 74 0.514 -0.381 -6.591 1.00 0.00 C ATOM 1146 O ILE A 74 1.585 0.147 -6.890 1.00 0.00 O ATOM 1147 CB ILE A 74 1.266 -1.478 -4.479 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.255 -2.764 -3.651 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.682 -0.322 -3.681 1.00 0.00 C ATOM 1150 CD1 ILE A 74 -0.007 -2.947 -2.836 1.00 0.00 C ATOM 0 H ILE A 74 2.021 -2.758 -6.712 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.554 -1.925 -5.547 1.00 0.00 H new ATOM 0 HB ILE A 74 2.300 -1.237 -4.726 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.374 -3.617 -4.319 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.114 -2.762 -2.980 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.248 -0.194 -2.759 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.738 0.593 -4.271 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.360 -0.535 -3.441 1.00 0.00 H new ATOM 0 HD11 ILE A 74 0.055 -3.879 -2.274 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.117 -2.113 -2.143 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.869 -2.981 -3.503 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.665 0.126 -6.934 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.771 1.362 -7.700 1.00 0.00 C ATOM 1164 C ILE A 75 -1.489 2.444 -6.901 1.00 0.00 C ATOM 1165 O ILE A 75 -2.460 2.168 -6.196 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.517 1.140 -9.028 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -0.956 -0.084 -9.755 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.414 2.378 -9.907 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -1.930 -0.706 -10.731 1.00 0.00 C ATOM 0 H ILE A 75 -1.560 -0.300 -6.694 1.00 0.00 H new ATOM 0 HA ILE A 75 0.247 1.687 -7.915 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.570 0.959 -8.810 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.052 0.205 -10.291 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.665 -0.832 -9.018 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.946 2.205 -10.842 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -1.856 3.229 -9.390 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.366 2.587 -10.120 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.465 -1.568 -11.209 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.825 -1.026 -10.198 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.203 0.027 -11.490 1.00 0.00 H new ATOM 1181 N VAL A 76 -1.007 3.677 -7.017 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.605 4.802 -6.307 1.00 0.00 C ATOM 1183 C VAL A 76 -2.031 5.899 -7.277 1.00 0.00 C ATOM 1184 O VAL A 76 -1.195 6.524 -7.930 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.630 5.396 -5.274 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.315 6.479 -4.454 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.079 4.302 -4.371 1.00 0.00 C ATOM 0 H VAL A 76 -0.204 3.923 -7.596 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.483 4.418 -5.788 1.00 0.00 H new ATOM 0 HB VAL A 76 0.205 5.850 -5.808 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.610 6.887 -3.729 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.657 7.275 -5.116 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.169 6.052 -3.929 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.608 4.740 -3.647 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -0.901 3.817 -3.844 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.451 3.565 -4.974 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.336 6.129 -7.365 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.876 7.152 -8.253 1.00 0.00 C ATOM 1199 C LYS A 77 -4.694 8.174 -7.471 1.00 0.00 C ATOM 1200 O LYS A 77 -4.878 8.042 -6.261 1.00 0.00 O ATOM 1201 CB LYS A 77 -4.744 6.509 -9.337 1.00 0.00 C ATOM 1202 CG LYS A 77 -3.943 5.877 -10.462 1.00 0.00 C ATOM 1203 CD LYS A 77 -4.848 5.196 -11.476 1.00 0.00 C ATOM 1204 CE LYS A 77 -5.157 3.763 -11.071 1.00 0.00 C ATOM 1205 NZ LYS A 77 -6.270 3.187 -11.876 1.00 0.00 N ATOM 0 H LYS A 77 -4.041 5.620 -6.831 1.00 0.00 H new ATOM 0 HA LYS A 77 -3.039 7.667 -8.725 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -5.376 5.748 -8.880 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -5.408 7.266 -9.755 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.347 6.642 -10.960 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -3.245 5.149 -10.049 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -5.778 5.757 -11.571 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.370 5.204 -12.455 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.264 3.150 -11.195 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.420 3.733 -10.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.450 2.210 -11.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -7.129 3.757 -11.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.009 3.192 -12.883 1.00 0.00 H new ATOM 1219 N ASP A 78 -5.183 9.193 -8.170 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.984 10.237 -7.542 1.00 0.00 C ATOM 1221 C ASP A 78 -7.468 10.031 -7.830 1.00 0.00 C ATOM 1222 O ASP A 78 -7.934 10.274 -8.943 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.542 11.615 -8.036 1.00 0.00 C ATOM 1224 CG ASP A 78 -4.407 12.190 -7.210 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -4.282 11.809 -6.027 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -3.644 13.019 -7.748 1.00 0.00 O ATOM 0 H ASP A 78 -5.038 9.318 -9.172 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.830 10.180 -6.464 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -5.228 11.541 -9.077 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.391 12.298 -8.007 1.00 0.00 H new ATOM 1231 N PHE A 79 -8.205 9.581 -6.820 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.636 9.340 -6.965 1.00 0.00 C ATOM 1233 C PHE A 79 -10.272 10.382 -7.882 1.00 0.00 C ATOM 1234 O PHE A 79 -11.186 10.075 -8.646 1.00 0.00 O ATOM 1235 CB PHE A 79 -10.320 9.362 -5.597 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.702 8.775 -5.608 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.886 7.402 -5.591 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.818 9.596 -5.636 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -13.157 6.859 -5.602 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -14.091 9.059 -5.647 1.00 0.00 C ATOM 1241 CZ PHE A 79 -14.261 7.688 -5.629 1.00 0.00 C ATOM 0 H PHE A 79 -7.835 9.376 -5.892 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.770 8.356 -7.414 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.706 8.812 -4.884 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.374 10.392 -5.243 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -11.026 6.748 -5.569 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.691 10.668 -5.649 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -13.287 5.787 -5.589 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.952 9.710 -5.670 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.255 7.266 -5.636 1.00 0.00 H new ATOM 1378 N ILE A 88 0.135 8.734 -9.704 1.00 0.00 N ATOM 1379 CA ILE A 88 0.954 9.301 -8.640 1.00 0.00 C ATOM 1380 C ILE A 88 2.208 8.465 -8.407 1.00 0.00 C ATOM 1381 O ILE A 88 3.314 8.997 -8.319 1.00 0.00 O ATOM 1382 CB ILE A 88 0.168 9.407 -7.320 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.994 10.392 -7.471 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.089 9.835 -6.188 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.951 10.381 -6.299 1.00 0.00 C ATOM 0 HA ILE A 88 1.242 10.302 -8.963 1.00 0.00 H new ATOM 0 HB ILE A 88 -0.241 8.426 -7.078 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.593 11.398 -7.593 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.544 10.155 -8.382 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.519 9.905 -5.262 1.00 0.00 H new ATOM 0 HG22 ILE A 88 1.885 9.100 -6.069 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.524 10.807 -6.421 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.749 11.103 -6.474 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -2.380 9.385 -6.189 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.414 10.647 -5.388 1.00 0.00 H new ATOM 1397 N GLY A 89 2.027 7.152 -8.308 1.00 0.00 N ATOM 1398 CA GLY A 89 3.152 6.262 -8.087 1.00 0.00 C ATOM 1399 C GLY A 89 2.732 4.809 -7.989 1.00 0.00 C ATOM 1400 O GLY A 89 1.601 4.506 -7.609 1.00 0.00 O ATOM 0 H GLY A 89 1.121 6.688 -8.377 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.867 6.376 -8.902 1.00 0.00 H new ATOM 0 HA3 GLY A 89 3.665 6.551 -7.170 1.00 0.00 H new ATOM 1404 N THR A 90 3.645 3.906 -8.334 1.00 0.00 N ATOM 1405 CA THR A 90 3.363 2.477 -8.286 1.00 0.00 C ATOM 1406 C THR A 90 4.536 1.705 -7.693 1.00 0.00 C ATOM 1407 O THR A 90 5.656 2.210 -7.632 1.00 0.00 O ATOM 1408 CB THR A 90 3.052 1.919 -9.687 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.203 2.042 -10.530 1.00 0.00 O ATOM 1410 CG2 THR A 90 1.877 2.654 -10.314 1.00 0.00 C ATOM 0 H THR A 90 4.586 4.140 -8.650 1.00 0.00 H new ATOM 0 HA THR A 90 2.488 2.349 -7.649 1.00 0.00 H new ATOM 0 HB THR A 90 2.788 0.866 -9.584 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.549 2.957 -10.479 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.676 2.242 -11.303 1.00 0.00 H new ATOM 0 HG22 THR A 90 0.995 2.534 -9.685 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.117 3.714 -10.404 1.00 0.00 H new ATOM 1418 N ALA A 91 4.270 0.478 -7.257 1.00 0.00 N ATOM 1419 CA ALA A 91 5.305 -0.365 -6.671 1.00 0.00 C ATOM 1420 C ALA A 91 4.893 -1.833 -6.689 1.00 0.00 C ATOM 1421 O ALA A 91 3.729 -2.166 -6.460 1.00 0.00 O ATOM 1422 CB ALA A 91 5.607 0.082 -5.248 1.00 0.00 C ATOM 0 H ALA A 91 3.347 0.046 -7.298 1.00 0.00 H new ATOM 0 HA ALA A 91 6.208 -0.260 -7.273 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.382 -0.556 -4.823 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.953 1.116 -5.257 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.703 0.007 -4.644 1.00 0.00 H new ATOM 1428 N THR A 92 5.854 -2.710 -6.965 1.00 0.00 N ATOM 1429 CA THR A 92 5.590 -4.142 -7.016 1.00 0.00 C ATOM 1430 C THR A 92 6.321 -4.875 -5.897 1.00 0.00 C ATOM 1431 O THR A 92 7.545 -4.796 -5.785 1.00 0.00 O ATOM 1432 CB THR A 92 6.012 -4.743 -8.370 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.427 -3.995 -9.441 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.587 -6.201 -8.470 1.00 0.00 C ATOM 0 H THR A 92 6.822 -2.453 -7.157 1.00 0.00 H new ATOM 0 HA THR A 92 4.515 -4.271 -6.890 1.00 0.00 H new ATOM 0 HB THR A 92 7.098 -4.692 -8.444 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.701 -4.382 -10.298 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.895 -6.605 -9.434 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.057 -6.773 -7.670 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.503 -6.271 -8.377 1.00 0.00 H new ATOM 1442 N VAL A 93 5.564 -5.590 -5.070 1.00 0.00 N ATOM 1443 CA VAL A 93 6.141 -6.340 -3.961 1.00 0.00 C ATOM 1444 C VAL A 93 6.244 -7.824 -4.295 1.00 0.00 C ATOM 1445 O VAL A 93 5.233 -8.517 -4.404 1.00 0.00 O ATOM 1446 CB VAL A 93 5.309 -6.170 -2.676 1.00 0.00 C ATOM 1447 CG1 VAL A 93 6.116 -6.592 -1.458 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.831 -4.733 -2.537 1.00 0.00 C ATOM 0 H VAL A 93 4.550 -5.665 -5.147 1.00 0.00 H new ATOM 0 HA VAL A 93 7.141 -5.939 -3.794 1.00 0.00 H new ATOM 0 HB VAL A 93 4.433 -6.815 -2.743 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.512 -6.465 -0.560 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.404 -7.639 -1.557 1.00 0.00 H new ATOM 0 HG13 VAL A 93 7.012 -5.975 -1.383 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.245 -4.631 -1.624 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.692 -4.066 -2.492 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.213 -4.470 -3.396 1.00 0.00 H new ATOM 1458 N ALA A 94 7.472 -8.305 -4.455 1.00 0.00 N ATOM 1459 CA ALA A 94 7.707 -9.708 -4.773 1.00 0.00 C ATOM 1460 C ALA A 94 7.347 -10.607 -3.595 1.00 0.00 C ATOM 1461 O ALA A 94 7.949 -10.515 -2.525 1.00 0.00 O ATOM 1462 CB ALA A 94 9.159 -9.921 -5.178 1.00 0.00 C ATOM 0 H ALA A 94 8.320 -7.744 -4.370 1.00 0.00 H new ATOM 0 HA ALA A 94 7.064 -9.977 -5.611 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.321 -10.973 -5.413 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.385 -9.315 -6.055 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.813 -9.628 -4.356 1.00 0.00 H new ATOM 1468 N LEU A 95 6.362 -11.474 -3.798 1.00 0.00 N ATOM 1469 CA LEU A 95 5.921 -12.390 -2.752 1.00 0.00 C ATOM 1470 C LEU A 95 6.897 -13.552 -2.598 1.00 0.00 C ATOM 1471 O LEU A 95 6.633 -14.506 -1.866 1.00 0.00 O ATOM 1472 CB LEU A 95 4.522 -12.922 -3.069 1.00 0.00 C ATOM 1473 CG LEU A 95 3.437 -11.867 -3.291 1.00 0.00 C ATOM 1474 CD1 LEU A 95 2.250 -12.470 -4.026 1.00 0.00 C ATOM 1475 CD2 LEU A 95 2.997 -11.268 -1.963 1.00 0.00 C ATOM 0 H LEU A 95 5.853 -11.562 -4.678 1.00 0.00 H new ATOM 0 HA LEU A 95 5.889 -11.840 -1.812 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.585 -13.543 -3.963 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.208 -13.571 -2.251 1.00 0.00 H new ATOM 0 HG LEU A 95 3.852 -11.069 -3.907 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.488 -11.705 -4.175 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.576 -12.851 -4.994 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.834 -13.287 -3.436 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.225 -10.519 -2.140 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.599 -12.055 -1.323 1.00 0.00 H new ATOM 0 HD23 LEU A 95 3.851 -10.800 -1.474 1.00 0.00 H new ATOM 1487 N LYS A 96 8.027 -13.464 -3.292 1.00 0.00 N ATOM 1488 CA LYS A 96 9.045 -14.506 -3.231 1.00 0.00 C ATOM 1489 C LYS A 96 9.649 -14.595 -1.833 1.00 0.00 C ATOM 1490 O LYS A 96 10.408 -15.517 -1.532 1.00 0.00 O ATOM 1491 CB LYS A 96 10.147 -14.232 -4.257 1.00 0.00 C ATOM 1492 CG LYS A 96 11.120 -13.147 -3.829 1.00 0.00 C ATOM 1493 CD LYS A 96 12.412 -13.211 -4.627 1.00 0.00 C ATOM 1494 CE LYS A 96 13.129 -11.869 -4.634 1.00 0.00 C ATOM 1495 NZ LYS A 96 14.426 -11.938 -5.364 1.00 0.00 N ATOM 0 H LYS A 96 8.261 -12.682 -3.903 1.00 0.00 H new ATOM 0 HA LYS A 96 8.569 -15.458 -3.464 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.700 -15.153 -4.438 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.688 -13.944 -5.203 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.657 -12.169 -3.962 1.00 0.00 H new ATOM 0 HG3 LYS A 96 11.341 -13.254 -2.767 1.00 0.00 H new ATOM 0 HD2 LYS A 96 13.066 -13.972 -4.202 1.00 0.00 H new ATOM 0 HD3 LYS A 96 12.194 -13.514 -5.651 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.490 -11.118 -5.099 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.306 -11.546 -3.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 14.884 -11.005 -5.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 15.046 -12.636 -4.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.255 -12.221 -6.350 1.00 0.00 H new ATOM 1509 N ASP A 97 9.306 -13.634 -0.983 1.00 0.00 N ATOM 1510 CA ASP A 97 9.813 -13.605 0.385 1.00 0.00 C ATOM 1511 C ASP A 97 8.903 -14.399 1.317 1.00 0.00 C ATOM 1512 O ASP A 97 9.368 -15.017 2.276 1.00 0.00 O ATOM 1513 CB ASP A 97 9.934 -12.162 0.877 1.00 0.00 C ATOM 1514 CG ASP A 97 11.283 -11.551 0.552 1.00 0.00 C ATOM 1515 OD1 ASP A 97 11.736 -11.692 -0.604 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.885 -10.931 1.453 1.00 0.00 O ATOM 0 H ASP A 97 8.679 -12.864 -1.216 1.00 0.00 H new ATOM 0 HA ASP A 97 10.801 -14.066 0.391 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.147 -11.559 0.424 1.00 0.00 H new ATOM 0 HB3 ASP A 97 9.776 -12.134 1.955 1.00 0.00 H new ATOM 1521 N LEU A 98 7.607 -14.377 1.031 1.00 0.00 N ATOM 1522 CA LEU A 98 6.631 -15.094 1.845 1.00 0.00 C ATOM 1523 C LEU A 98 6.575 -16.568 1.456 1.00 0.00 C ATOM 1524 O LEU A 98 6.152 -17.414 2.244 1.00 0.00 O ATOM 1525 CB LEU A 98 5.246 -14.462 1.691 1.00 0.00 C ATOM 1526 CG LEU A 98 5.198 -12.934 1.734 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.043 -12.413 0.892 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.078 -12.444 3.169 1.00 0.00 C ATOM 0 H LEU A 98 7.207 -13.870 0.241 1.00 0.00 H new ATOM 0 HA LEU A 98 6.942 -15.023 2.887 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.821 -14.793 0.743 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.602 -14.848 2.481 1.00 0.00 H new ATOM 0 HG LEU A 98 6.128 -12.548 1.317 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.024 -11.324 0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.173 -12.734 -0.142 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.104 -12.807 1.279 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.045 -11.355 3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.164 -12.839 3.613 1.00 0.00 H new ATOM 0 HD23 LEU A 98 5.938 -12.787 3.744 1.00 0.00 H new ATOM 1540 N THR A 99 7.007 -16.869 0.235 1.00 0.00 N ATOM 1541 CA THR A 99 7.007 -18.240 -0.259 1.00 0.00 C ATOM 1542 C THR A 99 7.512 -19.208 0.805 1.00 0.00 C ATOM 1543 O THR A 99 8.483 -18.924 1.506 1.00 0.00 O ATOM 1544 CB THR A 99 7.879 -18.383 -1.521 1.00 0.00 C ATOM 1545 OG1 THR A 99 9.157 -17.774 -1.305 1.00 0.00 O ATOM 1546 CG2 THR A 99 7.202 -17.739 -2.722 1.00 0.00 C ATOM 0 H THR A 99 7.361 -16.181 -0.430 1.00 0.00 H new ATOM 0 HA THR A 99 5.975 -18.485 -0.509 1.00 0.00 H new ATOM 0 HB THR A 99 8.013 -19.445 -1.725 1.00 0.00 H new ATOM 0 HG1 THR A 99 9.225 -16.957 -1.842 1.00 0.00 H new ATOM 0 HG21 THR A 99 7.836 -17.852 -3.601 1.00 0.00 H new ATOM 0 HG22 THR A 99 6.242 -18.224 -2.902 1.00 0.00 H new ATOM 0 HG23 THR A 99 7.042 -16.679 -2.524 1.00 0.00 H new ATOM 1554 N GLY A 100 6.846 -20.353 0.922 1.00 0.00 N ATOM 1555 CA GLY A 100 7.243 -21.345 1.903 1.00 0.00 C ATOM 1556 C GLY A 100 6.129 -22.323 2.223 1.00 0.00 C ATOM 1557 O GLY A 100 5.166 -22.445 1.466 1.00 0.00 O ATOM 0 H GLY A 100 6.039 -20.611 0.355 1.00 0.00 H new ATOM 0 HA2 GLY A 100 8.108 -21.894 1.531 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.555 -20.842 2.818 1.00 0.00 H new ATOM 1561 N ASP A 101 6.261 -23.022 3.345 1.00 0.00 N ATOM 1562 CA ASP A 101 5.258 -23.994 3.762 1.00 0.00 C ATOM 1563 C ASP A 101 4.716 -23.655 5.147 1.00 0.00 C ATOM 1564 O ASP A 101 4.464 -24.544 5.960 1.00 0.00 O ATOM 1565 CB ASP A 101 5.853 -25.403 3.765 1.00 0.00 C ATOM 1566 CG ASP A 101 6.233 -25.874 2.375 1.00 0.00 C ATOM 1567 OD1 ASP A 101 5.648 -25.365 1.396 1.00 0.00 O ATOM 1568 OD2 ASP A 101 7.114 -26.752 2.266 1.00 0.00 O ATOM 0 H ASP A 101 7.053 -22.933 3.982 1.00 0.00 H new ATOM 0 HA ASP A 101 4.434 -23.957 3.050 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.735 -25.420 4.405 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.132 -26.098 4.196 1.00 0.00 H new ATOM 1573 N GLN A 102 4.540 -22.363 5.408 1.00 0.00 N ATOM 1574 CA GLN A 102 4.030 -21.907 6.696 1.00 0.00 C ATOM 1575 C GLN A 102 3.775 -20.404 6.678 1.00 0.00 C ATOM 1576 O GLN A 102 4.581 -19.634 6.155 1.00 0.00 O ATOM 1577 CB GLN A 102 5.016 -22.257 7.812 1.00 0.00 C ATOM 1578 CG GLN A 102 6.229 -21.343 7.860 1.00 0.00 C ATOM 1579 CD GLN A 102 7.381 -21.944 8.641 1.00 0.00 C ATOM 1580 OE1 GLN A 102 7.860 -23.033 8.325 1.00 0.00 O ATOM 1581 NE2 GLN A 102 7.834 -21.234 9.669 1.00 0.00 N ATOM 0 H GLN A 102 4.743 -21.615 4.745 1.00 0.00 H new ATOM 0 HA GLN A 102 3.084 -22.415 6.885 1.00 0.00 H new ATOM 0 HB2 GLN A 102 4.499 -22.211 8.770 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.351 -23.286 7.680 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.557 -21.127 6.843 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.945 -20.392 8.312 1.00 0.00 H new ATOM 0 HE21 GLN A 102 7.407 -20.336 9.896 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.608 -21.587 10.231 1.00 0.00 H new ATOM 1590 N SER A 103 2.650 -19.992 7.254 1.00 0.00 N ATOM 1591 CA SER A 103 2.287 -18.581 7.301 1.00 0.00 C ATOM 1592 C SER A 103 3.529 -17.705 7.442 1.00 0.00 C ATOM 1593 O SER A 103 4.313 -17.867 8.377 1.00 0.00 O ATOM 1594 CB SER A 103 1.329 -18.317 8.465 1.00 0.00 C ATOM 1595 OG SER A 103 1.464 -16.991 8.946 1.00 0.00 O ATOM 0 H SER A 103 1.974 -20.616 7.695 1.00 0.00 H new ATOM 0 HA SER A 103 1.789 -18.328 6.365 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.302 -18.487 8.141 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.529 -19.022 9.272 1.00 0.00 H new ATOM 0 HG SER A 103 0.840 -16.847 9.688 1.00 0.00 H new ATOM 1601 N ARG A 104 3.700 -16.778 6.505 1.00 0.00 N ATOM 1602 CA ARG A 104 4.846 -15.877 6.523 1.00 0.00 C ATOM 1603 C ARG A 104 4.419 -14.447 6.201 1.00 0.00 C ATOM 1604 O ARG A 104 3.921 -14.168 5.111 1.00 0.00 O ATOM 1605 CB ARG A 104 5.903 -16.342 5.520 1.00 0.00 C ATOM 1606 CG ARG A 104 7.327 -16.019 5.942 1.00 0.00 C ATOM 1607 CD ARG A 104 8.333 -16.452 4.887 1.00 0.00 C ATOM 1608 NE ARG A 104 9.659 -16.678 5.454 1.00 0.00 N ATOM 1609 CZ ARG A 104 9.998 -17.779 6.115 1.00 0.00 C ATOM 1610 NH1 ARG A 104 9.112 -18.750 6.290 1.00 0.00 N ATOM 1611 NH2 ARG A 104 11.225 -17.912 6.602 1.00 0.00 N ATOM 0 H ARG A 104 3.060 -16.631 5.724 1.00 0.00 H new ATOM 0 HA ARG A 104 5.273 -15.894 7.526 1.00 0.00 H new ATOM 0 HB2 ARG A 104 5.810 -17.419 5.380 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.705 -15.877 4.554 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.421 -14.947 6.118 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.550 -16.518 6.885 1.00 0.00 H new ATOM 0 HD2 ARG A 104 7.984 -17.366 4.407 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.396 -15.689 4.111 1.00 0.00 H new ATOM 0 HE ARG A 104 10.364 -15.950 5.336 1.00 0.00 H new ATOM 0 HH11 ARG A 104 8.168 -18.652 5.917 1.00 0.00 H new ATOM 0 HH12 ARG A 104 9.375 -19.595 6.798 1.00 0.00 H new ATOM 0 HH21 ARG A 104 11.910 -17.168 6.469 1.00 0.00 H new ATOM 0 HH22 ARG A 104 11.483 -18.758 7.109 1.00 0.00 H new ATOM 1625 N SER A 105 4.618 -13.546 7.158 1.00 0.00 N ATOM 1626 CA SER A 105 4.249 -12.147 6.979 1.00 0.00 C ATOM 1627 C SER A 105 5.484 -11.251 7.015 1.00 0.00 C ATOM 1628 O SER A 105 6.089 -11.050 8.070 1.00 0.00 O ATOM 1629 CB SER A 105 3.260 -11.715 8.063 1.00 0.00 C ATOM 1630 OG SER A 105 3.853 -11.775 9.348 1.00 0.00 O ATOM 0 H SER A 105 5.033 -13.760 8.065 1.00 0.00 H new ATOM 0 HA SER A 105 3.774 -12.044 6.003 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.918 -10.699 7.864 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.381 -12.358 8.035 1.00 0.00 H new ATOM 0 HG SER A 105 4.824 -11.669 9.266 1.00 0.00 H new ATOM 1636 N LEU A 106 5.852 -10.716 5.857 1.00 0.00 N ATOM 1637 CA LEU A 106 7.015 -9.841 5.755 1.00 0.00 C ATOM 1638 C LEU A 106 6.589 -8.382 5.618 1.00 0.00 C ATOM 1639 O LEU A 106 5.864 -8.006 4.697 1.00 0.00 O ATOM 1640 CB LEU A 106 7.879 -10.246 4.559 1.00 0.00 C ATOM 1641 CG LEU A 106 8.688 -11.533 4.721 1.00 0.00 C ATOM 1642 CD1 LEU A 106 10.066 -11.230 5.288 1.00 0.00 C ATOM 1643 CD2 LEU A 106 7.948 -12.519 5.613 1.00 0.00 C ATOM 0 H LEU A 106 5.363 -10.872 4.976 1.00 0.00 H new ATOM 0 HA LEU A 106 7.599 -9.946 6.670 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.232 -10.355 3.689 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.570 -9.431 4.343 1.00 0.00 H new ATOM 0 HG LEU A 106 8.814 -11.986 3.738 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.627 -12.158 5.396 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.598 -10.561 4.612 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.962 -10.753 6.263 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.538 -13.429 5.717 1.00 0.00 H new ATOM 0 HD22 LEU A 106 7.791 -12.074 6.595 1.00 0.00 H new ATOM 0 HD23 LEU A 106 6.984 -12.761 5.166 1.00 0.00 H new ATOM 1655 N PRO A 107 7.051 -7.540 6.554 1.00 0.00 N ATOM 1656 CA PRO A 107 6.732 -6.109 6.558 1.00 0.00 C ATOM 1657 C PRO A 107 7.408 -5.362 5.413 1.00 0.00 C ATOM 1658 O PRO A 107 8.619 -5.143 5.431 1.00 0.00 O ATOM 1659 CB PRO A 107 7.277 -5.628 7.905 1.00 0.00 C ATOM 1660 CG PRO A 107 8.357 -6.596 8.244 1.00 0.00 C ATOM 1661 CD PRO A 107 7.919 -7.920 7.681 1.00 0.00 C ATOM 0 HA PRO A 107 5.665 -5.929 6.425 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.664 -4.611 7.835 1.00 0.00 H new ATOM 0 HB3 PRO A 107 6.498 -5.621 8.667 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.309 -6.285 7.814 1.00 0.00 H new ATOM 0 HG3 PRO A 107 8.500 -6.659 9.323 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.769 -8.517 7.350 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.381 -8.513 8.421 1.00 0.00 H new ATOM 1669 N TYR A 108 6.617 -4.973 4.419 1.00 0.00 N ATOM 1670 CA TYR A 108 7.139 -4.251 3.265 1.00 0.00 C ATOM 1671 C TYR A 108 6.941 -2.747 3.427 1.00 0.00 C ATOM 1672 O TYR A 108 5.848 -2.225 3.209 1.00 0.00 O ATOM 1673 CB TYR A 108 6.454 -4.732 1.984 1.00 0.00 C ATOM 1674 CG TYR A 108 6.667 -6.201 1.698 1.00 0.00 C ATOM 1675 CD1 TYR A 108 7.804 -6.642 1.033 1.00 0.00 C ATOM 1676 CD2 TYR A 108 5.731 -7.149 2.093 1.00 0.00 C ATOM 1677 CE1 TYR A 108 8.003 -7.984 0.769 1.00 0.00 C ATOM 1678 CE2 TYR A 108 5.922 -8.492 1.835 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.059 -8.905 1.173 1.00 0.00 C ATOM 1680 OH TYR A 108 7.252 -10.242 0.912 1.00 0.00 O ATOM 0 H TYR A 108 5.612 -5.146 4.389 1.00 0.00 H new ATOM 0 HA TYR A 108 8.208 -4.452 3.196 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.384 -4.536 2.059 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.827 -4.149 1.142 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.546 -5.923 0.717 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.839 -6.830 2.611 1.00 0.00 H new ATOM 0 HE1 TYR A 108 8.892 -8.310 0.250 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.185 -9.215 2.150 1.00 0.00 H new ATOM 0 HH TYR A 108 6.517 -10.576 0.357 1.00 0.00 H new ATOM 1690 N LYS A 109 8.009 -2.055 3.810 1.00 0.00 N ATOM 1691 CA LYS A 109 7.956 -0.610 4.000 1.00 0.00 C ATOM 1692 C LYS A 109 9.031 0.087 3.173 1.00 0.00 C ATOM 1693 O LYS A 109 9.813 -0.563 2.477 1.00 0.00 O ATOM 1694 CB LYS A 109 8.132 -0.263 5.481 1.00 0.00 C ATOM 1695 CG LYS A 109 7.496 -1.272 6.421 1.00 0.00 C ATOM 1696 CD LYS A 109 7.074 -0.626 7.730 1.00 0.00 C ATOM 1697 CE LYS A 109 7.133 -1.614 8.884 1.00 0.00 C ATOM 1698 NZ LYS A 109 8.477 -1.639 9.525 1.00 0.00 N ATOM 0 H LYS A 109 8.922 -2.471 3.995 1.00 0.00 H new ATOM 0 HA LYS A 109 6.980 -0.260 3.664 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.196 -0.191 5.705 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.699 0.720 5.669 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.628 -1.722 5.940 1.00 0.00 H new ATOM 0 HG3 LYS A 109 8.202 -2.078 6.623 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.723 0.223 7.943 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.060 -0.237 7.635 1.00 0.00 H new ATOM 0 HE2 LYS A 109 6.381 -1.349 9.627 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.885 -2.611 8.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 8.476 -2.325 10.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 9.192 -1.916 8.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 8.703 -0.693 9.894 1.00 0.00 H new ATOM 1712 N LEU A 110 9.067 1.412 3.254 1.00 0.00 N ATOM 1713 CA LEU A 110 10.048 2.198 2.514 1.00 0.00 C ATOM 1714 C LEU A 110 10.042 1.824 1.035 1.00 0.00 C ATOM 1715 O LEU A 110 11.092 1.769 0.394 1.00 0.00 O ATOM 1716 CB LEU A 110 11.446 1.987 3.099 1.00 0.00 C ATOM 1717 CG LEU A 110 11.551 2.042 4.623 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.739 1.224 5.106 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.664 3.483 5.099 1.00 0.00 C ATOM 0 H LEU A 110 8.428 1.965 3.825 1.00 0.00 H new ATOM 0 HA LEU A 110 9.777 3.250 2.605 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.816 1.018 2.764 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.111 2.743 2.681 1.00 0.00 H new ATOM 0 HG LEU A 110 10.643 1.611 5.046 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.798 1.275 6.193 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.616 0.186 4.797 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.656 1.624 4.674 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.738 3.502 6.186 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.554 3.940 4.667 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.781 4.040 4.785 1.00 0.00 H new ATOM 1731 N ILE A 111 8.852 1.571 0.500 1.00 0.00 N ATOM 1732 CA ILE A 111 8.709 1.206 -0.904 1.00 0.00 C ATOM 1733 C ILE A 111 8.730 2.441 -1.798 1.00 0.00 C ATOM 1734 O ILE A 111 7.886 3.327 -1.669 1.00 0.00 O ATOM 1735 CB ILE A 111 7.404 0.427 -1.153 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.410 -0.886 -0.368 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.222 0.160 -2.640 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.104 -1.644 -0.449 1.00 0.00 C ATOM 0 H ILE A 111 7.974 1.612 1.017 1.00 0.00 H new ATOM 0 HA ILE A 111 9.557 0.567 -1.152 1.00 0.00 H new ATOM 0 HB ILE A 111 6.566 1.032 -0.807 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.213 -1.521 -0.743 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.633 -0.674 0.678 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.295 -0.391 -2.800 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.178 1.107 -3.177 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.062 -0.428 -3.010 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.181 -2.564 0.131 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.300 -1.028 -0.047 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.889 -1.888 -1.489 1.00 0.00 H new ATOM 1750 N SER A 112 9.699 2.491 -2.707 1.00 0.00 N ATOM 1751 CA SER A 112 9.831 3.618 -3.622 1.00 0.00 C ATOM 1752 C SER A 112 8.815 3.519 -4.756 1.00 0.00 C ATOM 1753 O SER A 112 8.869 2.600 -5.575 1.00 0.00 O ATOM 1754 CB SER A 112 11.248 3.674 -4.195 1.00 0.00 C ATOM 1755 OG SER A 112 11.790 2.373 -4.344 1.00 0.00 O ATOM 0 H SER A 112 10.404 1.764 -2.829 1.00 0.00 H new ATOM 0 HA SER A 112 9.637 4.533 -3.062 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.233 4.178 -5.161 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.886 4.264 -3.538 1.00 0.00 H new ATOM 0 HG SER A 112 12.695 2.436 -4.713 1.00 0.00 H new ATOM 1761 N LEU A 113 7.890 4.472 -4.798 1.00 0.00 N ATOM 1762 CA LEU A 113 6.861 4.494 -5.832 1.00 0.00 C ATOM 1763 C LEU A 113 7.393 5.118 -7.118 1.00 0.00 C ATOM 1764 O LEU A 113 8.040 6.166 -7.090 1.00 0.00 O ATOM 1765 CB LEU A 113 5.636 5.269 -5.343 1.00 0.00 C ATOM 1766 CG LEU A 113 4.894 4.669 -4.149 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.952 5.694 -3.536 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.129 3.422 -4.568 1.00 0.00 C ATOM 0 H LEU A 113 7.831 5.239 -4.128 1.00 0.00 H new ATOM 0 HA LEU A 113 6.571 3.465 -6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.951 6.278 -5.079 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.934 5.361 -6.172 1.00 0.00 H new ATOM 0 HG LEU A 113 5.628 4.384 -3.395 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.432 5.249 -2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.524 6.558 -3.199 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.223 6.010 -4.282 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.607 3.008 -3.705 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.405 3.682 -5.340 1.00 0.00 H new ATOM 0 HD23 LEU A 113 4.827 2.681 -4.959 1.00 0.00 H new ATOM 1780 N LEU A 114 7.116 4.469 -8.243 1.00 0.00 N ATOM 1781 CA LEU A 114 7.565 4.962 -9.541 1.00 0.00 C ATOM 1782 C LEU A 114 6.379 5.217 -10.466 1.00 0.00 C ATOM 1783 O LEU A 114 5.304 4.647 -10.285 1.00 0.00 O ATOM 1784 CB LEU A 114 8.524 3.960 -10.185 1.00 0.00 C ATOM 1785 CG LEU A 114 9.440 3.196 -9.228 1.00 0.00 C ATOM 1786 CD1 LEU A 114 10.169 2.082 -9.962 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.433 4.144 -8.571 1.00 0.00 C ATOM 0 H LEU A 114 6.583 3.600 -8.283 1.00 0.00 H new ATOM 0 HA LEU A 114 8.088 5.905 -9.383 1.00 0.00 H new ATOM 0 HB2 LEU A 114 7.936 3.236 -10.749 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.146 4.494 -10.903 1.00 0.00 H new ATOM 0 HG LEU A 114 8.826 2.747 -8.448 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.816 1.550 -9.265 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.442 1.388 -10.385 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.772 2.508 -10.764 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.077 3.584 -7.893 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.042 4.622 -9.338 1.00 0.00 H new ATOM 0 HD23 LEU A 114 9.892 4.906 -8.010 1.00 0.00 H new ATOM 1799 N ASN A 115 6.585 6.075 -11.460 1.00 0.00 N ATOM 1800 CA ASN A 115 5.533 6.404 -12.416 1.00 0.00 C ATOM 1801 C ASN A 115 5.521 5.411 -13.574 1.00 0.00 C ATOM 1802 O ASN A 115 6.337 4.491 -13.624 1.00 0.00 O ATOM 1803 CB ASN A 115 5.727 7.825 -12.950 1.00 0.00 C ATOM 1804 CG ASN A 115 7.019 7.979 -13.728 1.00 0.00 C ATOM 1805 OD1 ASN A 115 7.630 6.993 -14.140 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.441 9.221 -13.932 1.00 0.00 N ATOM 0 H ASN A 115 7.470 6.555 -11.625 1.00 0.00 H new ATOM 0 HA ASN A 115 4.575 6.345 -11.900 1.00 0.00 H new ATOM 0 HB2 ASN A 115 4.886 8.087 -13.592 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.722 8.527 -12.116 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.304 9.388 -14.449 1.00 0.00 H new ATOM 0 HD22 ASN A 115 6.902 10.008 -13.572 1.00 0.00 H new ATOM 1813 N GLU A 116 4.590 5.605 -14.503 1.00 0.00 N ATOM 1814 CA GLU A 116 4.472 4.726 -15.660 1.00 0.00 C ATOM 1815 C GLU A 116 5.748 4.751 -16.496 1.00 0.00 C ATOM 1816 O GLU A 116 5.950 3.907 -17.369 1.00 0.00 O ATOM 1817 CB GLU A 116 3.277 5.139 -16.522 1.00 0.00 C ATOM 1818 CG GLU A 116 3.530 6.382 -17.358 1.00 0.00 C ATOM 1819 CD GLU A 116 2.247 7.033 -17.838 1.00 0.00 C ATOM 1820 OE1 GLU A 116 1.573 7.692 -17.019 1.00 0.00 O ATOM 1821 OE2 GLU A 116 1.919 6.884 -19.034 1.00 0.00 O ATOM 0 H GLU A 116 3.907 6.362 -14.477 1.00 0.00 H new ATOM 0 HA GLU A 116 4.316 3.710 -15.297 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.015 4.314 -17.184 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.417 5.315 -15.876 1.00 0.00 H new ATOM 0 HG2 GLU A 116 4.100 7.101 -16.770 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.143 6.117 -18.219 1.00 0.00 H new ATOM 1828 N LYS A 117 6.608 5.727 -16.222 1.00 0.00 N ATOM 1829 CA LYS A 117 7.866 5.864 -16.946 1.00 0.00 C ATOM 1830 C LYS A 117 8.992 5.130 -16.224 1.00 0.00 C ATOM 1831 O LYS A 117 10.000 4.770 -16.831 1.00 0.00 O ATOM 1832 CB LYS A 117 8.227 7.343 -17.106 1.00 0.00 C ATOM 1833 CG LYS A 117 7.350 8.078 -18.104 1.00 0.00 C ATOM 1834 CD LYS A 117 7.752 7.765 -19.536 1.00 0.00 C ATOM 1835 CE LYS A 117 7.120 8.740 -20.518 1.00 0.00 C ATOM 1836 NZ LYS A 117 7.837 10.044 -20.544 1.00 0.00 N ATOM 0 H LYS A 117 6.456 6.435 -15.503 1.00 0.00 H new ATOM 0 HA LYS A 117 7.740 5.418 -17.933 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.150 7.834 -16.136 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.267 7.422 -17.421 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.308 7.799 -17.948 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.422 9.152 -17.931 1.00 0.00 H new ATOM 0 HD2 LYS A 117 8.837 7.807 -19.628 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.450 6.748 -19.786 1.00 0.00 H new ATOM 0 HE2 LYS A 117 7.124 8.303 -21.517 1.00 0.00 H new ATOM 0 HE3 LYS A 117 6.077 8.904 -20.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.376 10.680 -21.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 7.811 10.473 -19.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 8.826 9.891 -20.828 1.00 0.00 H new ATOM 1850 N GLY A 118 8.812 4.910 -14.926 1.00 0.00 N ATOM 1851 CA GLY A 118 9.821 4.219 -14.144 1.00 0.00 C ATOM 1852 C GLY A 118 10.707 5.172 -13.368 1.00 0.00 C ATOM 1853 O GLY A 118 11.810 4.810 -12.959 1.00 0.00 O ATOM 0 H GLY A 118 7.986 5.198 -14.402 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.333 3.535 -13.450 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.438 3.613 -14.807 1.00 0.00 H new ATOM 1857 N GLN A 119 10.225 6.394 -13.166 1.00 0.00 N ATOM 1858 CA GLN A 119 10.984 7.403 -12.436 1.00 0.00 C ATOM 1859 C GLN A 119 10.543 7.466 -10.977 1.00 0.00 C ATOM 1860 O GLN A 119 9.348 7.481 -10.680 1.00 0.00 O ATOM 1861 CB GLN A 119 10.813 8.774 -13.092 1.00 0.00 C ATOM 1862 CG GLN A 119 11.506 8.893 -14.440 1.00 0.00 C ATOM 1863 CD GLN A 119 12.991 9.167 -14.311 1.00 0.00 C ATOM 1864 OE1 GLN A 119 13.546 9.141 -13.212 1.00 0.00 O ATOM 1865 NE2 GLN A 119 13.645 9.431 -15.436 1.00 0.00 N ATOM 0 H GLN A 119 9.313 6.709 -13.497 1.00 0.00 H new ATOM 0 HA GLN A 119 12.037 7.122 -12.467 1.00 0.00 H new ATOM 0 HB2 GLN A 119 9.750 8.976 -13.220 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.205 9.540 -12.422 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.358 7.971 -15.003 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.041 9.695 -15.014 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.146 9.442 -16.325 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.647 9.622 -15.411 1.00 0.00 H new ATOM 1874 N ASP A 120 11.514 7.502 -10.072 1.00 0.00 N ATOM 1875 CA ASP A 120 11.225 7.564 -8.643 1.00 0.00 C ATOM 1876 C ASP A 120 10.439 8.826 -8.302 1.00 0.00 C ATOM 1877 O ASP A 120 10.983 9.931 -8.306 1.00 0.00 O ATOM 1878 CB ASP A 120 12.525 7.525 -7.837 1.00 0.00 C ATOM 1879 CG ASP A 120 13.653 8.272 -8.520 1.00 0.00 C ATOM 1880 OD1 ASP A 120 13.363 9.223 -9.275 1.00 0.00 O ATOM 1881 OD2 ASP A 120 14.827 7.904 -8.301 1.00 0.00 O ATOM 0 H ASP A 120 12.508 7.489 -10.301 1.00 0.00 H new ATOM 0 HA ASP A 120 10.618 6.698 -8.382 1.00 0.00 H new ATOM 0 HB2 ASP A 120 12.351 7.958 -6.852 1.00 0.00 H new ATOM 0 HB3 ASP A 120 12.822 6.488 -7.682 1.00 0.00 H new ATOM 1886 N THR A 121 9.154 8.654 -8.007 1.00 0.00 N ATOM 1887 CA THR A 121 8.291 9.779 -7.666 1.00 0.00 C ATOM 1888 C THR A 121 8.696 10.397 -6.333 1.00 0.00 C ATOM 1889 O THR A 121 8.463 11.581 -6.091 1.00 0.00 O ATOM 1890 CB THR A 121 6.813 9.351 -7.593 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.623 8.427 -6.516 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.370 8.712 -8.900 1.00 0.00 C ATOM 0 H THR A 121 8.688 7.747 -7.997 1.00 0.00 H new ATOM 0 HA THR A 121 8.408 10.519 -8.457 1.00 0.00 H new ATOM 0 HB THR A 121 6.208 10.241 -7.418 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.172 7.630 -6.668 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.323 8.418 -8.825 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.488 9.428 -9.713 1.00 0.00 H new ATOM 0 HG23 THR A 121 6.981 7.832 -9.100 1.00 0.00 H new ATOM 1900 N GLY A 122 9.305 9.588 -5.471 1.00 0.00 N ATOM 1901 CA GLY A 122 9.733 10.075 -4.172 1.00 0.00 C ATOM 1902 C GLY A 122 8.710 9.805 -3.086 1.00 0.00 C ATOM 1903 O GLY A 122 8.834 10.307 -1.970 1.00 0.00 O ATOM 0 H GLY A 122 9.510 8.605 -5.649 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.677 9.602 -3.903 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.920 11.147 -4.233 1.00 0.00 H new ATOM 1907 N ALA A 123 7.696 9.012 -3.414 1.00 0.00 N ATOM 1908 CA ALA A 123 6.648 8.676 -2.458 1.00 0.00 C ATOM 1909 C ALA A 123 6.868 7.288 -1.868 1.00 0.00 C ATOM 1910 O ALA A 123 7.202 6.343 -2.584 1.00 0.00 O ATOM 1911 CB ALA A 123 5.282 8.760 -3.122 1.00 0.00 C ATOM 0 H ALA A 123 7.578 8.590 -4.335 1.00 0.00 H new ATOM 0 HA ALA A 123 6.688 9.398 -1.643 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.509 8.507 -2.397 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.117 9.773 -3.489 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.240 8.060 -3.957 1.00 0.00 H new ATOM 1917 N THR A 124 6.679 7.170 -0.557 1.00 0.00 N ATOM 1918 CA THR A 124 6.858 5.897 0.130 1.00 0.00 C ATOM 1919 C THR A 124 5.571 5.458 0.819 1.00 0.00 C ATOM 1920 O THR A 124 4.827 6.285 1.348 1.00 0.00 O ATOM 1921 CB THR A 124 7.986 5.977 1.175 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.546 6.726 2.314 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.228 6.627 0.583 1.00 0.00 C ATOM 0 H THR A 124 6.402 7.941 0.050 1.00 0.00 H new ATOM 0 HA THR A 124 7.128 5.163 -0.629 1.00 0.00 H new ATOM 0 HB THR A 124 8.239 4.962 1.483 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.268 6.771 2.975 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.011 6.672 1.340 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.577 6.039 -0.265 1.00 0.00 H new ATOM 0 HG23 THR A 124 8.987 7.636 0.250 1.00 0.00 H new ATOM 1931 N ILE A 125 5.316 4.155 0.811 1.00 0.00 N ATOM 1932 CA ILE A 125 4.120 3.607 1.438 1.00 0.00 C ATOM 1933 C ILE A 125 4.439 2.332 2.211 1.00 0.00 C ATOM 1934 O ILE A 125 5.190 1.478 1.738 1.00 0.00 O ATOM 1935 CB ILE A 125 3.027 3.303 0.396 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.796 2.701 1.077 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.562 2.361 -0.672 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.527 2.843 0.266 1.00 0.00 C ATOM 0 H ILE A 125 5.922 3.458 0.377 1.00 0.00 H new ATOM 0 HA ILE A 125 3.751 4.365 2.129 1.00 0.00 H new ATOM 0 HB ILE A 125 2.733 4.236 -0.084 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.978 1.644 1.270 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.655 3.182 2.045 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.778 2.155 -1.401 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.412 2.824 -1.173 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.880 1.427 -0.208 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.304 2.394 0.810 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.321 3.900 0.095 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.649 2.338 -0.692 1.00 0.00 H new ATOM 1950 N ASP A 126 3.862 2.208 3.401 1.00 0.00 N ATOM 1951 CA ASP A 126 4.082 1.035 4.239 1.00 0.00 C ATOM 1952 C ASP A 126 2.979 0.001 4.028 1.00 0.00 C ATOM 1953 O ASP A 126 1.792 0.330 4.052 1.00 0.00 O ATOM 1954 CB ASP A 126 4.143 1.439 5.713 1.00 0.00 C ATOM 1955 CG ASP A 126 5.406 2.208 6.050 1.00 0.00 C ATOM 1956 OD1 ASP A 126 6.251 2.384 5.148 1.00 0.00 O ATOM 1957 OD2 ASP A 126 5.548 2.633 7.216 1.00 0.00 O ATOM 0 H ASP A 126 3.238 2.905 3.807 1.00 0.00 H new ATOM 0 HA ASP A 126 5.034 0.588 3.953 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.273 2.050 5.956 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.088 0.545 6.334 1.00 0.00 H new ATOM 1962 N LEU A 127 3.379 -1.248 3.819 1.00 0.00 N ATOM 1963 CA LEU A 127 2.425 -2.330 3.603 1.00 0.00 C ATOM 1964 C LEU A 127 2.899 -3.616 4.272 1.00 0.00 C ATOM 1965 O LEU A 127 4.095 -3.905 4.310 1.00 0.00 O ATOM 1966 CB LEU A 127 2.224 -2.567 2.105 1.00 0.00 C ATOM 1967 CG LEU A 127 1.740 -1.363 1.295 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.142 -1.506 -0.165 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.231 -1.207 1.421 1.00 0.00 C ATOM 0 H LEU A 127 4.357 -1.537 3.794 1.00 0.00 H new ATOM 0 HA LEU A 127 1.475 -2.038 4.050 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.168 -2.909 1.681 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.506 -3.377 1.979 1.00 0.00 H new ATOM 0 HG LEU A 127 2.213 -0.466 1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.789 -0.641 -0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.228 -1.569 -0.239 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.697 -2.412 -0.578 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -0.096 -0.346 0.838 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.260 -2.105 1.047 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -0.033 -1.058 2.468 1.00 0.00 H new ATOM 1981 N VAL A 128 1.952 -4.387 4.799 1.00 0.00 N ATOM 1982 CA VAL A 128 2.272 -5.644 5.465 1.00 0.00 C ATOM 1983 C VAL A 128 1.465 -6.797 4.879 1.00 0.00 C ATOM 1984 O VAL A 128 0.289 -6.971 5.202 1.00 0.00 O ATOM 1985 CB VAL A 128 2.004 -5.561 6.979 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.386 -6.866 7.661 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.759 -4.390 7.590 1.00 0.00 C ATOM 0 H VAL A 128 0.957 -4.163 4.777 1.00 0.00 H new ATOM 0 HA VAL A 128 3.334 -5.828 5.301 1.00 0.00 H new ATOM 0 HB VAL A 128 0.938 -5.397 7.133 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.190 -6.789 8.730 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.797 -7.682 7.242 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.446 -7.064 7.500 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.558 -4.346 8.660 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.829 -4.522 7.427 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.432 -3.462 7.121 1.00 0.00 H new ATOM 1997 N ILE A 129 2.103 -7.582 4.018 1.00 0.00 N ATOM 1998 CA ILE A 129 1.444 -8.719 3.389 1.00 0.00 C ATOM 1999 C ILE A 129 1.708 -10.006 4.164 1.00 0.00 C ATOM 2000 O ILE A 129 2.785 -10.192 4.730 1.00 0.00 O ATOM 2001 CB ILE A 129 1.911 -8.906 1.933 1.00 0.00 C ATOM 2002 CG1 ILE A 129 1.999 -7.552 1.225 1.00 0.00 C ATOM 2003 CG2 ILE A 129 0.967 -9.839 1.189 1.00 0.00 C ATOM 2004 CD1 ILE A 129 2.947 -7.547 0.047 1.00 0.00 C ATOM 0 H ILE A 129 3.076 -7.451 3.740 1.00 0.00 H new ATOM 0 HA ILE A 129 0.375 -8.506 3.395 1.00 0.00 H new ATOM 0 HB ILE A 129 2.904 -9.356 1.940 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.005 -7.265 0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.319 -6.796 1.942 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.311 -9.961 0.162 1.00 0.00 H new ATOM 0 HG22 ILE A 129 0.950 -10.810 1.684 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -0.037 -9.415 1.188 1.00 0.00 H new ATOM 0 HD11 ILE A 129 2.959 -6.556 -0.406 1.00 0.00 H new ATOM 0 HD12 ILE A 129 3.951 -7.803 0.387 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.616 -8.279 -0.690 1.00 0.00 H new ATOM 2016 N GLY A 130 0.717 -10.892 4.185 1.00 0.00 N ATOM 2017 CA GLY A 130 0.863 -12.151 4.892 1.00 0.00 C ATOM 2018 C GLY A 130 0.435 -13.339 4.054 1.00 0.00 C ATOM 2019 O GLY A 130 -0.681 -13.373 3.535 1.00 0.00 O ATOM 0 H GLY A 130 -0.184 -10.760 3.725 1.00 0.00 H new ATOM 0 HA2 GLY A 130 1.903 -12.277 5.192 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.269 -12.122 5.806 1.00 0.00 H new ATOM 2023 N TYR A 131 1.324 -14.317 3.920 1.00 0.00 N ATOM 2024 CA TYR A 131 1.035 -15.511 3.136 1.00 0.00 C ATOM 2025 C TYR A 131 0.485 -16.625 4.022 1.00 0.00 C ATOM 2026 O TYR A 131 0.844 -16.735 5.195 1.00 0.00 O ATOM 2027 CB TYR A 131 2.296 -15.992 2.416 1.00 0.00 C ATOM 2028 CG TYR A 131 2.168 -17.382 1.835 1.00 0.00 C ATOM 2029 CD1 TYR A 131 1.116 -17.708 0.987 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.098 -18.370 2.133 1.00 0.00 C ATOM 2031 CE1 TYR A 131 0.995 -18.977 0.454 1.00 0.00 C ATOM 2032 CE2 TYR A 131 2.986 -19.641 1.604 1.00 0.00 C ATOM 2033 CZ TYR A 131 1.932 -19.940 0.765 1.00 0.00 C ATOM 2034 OH TYR A 131 1.816 -21.205 0.236 1.00 0.00 O ATOM 0 H TYR A 131 2.251 -14.306 4.345 1.00 0.00 H new ATOM 0 HA TYR A 131 0.278 -15.254 2.395 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.536 -15.293 1.615 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.132 -15.975 3.115 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.381 -16.956 0.741 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.924 -18.140 2.790 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.171 -19.214 -0.203 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.719 -20.396 1.846 1.00 0.00 H new ATOM 0 HH TYR A 131 2.558 -21.762 0.553 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.387 -17.449 3.452 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.986 -18.557 4.188 1.00 0.00 C ATOM 2046 C ASP A 132 -1.125 -19.788 3.298 1.00 0.00 C ATOM 2047 O ASP A 132 -1.877 -19.798 2.323 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.355 -18.151 4.737 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.252 -17.123 5.847 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.434 -16.189 5.716 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -2.989 -17.254 6.846 1.00 0.00 O ATOM 0 H ASP A 132 -0.695 -17.371 2.483 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.329 -18.806 5.021 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.963 -17.747 3.927 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.870 -19.036 5.112 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.384 -20.852 3.640 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.407 -22.109 2.885 1.00 0.00 C ATOM 2058 C PRO A 133 -1.727 -22.855 3.042 1.00 0.00 C ATOM 2059 O PRO A 133 -2.217 -23.072 4.150 1.00 0.00 O ATOM 2060 CB PRO A 133 0.740 -22.914 3.501 1.00 0.00 C ATOM 2061 CG PRO A 133 0.886 -22.371 4.881 1.00 0.00 C ATOM 2062 CD PRO A 133 0.534 -20.911 4.790 1.00 0.00 C ATOM 0 HA PRO A 133 -0.301 -21.943 1.813 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.512 -23.980 3.517 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.660 -22.794 2.929 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.226 -22.889 5.576 1.00 0.00 H new ATOM 0 HG3 PRO A 133 1.904 -22.505 5.248 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.057 -20.555 5.703 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.418 -20.294 4.630 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.318 -23.259 1.908 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.590 -23.989 1.894 1.00 0.00 C ATOM 2072 C PRO A 134 -3.451 -25.405 2.441 1.00 0.00 C ATOM 2073 O PRO A 134 -2.545 -26.144 2.056 1.00 0.00 O ATOM 2074 CB PRO A 134 -3.963 -24.023 0.410 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.664 -23.904 -0.310 1.00 0.00 C ATOM 2076 CD PRO A 134 -1.791 -23.034 0.551 1.00 0.00 C ATOM 0 HA PRO A 134 -4.340 -23.513 2.525 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.475 -24.950 0.152 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.635 -23.205 0.152 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.211 -24.884 -0.461 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -2.804 -23.462 -1.296 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -0.741 -23.318 0.475 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -1.859 -21.985 0.262 1.00 0.00 H new