USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1104 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 127 GLN : amide:sc= -1.06 K(o=-2.1,f=2.2) USER MOD Set 1.2: A 134 SER OG : rot 180:sc= -1.05 USER MOD Set 2.1: A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 58 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0701) USER MOD Set 3.1: A 10 MET CE :methyl -113:sc= -3.29 (180deg=-3.14!) USER MOD Set 3.2: A 51 HIS : no HD1:sc= -2.04 K(o=-5.3,f=-6.6!) USER MOD Set 4.1: A 22 SER OG : rot 180:sc= 0.0666 USER MOD Set 4.2: A 34 LYS NZ :NH3+ -107:sc= -10.1! (180deg=-12.8!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 73:sc= 0.378 USER MOD Single : A 17 ASN : amide:sc= -1.81 K(o=-1.8,f=-0.57) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 165:sc= -2.64 (180deg=-3.24!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.633 K(o=-0.63,f=-0.0064) USER MOD Single : A 39 THR OG1 : rot 81:sc= 0.324 USER MOD Single : A 40 LYS NZ :NH3+ 170:sc= -0.004 (180deg=-0.107) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 170:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -1.94 K(o=-1.9,f=-3!) USER MOD Single : A 62 LYS NZ :NH3+ -120:sc=-0.00834 (180deg=-0.676) USER MOD Single : A 63 CYS SG : rot -50:sc= 0.695 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot -170:sc= 0.631 USER MOD Single : A 68 LYS NZ :NH3+ 163:sc= 1.79 (180deg=1.52) USER MOD Single : A 73 TYR OH : rot 180:sc= 0.994 USER MOD Single : A 77 SER OG : rot 160:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -2.23 K(o=-2.2,f=-1.1) USER MOD Single : A 82 SER OG : rot 118:sc= 0.23 USER MOD Single : A 84 HIS : no HD1:sc= -0.205 X(o=-0.21,f=0) USER MOD Single : A 85 GLN : amide:sc= -5.28! C(o=-5.3!,f=-3.7!) USER MOD Single : A 98 SER OG : rot 89:sc= 1.3 USER MOD Single : A 99 ASN : amide:sc= -1.6 K(o=-1.6,f=-2.7) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 172:sc= 0.972 USER MOD Single : A 106 GLN : amide:sc= 0.384 K(o=0.38,f=-1.1!) USER MOD Single : A 107 ASN : amide:sc= -0.538 X(o=-0.54,f=-0.92) USER MOD Single : A 109 TYR OH : rot -108:sc= 1.19 USER MOD Single : A 111 CYS SG : rot -81:sc= 0.354 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -166:sc=-0.000883 (180deg=-0.118) USER MOD Single : A 124 ASN : amide:sc= 0.15 X(o=0.15,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 ASN : amide:sc= 0.323 X(o=0.32,f=0) USER MOD Single : A 130 ASN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 GLN : amide:sc= 0.377 K(o=0.38,f=-0.19) USER MOD Single : A 143 MET CE :methyl -168:sc= -3.75! (180deg=-4.53) USER MOD ----------------------------------------------------------------- ATOM 92 N MET A 10 -16.674 11.976 2.585 1.00 0.00 N ATOM 93 CA MET A 10 -15.525 11.202 2.128 1.00 0.00 C ATOM 94 C MET A 10 -15.975 9.935 1.407 1.00 0.00 C ATOM 95 O MET A 10 -15.538 8.833 1.739 1.00 0.00 O ATOM 96 CB MET A 10 -14.626 10.838 3.310 1.00 0.00 C ATOM 97 CG MET A 10 -14.142 12.044 4.100 1.00 0.00 C ATOM 98 SD MET A 10 -13.038 11.592 5.452 1.00 0.00 S ATOM 99 CE MET A 10 -11.677 10.860 4.547 1.00 0.00 C ATOM 0 HA MET A 10 -14.960 11.816 1.427 1.00 0.00 H new ATOM 0 HB2 MET A 10 -15.171 10.171 3.978 1.00 0.00 H new ATOM 0 HB3 MET A 10 -13.762 10.285 2.942 1.00 0.00 H new ATOM 0 HG2 MET A 10 -13.626 12.730 3.428 1.00 0.00 H new ATOM 0 HG3 MET A 10 -15.002 12.579 4.502 1.00 0.00 H new ATOM 0 HE1 MET A 10 -11.626 9.793 4.766 1.00 0.00 H new ATOM 0 HE2 MET A 10 -11.832 11.004 3.478 1.00 0.00 H new ATOM 0 HE3 MET A 10 -10.743 11.337 4.846 1.00 0.00 H new ATOM 109 N GLU A 11 -16.851 10.099 0.421 1.00 0.00 N ATOM 110 CA GLU A 11 -17.361 8.967 -0.344 1.00 0.00 C ATOM 111 C GLU A 11 -16.277 8.392 -1.251 1.00 0.00 C ATOM 112 O GLU A 11 -16.164 7.176 -1.408 1.00 0.00 O ATOM 113 CB GLU A 11 -18.569 9.391 -1.181 1.00 0.00 C ATOM 114 CG GLU A 11 -19.154 8.267 -2.019 1.00 0.00 C ATOM 115 CD GLU A 11 -20.568 8.560 -2.484 1.00 0.00 C ATOM 116 OE1 GLU A 11 -20.902 9.752 -2.647 1.00 0.00 O ATOM 117 OE2 GLU A 11 -21.339 7.598 -2.683 1.00 0.00 O ATOM 0 H GLU A 11 -17.222 11.004 0.133 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.670 8.195 0.360 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -19.342 9.778 -0.517 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -18.275 10.209 -1.839 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.518 8.098 -2.888 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.151 7.345 -1.437 1.00 0.00 H new ATOM 124 N ALA A 12 -15.482 9.275 -1.847 1.00 0.00 N ATOM 125 CA ALA A 12 -14.406 8.856 -2.737 1.00 0.00 C ATOM 126 C ALA A 12 -13.471 7.872 -2.042 1.00 0.00 C ATOM 127 O ALA A 12 -13.117 6.835 -2.603 1.00 0.00 O ATOM 128 CB ALA A 12 -13.628 10.066 -3.231 1.00 0.00 C ATOM 0 H ALA A 12 -15.563 10.285 -1.730 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.852 8.351 -3.593 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.828 9.738 -3.894 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.298 10.733 -3.773 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.200 10.595 -2.380 1.00 0.00 H new ATOM 134 N VAL A 13 -13.073 8.204 -0.818 1.00 0.00 N ATOM 135 CA VAL A 13 -12.179 7.349 -0.047 1.00 0.00 C ATOM 136 C VAL A 13 -12.784 5.965 0.160 1.00 0.00 C ATOM 137 O VAL A 13 -12.285 4.971 -0.367 1.00 0.00 O ATOM 138 CB VAL A 13 -11.858 7.967 1.327 1.00 0.00 C ATOM 139 CG1 VAL A 13 -11.024 7.007 2.163 1.00 0.00 C ATOM 140 CG2 VAL A 13 -11.142 9.299 1.157 1.00 0.00 C ATOM 0 H VAL A 13 -13.356 9.059 -0.339 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.257 7.257 -0.621 1.00 0.00 H new ATOM 0 HB VAL A 13 -12.795 8.148 1.853 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -10.807 7.461 3.130 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -11.578 6.080 2.313 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.089 6.792 1.645 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.923 9.722 2.137 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.211 9.145 0.612 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.779 9.986 0.600 1.00 0.00 H new ATOM 150 N LYS A 14 -13.865 5.907 0.932 1.00 0.00 N ATOM 151 CA LYS A 14 -14.541 4.646 1.209 1.00 0.00 C ATOM 152 C LYS A 14 -14.470 3.714 0.003 1.00 0.00 C ATOM 153 O LYS A 14 -14.272 2.507 0.148 1.00 0.00 O ATOM 154 CB LYS A 14 -16.003 4.899 1.585 1.00 0.00 C ATOM 155 CG LYS A 14 -16.171 5.773 2.816 1.00 0.00 C ATOM 156 CD LYS A 14 -17.533 6.447 2.839 1.00 0.00 C ATOM 157 CE LYS A 14 -17.511 7.720 3.672 1.00 0.00 C ATOM 158 NZ LYS A 14 -17.788 7.446 5.109 1.00 0.00 N ATOM 0 H LYS A 14 -14.291 6.720 1.377 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.034 4.167 2.047 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -16.510 5.370 0.743 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.496 3.942 1.759 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.049 5.167 3.713 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.388 6.531 2.835 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -17.841 6.683 1.820 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -18.274 5.758 3.245 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.538 8.201 3.575 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.252 8.420 3.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -17.764 8.338 5.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.727 7.010 5.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -17.066 6.798 5.484 1.00 0.00 H new ATOM 172 N THR A 15 -14.632 4.282 -1.188 1.00 0.00 N ATOM 173 CA THR A 15 -14.585 3.503 -2.419 1.00 0.00 C ATOM 174 C THR A 15 -13.224 2.841 -2.600 1.00 0.00 C ATOM 175 O THR A 15 -13.136 1.637 -2.845 1.00 0.00 O ATOM 176 CB THR A 15 -14.885 4.378 -3.650 1.00 0.00 C ATOM 177 OG1 THR A 15 -16.174 4.987 -3.516 1.00 0.00 O ATOM 178 CG2 THR A 15 -14.839 3.552 -4.926 1.00 0.00 C ATOM 0 H THR A 15 -14.797 5.279 -1.326 1.00 0.00 H new ATOM 0 HA THR A 15 -15.352 2.733 -2.334 1.00 0.00 H new ATOM 0 HB THR A 15 -14.122 5.154 -3.711 1.00 0.00 H new ATOM 0 HG1 THR A 15 -16.132 5.696 -2.841 1.00 0.00 H new ATOM 0 HG21 THR A 15 -15.054 4.192 -5.782 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.847 3.114 -5.040 1.00 0.00 H new ATOM 0 HG23 THR A 15 -15.583 2.757 -4.872 1.00 0.00 H new ATOM 186 N PHE A 16 -12.165 3.633 -2.476 1.00 0.00 N ATOM 187 CA PHE A 16 -10.807 3.124 -2.626 1.00 0.00 C ATOM 188 C PHE A 16 -10.456 2.169 -1.489 1.00 0.00 C ATOM 189 O PHE A 16 -9.757 1.176 -1.691 1.00 0.00 O ATOM 190 CB PHE A 16 -9.806 4.281 -2.663 1.00 0.00 C ATOM 191 CG PHE A 16 -8.373 3.835 -2.616 1.00 0.00 C ATOM 192 CD1 PHE A 16 -7.733 3.642 -1.402 1.00 0.00 C ATOM 193 CD2 PHE A 16 -7.665 3.610 -3.785 1.00 0.00 C ATOM 194 CE1 PHE A 16 -6.414 3.231 -1.355 1.00 0.00 C ATOM 195 CE2 PHE A 16 -6.346 3.200 -3.745 1.00 0.00 C ATOM 196 CZ PHE A 16 -5.719 3.011 -2.529 1.00 0.00 C ATOM 0 H PHE A 16 -12.221 4.631 -2.272 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.753 2.577 -3.567 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.968 4.862 -3.571 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.999 4.945 -1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -8.271 3.815 -0.482 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -8.150 3.757 -4.739 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -5.927 3.082 -0.402 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.806 3.027 -4.664 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.688 2.692 -2.496 1.00 0.00 H new ATOM 206 N ASN A 17 -10.946 2.477 -0.293 1.00 0.00 N ATOM 207 CA ASN A 17 -10.683 1.647 0.878 1.00 0.00 C ATOM 208 C ASN A 17 -11.101 0.202 0.624 1.00 0.00 C ATOM 209 O ASN A 17 -10.665 -0.713 1.323 1.00 0.00 O ATOM 210 CB ASN A 17 -11.426 2.198 2.096 1.00 0.00 C ATOM 211 CG ASN A 17 -10.593 3.194 2.880 1.00 0.00 C ATOM 212 OD1 ASN A 17 -10.403 3.047 4.087 1.00 0.00 O ATOM 213 ND2 ASN A 17 -10.090 4.214 2.194 1.00 0.00 N ATOM 0 H ASN A 17 -11.527 3.295 -0.109 1.00 0.00 H new ATOM 0 HA ASN A 17 -9.611 1.668 1.075 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -12.348 2.678 1.769 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -11.710 1.373 2.749 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.520 4.915 2.667 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -10.273 4.296 1.194 1.00 0.00 H new ATOM 220 N SER A 18 -11.948 0.004 -0.380 1.00 0.00 N ATOM 221 CA SER A 18 -12.428 -1.330 -0.724 1.00 0.00 C ATOM 222 C SER A 18 -11.532 -1.974 -1.779 1.00 0.00 C ATOM 223 O SER A 18 -11.183 -3.149 -1.677 1.00 0.00 O ATOM 224 CB SER A 18 -13.868 -1.261 -1.235 1.00 0.00 C ATOM 225 OG SER A 18 -14.456 -2.550 -1.279 1.00 0.00 O ATOM 0 H SER A 18 -12.317 0.750 -0.970 1.00 0.00 H new ATOM 0 HA SER A 18 -12.399 -1.943 0.177 1.00 0.00 H new ATOM 0 HB2 SER A 18 -14.456 -0.611 -0.587 1.00 0.00 H new ATOM 0 HB3 SER A 18 -13.883 -0.817 -2.230 1.00 0.00 H new ATOM 0 HG SER A 18 -15.377 -2.479 -1.607 1.00 0.00 H new ATOM 231 N GLU A 19 -11.166 -1.194 -2.791 1.00 0.00 N ATOM 232 CA GLU A 19 -10.312 -1.688 -3.865 1.00 0.00 C ATOM 233 C GLU A 19 -8.911 -1.999 -3.347 1.00 0.00 C ATOM 234 O GLU A 19 -8.345 -3.051 -3.647 1.00 0.00 O ATOM 235 CB GLU A 19 -10.233 -0.662 -4.997 1.00 0.00 C ATOM 236 CG GLU A 19 -11.586 -0.111 -5.415 1.00 0.00 C ATOM 237 CD GLU A 19 -12.434 -1.136 -6.142 1.00 0.00 C ATOM 238 OE1 GLU A 19 -12.312 -1.236 -7.381 1.00 0.00 O ATOM 239 OE2 GLU A 19 -13.220 -1.839 -5.472 1.00 0.00 O ATOM 0 H GLU A 19 -11.447 -0.218 -2.890 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.751 -2.609 -4.249 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.595 0.164 -4.683 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -9.755 -1.123 -5.861 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -12.121 0.237 -4.531 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -11.438 0.755 -6.060 1.00 0.00 H new ATOM 246 N LEU A 20 -8.357 -1.077 -2.567 1.00 0.00 N ATOM 247 CA LEU A 20 -7.021 -1.251 -2.007 1.00 0.00 C ATOM 248 C LEU A 20 -6.862 -2.642 -1.402 1.00 0.00 C ATOM 249 O LEU A 20 -5.931 -3.374 -1.741 1.00 0.00 O ATOM 250 CB LEU A 20 -6.751 -0.186 -0.943 1.00 0.00 C ATOM 251 CG LEU A 20 -5.331 -0.149 -0.377 1.00 0.00 C ATOM 252 CD1 LEU A 20 -5.129 -1.268 0.633 1.00 0.00 C ATOM 253 CD2 LEU A 20 -4.306 -0.249 -1.498 1.00 0.00 C ATOM 0 H LEU A 20 -8.812 -0.202 -2.308 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.297 -1.141 -2.815 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -6.976 0.791 -1.370 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -7.446 -0.341 -0.118 1.00 0.00 H new ATOM 0 HG LEU A 20 -5.190 0.804 0.134 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -4.113 -1.225 1.025 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -5.839 -1.151 1.452 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.291 -2.230 0.147 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -3.301 -0.221 -1.076 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -4.447 -1.186 -2.037 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -4.435 0.588 -2.184 1.00 0.00 H new ATOM 265 N TYR A 21 -7.776 -3.001 -0.508 1.00 0.00 N ATOM 266 CA TYR A 21 -7.737 -4.305 0.144 1.00 0.00 C ATOM 267 C TYR A 21 -8.263 -5.395 -0.785 1.00 0.00 C ATOM 268 O TYR A 21 -7.911 -6.566 -0.648 1.00 0.00 O ATOM 269 CB TYR A 21 -8.558 -4.278 1.434 1.00 0.00 C ATOM 270 CG TYR A 21 -7.856 -3.593 2.585 1.00 0.00 C ATOM 271 CD1 TYR A 21 -7.788 -2.206 2.656 1.00 0.00 C ATOM 272 CD2 TYR A 21 -7.260 -4.330 3.600 1.00 0.00 C ATOM 273 CE1 TYR A 21 -7.147 -1.576 3.704 1.00 0.00 C ATOM 274 CE2 TYR A 21 -6.619 -3.708 4.653 1.00 0.00 C ATOM 275 CZ TYR A 21 -6.564 -2.331 4.701 1.00 0.00 C ATOM 276 OH TYR A 21 -5.925 -1.707 5.748 1.00 0.00 O ATOM 0 H TYR A 21 -8.553 -2.408 -0.218 1.00 0.00 H new ATOM 0 HA TYR A 21 -6.699 -4.531 0.387 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -9.503 -3.770 1.242 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -8.798 -5.301 1.723 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.244 -1.612 1.878 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -7.299 -5.409 3.565 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -7.102 -0.498 3.743 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.163 -4.297 5.435 1.00 0.00 H new ATOM 0 HH TYR A 21 -5.570 -2.382 6.364 1.00 0.00 H new ATOM 286 N SER A 22 -9.109 -4.999 -1.731 1.00 0.00 N ATOM 287 CA SER A 22 -9.688 -5.941 -2.681 1.00 0.00 C ATOM 288 C SER A 22 -8.616 -6.867 -3.249 1.00 0.00 C ATOM 289 O SER A 22 -8.909 -7.981 -3.686 1.00 0.00 O ATOM 290 CB SER A 22 -10.382 -5.189 -3.818 1.00 0.00 C ATOM 291 OG SER A 22 -11.064 -6.084 -4.680 1.00 0.00 O ATOM 0 H SER A 22 -9.408 -4.032 -1.860 1.00 0.00 H new ATOM 0 HA SER A 22 -10.424 -6.546 -2.152 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.088 -4.469 -3.404 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.645 -4.622 -4.387 1.00 0.00 H new ATOM 0 HG SER A 22 -11.500 -5.579 -5.397 1.00 0.00 H new ATOM 297 N LEU A 23 -7.373 -6.399 -3.239 1.00 0.00 N ATOM 298 CA LEU A 23 -6.256 -7.184 -3.752 1.00 0.00 C ATOM 299 C LEU A 23 -6.285 -8.603 -3.193 1.00 0.00 C ATOM 300 O LEU A 23 -5.936 -9.560 -3.884 1.00 0.00 O ATOM 301 CB LEU A 23 -4.928 -6.511 -3.397 1.00 0.00 C ATOM 302 CG LEU A 23 -4.482 -5.378 -4.322 1.00 0.00 C ATOM 303 CD1 LEU A 23 -3.178 -4.770 -3.830 1.00 0.00 C ATOM 304 CD2 LEU A 23 -4.332 -5.883 -5.750 1.00 0.00 C ATOM 0 H LEU A 23 -7.113 -5.480 -2.881 1.00 0.00 H new ATOM 0 HA LEU A 23 -6.350 -7.238 -4.837 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -5.003 -6.118 -2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.149 -7.273 -3.387 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.248 -4.602 -4.311 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.876 -3.965 -4.500 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.319 -4.372 -2.825 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.403 -5.537 -3.811 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.014 -5.063 -6.394 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.586 -6.677 -5.779 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.288 -6.271 -6.101 1.00 0.00 H new ATOM 316 N ASN A 24 -6.705 -8.731 -1.939 1.00 0.00 N ATOM 317 CA ASN A 24 -6.782 -10.034 -1.288 1.00 0.00 C ATOM 318 C ASN A 24 -7.478 -11.052 -2.187 1.00 0.00 C ATOM 319 O ASN A 24 -7.040 -12.197 -2.301 1.00 0.00 O ATOM 320 CB ASN A 24 -7.528 -9.919 0.043 1.00 0.00 C ATOM 321 CG ASN A 24 -6.752 -9.120 1.073 1.00 0.00 C ATOM 322 OD1 ASN A 24 -5.537 -9.267 1.203 1.00 0.00 O ATOM 323 ND2 ASN A 24 -7.454 -8.268 1.811 1.00 0.00 N ATOM 0 H ASN A 24 -6.997 -7.949 -1.353 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.765 -10.378 -1.099 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.496 -9.447 -0.126 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.724 -10.917 0.434 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -6.987 -7.703 2.520 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -8.460 -8.179 1.669 1.00 0.00 H new ATOM 330 N ASP A 25 -8.563 -10.626 -2.824 1.00 0.00 N ATOM 331 CA ASP A 25 -9.319 -11.499 -3.714 1.00 0.00 C ATOM 332 C ASP A 25 -8.404 -12.138 -4.754 1.00 0.00 C ATOM 333 O ASP A 25 -8.547 -13.317 -5.081 1.00 0.00 O ATOM 334 CB ASP A 25 -10.431 -10.713 -4.411 1.00 0.00 C ATOM 335 CG ASP A 25 -11.599 -11.593 -4.811 1.00 0.00 C ATOM 336 OD1 ASP A 25 -12.361 -12.012 -3.914 1.00 0.00 O ATOM 337 OD2 ASP A 25 -11.751 -11.862 -6.020 1.00 0.00 O ATOM 0 H ASP A 25 -8.939 -9.681 -2.741 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.766 -12.291 -3.113 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -10.785 -9.924 -3.747 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -10.026 -10.226 -5.298 1.00 0.00 H new ATOM 342 N TYR A 26 -7.464 -11.354 -5.270 1.00 0.00 N ATOM 343 CA TYR A 26 -6.528 -11.843 -6.275 1.00 0.00 C ATOM 344 C TYR A 26 -5.168 -12.145 -5.652 1.00 0.00 C ATOM 345 O TYR A 26 -4.696 -11.416 -4.779 1.00 0.00 O ATOM 346 CB TYR A 26 -6.370 -10.815 -7.397 1.00 0.00 C ATOM 347 CG TYR A 26 -7.642 -10.062 -7.712 1.00 0.00 C ATOM 348 CD1 TYR A 26 -8.094 -9.044 -6.882 1.00 0.00 C ATOM 349 CD2 TYR A 26 -8.392 -10.368 -8.842 1.00 0.00 C ATOM 350 CE1 TYR A 26 -9.257 -8.354 -7.166 1.00 0.00 C ATOM 351 CE2 TYR A 26 -9.555 -9.682 -9.134 1.00 0.00 C ATOM 352 CZ TYR A 26 -9.984 -8.677 -8.293 1.00 0.00 C ATOM 353 OH TYR A 26 -11.142 -7.991 -8.580 1.00 0.00 O ATOM 0 H TYR A 26 -7.330 -10.377 -5.009 1.00 0.00 H new ATOM 0 HA TYR A 26 -6.930 -12.767 -6.691 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.595 -10.101 -7.118 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -6.026 -11.323 -8.298 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -7.527 -8.787 -6.000 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.060 -11.155 -9.503 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.595 -7.566 -6.509 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -10.125 -9.932 -10.017 1.00 0.00 H new ATOM 0 HH TYR A 26 -11.532 -8.340 -9.408 1.00 0.00 H new ATOM 363 N LYS A 27 -4.543 -13.225 -6.107 1.00 0.00 N ATOM 364 CA LYS A 27 -3.237 -13.625 -5.598 1.00 0.00 C ATOM 365 C LYS A 27 -2.130 -13.232 -6.571 1.00 0.00 C ATOM 366 O LYS A 27 -2.249 -13.399 -7.785 1.00 0.00 O ATOM 367 CB LYS A 27 -3.203 -15.136 -5.354 1.00 0.00 C ATOM 368 CG LYS A 27 -4.368 -15.644 -4.522 1.00 0.00 C ATOM 369 CD LYS A 27 -4.507 -17.154 -4.620 1.00 0.00 C ATOM 370 CE LYS A 27 -3.562 -17.863 -3.663 1.00 0.00 C ATOM 371 NZ LYS A 27 -4.095 -19.186 -3.235 1.00 0.00 N ATOM 0 H LYS A 27 -4.920 -13.840 -6.828 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.068 -13.106 -4.654 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -3.202 -15.651 -6.315 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.270 -15.394 -4.853 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.224 -15.358 -3.480 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -5.290 -15.170 -4.858 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -5.535 -17.441 -4.398 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -4.300 -17.474 -5.641 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -2.594 -18.000 -4.144 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -3.397 -17.237 -2.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -3.422 -19.637 -2.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -5.007 -19.053 -2.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -4.229 -19.793 -4.069 1.00 0.00 H new ATOM 385 N PRO A 28 -1.025 -12.699 -6.028 1.00 0.00 N ATOM 386 CA PRO A 28 0.125 -12.273 -6.831 1.00 0.00 C ATOM 387 C PRO A 28 0.549 -13.332 -7.843 1.00 0.00 C ATOM 388 O PRO A 28 0.646 -14.519 -7.532 1.00 0.00 O ATOM 389 CB PRO A 28 1.225 -12.059 -5.788 1.00 0.00 C ATOM 390 CG PRO A 28 0.496 -11.748 -4.527 1.00 0.00 C ATOM 391 CD PRO A 28 -0.815 -12.470 -4.589 1.00 0.00 C ATOM 0 HA PRO A 28 -0.098 -11.386 -7.424 1.00 0.00 H new ATOM 0 HB2 PRO A 28 1.845 -12.949 -5.678 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.888 -11.242 -6.074 1.00 0.00 H new ATOM 0 HG2 PRO A 28 1.072 -12.069 -3.659 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.340 -10.674 -4.427 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.781 -13.409 -4.036 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.620 -11.875 -4.157 1.00 0.00 H new ATOM 399 N PRO A 29 0.809 -12.894 -9.084 1.00 0.00 N ATOM 400 CA PRO A 29 0.696 -11.484 -9.466 1.00 0.00 C ATOM 401 C PRO A 29 -0.751 -11.005 -9.495 1.00 0.00 C ATOM 402 O PRO A 29 -1.682 -11.811 -9.496 1.00 0.00 O ATOM 403 CB PRO A 29 1.299 -11.448 -10.873 1.00 0.00 C ATOM 404 CG PRO A 29 1.116 -12.829 -11.399 1.00 0.00 C ATOM 405 CD PRO A 29 1.232 -13.743 -10.210 1.00 0.00 C ATOM 0 HA PRO A 29 1.198 -10.828 -8.755 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.794 -10.715 -11.502 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.353 -11.171 -10.845 1.00 0.00 H new ATOM 0 HG2 PRO A 29 0.145 -12.937 -11.881 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.872 -13.065 -12.148 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.593 -14.620 -10.314 1.00 0.00 H new ATOM 0 HD3 PRO A 29 2.252 -14.105 -10.079 1.00 0.00 H new ATOM 413 N ILE A 30 -0.934 -9.689 -9.519 1.00 0.00 N ATOM 414 CA ILE A 30 -2.268 -9.104 -9.549 1.00 0.00 C ATOM 415 C ILE A 30 -2.638 -8.650 -10.957 1.00 0.00 C ATOM 416 O ILE A 30 -1.844 -8.003 -11.640 1.00 0.00 O ATOM 417 CB ILE A 30 -2.379 -7.904 -8.590 1.00 0.00 C ATOM 418 CG1 ILE A 30 -2.037 -8.332 -7.161 1.00 0.00 C ATOM 419 CG2 ILE A 30 -3.777 -7.306 -8.649 1.00 0.00 C ATOM 420 CD1 ILE A 30 -2.950 -9.409 -6.618 1.00 0.00 C ATOM 0 H ILE A 30 -0.175 -9.008 -9.518 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.960 -9.882 -9.226 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.665 -7.141 -8.902 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.008 -8.692 -7.134 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.087 -7.461 -6.508 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.840 -6.459 -7.966 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -3.986 -6.969 -9.664 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -4.508 -8.061 -8.359 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.649 -9.663 -5.602 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -3.978 -9.046 -6.612 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -2.882 -10.296 -7.249 1.00 0.00 H new ATOM 432 N SER A 31 -3.849 -8.993 -11.385 1.00 0.00 N ATOM 433 CA SER A 31 -4.323 -8.622 -12.713 1.00 0.00 C ATOM 434 C SER A 31 -3.984 -7.168 -13.025 1.00 0.00 C ATOM 435 O SER A 31 -4.149 -6.285 -12.184 1.00 0.00 O ATOM 436 CB SER A 31 -5.835 -8.838 -12.816 1.00 0.00 C ATOM 437 OG SER A 31 -6.133 -10.154 -13.248 1.00 0.00 O ATOM 0 H SER A 31 -4.519 -9.527 -10.832 1.00 0.00 H new ATOM 0 HA SER A 31 -3.821 -9.258 -13.442 1.00 0.00 H new ATOM 0 HB2 SER A 31 -6.299 -8.656 -11.846 1.00 0.00 H new ATOM 0 HB3 SER A 31 -6.262 -8.117 -13.513 1.00 0.00 H new ATOM 0 HG SER A 31 -7.105 -10.268 -13.304 1.00 0.00 H new ATOM 443 N LYS A 32 -3.508 -6.926 -14.242 1.00 0.00 N ATOM 444 CA LYS A 32 -3.145 -5.580 -14.669 1.00 0.00 C ATOM 445 C LYS A 32 -4.329 -4.628 -14.531 1.00 0.00 C ATOM 446 O LYS A 32 -4.162 -3.464 -14.168 1.00 0.00 O ATOM 447 CB LYS A 32 -2.657 -5.597 -16.120 1.00 0.00 C ATOM 448 CG LYS A 32 -1.163 -5.831 -16.256 1.00 0.00 C ATOM 449 CD LYS A 32 -0.831 -7.314 -16.291 1.00 0.00 C ATOM 450 CE LYS A 32 0.666 -7.547 -16.420 1.00 0.00 C ATOM 451 NZ LYS A 32 1.031 -8.966 -16.153 1.00 0.00 N ATOM 0 H LYS A 32 -3.365 -7.646 -14.951 1.00 0.00 H new ATOM 0 HA LYS A 32 -2.340 -5.226 -14.025 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.189 -6.377 -16.665 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -2.912 -4.648 -16.592 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -0.801 -5.355 -17.167 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.643 -5.360 -15.422 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -1.198 -7.792 -15.382 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -1.347 -7.784 -17.128 1.00 0.00 H new ATOM 0 HE2 LYS A 32 0.992 -7.271 -17.423 1.00 0.00 H new ATOM 0 HE3 LYS A 32 1.196 -6.898 -15.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 2.060 -9.084 -16.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 0.743 -9.223 -15.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 0.545 -9.584 -16.834 1.00 0.00 H new ATOM 465 N ALA A 33 -5.524 -5.131 -14.822 1.00 0.00 N ATOM 466 CA ALA A 33 -6.735 -4.326 -14.726 1.00 0.00 C ATOM 467 C ALA A 33 -7.031 -3.948 -13.279 1.00 0.00 C ATOM 468 O ALA A 33 -7.677 -2.935 -13.010 1.00 0.00 O ATOM 469 CB ALA A 33 -7.915 -5.074 -15.330 1.00 0.00 C ATOM 0 H ALA A 33 -5.679 -6.092 -15.126 1.00 0.00 H new ATOM 0 HA ALA A 33 -6.575 -3.406 -15.288 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -8.813 -4.461 -15.252 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -7.712 -5.287 -16.379 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -8.066 -6.010 -14.792 1.00 0.00 H new ATOM 475 N LYS A 34 -6.555 -4.769 -12.349 1.00 0.00 N ATOM 476 CA LYS A 34 -6.767 -4.522 -10.928 1.00 0.00 C ATOM 477 C LYS A 34 -6.066 -3.240 -10.488 1.00 0.00 C ATOM 478 O LYS A 34 -6.709 -2.295 -10.031 1.00 0.00 O ATOM 479 CB LYS A 34 -6.256 -5.704 -10.101 1.00 0.00 C ATOM 480 CG LYS A 34 -6.430 -5.520 -8.604 1.00 0.00 C ATOM 481 CD LYS A 34 -7.899 -5.485 -8.214 1.00 0.00 C ATOM 482 CE LYS A 34 -8.093 -4.898 -6.824 1.00 0.00 C ATOM 483 NZ LYS A 34 -8.039 -5.944 -5.767 1.00 0.00 N ATOM 0 H LYS A 34 -6.019 -5.612 -12.554 1.00 0.00 H new ATOM 0 HA LYS A 34 -7.838 -4.406 -10.761 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -6.781 -6.607 -10.411 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -5.199 -5.859 -10.319 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.932 -6.333 -8.076 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -5.947 -4.594 -8.292 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.455 -4.893 -8.941 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.309 -6.495 -8.244 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.322 -4.151 -6.635 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -9.053 -4.384 -6.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -8.996 -6.113 -5.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.663 -6.826 -6.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -7.420 -5.625 -4.994 1.00 0.00 H new ATOM 497 N MET A 35 -4.745 -3.214 -10.631 1.00 0.00 N ATOM 498 CA MET A 35 -3.958 -2.047 -10.251 1.00 0.00 C ATOM 499 C MET A 35 -4.607 -0.764 -10.762 1.00 0.00 C ATOM 500 O MET A 35 -4.491 0.293 -10.141 1.00 0.00 O ATOM 501 CB MET A 35 -2.534 -2.165 -10.798 1.00 0.00 C ATOM 502 CG MET A 35 -1.611 -2.991 -9.917 1.00 0.00 C ATOM 503 SD MET A 35 -1.436 -2.304 -8.259 1.00 0.00 S ATOM 504 CE MET A 35 -0.935 -3.759 -7.342 1.00 0.00 C ATOM 0 H MET A 35 -4.197 -3.988 -11.007 1.00 0.00 H new ATOM 0 HA MET A 35 -3.919 -2.005 -9.163 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.571 -2.612 -11.791 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.114 -1.166 -10.914 1.00 0.00 H new ATOM 0 HG2 MET A 35 -1.997 -4.008 -9.846 1.00 0.00 H new ATOM 0 HG3 MET A 35 -0.629 -3.055 -10.385 1.00 0.00 H new ATOM 0 HE1 MET A 35 -0.533 -3.459 -6.374 1.00 0.00 H new ATOM 0 HE2 MET A 35 -1.797 -4.409 -7.191 1.00 0.00 H new ATOM 0 HE3 MET A 35 -0.169 -4.296 -7.902 1.00 0.00 H new ATOM 514 N THR A 36 -5.290 -0.864 -11.897 1.00 0.00 N ATOM 515 CA THR A 36 -5.956 0.289 -12.492 1.00 0.00 C ATOM 516 C THR A 36 -7.251 0.615 -11.757 1.00 0.00 C ATOM 517 O THR A 36 -7.525 1.775 -11.450 1.00 0.00 O ATOM 518 CB THR A 36 -6.271 0.049 -13.981 1.00 0.00 C ATOM 519 OG1 THR A 36 -5.054 -0.067 -14.726 1.00 0.00 O ATOM 520 CG2 THR A 36 -7.111 1.185 -14.546 1.00 0.00 C ATOM 0 H THR A 36 -5.397 -1.731 -12.423 1.00 0.00 H new ATOM 0 HA THR A 36 -5.269 1.131 -12.404 1.00 0.00 H new ATOM 0 HB THR A 36 -6.838 -0.878 -14.065 1.00 0.00 H new ATOM 0 HG1 THR A 36 -5.262 -0.221 -15.671 1.00 0.00 H new ATOM 0 HG21 THR A 36 -7.321 0.994 -15.598 1.00 0.00 H new ATOM 0 HG22 THR A 36 -8.049 1.253 -13.995 1.00 0.00 H new ATOM 0 HG23 THR A 36 -6.565 2.124 -14.450 1.00 0.00 H new ATOM 528 N GLN A 37 -8.043 -0.415 -11.476 1.00 0.00 N ATOM 529 CA GLN A 37 -9.309 -0.236 -10.776 1.00 0.00 C ATOM 530 C GLN A 37 -9.105 0.513 -9.463 1.00 0.00 C ATOM 531 O GLN A 37 -9.916 1.360 -9.088 1.00 0.00 O ATOM 532 CB GLN A 37 -9.964 -1.592 -10.507 1.00 0.00 C ATOM 533 CG GLN A 37 -10.413 -2.312 -11.768 1.00 0.00 C ATOM 534 CD GLN A 37 -11.756 -1.822 -12.273 1.00 0.00 C ATOM 535 OE1 GLN A 37 -12.777 -2.487 -12.101 1.00 0.00 O ATOM 536 NE2 GLN A 37 -11.761 -0.652 -12.902 1.00 0.00 N ATOM 0 H GLN A 37 -7.830 -1.382 -11.722 1.00 0.00 H new ATOM 0 HA GLN A 37 -9.966 0.357 -11.413 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -9.260 -2.226 -9.968 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -10.826 -1.447 -9.855 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -9.664 -2.174 -12.547 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -10.472 -3.382 -11.569 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -10.891 -0.134 -13.022 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -12.635 -0.272 -13.265 1.00 0.00 H new ATOM 545 N ILE A 38 -8.017 0.195 -8.770 1.00 0.00 N ATOM 546 CA ILE A 38 -7.706 0.838 -7.500 1.00 0.00 C ATOM 547 C ILE A 38 -7.229 2.271 -7.711 1.00 0.00 C ATOM 548 O ILE A 38 -7.770 3.210 -7.126 1.00 0.00 O ATOM 549 CB ILE A 38 -6.627 0.059 -6.723 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.903 -1.444 -6.794 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.576 0.526 -5.276 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.958 -2.272 -5.951 1.00 0.00 C ATOM 0 H ILE A 38 -7.336 -0.504 -9.067 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.627 0.846 -6.917 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.657 0.254 -7.181 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.926 -1.633 -6.470 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.832 -1.770 -7.832 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.809 -0.033 -4.740 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.338 1.589 -5.245 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.544 0.357 -4.805 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -6.212 -3.327 -6.049 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.934 -2.112 -6.289 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -6.046 -1.974 -4.906 1.00 0.00 H new ATOM 564 N THR A 39 -6.214 2.433 -8.554 1.00 0.00 N ATOM 565 CA THR A 39 -5.664 3.751 -8.844 1.00 0.00 C ATOM 566 C THR A 39 -6.767 4.740 -9.204 1.00 0.00 C ATOM 567 O THR A 39 -6.758 5.886 -8.756 1.00 0.00 O ATOM 568 CB THR A 39 -4.645 3.693 -9.998 1.00 0.00 C ATOM 569 OG1 THR A 39 -3.557 2.831 -9.648 1.00 0.00 O ATOM 570 CG2 THR A 39 -4.115 5.082 -10.322 1.00 0.00 C ATOM 0 H THR A 39 -5.756 1.667 -9.048 1.00 0.00 H new ATOM 0 HA THR A 39 -5.158 4.089 -7.939 1.00 0.00 H new ATOM 0 HB THR A 39 -5.150 3.299 -10.880 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.818 1.898 -9.797 1.00 0.00 H new ATOM 0 HG21 THR A 39 -3.397 5.016 -11.140 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.942 5.728 -10.617 1.00 0.00 H new ATOM 0 HG23 THR A 39 -3.625 5.499 -9.442 1.00 0.00 H new ATOM 578 N LYS A 40 -7.718 4.289 -10.016 1.00 0.00 N ATOM 579 CA LYS A 40 -8.830 5.132 -10.435 1.00 0.00 C ATOM 580 C LYS A 40 -9.602 5.656 -9.228 1.00 0.00 C ATOM 581 O LYS A 40 -10.057 6.799 -9.218 1.00 0.00 O ATOM 582 CB LYS A 40 -9.771 4.351 -11.355 1.00 0.00 C ATOM 583 CG LYS A 40 -9.212 4.130 -12.750 1.00 0.00 C ATOM 584 CD LYS A 40 -9.767 2.863 -13.379 1.00 0.00 C ATOM 585 CE LYS A 40 -11.280 2.930 -13.524 1.00 0.00 C ATOM 586 NZ LYS A 40 -11.700 4.001 -14.469 1.00 0.00 N ATOM 0 H LYS A 40 -7.740 3.343 -10.397 1.00 0.00 H new ATOM 0 HA LYS A 40 -8.422 5.983 -10.980 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.988 3.384 -10.902 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -10.717 4.886 -11.432 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.454 4.986 -13.380 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -8.125 4.067 -12.702 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.313 2.712 -14.358 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.497 2.003 -12.767 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.654 1.968 -13.876 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.731 3.110 -12.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.716 3.907 -14.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.517 4.932 -14.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.161 3.914 -15.354 1.00 0.00 H new ATOM 600 N ALA A 41 -9.743 4.812 -8.211 1.00 0.00 N ATOM 601 CA ALA A 41 -10.456 5.191 -6.997 1.00 0.00 C ATOM 602 C ALA A 41 -9.649 6.191 -6.176 1.00 0.00 C ATOM 603 O ALA A 41 -10.174 7.211 -5.732 1.00 0.00 O ATOM 604 CB ALA A 41 -10.775 3.958 -6.165 1.00 0.00 C ATOM 0 H ALA A 41 -9.373 3.861 -8.204 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.390 5.670 -7.289 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.307 4.256 -5.262 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.398 3.278 -6.746 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.848 3.455 -5.890 1.00 0.00 H new ATOM 610 N ALA A 42 -8.370 5.891 -5.977 1.00 0.00 N ATOM 611 CA ALA A 42 -7.490 6.764 -5.211 1.00 0.00 C ATOM 612 C ALA A 42 -7.452 8.167 -5.808 1.00 0.00 C ATOM 613 O ALA A 42 -7.902 9.129 -5.186 1.00 0.00 O ATOM 614 CB ALA A 42 -6.088 6.177 -5.147 1.00 0.00 C ATOM 0 H ALA A 42 -7.920 5.049 -6.336 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.886 6.839 -4.198 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.442 6.840 -4.572 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -6.125 5.199 -4.667 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.692 6.071 -6.157 1.00 0.00 H new ATOM 620 N ILE A 43 -6.911 8.275 -7.017 1.00 0.00 N ATOM 621 CA ILE A 43 -6.815 9.560 -7.699 1.00 0.00 C ATOM 622 C ILE A 43 -8.116 10.345 -7.577 1.00 0.00 C ATOM 623 O ILE A 43 -8.113 11.577 -7.566 1.00 0.00 O ATOM 624 CB ILE A 43 -6.474 9.383 -9.190 1.00 0.00 C ATOM 625 CG1 ILE A 43 -5.117 8.693 -9.346 1.00 0.00 C ATOM 626 CG2 ILE A 43 -6.474 10.729 -9.897 1.00 0.00 C ATOM 627 CD1 ILE A 43 -3.942 9.598 -9.047 1.00 0.00 C ATOM 0 H ILE A 43 -6.533 7.488 -7.544 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.011 10.114 -7.215 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.236 8.754 -9.650 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.079 7.830 -8.682 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -5.025 8.316 -10.365 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -6.231 10.587 -10.950 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.460 11.185 -9.810 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.731 11.381 -9.438 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.013 9.043 -9.178 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.955 10.449 -9.728 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -4.010 9.955 -8.019 1.00 0.00 H new ATOM 639 N LYS A 44 -9.229 9.625 -7.483 1.00 0.00 N ATOM 640 CA LYS A 44 -10.539 10.253 -7.358 1.00 0.00 C ATOM 641 C LYS A 44 -10.743 10.812 -5.954 1.00 0.00 C ATOM 642 O LYS A 44 -11.383 11.848 -5.775 1.00 0.00 O ATOM 643 CB LYS A 44 -11.644 9.245 -7.683 1.00 0.00 C ATOM 644 CG LYS A 44 -12.027 9.216 -9.153 1.00 0.00 C ATOM 645 CD LYS A 44 -13.063 10.279 -9.480 1.00 0.00 C ATOM 646 CE LYS A 44 -14.471 9.804 -9.157 1.00 0.00 C ATOM 647 NZ LYS A 44 -15.507 10.690 -9.757 1.00 0.00 N ATOM 0 H LYS A 44 -9.250 8.605 -7.491 1.00 0.00 H new ATOM 0 HA LYS A 44 -10.588 11.078 -8.069 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.317 8.250 -7.382 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.527 9.483 -7.091 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.138 9.372 -9.765 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -12.421 8.232 -9.408 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -12.846 11.186 -8.916 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.999 10.538 -10.537 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -14.605 8.787 -9.526 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.604 9.771 -8.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -16.453 10.332 -9.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.396 11.655 -9.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.397 10.702 -10.791 1.00 0.00 H new ATOM 661 N ALA A 45 -10.194 10.120 -4.961 1.00 0.00 N ATOM 662 CA ALA A 45 -10.313 10.549 -3.573 1.00 0.00 C ATOM 663 C ALA A 45 -9.149 11.451 -3.176 1.00 0.00 C ATOM 664 O ALA A 45 -8.860 11.621 -1.991 1.00 0.00 O ATOM 665 CB ALA A 45 -10.385 9.341 -2.651 1.00 0.00 C ATOM 0 H ALA A 45 -9.662 9.260 -5.092 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.234 11.123 -3.474 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.474 9.677 -1.618 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.253 8.736 -2.912 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.480 8.744 -2.762 1.00 0.00 H new ATOM 671 N ILE A 46 -8.485 12.026 -4.173 1.00 0.00 N ATOM 672 CA ILE A 46 -7.353 12.911 -3.926 1.00 0.00 C ATOM 673 C ILE A 46 -7.696 13.961 -2.875 1.00 0.00 C ATOM 674 O ILE A 46 -6.922 14.204 -1.948 1.00 0.00 O ATOM 675 CB ILE A 46 -6.901 13.620 -5.216 1.00 0.00 C ATOM 676 CG1 ILE A 46 -5.433 14.035 -5.108 1.00 0.00 C ATOM 677 CG2 ILE A 46 -7.781 14.830 -5.492 1.00 0.00 C ATOM 678 CD1 ILE A 46 -4.722 14.094 -6.442 1.00 0.00 C ATOM 0 H ILE A 46 -8.711 11.895 -5.159 1.00 0.00 H new ATOM 0 HA ILE A 46 -6.538 12.287 -3.560 1.00 0.00 H new ATOM 0 HB ILE A 46 -7.002 12.925 -6.050 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.375 15.013 -4.631 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.912 13.332 -4.458 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -7.449 15.320 -6.407 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -8.816 14.508 -5.608 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -7.710 15.529 -4.659 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.686 14.395 -6.289 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.749 13.111 -6.912 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -5.219 14.819 -7.087 1.00 0.00 H new ATOM 690 N LYS A 47 -8.861 14.582 -3.025 1.00 0.00 N ATOM 691 CA LYS A 47 -9.309 15.605 -2.088 1.00 0.00 C ATOM 692 C LYS A 47 -9.159 15.127 -0.647 1.00 0.00 C ATOM 693 O LYS A 47 -8.824 15.907 0.245 1.00 0.00 O ATOM 694 CB LYS A 47 -10.768 15.975 -2.364 1.00 0.00 C ATOM 695 CG LYS A 47 -11.708 14.781 -2.370 1.00 0.00 C ATOM 696 CD LYS A 47 -12.921 15.031 -3.250 1.00 0.00 C ATOM 697 CE LYS A 47 -13.697 13.749 -3.507 1.00 0.00 C ATOM 698 NZ LYS A 47 -14.791 13.951 -4.497 1.00 0.00 N ATOM 0 H LYS A 47 -9.512 14.394 -3.787 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.684 16.487 -2.227 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -11.103 16.686 -1.609 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -10.830 16.480 -3.328 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -11.175 13.899 -2.725 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.034 14.568 -1.352 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -13.573 15.763 -2.773 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -12.601 15.460 -4.199 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -13.016 12.979 -3.870 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -14.118 13.385 -2.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -15.296 13.054 -4.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -15.455 14.667 -4.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -14.387 14.273 -5.400 1.00 0.00 H new ATOM 712 N PHE A 48 -9.408 13.840 -0.427 1.00 0.00 N ATOM 713 CA PHE A 48 -9.300 13.258 0.906 1.00 0.00 C ATOM 714 C PHE A 48 -8.197 12.205 0.951 1.00 0.00 C ATOM 715 O PHE A 48 -8.148 11.381 1.865 1.00 0.00 O ATOM 716 CB PHE A 48 -10.634 12.635 1.323 1.00 0.00 C ATOM 717 CG PHE A 48 -11.828 13.454 0.926 1.00 0.00 C ATOM 718 CD1 PHE A 48 -11.777 14.838 0.958 1.00 0.00 C ATOM 719 CD2 PHE A 48 -13.002 12.839 0.520 1.00 0.00 C ATOM 720 CE1 PHE A 48 -12.876 15.594 0.593 1.00 0.00 C ATOM 721 CE2 PHE A 48 -14.104 13.590 0.154 1.00 0.00 C ATOM 722 CZ PHE A 48 -14.040 14.969 0.190 1.00 0.00 C ATOM 0 H PHE A 48 -9.686 13.181 -1.154 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.046 14.055 1.605 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -10.718 11.644 0.877 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.640 12.499 2.404 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -10.869 15.332 1.271 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -13.057 11.761 0.489 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -12.824 16.672 0.623 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -15.013 13.099 -0.160 1.00 0.00 H new ATOM 0 HZ PHE A 48 -14.899 15.558 -0.097 1.00 0.00 H new ATOM 732 N TYR A 49 -7.315 12.238 -0.041 1.00 0.00 N ATOM 733 CA TYR A 49 -6.214 11.285 -0.117 1.00 0.00 C ATOM 734 C TYR A 49 -5.630 11.016 1.266 1.00 0.00 C ATOM 735 O TYR A 49 -5.225 9.895 1.576 1.00 0.00 O ATOM 736 CB TYR A 49 -5.122 11.808 -1.051 1.00 0.00 C ATOM 737 CG TYR A 49 -4.075 12.644 -0.350 1.00 0.00 C ATOM 738 CD1 TYR A 49 -4.302 13.986 -0.072 1.00 0.00 C ATOM 739 CD2 TYR A 49 -2.859 12.092 0.033 1.00 0.00 C ATOM 740 CE1 TYR A 49 -3.348 14.754 0.568 1.00 0.00 C ATOM 741 CE2 TYR A 49 -1.900 12.852 0.675 1.00 0.00 C ATOM 742 CZ TYR A 49 -2.149 14.183 0.940 1.00 0.00 C ATOM 743 OH TYR A 49 -1.196 14.943 1.577 1.00 0.00 O ATOM 0 H TYR A 49 -7.341 12.914 -0.804 1.00 0.00 H new ATOM 0 HA TYR A 49 -6.605 10.349 -0.515 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -4.635 10.962 -1.536 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.584 12.404 -1.838 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -5.240 14.437 -0.361 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -2.660 11.051 -0.175 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -3.540 15.796 0.776 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -0.961 12.407 0.968 1.00 0.00 H new ATOM 0 HH TYR A 49 -0.411 14.389 1.771 1.00 0.00 H new ATOM 753 N LYS A 50 -5.589 12.053 2.096 1.00 0.00 N ATOM 754 CA LYS A 50 -5.057 11.931 3.448 1.00 0.00 C ATOM 755 C LYS A 50 -5.386 10.565 4.042 1.00 0.00 C ATOM 756 O LYS A 50 -4.621 10.024 4.840 1.00 0.00 O ATOM 757 CB LYS A 50 -5.623 13.037 4.342 1.00 0.00 C ATOM 758 CG LYS A 50 -5.113 14.424 3.991 1.00 0.00 C ATOM 759 CD LYS A 50 -6.043 15.508 4.509 1.00 0.00 C ATOM 760 CE LYS A 50 -5.326 16.843 4.638 1.00 0.00 C ATOM 761 NZ LYS A 50 -6.102 17.811 5.462 1.00 0.00 N ATOM 0 H LYS A 50 -5.918 12.988 1.856 1.00 0.00 H new ATOM 0 HA LYS A 50 -3.973 12.033 3.395 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -6.711 13.030 4.270 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -5.371 12.818 5.380 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -4.118 14.564 4.414 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -5.015 14.514 2.909 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.892 15.614 3.834 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -6.442 15.213 5.479 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.346 16.687 5.088 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -5.158 17.263 3.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -5.580 18.708 5.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -7.028 17.980 5.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -6.240 17.422 6.416 1.00 0.00 H new ATOM 775 N HIS A 51 -6.528 10.012 3.645 1.00 0.00 N ATOM 776 CA HIS A 51 -6.956 8.707 4.137 1.00 0.00 C ATOM 777 C HIS A 51 -6.386 7.587 3.272 1.00 0.00 C ATOM 778 O HIS A 51 -5.788 6.639 3.781 1.00 0.00 O ATOM 779 CB HIS A 51 -8.482 8.623 4.159 1.00 0.00 C ATOM 780 CG HIS A 51 -9.091 9.117 5.436 1.00 0.00 C ATOM 781 ND1 HIS A 51 -10.060 8.421 6.126 1.00 0.00 N ATOM 782 CD2 HIS A 51 -8.860 10.245 6.147 1.00 0.00 C ATOM 783 CE1 HIS A 51 -10.402 9.101 7.206 1.00 0.00 C ATOM 784 NE2 HIS A 51 -9.688 10.211 7.243 1.00 0.00 N ATOM 0 H HIS A 51 -7.173 10.447 2.985 1.00 0.00 H new ATOM 0 HA HIS A 51 -6.578 8.587 5.152 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -8.882 9.203 3.327 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -8.783 7.588 3.999 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -8.156 11.026 5.899 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -11.140 8.800 7.935 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -9.742 10.927 7.967 1.00 0.00 H new ATOM 792 N VAL A 52 -6.576 7.702 1.961 1.00 0.00 N ATOM 793 CA VAL A 52 -6.081 6.699 1.026 1.00 0.00 C ATOM 794 C VAL A 52 -4.648 6.298 1.359 1.00 0.00 C ATOM 795 O VAL A 52 -4.392 5.175 1.795 1.00 0.00 O ATOM 796 CB VAL A 52 -6.135 7.211 -0.426 1.00 0.00 C ATOM 797 CG1 VAL A 52 -5.214 6.391 -1.316 1.00 0.00 C ATOM 798 CG2 VAL A 52 -7.563 7.178 -0.949 1.00 0.00 C ATOM 0 H VAL A 52 -7.069 8.480 1.523 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.730 5.829 1.121 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.790 8.245 -0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.266 6.767 -2.338 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.190 6.470 -0.951 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.526 5.347 -1.298 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.583 7.543 -1.976 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.937 6.155 -0.920 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.193 7.813 -0.326 1.00 0.00 H new ATOM 808 N VAL A 53 -3.716 7.222 1.150 1.00 0.00 N ATOM 809 CA VAL A 53 -2.308 6.966 1.429 1.00 0.00 C ATOM 810 C VAL A 53 -2.146 6.049 2.636 1.00 0.00 C ATOM 811 O VAL A 53 -1.536 4.984 2.541 1.00 0.00 O ATOM 812 CB VAL A 53 -1.539 8.275 1.685 1.00 0.00 C ATOM 813 CG1 VAL A 53 -0.174 7.984 2.288 1.00 0.00 C ATOM 814 CG2 VAL A 53 -1.403 9.073 0.397 1.00 0.00 C ATOM 0 H VAL A 53 -3.911 8.156 0.788 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.894 6.478 0.547 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.104 8.874 2.399 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.354 8.921 2.462 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.299 7.457 3.234 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.403 7.364 1.601 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.857 9.995 0.596 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.861 8.482 -0.341 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.394 9.314 0.012 1.00 0.00 H new ATOM 824 N GLN A 54 -2.696 6.470 3.770 1.00 0.00 N ATOM 825 CA GLN A 54 -2.611 5.686 4.997 1.00 0.00 C ATOM 826 C GLN A 54 -3.035 4.242 4.750 1.00 0.00 C ATOM 827 O GLN A 54 -2.269 3.310 4.994 1.00 0.00 O ATOM 828 CB GLN A 54 -3.487 6.308 6.086 1.00 0.00 C ATOM 829 CG GLN A 54 -3.198 5.773 7.479 1.00 0.00 C ATOM 830 CD GLN A 54 -3.833 6.611 8.570 1.00 0.00 C ATOM 831 OE1 GLN A 54 -3.286 7.636 8.979 1.00 0.00 O ATOM 832 NE2 GLN A 54 -4.994 6.180 9.049 1.00 0.00 N ATOM 0 H GLN A 54 -3.205 7.349 3.865 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.573 5.689 5.330 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.343 7.388 6.084 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.535 6.126 5.846 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -3.564 4.749 7.554 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.120 5.738 7.634 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -5.412 5.325 8.681 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -5.468 6.704 9.785 1.00 0.00 H new ATOM 841 N SER A 55 -4.260 4.064 4.265 1.00 0.00 N ATOM 842 CA SER A 55 -4.787 2.733 3.989 1.00 0.00 C ATOM 843 C SER A 55 -3.791 1.912 3.175 1.00 0.00 C ATOM 844 O SER A 55 -3.580 0.729 3.442 1.00 0.00 O ATOM 845 CB SER A 55 -6.116 2.833 3.238 1.00 0.00 C ATOM 846 OG SER A 55 -7.192 3.057 4.134 1.00 0.00 O ATOM 0 H SER A 55 -4.906 4.825 4.055 1.00 0.00 H new ATOM 0 HA SER A 55 -4.953 2.231 4.942 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.067 3.645 2.513 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.291 1.915 2.677 1.00 0.00 H new ATOM 0 HG SER A 55 -8.001 3.277 3.626 1.00 0.00 H new ATOM 852 N VAL A 56 -3.181 2.550 2.181 1.00 0.00 N ATOM 853 CA VAL A 56 -2.206 1.880 1.328 1.00 0.00 C ATOM 854 C VAL A 56 -1.031 1.354 2.145 1.00 0.00 C ATOM 855 O VAL A 56 -0.508 0.274 1.872 1.00 0.00 O ATOM 856 CB VAL A 56 -1.675 2.826 0.234 1.00 0.00 C ATOM 857 CG1 VAL A 56 -0.576 2.148 -0.570 1.00 0.00 C ATOM 858 CG2 VAL A 56 -2.808 3.280 -0.673 1.00 0.00 C ATOM 0 H VAL A 56 -3.345 3.529 1.947 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.720 1.043 0.856 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.250 3.707 0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.213 2.831 -1.338 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.246 1.878 0.093 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -0.972 1.249 -1.042 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -2.415 3.948 -1.440 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -3.265 2.411 -1.147 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.558 3.807 -0.083 1.00 0.00 H new ATOM 868 N GLU A 57 -0.622 2.125 3.147 1.00 0.00 N ATOM 869 CA GLU A 57 0.493 1.736 4.004 1.00 0.00 C ATOM 870 C GLU A 57 0.060 0.674 5.011 1.00 0.00 C ATOM 871 O GLU A 57 0.804 -0.263 5.302 1.00 0.00 O ATOM 872 CB GLU A 57 1.049 2.956 4.740 1.00 0.00 C ATOM 873 CG GLU A 57 1.376 4.123 3.824 1.00 0.00 C ATOM 874 CD GLU A 57 1.953 3.677 2.494 1.00 0.00 C ATOM 875 OE1 GLU A 57 1.300 2.865 1.806 1.00 0.00 O ATOM 876 OE2 GLU A 57 3.057 4.142 2.142 1.00 0.00 O ATOM 0 H GLU A 57 -1.045 3.022 3.386 1.00 0.00 H new ATOM 0 HA GLU A 57 1.275 1.315 3.372 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.323 3.282 5.485 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.950 2.665 5.279 1.00 0.00 H new ATOM 0 HG2 GLU A 57 0.472 4.705 3.647 1.00 0.00 H new ATOM 0 HG3 GLU A 57 2.087 4.782 4.322 1.00 0.00 H new ATOM 883 N LYS A 58 -1.149 0.827 5.540 1.00 0.00 N ATOM 884 CA LYS A 58 -1.683 -0.117 6.514 1.00 0.00 C ATOM 885 C LYS A 58 -1.902 -1.487 5.880 1.00 0.00 C ATOM 886 O LYS A 58 -1.309 -2.480 6.303 1.00 0.00 O ATOM 887 CB LYS A 58 -3.000 0.405 7.092 1.00 0.00 C ATOM 888 CG LYS A 58 -2.883 1.780 7.727 1.00 0.00 C ATOM 889 CD LYS A 58 -2.021 1.744 8.979 1.00 0.00 C ATOM 890 CE LYS A 58 -1.956 3.108 9.649 1.00 0.00 C ATOM 891 NZ LYS A 58 -3.256 3.485 10.268 1.00 0.00 N ATOM 0 H LYS A 58 -1.778 1.596 5.310 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.955 -0.220 7.319 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.746 0.443 6.298 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.365 -0.301 7.838 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.454 2.478 7.009 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.876 2.152 7.978 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -2.424 1.012 9.679 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.014 1.416 8.720 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -1.179 3.100 10.413 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -1.672 3.861 8.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.128 4.334 10.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -3.952 3.683 9.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.598 2.702 10.861 1.00 0.00 H new ATOM 905 N PHE A 59 -2.756 -1.534 4.863 1.00 0.00 N ATOM 906 CA PHE A 59 -3.053 -2.783 4.170 1.00 0.00 C ATOM 907 C PHE A 59 -1.783 -3.601 3.957 1.00 0.00 C ATOM 908 O PHE A 59 -1.822 -4.832 3.932 1.00 0.00 O ATOM 909 CB PHE A 59 -3.721 -2.497 2.824 1.00 0.00 C ATOM 910 CG PHE A 59 -3.538 -3.598 1.818 1.00 0.00 C ATOM 911 CD1 PHE A 59 -4.411 -4.673 1.782 1.00 0.00 C ATOM 912 CD2 PHE A 59 -2.493 -3.558 0.909 1.00 0.00 C ATOM 913 CE1 PHE A 59 -4.245 -5.688 0.859 1.00 0.00 C ATOM 914 CE2 PHE A 59 -2.322 -4.569 -0.017 1.00 0.00 C ATOM 915 CZ PHE A 59 -3.200 -5.635 -0.043 1.00 0.00 C ATOM 0 H PHE A 59 -3.255 -0.722 4.500 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.737 -3.361 4.791 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.787 -2.335 2.984 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.316 -1.571 2.416 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.231 -4.718 2.483 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.804 -2.727 0.925 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.931 -6.522 0.843 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.503 -4.526 -0.720 1.00 0.00 H new ATOM 0 HZ PHE A 59 -3.070 -6.426 -0.767 1.00 0.00 H new ATOM 925 N ILE A 60 -0.659 -2.909 3.803 1.00 0.00 N ATOM 926 CA ILE A 60 0.623 -3.571 3.593 1.00 0.00 C ATOM 927 C ILE A 60 1.053 -4.343 4.835 1.00 0.00 C ATOM 928 O ILE A 60 1.576 -5.453 4.738 1.00 0.00 O ATOM 929 CB ILE A 60 1.724 -2.561 3.223 1.00 0.00 C ATOM 930 CG1 ILE A 60 1.508 -2.034 1.803 1.00 0.00 C ATOM 931 CG2 ILE A 60 3.097 -3.203 3.351 1.00 0.00 C ATOM 932 CD1 ILE A 60 2.348 -0.821 1.473 1.00 0.00 C ATOM 0 H ILE A 60 -0.610 -1.890 3.820 1.00 0.00 H new ATOM 0 HA ILE A 60 0.487 -4.267 2.765 1.00 0.00 H new ATOM 0 HB ILE A 60 1.671 -1.720 3.915 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.736 -2.828 1.091 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.455 -1.783 1.674 1.00 0.00 H new ATOM 0 HG21 ILE A 60 3.865 -2.476 3.086 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.250 -3.534 4.378 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.162 -4.060 2.681 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.142 -0.503 0.451 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.104 -0.011 2.161 1.00 0.00 H new ATOM 0 HD13 ILE A 60 3.404 -1.073 1.569 1.00 0.00 H new ATOM 944 N GLN A 61 0.828 -3.749 6.002 1.00 0.00 N ATOM 945 CA GLN A 61 1.191 -4.382 7.264 1.00 0.00 C ATOM 946 C GLN A 61 0.197 -5.479 7.630 1.00 0.00 C ATOM 947 O GLN A 61 0.553 -6.465 8.275 1.00 0.00 O ATOM 948 CB GLN A 61 1.253 -3.340 8.383 1.00 0.00 C ATOM 949 CG GLN A 61 -0.105 -2.763 8.752 1.00 0.00 C ATOM 950 CD GLN A 61 -0.197 -2.377 10.215 1.00 0.00 C ATOM 951 OE1 GLN A 61 0.719 -2.638 10.996 1.00 0.00 O ATOM 952 NE2 GLN A 61 -1.305 -1.753 10.594 1.00 0.00 N ATOM 0 H GLN A 61 0.396 -2.830 6.100 1.00 0.00 H new ATOM 0 HA GLN A 61 2.175 -4.835 7.143 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.698 -3.795 9.268 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.912 -2.528 8.076 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -0.302 -1.886 8.136 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.880 -3.494 8.524 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -2.038 -1.557 9.913 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -1.423 -1.469 11.567 1.00 0.00 H new ATOM 961 N LYS A 62 -1.052 -5.301 7.213 1.00 0.00 N ATOM 962 CA LYS A 62 -2.099 -6.276 7.494 1.00 0.00 C ATOM 963 C LYS A 62 -2.015 -7.458 6.534 1.00 0.00 C ATOM 964 O LYS A 62 -2.200 -8.608 6.933 1.00 0.00 O ATOM 965 CB LYS A 62 -3.477 -5.619 7.391 1.00 0.00 C ATOM 966 CG LYS A 62 -3.524 -4.212 7.961 1.00 0.00 C ATOM 967 CD LYS A 62 -3.307 -4.211 9.465 1.00 0.00 C ATOM 968 CE LYS A 62 -4.622 -4.342 10.218 1.00 0.00 C ATOM 969 NZ LYS A 62 -4.972 -5.766 10.480 1.00 0.00 N ATOM 0 H LYS A 62 -1.364 -4.490 6.679 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.954 -6.645 8.509 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -3.778 -5.588 6.344 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -4.206 -6.238 7.914 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.760 -3.599 7.482 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -4.488 -3.758 7.731 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.646 -5.033 9.739 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.807 -3.289 9.761 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.554 -3.805 11.164 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.419 -3.872 9.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -5.883 -5.988 10.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -4.233 -6.383 10.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -5.045 -5.923 11.506 1.00 0.00 H new ATOM 983 N CYS A 63 -1.733 -7.168 5.269 1.00 0.00 N ATOM 984 CA CYS A 63 -1.624 -8.207 4.252 1.00 0.00 C ATOM 985 C CYS A 63 -0.634 -9.285 4.681 1.00 0.00 C ATOM 986 O CYS A 63 -0.075 -9.230 5.776 1.00 0.00 O ATOM 987 CB CYS A 63 -1.188 -7.600 2.917 1.00 0.00 C ATOM 988 SG CYS A 63 0.578 -7.226 2.818 1.00 0.00 S ATOM 0 H CYS A 63 -1.576 -6.221 4.923 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.605 -8.667 4.131 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.448 -8.290 2.114 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.753 -6.684 2.745 1.00 0.00 H new ATOM 0 HG CYS A 63 0.938 -6.551 3.869 1.00 0.00 H new ATOM 994 N LYS A 64 -0.422 -10.267 3.811 1.00 0.00 N ATOM 995 CA LYS A 64 0.499 -11.360 4.098 1.00 0.00 C ATOM 996 C LYS A 64 1.842 -11.134 3.411 1.00 0.00 C ATOM 997 O LYS A 64 1.949 -10.394 2.433 1.00 0.00 O ATOM 998 CB LYS A 64 -0.100 -12.693 3.645 1.00 0.00 C ATOM 999 CG LYS A 64 -1.444 -13.003 4.281 1.00 0.00 C ATOM 1000 CD LYS A 64 -2.594 -12.466 3.445 1.00 0.00 C ATOM 1001 CE LYS A 64 -3.849 -13.308 3.617 1.00 0.00 C ATOM 1002 NZ LYS A 64 -4.979 -12.793 2.796 1.00 0.00 N ATOM 0 H LYS A 64 -0.877 -10.328 2.900 1.00 0.00 H new ATOM 0 HA LYS A 64 0.662 -11.390 5.175 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.215 -12.681 2.561 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.599 -13.495 3.883 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.551 -14.081 4.399 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.484 -12.567 5.279 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -2.804 -11.436 3.732 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.305 -12.452 2.394 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -3.636 -14.339 3.335 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.139 -13.318 4.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -5.815 -13.394 2.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.199 -11.818 3.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -4.713 -12.807 1.791 1.00 0.00 H new ATOM 1016 N PRO A 65 2.892 -11.786 3.932 1.00 0.00 N ATOM 1017 CA PRO A 65 4.246 -11.674 3.382 1.00 0.00 C ATOM 1018 C PRO A 65 4.273 -11.849 1.867 1.00 0.00 C ATOM 1019 O PRO A 65 5.235 -11.458 1.206 1.00 0.00 O ATOM 1020 CB PRO A 65 5.003 -12.815 4.066 1.00 0.00 C ATOM 1021 CG PRO A 65 4.271 -13.043 5.344 1.00 0.00 C ATOM 1022 CD PRO A 65 2.837 -12.685 5.097 1.00 0.00 C ATOM 0 HA PRO A 65 4.678 -10.690 3.562 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.009 -13.713 3.448 1.00 0.00 H new ATOM 0 HB3 PRO A 65 6.044 -12.546 4.248 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.360 -14.083 5.659 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.689 -12.431 6.143 1.00 0.00 H new ATOM 0 HD2 PRO A 65 2.234 -13.569 4.891 1.00 0.00 H new ATOM 0 HD3 PRO A 65 2.394 -12.192 5.962 1.00 0.00 H new ATOM 1030 N GLU A 66 3.212 -12.438 1.325 1.00 0.00 N ATOM 1031 CA GLU A 66 3.116 -12.664 -0.112 1.00 0.00 C ATOM 1032 C GLU A 66 2.570 -11.429 -0.822 1.00 0.00 C ATOM 1033 O GLU A 66 2.894 -11.172 -1.982 1.00 0.00 O ATOM 1034 CB GLU A 66 2.221 -13.870 -0.402 1.00 0.00 C ATOM 1035 CG GLU A 66 0.754 -13.629 -0.086 1.00 0.00 C ATOM 1036 CD GLU A 66 0.011 -14.909 0.245 1.00 0.00 C ATOM 1037 OE1 GLU A 66 0.303 -15.945 -0.389 1.00 0.00 O ATOM 1038 OE2 GLU A 66 -0.863 -14.874 1.136 1.00 0.00 O ATOM 0 H GLU A 66 2.408 -12.767 1.859 1.00 0.00 H new ATOM 0 HA GLU A 66 4.118 -12.865 -0.490 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.318 -14.139 -1.454 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.574 -14.722 0.179 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.676 -12.940 0.755 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.277 -13.146 -0.939 1.00 0.00 H new ATOM 1045 N TYR A 67 1.740 -10.668 -0.118 1.00 0.00 N ATOM 1046 CA TYR A 67 1.146 -9.461 -0.681 1.00 0.00 C ATOM 1047 C TYR A 67 2.018 -8.241 -0.397 1.00 0.00 C ATOM 1048 O TYR A 67 1.520 -7.123 -0.271 1.00 0.00 O ATOM 1049 CB TYR A 67 -0.256 -9.243 -0.110 1.00 0.00 C ATOM 1050 CG TYR A 67 -1.294 -10.183 -0.680 1.00 0.00 C ATOM 1051 CD1 TYR A 67 -1.546 -11.414 -0.087 1.00 0.00 C ATOM 1052 CD2 TYR A 67 -2.023 -9.840 -1.812 1.00 0.00 C ATOM 1053 CE1 TYR A 67 -2.494 -12.276 -0.605 1.00 0.00 C ATOM 1054 CE2 TYR A 67 -2.973 -10.695 -2.336 1.00 0.00 C ATOM 1055 CZ TYR A 67 -3.205 -11.912 -1.729 1.00 0.00 C ATOM 1056 OH TYR A 67 -4.149 -12.767 -2.248 1.00 0.00 O ATOM 0 H TYR A 67 1.463 -10.865 0.844 1.00 0.00 H new ATOM 0 HA TYR A 67 1.075 -9.591 -1.761 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.222 -9.366 0.972 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.563 -8.215 -0.304 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.992 -11.702 0.794 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.844 -8.888 -2.290 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -2.677 -13.230 -0.132 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.531 -10.412 -3.216 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.445 -12.436 -3.122 1.00 0.00 H new ATOM 1066 N LYS A 68 3.324 -8.466 -0.298 1.00 0.00 N ATOM 1067 CA LYS A 68 4.268 -7.388 -0.032 1.00 0.00 C ATOM 1068 C LYS A 68 4.665 -6.680 -1.323 1.00 0.00 C ATOM 1069 O LYS A 68 5.092 -5.525 -1.304 1.00 0.00 O ATOM 1070 CB LYS A 68 5.515 -7.935 0.666 1.00 0.00 C ATOM 1071 CG LYS A 68 5.237 -8.516 2.042 1.00 0.00 C ATOM 1072 CD LYS A 68 4.372 -7.586 2.876 1.00 0.00 C ATOM 1073 CE LYS A 68 4.430 -7.946 4.352 1.00 0.00 C ATOM 1074 NZ LYS A 68 3.835 -6.881 5.206 1.00 0.00 N ATOM 0 H LYS A 68 3.753 -9.386 -0.398 1.00 0.00 H new ATOM 0 HA LYS A 68 3.780 -6.665 0.622 1.00 0.00 H new ATOM 0 HB2 LYS A 68 5.963 -8.706 0.039 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.249 -7.135 0.760 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.740 -9.480 1.937 1.00 0.00 H new ATOM 0 HG3 LYS A 68 6.180 -8.698 2.558 1.00 0.00 H new ATOM 0 HD2 LYS A 68 4.704 -6.557 2.738 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.340 -7.637 2.528 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.900 -8.884 4.518 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.467 -8.110 4.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 3.629 -7.267 6.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.506 -6.091 5.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 2.954 -6.539 4.772 1.00 0.00 H new ATOM 1088 N VAL A 69 4.520 -7.379 -2.444 1.00 0.00 N ATOM 1089 CA VAL A 69 4.861 -6.817 -3.746 1.00 0.00 C ATOM 1090 C VAL A 69 3.729 -5.948 -4.282 1.00 0.00 C ATOM 1091 O VAL A 69 3.938 -4.822 -4.736 1.00 0.00 O ATOM 1092 CB VAL A 69 5.174 -7.923 -4.771 1.00 0.00 C ATOM 1093 CG1 VAL A 69 4.781 -7.480 -6.172 1.00 0.00 C ATOM 1094 CG2 VAL A 69 6.647 -8.298 -4.715 1.00 0.00 C ATOM 0 H VAL A 69 4.169 -8.336 -2.477 1.00 0.00 H new ATOM 0 HA VAL A 69 5.750 -6.203 -3.603 1.00 0.00 H new ATOM 0 HB VAL A 69 4.587 -8.806 -4.518 1.00 0.00 H new ATOM 0 HG11 VAL A 69 5.010 -8.274 -6.882 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.713 -7.265 -6.199 1.00 0.00 H new ATOM 0 HG13 VAL A 69 5.339 -6.582 -6.440 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.851 -9.081 -5.446 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.254 -7.422 -4.942 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.892 -8.660 -3.717 1.00 0.00 H new ATOM 1104 N PRO A 70 2.499 -6.479 -4.230 1.00 0.00 N ATOM 1105 CA PRO A 70 1.308 -5.769 -4.705 1.00 0.00 C ATOM 1106 C PRO A 70 1.238 -4.339 -4.179 1.00 0.00 C ATOM 1107 O PRO A 70 1.232 -3.382 -4.953 1.00 0.00 O ATOM 1108 CB PRO A 70 0.152 -6.602 -4.147 1.00 0.00 C ATOM 1109 CG PRO A 70 0.714 -7.972 -3.988 1.00 0.00 C ATOM 1110 CD PRO A 70 2.175 -7.815 -3.701 1.00 0.00 C ATOM 0 HA PRO A 70 1.296 -5.673 -5.791 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.198 -6.205 -3.194 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -0.701 -6.600 -4.826 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.216 -8.501 -3.176 1.00 0.00 H new ATOM 0 HG3 PRO A 70 0.560 -8.560 -4.893 1.00 0.00 H new ATOM 0 HD2 PRO A 70 2.382 -7.883 -2.633 1.00 0.00 H new ATOM 0 HD3 PRO A 70 2.764 -8.592 -4.189 1.00 0.00 H new ATOM 1118 N GLY A 71 1.184 -4.202 -2.858 1.00 0.00 N ATOM 1119 CA GLY A 71 1.115 -2.885 -2.251 1.00 0.00 C ATOM 1120 C GLY A 71 2.004 -1.877 -2.952 1.00 0.00 C ATOM 1121 O GLY A 71 1.523 -0.869 -3.472 1.00 0.00 O ATOM 0 H GLY A 71 1.187 -4.979 -2.197 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.084 -2.532 -2.272 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.407 -2.955 -1.203 1.00 0.00 H new ATOM 1125 N LEU A 72 3.305 -2.146 -2.964 1.00 0.00 N ATOM 1126 CA LEU A 72 4.265 -1.253 -3.604 1.00 0.00 C ATOM 1127 C LEU A 72 3.713 -0.715 -4.920 1.00 0.00 C ATOM 1128 O LEU A 72 3.730 0.492 -5.165 1.00 0.00 O ATOM 1129 CB LEU A 72 5.585 -1.985 -3.852 1.00 0.00 C ATOM 1130 CG LEU A 72 6.829 -1.104 -3.968 1.00 0.00 C ATOM 1131 CD1 LEU A 72 6.666 -0.095 -5.093 1.00 0.00 C ATOM 1132 CD2 LEU A 72 7.105 -0.396 -2.650 1.00 0.00 C ATOM 0 H LEU A 72 3.719 -2.975 -2.538 1.00 0.00 H new ATOM 0 HA LEU A 72 4.444 -0.411 -2.935 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.742 -2.695 -3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.489 -2.566 -4.769 1.00 0.00 H new ATOM 0 HG LEU A 72 7.682 -1.742 -4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.561 0.523 -5.160 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.517 -0.622 -6.036 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.802 0.539 -4.891 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.994 0.227 -2.751 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.252 0.229 -2.387 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.267 -1.136 -1.866 1.00 0.00 H new ATOM 1144 N TYR A 73 3.224 -1.617 -5.764 1.00 0.00 N ATOM 1145 CA TYR A 73 2.668 -1.232 -7.056 1.00 0.00 C ATOM 1146 C TYR A 73 1.547 -0.211 -6.884 1.00 0.00 C ATOM 1147 O TYR A 73 1.510 0.808 -7.574 1.00 0.00 O ATOM 1148 CB TYR A 73 2.141 -2.464 -7.794 1.00 0.00 C ATOM 1149 CG TYR A 73 3.233 -3.376 -8.306 1.00 0.00 C ATOM 1150 CD1 TYR A 73 4.557 -3.189 -7.926 1.00 0.00 C ATOM 1151 CD2 TYR A 73 2.942 -4.425 -9.170 1.00 0.00 C ATOM 1152 CE1 TYR A 73 5.558 -4.019 -8.391 1.00 0.00 C ATOM 1153 CE2 TYR A 73 3.937 -5.261 -9.639 1.00 0.00 C ATOM 1154 CZ TYR A 73 5.243 -5.054 -9.247 1.00 0.00 C ATOM 1155 OH TYR A 73 6.237 -5.884 -9.713 1.00 0.00 O ATOM 0 H TYR A 73 3.201 -2.619 -5.577 1.00 0.00 H new ATOM 0 HA TYR A 73 3.464 -0.776 -7.645 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.492 -3.028 -7.124 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.527 -2.139 -8.634 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.807 -2.380 -7.255 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.921 -4.589 -9.480 1.00 0.00 H new ATOM 0 HE1 TYR A 73 6.582 -3.859 -8.086 1.00 0.00 H new ATOM 0 HE2 TYR A 73 3.693 -6.072 -10.309 1.00 0.00 H new ATOM 0 HH TYR A 73 5.847 -6.561 -10.304 1.00 0.00 H new ATOM 1165 N VAL A 74 0.636 -0.492 -5.959 1.00 0.00 N ATOM 1166 CA VAL A 74 -0.485 0.402 -5.693 1.00 0.00 C ATOM 1167 C VAL A 74 -0.006 1.829 -5.456 1.00 0.00 C ATOM 1168 O VAL A 74 -0.601 2.786 -5.954 1.00 0.00 O ATOM 1169 CB VAL A 74 -1.298 -0.065 -4.471 1.00 0.00 C ATOM 1170 CG1 VAL A 74 -2.288 1.009 -4.046 1.00 0.00 C ATOM 1171 CG2 VAL A 74 -2.015 -1.371 -4.776 1.00 0.00 C ATOM 0 H VAL A 74 0.652 -1.332 -5.381 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.124 0.379 -6.576 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.610 -0.239 -3.644 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.853 0.661 -3.181 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.748 1.919 -3.784 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.973 1.218 -4.867 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -2.584 -1.686 -3.902 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.693 -1.226 -5.617 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.283 -2.138 -5.028 1.00 0.00 H new ATOM 1181 N ILE A 75 1.074 1.966 -4.694 1.00 0.00 N ATOM 1182 CA ILE A 75 1.635 3.277 -4.392 1.00 0.00 C ATOM 1183 C ILE A 75 2.143 3.962 -5.657 1.00 0.00 C ATOM 1184 O ILE A 75 1.920 5.156 -5.861 1.00 0.00 O ATOM 1185 CB ILE A 75 2.789 3.176 -3.378 1.00 0.00 C ATOM 1186 CG1 ILE A 75 2.259 2.738 -2.011 1.00 0.00 C ATOM 1187 CG2 ILE A 75 3.515 4.508 -3.268 1.00 0.00 C ATOM 1188 CD1 ILE A 75 3.331 2.193 -1.093 1.00 0.00 C ATOM 0 H ILE A 75 1.578 1.185 -4.274 1.00 0.00 H new ATOM 0 HA ILE A 75 0.831 3.871 -3.957 1.00 0.00 H new ATOM 0 HB ILE A 75 3.497 2.426 -3.730 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.776 3.588 -1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.493 1.976 -2.155 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.328 4.421 -2.547 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.921 4.783 -4.242 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.817 5.277 -2.936 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.883 1.903 -0.143 1.00 0.00 H new ATOM 0 HD12 ILE A 75 3.798 1.323 -1.555 1.00 0.00 H new ATOM 0 HD13 ILE A 75 4.085 2.960 -0.919 1.00 0.00 H new ATOM 1200 N ASP A 76 2.824 3.198 -6.503 1.00 0.00 N ATOM 1201 CA ASP A 76 3.362 3.730 -7.750 1.00 0.00 C ATOM 1202 C ASP A 76 2.237 4.110 -8.708 1.00 0.00 C ATOM 1203 O ASP A 76 2.117 5.267 -9.112 1.00 0.00 O ATOM 1204 CB ASP A 76 4.287 2.706 -8.410 1.00 0.00 C ATOM 1205 CG ASP A 76 4.344 2.864 -9.917 1.00 0.00 C ATOM 1206 OD1 ASP A 76 3.391 2.426 -10.595 1.00 0.00 O ATOM 1207 OD2 ASP A 76 5.341 3.424 -10.418 1.00 0.00 O ATOM 0 H ASP A 76 3.017 2.208 -6.349 1.00 0.00 H new ATOM 0 HA ASP A 76 3.935 4.627 -7.516 1.00 0.00 H new ATOM 0 HB2 ASP A 76 5.291 2.809 -7.999 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.944 1.701 -8.166 1.00 0.00 H new ATOM 1212 N SER A 77 1.417 3.129 -9.069 1.00 0.00 N ATOM 1213 CA SER A 77 0.305 3.359 -9.984 1.00 0.00 C ATOM 1214 C SER A 77 -0.436 4.644 -9.626 1.00 0.00 C ATOM 1215 O SER A 77 -0.983 5.320 -10.497 1.00 0.00 O ATOM 1216 CB SER A 77 -0.662 2.174 -9.953 1.00 0.00 C ATOM 1217 OG SER A 77 -0.045 0.999 -10.449 1.00 0.00 O ATOM 0 H SER A 77 1.501 2.167 -8.742 1.00 0.00 H new ATOM 0 HA SER A 77 0.710 3.462 -10.991 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.003 2.006 -8.932 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.544 2.405 -10.550 1.00 0.00 H new ATOM 0 HG SER A 77 -0.538 0.213 -10.134 1.00 0.00 H new ATOM 1223 N ILE A 78 -0.448 4.974 -8.339 1.00 0.00 N ATOM 1224 CA ILE A 78 -1.119 6.177 -7.865 1.00 0.00 C ATOM 1225 C ILE A 78 -0.252 7.413 -8.083 1.00 0.00 C ATOM 1226 O ILE A 78 -0.576 8.275 -8.899 1.00 0.00 O ATOM 1227 CB ILE A 78 -1.477 6.071 -6.371 1.00 0.00 C ATOM 1228 CG1 ILE A 78 -2.673 5.138 -6.175 1.00 0.00 C ATOM 1229 CG2 ILE A 78 -1.774 7.449 -5.799 1.00 0.00 C ATOM 1230 CD1 ILE A 78 -2.734 4.515 -4.798 1.00 0.00 C ATOM 0 H ILE A 78 -0.000 4.424 -7.606 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.038 6.274 -8.444 1.00 0.00 H new ATOM 0 HB ILE A 78 -0.624 5.653 -5.837 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.592 5.696 -6.353 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.631 4.345 -6.922 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -2.025 7.358 -4.742 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -0.896 8.086 -5.910 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.613 7.892 -6.335 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.607 3.866 -4.731 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.832 3.929 -4.624 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -2.807 5.301 -4.046 1.00 0.00 H new ATOM 1242 N VAL A 79 0.852 7.490 -7.348 1.00 0.00 N ATOM 1243 CA VAL A 79 1.769 8.619 -7.462 1.00 0.00 C ATOM 1244 C VAL A 79 1.999 8.994 -8.922 1.00 0.00 C ATOM 1245 O VAL A 79 2.000 10.172 -9.278 1.00 0.00 O ATOM 1246 CB VAL A 79 3.126 8.309 -6.802 1.00 0.00 C ATOM 1247 CG1 VAL A 79 4.082 9.480 -6.972 1.00 0.00 C ATOM 1248 CG2 VAL A 79 2.938 7.972 -5.331 1.00 0.00 C ATOM 0 H VAL A 79 1.134 6.785 -6.667 1.00 0.00 H new ATOM 0 HA VAL A 79 1.305 9.458 -6.943 1.00 0.00 H new ATOM 0 HB VAL A 79 3.562 7.441 -7.297 1.00 0.00 H new ATOM 0 HG11 VAL A 79 5.035 9.243 -6.500 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.240 9.669 -8.034 1.00 0.00 H new ATOM 0 HG13 VAL A 79 3.656 10.368 -6.505 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.907 7.756 -4.881 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.481 8.819 -4.819 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.291 7.099 -5.237 1.00 0.00 H new ATOM 1258 N ARG A 80 2.195 7.983 -9.763 1.00 0.00 N ATOM 1259 CA ARG A 80 2.427 8.207 -11.184 1.00 0.00 C ATOM 1260 C ARG A 80 1.271 8.981 -11.809 1.00 0.00 C ATOM 1261 O ARG A 80 1.483 9.944 -12.546 1.00 0.00 O ATOM 1262 CB ARG A 80 2.612 6.872 -11.909 1.00 0.00 C ATOM 1263 CG ARG A 80 3.883 6.137 -11.516 1.00 0.00 C ATOM 1264 CD ARG A 80 4.375 5.236 -12.638 1.00 0.00 C ATOM 1265 NE ARG A 80 3.495 4.089 -12.845 1.00 0.00 N ATOM 1266 CZ ARG A 80 3.485 3.362 -13.957 1.00 0.00 C ATOM 1267 NH1 ARG A 80 4.303 3.661 -14.956 1.00 0.00 N ATOM 1268 NH2 ARG A 80 2.656 2.332 -14.069 1.00 0.00 N ATOM 0 H ARG A 80 2.198 7.002 -9.484 1.00 0.00 H new ATOM 0 HA ARG A 80 3.336 8.799 -11.289 1.00 0.00 H new ATOM 0 HB2 ARG A 80 1.754 6.233 -11.701 1.00 0.00 H new ATOM 0 HB3 ARG A 80 2.623 7.051 -12.984 1.00 0.00 H new ATOM 0 HG2 ARG A 80 4.658 6.859 -11.261 1.00 0.00 H new ATOM 0 HG3 ARG A 80 3.698 5.540 -10.623 1.00 0.00 H new ATOM 0 HD2 ARG A 80 4.444 5.811 -13.561 1.00 0.00 H new ATOM 0 HD3 ARG A 80 5.380 4.884 -12.406 1.00 0.00 H new ATOM 0 HE ARG A 80 2.853 3.832 -12.095 1.00 0.00 H new ATOM 0 HH11 ARG A 80 4.943 4.451 -14.872 1.00 0.00 H new ATOM 0 HH12 ARG A 80 4.293 3.101 -15.808 1.00 0.00 H new ATOM 0 HH21 ARG A 80 2.026 2.098 -13.301 1.00 0.00 H new ATOM 0 HH22 ARG A 80 2.648 1.774 -14.923 1.00 0.00 H new ATOM 1282 N GLN A 81 0.049 8.553 -11.510 1.00 0.00 N ATOM 1283 CA GLN A 81 -1.141 9.205 -12.044 1.00 0.00 C ATOM 1284 C GLN A 81 -1.272 10.626 -11.504 1.00 0.00 C ATOM 1285 O GLN A 81 -1.150 11.598 -12.250 1.00 0.00 O ATOM 1286 CB GLN A 81 -2.392 8.397 -11.695 1.00 0.00 C ATOM 1287 CG GLN A 81 -2.766 7.369 -12.751 1.00 0.00 C ATOM 1288 CD GLN A 81 -2.724 7.934 -14.157 1.00 0.00 C ATOM 1289 OE1 GLN A 81 -2.198 7.305 -15.075 1.00 0.00 O ATOM 1290 NE2 GLN A 81 -3.279 9.128 -14.332 1.00 0.00 N ATOM 0 H GLN A 81 -0.143 7.758 -10.901 1.00 0.00 H new ATOM 0 HA GLN A 81 -1.041 9.255 -13.128 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.232 7.888 -10.745 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.229 9.081 -11.553 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.085 6.521 -12.684 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -3.767 6.991 -12.545 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -3.704 9.614 -13.542 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -3.280 9.559 -15.256 1.00 0.00 H new ATOM 1299 N SER A 82 -1.519 10.738 -10.203 1.00 0.00 N ATOM 1300 CA SER A 82 -1.671 12.040 -9.563 1.00 0.00 C ATOM 1301 C SER A 82 -0.572 12.997 -10.014 1.00 0.00 C ATOM 1302 O SER A 82 -0.840 14.147 -10.365 1.00 0.00 O ATOM 1303 CB SER A 82 -1.640 11.890 -8.041 1.00 0.00 C ATOM 1304 OG SER A 82 -0.552 11.081 -7.630 1.00 0.00 O ATOM 0 H SER A 82 -1.618 9.943 -9.571 1.00 0.00 H new ATOM 0 HA SER A 82 -2.634 12.454 -9.860 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.562 12.873 -7.577 1.00 0.00 H new ATOM 0 HB3 SER A 82 -2.575 11.449 -7.697 1.00 0.00 H new ATOM 0 HG SER A 82 0.056 11.609 -7.071 1.00 0.00 H new ATOM 1310 N ARG A 83 0.667 12.515 -10.001 1.00 0.00 N ATOM 1311 CA ARG A 83 1.807 13.328 -10.407 1.00 0.00 C ATOM 1312 C ARG A 83 1.633 13.834 -11.835 1.00 0.00 C ATOM 1313 O ARG A 83 2.144 14.895 -12.196 1.00 0.00 O ATOM 1314 CB ARG A 83 3.102 12.520 -10.294 1.00 0.00 C ATOM 1315 CG ARG A 83 4.326 13.257 -10.812 1.00 0.00 C ATOM 1316 CD ARG A 83 5.409 12.289 -11.263 1.00 0.00 C ATOM 1317 NE ARG A 83 6.595 12.985 -11.754 1.00 0.00 N ATOM 1318 CZ ARG A 83 7.515 13.521 -10.959 1.00 0.00 C ATOM 1319 NH1 ARG A 83 7.386 13.439 -9.642 1.00 0.00 N ATOM 1320 NH2 ARG A 83 8.567 14.138 -11.482 1.00 0.00 N ATOM 0 H ARG A 83 0.906 11.566 -9.714 1.00 0.00 H new ATOM 0 HA ARG A 83 1.864 14.188 -9.740 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.264 12.253 -9.250 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.988 11.588 -10.847 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.040 13.899 -11.645 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.719 13.906 -10.030 1.00 0.00 H new ATOM 0 HD2 ARG A 83 5.687 11.642 -10.431 1.00 0.00 H new ATOM 0 HD3 ARG A 83 5.015 11.645 -12.049 1.00 0.00 H new ATOM 0 HE ARG A 83 6.724 13.064 -12.763 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.579 12.964 -9.237 1.00 0.00 H new ATOM 0 HH12 ARG A 83 8.093 13.851 -9.034 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.670 14.201 -12.495 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.273 14.549 -10.871 1.00 0.00 H new ATOM 1334 N HIS A 84 0.909 13.068 -12.645 1.00 0.00 N ATOM 1335 CA HIS A 84 0.667 13.439 -14.035 1.00 0.00 C ATOM 1336 C HIS A 84 -0.649 14.198 -14.174 1.00 0.00 C ATOM 1337 O HIS A 84 -0.660 15.382 -14.508 1.00 0.00 O ATOM 1338 CB HIS A 84 0.647 12.193 -14.921 1.00 0.00 C ATOM 1339 CG HIS A 84 0.090 12.440 -16.289 1.00 0.00 C ATOM 1340 ND1 HIS A 84 0.862 12.857 -17.353 1.00 0.00 N ATOM 1341 CD2 HIS A 84 -1.172 12.326 -16.765 1.00 0.00 C ATOM 1342 CE1 HIS A 84 0.099 12.989 -18.423 1.00 0.00 C ATOM 1343 NE2 HIS A 84 -1.140 12.673 -18.093 1.00 0.00 N ATOM 0 H HIS A 84 0.480 12.187 -12.363 1.00 0.00 H new ATOM 0 HA HIS A 84 1.478 14.092 -14.357 1.00 0.00 H new ATOM 0 HB2 HIS A 84 1.662 11.808 -15.015 1.00 0.00 H new ATOM 0 HB3 HIS A 84 0.056 11.419 -14.432 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -2.042 12.019 -16.204 1.00 0.00 H new ATOM 0 HE1 HIS A 84 0.432 13.302 -19.402 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -1.943 12.685 -18.722 1.00 0.00 H new ATOM 1351 N GLN A 85 -1.755 13.507 -13.916 1.00 0.00 N ATOM 1352 CA GLN A 85 -3.076 14.116 -14.014 1.00 0.00 C ATOM 1353 C GLN A 85 -3.066 15.532 -13.448 1.00 0.00 C ATOM 1354 O GLN A 85 -3.358 16.497 -14.154 1.00 0.00 O ATOM 1355 CB GLN A 85 -4.109 13.265 -13.274 1.00 0.00 C ATOM 1356 CG GLN A 85 -4.778 12.220 -14.153 1.00 0.00 C ATOM 1357 CD GLN A 85 -6.198 11.915 -13.718 1.00 0.00 C ATOM 1358 OE1 GLN A 85 -7.154 12.510 -14.217 1.00 0.00 O ATOM 1359 NE2 GLN A 85 -6.344 10.983 -12.783 1.00 0.00 N ATOM 0 H GLN A 85 -1.762 12.526 -13.638 1.00 0.00 H new ATOM 0 HA GLN A 85 -3.347 14.168 -15.068 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -3.623 12.766 -12.436 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -4.874 13.919 -12.855 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -4.785 12.570 -15.185 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -4.190 11.302 -14.132 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -5.524 10.515 -12.397 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -7.276 10.735 -12.451 1.00 0.00 H new ATOM 1449 N ASP A 91 0.866 16.872 -7.210 1.00 0.00 N ATOM 1450 CA ASP A 91 0.874 15.555 -6.584 1.00 0.00 C ATOM 1451 C ASP A 91 0.695 15.670 -5.074 1.00 0.00 C ATOM 1452 O ASP A 91 1.128 16.645 -4.459 1.00 0.00 O ATOM 1453 CB ASP A 91 2.180 14.824 -6.901 1.00 0.00 C ATOM 1454 CG ASP A 91 2.104 13.342 -6.592 1.00 0.00 C ATOM 1455 OD1 ASP A 91 1.191 12.939 -5.841 1.00 0.00 O ATOM 1456 OD2 ASP A 91 2.957 12.585 -7.100 1.00 0.00 O ATOM 0 HA ASP A 91 0.039 14.983 -6.988 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.423 14.960 -7.955 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.992 15.271 -6.327 1.00 0.00 H new ATOM 1461 N VAL A 92 0.052 14.669 -4.481 1.00 0.00 N ATOM 1462 CA VAL A 92 -0.185 14.658 -3.042 1.00 0.00 C ATOM 1463 C VAL A 92 0.325 13.367 -2.411 1.00 0.00 C ATOM 1464 O VAL A 92 0.776 13.359 -1.266 1.00 0.00 O ATOM 1465 CB VAL A 92 -1.682 14.818 -2.719 1.00 0.00 C ATOM 1466 CG1 VAL A 92 -2.158 16.220 -3.070 1.00 0.00 C ATOM 1467 CG2 VAL A 92 -2.501 13.769 -3.455 1.00 0.00 C ATOM 0 H VAL A 92 -0.314 13.855 -4.975 1.00 0.00 H new ATOM 0 HA VAL A 92 0.362 15.504 -2.624 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.822 14.670 -1.648 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.218 16.314 -2.835 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.592 16.951 -2.493 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.005 16.400 -4.134 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.556 13.897 -3.215 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.357 13.883 -4.529 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.177 12.774 -3.149 1.00 0.00 H new ATOM 1477 N PHE A 93 0.250 12.276 -3.167 1.00 0.00 N ATOM 1478 CA PHE A 93 0.703 10.978 -2.682 1.00 0.00 C ATOM 1479 C PHE A 93 2.227 10.890 -2.705 1.00 0.00 C ATOM 1480 O PHE A 93 2.825 10.102 -1.973 1.00 0.00 O ATOM 1481 CB PHE A 93 0.103 9.855 -3.530 1.00 0.00 C ATOM 1482 CG PHE A 93 -1.396 9.900 -3.610 1.00 0.00 C ATOM 1483 CD1 PHE A 93 -2.029 10.720 -4.531 1.00 0.00 C ATOM 1484 CD2 PHE A 93 -2.172 9.122 -2.766 1.00 0.00 C ATOM 1485 CE1 PHE A 93 -3.408 10.764 -4.606 1.00 0.00 C ATOM 1486 CE2 PHE A 93 -3.552 9.162 -2.837 1.00 0.00 C ATOM 1487 CZ PHE A 93 -4.171 9.983 -3.759 1.00 0.00 C ATOM 0 H PHE A 93 -0.120 12.266 -4.117 1.00 0.00 H new ATOM 0 HA PHE A 93 0.366 10.865 -1.652 1.00 0.00 H new ATOM 0 HB2 PHE A 93 0.515 9.912 -4.538 1.00 0.00 H new ATOM 0 HB3 PHE A 93 0.408 8.894 -3.115 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -1.438 11.331 -5.197 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -1.693 8.477 -2.044 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -3.889 11.409 -5.326 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -4.145 8.552 -2.172 1.00 0.00 H new ATOM 0 HZ PHE A 93 -5.249 10.015 -3.818 1.00 0.00 H new ATOM 1497 N ALA A 94 2.847 11.704 -3.553 1.00 0.00 N ATOM 1498 CA ALA A 94 4.300 11.720 -3.672 1.00 0.00 C ATOM 1499 C ALA A 94 4.949 12.256 -2.401 1.00 0.00 C ATOM 1500 O ALA A 94 5.763 11.589 -1.762 1.00 0.00 O ATOM 1501 CB ALA A 94 4.721 12.553 -4.874 1.00 0.00 C ATOM 0 H ALA A 94 2.366 12.361 -4.168 1.00 0.00 H new ATOM 0 HA ALA A 94 4.640 10.695 -3.817 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.808 12.557 -4.951 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.294 12.125 -5.781 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.363 13.575 -4.752 1.00 0.00 H new ATOM 1507 N PRO A 95 4.583 13.490 -2.023 1.00 0.00 N ATOM 1508 CA PRO A 95 5.118 14.142 -0.824 1.00 0.00 C ATOM 1509 C PRO A 95 4.617 13.494 0.462 1.00 0.00 C ATOM 1510 O PRO A 95 5.261 13.588 1.507 1.00 0.00 O ATOM 1511 CB PRO A 95 4.596 15.577 -0.938 1.00 0.00 C ATOM 1512 CG PRO A 95 3.365 15.467 -1.770 1.00 0.00 C ATOM 1513 CD PRO A 95 3.617 14.343 -2.736 1.00 0.00 C ATOM 0 HA PRO A 95 6.204 14.071 -0.773 1.00 0.00 H new ATOM 0 HB2 PRO A 95 4.374 15.997 0.043 1.00 0.00 H new ATOM 0 HB3 PRO A 95 5.333 16.230 -1.405 1.00 0.00 H new ATOM 0 HG2 PRO A 95 2.492 15.261 -1.150 1.00 0.00 H new ATOM 0 HG3 PRO A 95 3.167 16.399 -2.299 1.00 0.00 H new ATOM 0 HD2 PRO A 95 2.700 13.802 -2.971 1.00 0.00 H new ATOM 0 HD3 PRO A 95 4.023 14.708 -3.680 1.00 0.00 H new ATOM 1521 N ARG A 96 3.466 12.836 0.377 1.00 0.00 N ATOM 1522 CA ARG A 96 2.878 12.172 1.535 1.00 0.00 C ATOM 1523 C ARG A 96 3.542 10.821 1.782 1.00 0.00 C ATOM 1524 O ARG A 96 3.889 10.485 2.914 1.00 0.00 O ATOM 1525 CB ARG A 96 1.374 11.984 1.333 1.00 0.00 C ATOM 1526 CG ARG A 96 0.606 11.777 2.628 1.00 0.00 C ATOM 1527 CD ARG A 96 1.440 11.029 3.656 1.00 0.00 C ATOM 1528 NE ARG A 96 0.685 10.749 4.875 1.00 0.00 N ATOM 1529 CZ ARG A 96 0.389 11.672 5.783 1.00 0.00 C ATOM 1530 NH1 ARG A 96 0.781 12.927 5.611 1.00 0.00 N ATOM 1531 NH2 ARG A 96 -0.302 11.340 6.867 1.00 0.00 N ATOM 0 H ARG A 96 2.922 12.748 -0.481 1.00 0.00 H new ATOM 0 HA ARG A 96 3.044 12.804 2.408 1.00 0.00 H new ATOM 0 HB2 ARG A 96 0.973 12.857 0.819 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.208 11.126 0.681 1.00 0.00 H new ATOM 0 HG2 ARG A 96 0.307 12.744 3.034 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -0.309 11.220 2.425 1.00 0.00 H new ATOM 0 HD2 ARG A 96 1.792 10.092 3.225 1.00 0.00 H new ATOM 0 HD3 ARG A 96 2.323 11.618 3.904 1.00 0.00 H new ATOM 0 HE ARG A 96 0.368 9.793 5.038 1.00 0.00 H new ATOM 0 HH11 ARG A 96 1.312 13.186 4.779 1.00 0.00 H new ATOM 0 HH12 ARG A 96 0.552 13.633 6.310 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -0.606 10.376 7.003 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -0.529 12.049 7.564 1.00 0.00 H new ATOM 1545 N PHE A 97 3.715 10.048 0.714 1.00 0.00 N ATOM 1546 CA PHE A 97 4.336 8.733 0.815 1.00 0.00 C ATOM 1547 C PHE A 97 5.780 8.848 1.295 1.00 0.00 C ATOM 1548 O PHE A 97 6.228 8.073 2.140 1.00 0.00 O ATOM 1549 CB PHE A 97 4.292 8.019 -0.538 1.00 0.00 C ATOM 1550 CG PHE A 97 2.995 7.308 -0.799 1.00 0.00 C ATOM 1551 CD1 PHE A 97 2.422 6.506 0.175 1.00 0.00 C ATOM 1552 CD2 PHE A 97 2.349 7.442 -2.017 1.00 0.00 C ATOM 1553 CE1 PHE A 97 1.229 5.850 -0.062 1.00 0.00 C ATOM 1554 CE2 PHE A 97 1.155 6.788 -2.260 1.00 0.00 C ATOM 1555 CZ PHE A 97 0.594 5.992 -1.281 1.00 0.00 C ATOM 0 H PHE A 97 3.434 10.310 -0.231 1.00 0.00 H new ATOM 0 HA PHE A 97 3.775 8.149 1.545 1.00 0.00 H new ATOM 0 HB2 PHE A 97 4.463 8.748 -1.330 1.00 0.00 H new ATOM 0 HB3 PHE A 97 5.108 7.298 -0.586 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.913 6.392 1.130 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.783 8.064 -2.786 1.00 0.00 H new ATOM 0 HE1 PHE A 97 0.793 5.227 0.705 1.00 0.00 H new ATOM 0 HE2 PHE A 97 0.662 6.900 -3.214 1.00 0.00 H new ATOM 0 HZ PHE A 97 -0.339 5.481 -1.468 1.00 0.00 H new ATOM 1565 N SER A 98 6.503 9.820 0.748 1.00 0.00 N ATOM 1566 CA SER A 98 7.898 10.035 1.117 1.00 0.00 C ATOM 1567 C SER A 98 8.045 10.175 2.629 1.00 0.00 C ATOM 1568 O SER A 98 9.073 9.813 3.199 1.00 0.00 O ATOM 1569 CB SER A 98 8.444 11.284 0.422 1.00 0.00 C ATOM 1570 OG SER A 98 8.286 11.197 -0.983 1.00 0.00 O ATOM 0 H SER A 98 6.147 10.471 0.048 1.00 0.00 H new ATOM 0 HA SER A 98 8.472 9.167 0.793 1.00 0.00 H new ATOM 0 HB2 SER A 98 7.926 12.167 0.795 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.499 11.407 0.665 1.00 0.00 H new ATOM 0 HG SER A 98 7.412 11.561 -1.237 1.00 0.00 H new ATOM 1576 N ASN A 99 7.008 10.702 3.272 1.00 0.00 N ATOM 1577 CA ASN A 99 7.021 10.890 4.718 1.00 0.00 C ATOM 1578 C ASN A 99 7.496 9.626 5.427 1.00 0.00 C ATOM 1579 O ASN A 99 8.621 9.565 5.921 1.00 0.00 O ATOM 1580 CB ASN A 99 5.626 11.274 5.216 1.00 0.00 C ATOM 1581 CG ASN A 99 5.173 12.621 4.686 1.00 0.00 C ATOM 1582 OD1 ASN A 99 5.940 13.336 4.040 1.00 0.00 O ATOM 1583 ND2 ASN A 99 3.922 12.973 4.958 1.00 0.00 N ATOM 0 H ASN A 99 6.149 11.006 2.815 1.00 0.00 H new ATOM 0 HA ASN A 99 7.717 11.697 4.948 1.00 0.00 H new ATOM 0 HB2 ASN A 99 4.912 10.509 4.913 1.00 0.00 H new ATOM 0 HB3 ASN A 99 5.626 11.297 6.306 1.00 0.00 H new ATOM 0 HD21 ASN A 99 3.561 13.868 4.628 1.00 0.00 H new ATOM 0 HD22 ASN A 99 3.322 12.348 5.497 1.00 0.00 H new ATOM 1590 N ASN A 100 6.631 8.618 5.472 1.00 0.00 N ATOM 1591 CA ASN A 100 6.962 7.354 6.120 1.00 0.00 C ATOM 1592 C ASN A 100 7.272 6.277 5.085 1.00 0.00 C ATOM 1593 O ASN A 100 7.201 5.083 5.378 1.00 0.00 O ATOM 1594 CB ASN A 100 5.808 6.900 7.017 1.00 0.00 C ATOM 1595 CG ASN A 100 5.135 8.059 7.725 1.00 0.00 C ATOM 1596 OD1 ASN A 100 4.008 8.432 7.396 1.00 0.00 O ATOM 1597 ND2 ASN A 100 5.824 8.636 8.702 1.00 0.00 N ATOM 0 H ASN A 100 5.695 8.652 5.067 1.00 0.00 H new ATOM 0 HA ASN A 100 7.850 7.509 6.733 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.071 6.368 6.415 1.00 0.00 H new ATOM 0 HB3 ASN A 100 6.183 6.194 7.758 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.423 9.422 9.214 1.00 0.00 H new ATOM 0 HD22 ASN A 100 6.755 8.294 8.941 1.00 0.00 H new ATOM 1604 N ILE A 101 7.615 6.707 3.876 1.00 0.00 N ATOM 1605 CA ILE A 101 7.937 5.780 2.799 1.00 0.00 C ATOM 1606 C ILE A 101 8.770 4.609 3.311 1.00 0.00 C ATOM 1607 O ILE A 101 8.539 3.459 2.938 1.00 0.00 O ATOM 1608 CB ILE A 101 8.703 6.481 1.662 1.00 0.00 C ATOM 1609 CG1 ILE A 101 8.978 5.500 0.521 1.00 0.00 C ATOM 1610 CG2 ILE A 101 10.005 7.070 2.185 1.00 0.00 C ATOM 1611 CD1 ILE A 101 7.890 5.475 -0.530 1.00 0.00 C ATOM 0 H ILE A 101 7.677 7.692 3.618 1.00 0.00 H new ATOM 0 HA ILE A 101 6.989 5.407 2.411 1.00 0.00 H new ATOM 0 HB ILE A 101 8.087 7.294 1.277 1.00 0.00 H new ATOM 0 HG12 ILE A 101 9.924 5.762 0.047 1.00 0.00 H new ATOM 0 HG13 ILE A 101 9.096 4.498 0.934 1.00 0.00 H new ATOM 0 HG21 ILE A 101 10.535 7.562 1.370 1.00 0.00 H new ATOM 0 HG22 ILE A 101 9.787 7.797 2.967 1.00 0.00 H new ATOM 0 HG23 ILE A 101 10.627 6.273 2.593 1.00 0.00 H new ATOM 0 HD11 ILE A 101 8.152 4.758 -1.308 1.00 0.00 H new ATOM 0 HD12 ILE A 101 6.946 5.183 -0.070 1.00 0.00 H new ATOM 0 HD13 ILE A 101 7.787 6.467 -0.971 1.00 0.00 H new ATOM 1623 N ILE A 102 9.738 4.911 4.171 1.00 0.00 N ATOM 1624 CA ILE A 102 10.603 3.884 4.737 1.00 0.00 C ATOM 1625 C ILE A 102 9.790 2.828 5.479 1.00 0.00 C ATOM 1626 O ILE A 102 9.831 1.646 5.139 1.00 0.00 O ATOM 1627 CB ILE A 102 11.639 4.490 5.702 1.00 0.00 C ATOM 1628 CG1 ILE A 102 12.459 5.569 4.993 1.00 0.00 C ATOM 1629 CG2 ILE A 102 12.549 3.402 6.253 1.00 0.00 C ATOM 1630 CD1 ILE A 102 13.402 5.021 3.945 1.00 0.00 C ATOM 0 H ILE A 102 9.942 5.858 4.490 1.00 0.00 H new ATOM 0 HA ILE A 102 11.126 3.416 3.903 1.00 0.00 H new ATOM 0 HB ILE A 102 11.110 4.952 6.536 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.780 6.280 4.523 1.00 0.00 H new ATOM 0 HG13 ILE A 102 13.035 6.122 5.735 1.00 0.00 H new ATOM 0 HG21 ILE A 102 13.276 3.846 6.933 1.00 0.00 H new ATOM 0 HG22 ILE A 102 11.952 2.665 6.790 1.00 0.00 H new ATOM 0 HG23 ILE A 102 13.072 2.914 5.431 1.00 0.00 H new ATOM 0 HD11 ILE A 102 13.950 5.842 3.484 1.00 0.00 H new ATOM 0 HD12 ILE A 102 14.106 4.332 4.413 1.00 0.00 H new ATOM 0 HD13 ILE A 102 12.830 4.493 3.182 1.00 0.00 H new ATOM 1642 N SER A 103 9.051 3.264 6.494 1.00 0.00 N ATOM 1643 CA SER A 103 8.229 2.357 7.286 1.00 0.00 C ATOM 1644 C SER A 103 7.320 1.523 6.388 1.00 0.00 C ATOM 1645 O SER A 103 7.067 0.348 6.659 1.00 0.00 O ATOM 1646 CB SER A 103 7.387 3.144 8.293 1.00 0.00 C ATOM 1647 OG SER A 103 7.137 2.377 9.458 1.00 0.00 O ATOM 0 H SER A 103 9.005 4.240 6.787 1.00 0.00 H new ATOM 0 HA SER A 103 8.894 1.684 7.827 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.904 4.064 8.564 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.441 3.433 7.834 1.00 0.00 H new ATOM 0 HG SER A 103 6.599 2.902 10.086 1.00 0.00 H new ATOM 1653 N THR A 104 6.831 2.139 5.317 1.00 0.00 N ATOM 1654 CA THR A 104 5.949 1.456 4.378 1.00 0.00 C ATOM 1655 C THR A 104 6.686 0.343 3.642 1.00 0.00 C ATOM 1656 O THR A 104 6.202 -0.786 3.558 1.00 0.00 O ATOM 1657 CB THR A 104 5.359 2.436 3.347 1.00 0.00 C ATOM 1658 OG1 THR A 104 4.478 3.359 3.996 1.00 0.00 O ATOM 1659 CG2 THR A 104 4.605 1.686 2.258 1.00 0.00 C ATOM 0 H THR A 104 7.031 3.110 5.078 1.00 0.00 H new ATOM 0 HA THR A 104 5.137 1.025 4.963 1.00 0.00 H new ATOM 0 HB THR A 104 6.181 2.983 2.887 1.00 0.00 H new ATOM 0 HG1 THR A 104 4.213 4.059 3.363 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.197 2.399 1.541 1.00 0.00 H new ATOM 0 HG22 THR A 104 5.286 1.006 1.746 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.791 1.116 2.706 1.00 0.00 H new ATOM 1667 N PHE A 105 7.860 0.668 3.110 1.00 0.00 N ATOM 1668 CA PHE A 105 8.664 -0.305 2.380 1.00 0.00 C ATOM 1669 C PHE A 105 9.113 -1.438 3.298 1.00 0.00 C ATOM 1670 O PHE A 105 9.170 -2.597 2.888 1.00 0.00 O ATOM 1671 CB PHE A 105 9.884 0.375 1.756 1.00 0.00 C ATOM 1672 CG PHE A 105 9.639 0.888 0.366 1.00 0.00 C ATOM 1673 CD1 PHE A 105 8.575 1.736 0.104 1.00 0.00 C ATOM 1674 CD2 PHE A 105 10.473 0.523 -0.678 1.00 0.00 C ATOM 1675 CE1 PHE A 105 8.347 2.210 -1.174 1.00 0.00 C ATOM 1676 CE2 PHE A 105 10.250 0.994 -1.958 1.00 0.00 C ATOM 1677 CZ PHE A 105 9.185 1.838 -2.207 1.00 0.00 C ATOM 0 H PHE A 105 8.275 1.598 3.171 1.00 0.00 H new ATOM 0 HA PHE A 105 8.047 -0.727 1.587 1.00 0.00 H new ATOM 0 HB2 PHE A 105 10.192 1.205 2.392 1.00 0.00 H new ATOM 0 HB3 PHE A 105 10.712 -0.333 1.733 1.00 0.00 H new ATOM 0 HD1 PHE A 105 7.916 2.030 0.908 1.00 0.00 H new ATOM 0 HD2 PHE A 105 11.307 -0.137 -0.490 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.514 2.871 -1.365 1.00 0.00 H new ATOM 0 HE2 PHE A 105 10.908 0.702 -2.763 1.00 0.00 H new ATOM 0 HZ PHE A 105 9.008 2.206 -3.207 1.00 0.00 H new ATOM 1687 N GLN A 106 9.431 -1.093 4.542 1.00 0.00 N ATOM 1688 CA GLN A 106 9.876 -2.080 5.518 1.00 0.00 C ATOM 1689 C GLN A 106 8.922 -3.270 5.563 1.00 0.00 C ATOM 1690 O GLN A 106 9.350 -4.422 5.524 1.00 0.00 O ATOM 1691 CB GLN A 106 9.984 -1.445 6.905 1.00 0.00 C ATOM 1692 CG GLN A 106 11.104 -0.424 7.021 1.00 0.00 C ATOM 1693 CD GLN A 106 12.446 -1.061 7.320 1.00 0.00 C ATOM 1694 OE1 GLN A 106 12.527 -2.058 8.039 1.00 0.00 O ATOM 1695 NE2 GLN A 106 13.510 -0.489 6.769 1.00 0.00 N ATOM 0 H GLN A 106 9.389 -0.138 4.897 1.00 0.00 H new ATOM 0 HA GLN A 106 10.859 -2.437 5.213 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.037 -0.963 7.149 1.00 0.00 H new ATOM 0 HB3 GLN A 106 10.142 -2.231 7.644 1.00 0.00 H new ATOM 0 HG2 GLN A 106 11.173 0.141 6.091 1.00 0.00 H new ATOM 0 HG3 GLN A 106 10.861 0.288 7.809 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.398 0.336 6.180 1.00 0.00 H new ATOM 0 HE22 GLN A 106 14.440 -0.875 6.935 1.00 0.00 H new ATOM 1704 N ASN A 107 7.628 -2.981 5.646 1.00 0.00 N ATOM 1705 CA ASN A 107 6.613 -4.027 5.698 1.00 0.00 C ATOM 1706 C ASN A 107 6.583 -4.821 4.396 1.00 0.00 C ATOM 1707 O ASN A 107 6.093 -5.950 4.355 1.00 0.00 O ATOM 1708 CB ASN A 107 5.236 -3.418 5.969 1.00 0.00 C ATOM 1709 CG ASN A 107 5.188 -2.657 7.280 1.00 0.00 C ATOM 1710 OD1 ASN A 107 6.038 -2.844 8.150 1.00 0.00 O ATOM 1711 ND2 ASN A 107 4.189 -1.795 7.427 1.00 0.00 N ATOM 0 H ASN A 107 7.257 -2.031 5.679 1.00 0.00 H new ATOM 0 HA ASN A 107 6.869 -4.706 6.511 1.00 0.00 H new ATOM 0 HB2 ASN A 107 4.972 -2.746 5.152 1.00 0.00 H new ATOM 0 HB3 ASN A 107 4.488 -4.211 5.985 1.00 0.00 H new ATOM 0 HD21 ASN A 107 4.104 -1.255 8.288 1.00 0.00 H new ATOM 0 HD22 ASN A 107 3.507 -1.672 6.679 1.00 0.00 H new ATOM 1718 N LEU A 108 7.111 -4.223 3.333 1.00 0.00 N ATOM 1719 CA LEU A 108 7.146 -4.874 2.028 1.00 0.00 C ATOM 1720 C LEU A 108 8.424 -5.689 1.860 1.00 0.00 C ATOM 1721 O LEU A 108 8.425 -6.735 1.211 1.00 0.00 O ATOM 1722 CB LEU A 108 7.042 -3.832 0.913 1.00 0.00 C ATOM 1723 CG LEU A 108 5.825 -2.909 0.969 1.00 0.00 C ATOM 1724 CD1 LEU A 108 6.048 -1.678 0.103 1.00 0.00 C ATOM 1725 CD2 LEU A 108 4.572 -3.652 0.529 1.00 0.00 C ATOM 0 H LEU A 108 7.520 -3.289 3.349 1.00 0.00 H new ATOM 0 HA LEU A 108 6.294 -5.551 1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 108 7.941 -3.216 0.933 1.00 0.00 H new ATOM 0 HB3 LEU A 108 7.034 -4.353 -0.044 1.00 0.00 H new ATOM 0 HG LEU A 108 5.687 -2.583 2.000 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.171 -1.033 0.155 1.00 0.00 H new ATOM 0 HD12 LEU A 108 6.921 -1.134 0.462 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.212 -1.985 -0.930 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.715 -2.980 0.575 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.700 -4.007 -0.494 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.402 -4.502 1.190 1.00 0.00 H new ATOM 1737 N TYR A 109 9.511 -5.204 2.451 1.00 0.00 N ATOM 1738 CA TYR A 109 10.796 -5.887 2.366 1.00 0.00 C ATOM 1739 C TYR A 109 10.811 -7.131 3.251 1.00 0.00 C ATOM 1740 O TYR A 109 11.734 -7.942 3.184 1.00 0.00 O ATOM 1741 CB TYR A 109 11.927 -4.943 2.776 1.00 0.00 C ATOM 1742 CG TYR A 109 12.364 -4.006 1.672 1.00 0.00 C ATOM 1743 CD1 TYR A 109 12.775 -4.497 0.439 1.00 0.00 C ATOM 1744 CD2 TYR A 109 12.364 -2.630 1.862 1.00 0.00 C ATOM 1745 CE1 TYR A 109 13.175 -3.645 -0.572 1.00 0.00 C ATOM 1746 CE2 TYR A 109 12.761 -1.770 0.856 1.00 0.00 C ATOM 1747 CZ TYR A 109 13.166 -2.282 -0.358 1.00 0.00 C ATOM 1748 OH TYR A 109 13.563 -1.430 -1.363 1.00 0.00 O ATOM 0 H TYR A 109 9.527 -4.341 2.994 1.00 0.00 H new ATOM 0 HA TYR A 109 10.947 -6.196 1.332 1.00 0.00 H new ATOM 0 HB2 TYR A 109 11.604 -4.354 3.634 1.00 0.00 H new ATOM 0 HB3 TYR A 109 12.784 -5.535 3.099 1.00 0.00 H new ATOM 0 HD1 TYR A 109 12.782 -5.563 0.268 1.00 0.00 H new ATOM 0 HD2 TYR A 109 12.048 -2.225 2.812 1.00 0.00 H new ATOM 0 HE1 TYR A 109 13.493 -4.043 -1.524 1.00 0.00 H new ATOM 0 HE2 TYR A 109 12.754 -0.703 1.020 1.00 0.00 H new ATOM 0 HH TYR A 109 14.439 -1.049 -1.142 1.00 0.00 H new ATOM 1758 N ARG A 110 9.781 -7.272 4.079 1.00 0.00 N ATOM 1759 CA ARG A 110 9.675 -8.415 4.978 1.00 0.00 C ATOM 1760 C ARG A 110 9.514 -9.712 4.190 1.00 0.00 C ATOM 1761 O ARG A 110 9.804 -10.797 4.696 1.00 0.00 O ATOM 1762 CB ARG A 110 8.492 -8.234 5.930 1.00 0.00 C ATOM 1763 CG ARG A 110 8.369 -6.825 6.488 1.00 0.00 C ATOM 1764 CD ARG A 110 7.476 -6.789 7.718 1.00 0.00 C ATOM 1765 NE ARG A 110 7.962 -7.672 8.774 1.00 0.00 N ATOM 1766 CZ ARG A 110 7.208 -8.098 9.781 1.00 0.00 C ATOM 1767 NH1 ARG A 110 5.939 -7.725 9.867 1.00 0.00 N ATOM 1768 NH2 ARG A 110 7.723 -8.900 10.704 1.00 0.00 N ATOM 0 H ARG A 110 9.008 -6.609 4.146 1.00 0.00 H new ATOM 0 HA ARG A 110 10.595 -8.475 5.560 1.00 0.00 H new ATOM 0 HB2 ARG A 110 7.572 -8.489 5.405 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.592 -8.936 6.758 1.00 0.00 H new ATOM 0 HG2 ARG A 110 9.358 -6.446 6.744 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.963 -6.164 5.723 1.00 0.00 H new ATOM 0 HD2 ARG A 110 7.421 -5.768 8.096 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.463 -7.081 7.439 1.00 0.00 H new ATOM 0 HE ARG A 110 8.934 -7.979 8.736 1.00 0.00 H new ATOM 0 HH11 ARG A 110 5.539 -7.109 9.159 1.00 0.00 H new ATOM 0 HH12 ARG A 110 5.362 -8.054 10.641 1.00 0.00 H new ATOM 0 HH21 ARG A 110 8.699 -9.190 10.641 1.00 0.00 H new ATOM 0 HH22 ARG A 110 7.143 -9.227 11.477 1.00 0.00 H new ATOM 1782 N CYS A 111 9.050 -9.592 2.951 1.00 0.00 N ATOM 1783 CA CYS A 111 8.849 -10.756 2.095 1.00 0.00 C ATOM 1784 C CYS A 111 10.008 -11.738 2.231 1.00 0.00 C ATOM 1785 O CYS A 111 11.106 -11.385 2.661 1.00 0.00 O ATOM 1786 CB CYS A 111 8.702 -10.321 0.636 1.00 0.00 C ATOM 1787 SG CYS A 111 9.958 -9.142 0.086 1.00 0.00 S ATOM 0 H CYS A 111 8.806 -8.702 2.517 1.00 0.00 H new ATOM 0 HA CYS A 111 7.934 -11.256 2.412 1.00 0.00 H new ATOM 0 HB2 CYS A 111 8.745 -11.204 -0.001 1.00 0.00 H new ATOM 0 HB3 CYS A 111 7.717 -9.876 0.498 1.00 0.00 H new ATOM 0 HG CYS A 111 9.632 -7.946 0.477 1.00 0.00 H new ATOM 1793 N PRO A 112 9.759 -13.002 1.857 1.00 0.00 N ATOM 1794 CA PRO A 112 10.769 -14.062 1.929 1.00 0.00 C ATOM 1795 C PRO A 112 12.103 -13.634 1.325 1.00 0.00 C ATOM 1796 O PRO A 112 13.166 -13.959 1.851 1.00 0.00 O ATOM 1797 CB PRO A 112 10.151 -15.198 1.110 1.00 0.00 C ATOM 1798 CG PRO A 112 8.681 -14.971 1.197 1.00 0.00 C ATOM 1799 CD PRO A 112 8.473 -13.494 1.335 1.00 0.00 C ATOM 0 HA PRO A 112 10.998 -14.337 2.959 1.00 0.00 H new ATOM 0 HB2 PRO A 112 10.495 -15.173 0.076 1.00 0.00 H new ATOM 0 HB3 PRO A 112 10.426 -16.172 1.514 1.00 0.00 H new ATOM 0 HG2 PRO A 112 8.179 -15.350 0.307 1.00 0.00 H new ATOM 0 HG3 PRO A 112 8.259 -15.501 2.051 1.00 0.00 H new ATOM 0 HD2 PRO A 112 8.228 -13.034 0.378 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.653 -13.268 2.016 1.00 0.00 H new ATOM 1807 N GLY A 113 12.038 -12.903 0.216 1.00 0.00 N ATOM 1808 CA GLY A 113 13.247 -12.443 -0.441 1.00 0.00 C ATOM 1809 C GLY A 113 13.146 -12.506 -1.952 1.00 0.00 C ATOM 1810 O GLY A 113 13.623 -11.611 -2.651 1.00 0.00 O ATOM 0 H GLY A 113 11.170 -12.621 -0.239 1.00 0.00 H new ATOM 0 HA2 GLY A 113 13.454 -11.417 -0.136 1.00 0.00 H new ATOM 0 HA3 GLY A 113 14.090 -13.050 -0.111 1.00 0.00 H new ATOM 1814 N ASP A 114 12.525 -13.566 -2.458 1.00 0.00 N ATOM 1815 CA ASP A 114 12.363 -13.743 -3.896 1.00 0.00 C ATOM 1816 C ASP A 114 11.376 -12.726 -4.461 1.00 0.00 C ATOM 1817 O ASP A 114 11.104 -12.711 -5.662 1.00 0.00 O ATOM 1818 CB ASP A 114 11.886 -15.162 -4.206 1.00 0.00 C ATOM 1819 CG ASP A 114 12.955 -16.204 -3.941 1.00 0.00 C ATOM 1820 OD1 ASP A 114 13.481 -16.238 -2.809 1.00 0.00 O ATOM 1821 OD2 ASP A 114 13.268 -16.983 -4.865 1.00 0.00 O ATOM 0 H ASP A 114 12.126 -14.316 -1.893 1.00 0.00 H new ATOM 0 HA ASP A 114 13.332 -13.583 -4.368 1.00 0.00 H new ATOM 0 HB2 ASP A 114 11.007 -15.386 -3.602 1.00 0.00 H new ATOM 0 HB3 ASP A 114 11.579 -15.219 -5.250 1.00 0.00 H new ATOM 1826 N ASP A 115 10.842 -11.879 -3.588 1.00 0.00 N ATOM 1827 CA ASP A 115 9.884 -10.859 -4.000 1.00 0.00 C ATOM 1828 C ASP A 115 10.529 -9.477 -3.997 1.00 0.00 C ATOM 1829 O ASP A 115 10.064 -8.562 -4.677 1.00 0.00 O ATOM 1830 CB ASP A 115 8.666 -10.870 -3.075 1.00 0.00 C ATOM 1831 CG ASP A 115 8.360 -12.253 -2.536 1.00 0.00 C ATOM 1832 OD1 ASP A 115 9.280 -12.893 -1.986 1.00 0.00 O ATOM 1833 OD2 ASP A 115 7.200 -12.697 -2.666 1.00 0.00 O ATOM 0 H ASP A 115 11.056 -11.878 -2.591 1.00 0.00 H new ATOM 0 HA ASP A 115 9.560 -11.087 -5.016 1.00 0.00 H new ATOM 0 HB2 ASP A 115 8.840 -10.189 -2.242 1.00 0.00 H new ATOM 0 HB3 ASP A 115 7.798 -10.495 -3.617 1.00 0.00 H new ATOM 1838 N LYS A 116 11.601 -9.331 -3.226 1.00 0.00 N ATOM 1839 CA LYS A 116 12.311 -8.060 -3.134 1.00 0.00 C ATOM 1840 C LYS A 116 12.501 -7.442 -4.516 1.00 0.00 C ATOM 1841 O LYS A 116 12.343 -6.235 -4.693 1.00 0.00 O ATOM 1842 CB LYS A 116 13.671 -8.260 -2.461 1.00 0.00 C ATOM 1843 CG LYS A 116 13.634 -8.086 -0.953 1.00 0.00 C ATOM 1844 CD LYS A 116 14.784 -8.815 -0.279 1.00 0.00 C ATOM 1845 CE LYS A 116 16.124 -8.419 -0.881 1.00 0.00 C ATOM 1846 NZ LYS A 116 17.174 -9.443 -0.619 1.00 0.00 N ATOM 0 H LYS A 116 11.998 -10.077 -2.655 1.00 0.00 H new ATOM 0 HA LYS A 116 11.711 -7.379 -2.531 1.00 0.00 H new ATOM 0 HB2 LYS A 116 14.039 -9.259 -2.694 1.00 0.00 H new ATOM 0 HB3 LYS A 116 14.384 -7.551 -2.883 1.00 0.00 H new ATOM 0 HG2 LYS A 116 13.681 -7.025 -0.707 1.00 0.00 H new ATOM 0 HG3 LYS A 116 12.687 -8.462 -0.566 1.00 0.00 H new ATOM 0 HD2 LYS A 116 14.783 -8.591 0.788 1.00 0.00 H new ATOM 0 HD3 LYS A 116 14.643 -9.891 -0.379 1.00 0.00 H new ATOM 0 HE2 LYS A 116 16.012 -8.280 -1.956 1.00 0.00 H new ATOM 0 HE3 LYS A 116 16.439 -7.461 -0.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 18.072 -9.136 -1.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 17.299 -9.557 0.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 16.885 -10.351 -1.036 1.00 0.00 H new ATOM 1860 N SER A 117 12.841 -8.278 -5.492 1.00 0.00 N ATOM 1861 CA SER A 117 13.055 -7.813 -6.857 1.00 0.00 C ATOM 1862 C SER A 117 11.923 -6.892 -7.301 1.00 0.00 C ATOM 1863 O SER A 117 12.160 -5.786 -7.788 1.00 0.00 O ATOM 1864 CB SER A 117 13.164 -9.003 -7.812 1.00 0.00 C ATOM 1865 OG SER A 117 13.253 -8.569 -9.159 1.00 0.00 O ATOM 0 H SER A 117 12.974 -9.281 -5.362 1.00 0.00 H new ATOM 0 HA SER A 117 13.988 -7.250 -6.881 1.00 0.00 H new ATOM 0 HB2 SER A 117 14.042 -9.597 -7.559 1.00 0.00 H new ATOM 0 HB3 SER A 117 12.296 -9.651 -7.692 1.00 0.00 H new ATOM 0 HG SER A 117 13.323 -9.348 -9.750 1.00 0.00 H new ATOM 1871 N LYS A 118 10.689 -7.356 -7.129 1.00 0.00 N ATOM 1872 CA LYS A 118 9.518 -6.575 -7.510 1.00 0.00 C ATOM 1873 C LYS A 118 9.447 -5.276 -6.713 1.00 0.00 C ATOM 1874 O LYS A 118 8.767 -4.330 -7.111 1.00 0.00 O ATOM 1875 CB LYS A 118 8.242 -7.391 -7.289 1.00 0.00 C ATOM 1876 CG LYS A 118 7.921 -8.339 -8.432 1.00 0.00 C ATOM 1877 CD LYS A 118 8.527 -9.714 -8.202 1.00 0.00 C ATOM 1878 CE LYS A 118 7.857 -10.770 -9.069 1.00 0.00 C ATOM 1879 NZ LYS A 118 6.491 -11.103 -8.580 1.00 0.00 N ATOM 0 H LYS A 118 10.475 -8.269 -6.728 1.00 0.00 H new ATOM 0 HA LYS A 118 9.606 -6.327 -8.568 1.00 0.00 H new ATOM 0 HB2 LYS A 118 8.343 -7.966 -6.369 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.404 -6.708 -7.148 1.00 0.00 H new ATOM 0 HG2 LYS A 118 6.840 -8.430 -8.538 1.00 0.00 H new ATOM 0 HG3 LYS A 118 8.299 -7.925 -9.367 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.594 -9.684 -8.422 1.00 0.00 H new ATOM 0 HD3 LYS A 118 8.426 -9.986 -7.151 1.00 0.00 H new ATOM 0 HE2 LYS A 118 7.798 -10.412 -10.097 1.00 0.00 H new ATOM 0 HE3 LYS A 118 8.469 -11.672 -9.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 6.162 -11.977 -9.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 6.515 -11.240 -7.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 5.840 -10.325 -8.811 1.00 0.00 H new ATOM 1893 N ILE A 119 10.154 -5.238 -5.589 1.00 0.00 N ATOM 1894 CA ILE A 119 10.173 -4.054 -4.739 1.00 0.00 C ATOM 1895 C ILE A 119 11.283 -3.095 -5.156 1.00 0.00 C ATOM 1896 O ILE A 119 11.096 -1.878 -5.166 1.00 0.00 O ATOM 1897 CB ILE A 119 10.363 -4.427 -3.257 1.00 0.00 C ATOM 1898 CG1 ILE A 119 9.356 -5.503 -2.847 1.00 0.00 C ATOM 1899 CG2 ILE A 119 10.218 -3.195 -2.377 1.00 0.00 C ATOM 1900 CD1 ILE A 119 9.642 -6.115 -1.493 1.00 0.00 C ATOM 0 H ILE A 119 10.721 -6.013 -5.246 1.00 0.00 H new ATOM 0 HA ILE A 119 9.207 -3.564 -4.861 1.00 0.00 H new ATOM 0 HB ILE A 119 11.368 -4.827 -3.124 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.356 -5.068 -2.836 1.00 0.00 H new ATOM 0 HG13 ILE A 119 9.353 -6.291 -3.600 1.00 0.00 H new ATOM 0 HG21 ILE A 119 10.355 -3.476 -1.333 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.971 -2.458 -2.656 1.00 0.00 H new ATOM 0 HG23 ILE A 119 9.224 -2.767 -2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.888 -6.869 -1.268 1.00 0.00 H new ATOM 0 HD12 ILE A 119 10.628 -6.580 -1.505 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.616 -5.337 -0.730 1.00 0.00 H new ATOM 1912 N VAL A 120 12.440 -3.652 -5.503 1.00 0.00 N ATOM 1913 CA VAL A 120 13.580 -2.847 -5.924 1.00 0.00 C ATOM 1914 C VAL A 120 13.416 -2.375 -7.365 1.00 0.00 C ATOM 1915 O VAL A 120 13.983 -1.357 -7.763 1.00 0.00 O ATOM 1916 CB VAL A 120 14.898 -3.633 -5.800 1.00 0.00 C ATOM 1917 CG1 VAL A 120 14.953 -4.378 -4.475 1.00 0.00 C ATOM 1918 CG2 VAL A 120 15.058 -4.594 -6.969 1.00 0.00 C ATOM 0 H VAL A 120 12.612 -4.657 -5.501 1.00 0.00 H new ATOM 0 HA VAL A 120 13.619 -1.981 -5.263 1.00 0.00 H new ATOM 0 HB VAL A 120 15.726 -2.925 -5.826 1.00 0.00 H new ATOM 0 HG11 VAL A 120 15.892 -4.928 -4.405 1.00 0.00 H new ATOM 0 HG12 VAL A 120 14.889 -3.665 -3.653 1.00 0.00 H new ATOM 0 HG13 VAL A 120 14.118 -5.076 -4.415 1.00 0.00 H new ATOM 0 HG21 VAL A 120 15.995 -5.141 -6.865 1.00 0.00 H new ATOM 0 HG22 VAL A 120 14.226 -5.298 -6.978 1.00 0.00 H new ATOM 0 HG23 VAL A 120 15.068 -4.032 -7.903 1.00 0.00 H new ATOM 1928 N ARG A 121 12.638 -3.121 -8.142 1.00 0.00 N ATOM 1929 CA ARG A 121 12.400 -2.779 -9.539 1.00 0.00 C ATOM 1930 C ARG A 121 11.608 -1.480 -9.653 1.00 0.00 C ATOM 1931 O ARG A 121 11.812 -0.696 -10.581 1.00 0.00 O ATOM 1932 CB ARG A 121 11.649 -3.910 -10.242 1.00 0.00 C ATOM 1933 CG ARG A 121 10.154 -3.913 -9.965 1.00 0.00 C ATOM 1934 CD ARG A 121 9.412 -4.830 -10.925 1.00 0.00 C ATOM 1935 NE ARG A 121 8.056 -4.359 -11.193 1.00 0.00 N ATOM 1936 CZ ARG A 121 7.772 -3.393 -12.060 1.00 0.00 C ATOM 1937 NH1 ARG A 121 8.744 -2.801 -12.739 1.00 0.00 N ATOM 1938 NH2 ARG A 121 6.513 -3.020 -12.250 1.00 0.00 N ATOM 0 H ARG A 121 12.162 -3.966 -7.828 1.00 0.00 H new ATOM 0 HA ARG A 121 13.367 -2.639 -10.023 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.811 -3.829 -11.317 1.00 0.00 H new ATOM 0 HB3 ARG A 121 12.070 -4.865 -9.927 1.00 0.00 H new ATOM 0 HG2 ARG A 121 9.973 -4.235 -8.939 1.00 0.00 H new ATOM 0 HG3 ARG A 121 9.764 -2.899 -10.054 1.00 0.00 H new ATOM 0 HD2 ARG A 121 9.964 -4.897 -11.862 1.00 0.00 H new ATOM 0 HD3 ARG A 121 9.371 -5.836 -10.507 1.00 0.00 H new ATOM 0 HE ARG A 121 7.285 -4.795 -10.687 1.00 0.00 H new ATOM 0 HH11 ARG A 121 9.713 -3.087 -12.597 1.00 0.00 H new ATOM 0 HH12 ARG A 121 8.523 -2.060 -13.404 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.762 -3.475 -11.730 1.00 0.00 H new ATOM 0 HH22 ARG A 121 6.296 -2.278 -12.916 1.00 0.00 H new ATOM 1952 N VAL A 122 10.704 -1.258 -8.705 1.00 0.00 N ATOM 1953 CA VAL A 122 9.882 -0.054 -8.699 1.00 0.00 C ATOM 1954 C VAL A 122 10.731 1.190 -8.464 1.00 0.00 C ATOM 1955 O VAL A 122 10.576 2.199 -9.153 1.00 0.00 O ATOM 1956 CB VAL A 122 8.788 -0.128 -7.617 1.00 0.00 C ATOM 1957 CG1 VAL A 122 7.861 1.075 -7.712 1.00 0.00 C ATOM 1958 CG2 VAL A 122 8.004 -1.426 -7.739 1.00 0.00 C ATOM 0 H VAL A 122 10.522 -1.896 -7.931 1.00 0.00 H new ATOM 0 HA VAL A 122 9.410 0.012 -9.679 1.00 0.00 H new ATOM 0 HB VAL A 122 9.268 -0.111 -6.638 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.095 1.006 -6.940 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.437 1.990 -7.571 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.387 1.092 -8.693 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.236 -1.461 -6.967 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.534 -1.476 -8.721 1.00 0.00 H new ATOM 0 HG23 VAL A 122 8.680 -2.272 -7.617 1.00 0.00 H new ATOM 1968 N LEU A 123 11.628 1.111 -7.487 1.00 0.00 N ATOM 1969 CA LEU A 123 12.504 2.232 -7.161 1.00 0.00 C ATOM 1970 C LEU A 123 13.260 2.709 -8.397 1.00 0.00 C ATOM 1971 O LEU A 123 13.309 3.905 -8.683 1.00 0.00 O ATOM 1972 CB LEU A 123 13.494 1.828 -6.067 1.00 0.00 C ATOM 1973 CG LEU A 123 12.883 1.428 -4.724 1.00 0.00 C ATOM 1974 CD1 LEU A 123 13.974 1.051 -3.733 1.00 0.00 C ATOM 1975 CD2 LEU A 123 12.024 2.555 -4.171 1.00 0.00 C ATOM 0 H LEU A 123 11.768 0.284 -6.907 1.00 0.00 H new ATOM 0 HA LEU A 123 11.885 3.052 -6.798 1.00 0.00 H new ATOM 0 HB2 LEU A 123 14.091 0.993 -6.435 1.00 0.00 H new ATOM 0 HB3 LEU A 123 14.178 2.660 -5.899 1.00 0.00 H new ATOM 0 HG LEU A 123 12.246 0.557 -4.881 1.00 0.00 H new ATOM 0 HD11 LEU A 123 13.521 0.769 -2.783 1.00 0.00 H new ATOM 0 HD12 LEU A 123 14.547 0.211 -4.125 1.00 0.00 H new ATOM 0 HD13 LEU A 123 14.637 1.903 -3.580 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.598 2.252 -3.215 1.00 0.00 H new ATOM 0 HD22 LEU A 123 12.638 3.444 -4.029 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.220 2.778 -4.873 1.00 0.00 H new ATOM 1987 N ASN A 124 13.847 1.766 -9.126 1.00 0.00 N ATOM 1988 CA ASN A 124 14.600 2.091 -10.333 1.00 0.00 C ATOM 1989 C ASN A 124 13.742 2.886 -11.312 1.00 0.00 C ATOM 1990 O ASN A 124 14.248 3.723 -12.060 1.00 0.00 O ATOM 1991 CB ASN A 124 15.106 0.812 -11.003 1.00 0.00 C ATOM 1992 CG ASN A 124 16.434 0.348 -10.435 1.00 0.00 C ATOM 1993 OD1 ASN A 124 17.488 0.888 -10.772 1.00 0.00 O ATOM 1994 ND2 ASN A 124 16.388 -0.657 -9.568 1.00 0.00 N ATOM 0 H ASN A 124 13.816 0.771 -8.903 1.00 0.00 H new ATOM 0 HA ASN A 124 15.454 2.705 -10.045 1.00 0.00 H new ATOM 0 HB2 ASN A 124 14.365 0.022 -10.879 1.00 0.00 H new ATOM 0 HB3 ASN A 124 15.212 0.984 -12.074 1.00 0.00 H new ATOM 0 HD21 ASN A 124 17.249 -1.012 -9.152 1.00 0.00 H new ATOM 0 HD22 ASN A 124 15.491 -1.074 -9.318 1.00 0.00 H new ATOM 2001 N LEU A 125 12.440 2.618 -11.302 1.00 0.00 N ATOM 2002 CA LEU A 125 11.510 3.309 -12.188 1.00 0.00 C ATOM 2003 C LEU A 125 11.179 4.698 -11.654 1.00 0.00 C ATOM 2004 O LEU A 125 11.061 5.656 -12.419 1.00 0.00 O ATOM 2005 CB LEU A 125 10.227 2.492 -12.349 1.00 0.00 C ATOM 2006 CG LEU A 125 10.289 1.332 -13.344 1.00 0.00 C ATOM 2007 CD1 LEU A 125 9.184 0.327 -13.060 1.00 0.00 C ATOM 2008 CD2 LEU A 125 10.190 1.848 -14.772 1.00 0.00 C ATOM 0 H LEU A 125 12.005 1.927 -10.690 1.00 0.00 H new ATOM 0 HA LEU A 125 11.988 3.420 -13.161 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.950 2.093 -11.373 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.427 3.166 -12.657 1.00 0.00 H new ATOM 0 HG LEU A 125 11.249 0.829 -13.227 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.243 -0.491 -13.777 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.301 -0.066 -12.050 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.215 0.817 -13.148 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.236 1.009 -15.466 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.246 2.376 -14.903 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.017 2.529 -14.971 1.00 0.00 H new ATOM 2020 N TRP A 126 11.032 4.801 -10.339 1.00 0.00 N ATOM 2021 CA TRP A 126 10.717 6.075 -9.702 1.00 0.00 C ATOM 2022 C TRP A 126 11.825 7.094 -9.944 1.00 0.00 C ATOM 2023 O TRP A 126 11.571 8.196 -10.429 1.00 0.00 O ATOM 2024 CB TRP A 126 10.506 5.879 -8.200 1.00 0.00 C ATOM 2025 CG TRP A 126 9.146 5.353 -7.854 1.00 0.00 C ATOM 2026 CD1 TRP A 126 8.082 5.213 -8.699 1.00 0.00 C ATOM 2027 CD2 TRP A 126 8.703 4.899 -6.570 1.00 0.00 C ATOM 2028 NE1 TRP A 126 7.005 4.700 -8.018 1.00 0.00 N ATOM 2029 CE2 TRP A 126 7.360 4.498 -6.711 1.00 0.00 C ATOM 2030 CE3 TRP A 126 9.311 4.791 -5.317 1.00 0.00 C ATOM 2031 CZ2 TRP A 126 6.618 3.998 -5.644 1.00 0.00 C ATOM 2032 CZ3 TRP A 126 8.572 4.296 -4.259 1.00 0.00 C ATOM 2033 CH2 TRP A 126 7.238 3.903 -4.428 1.00 0.00 C ATOM 0 H TRP A 126 11.126 4.018 -9.692 1.00 0.00 H new ATOM 0 HA TRP A 126 9.797 6.456 -10.144 1.00 0.00 H new ATOM 0 HB2 TRP A 126 11.261 5.190 -7.821 1.00 0.00 H new ATOM 0 HB3 TRP A 126 10.659 6.831 -7.692 1.00 0.00 H new ATOM 0 HD1 TRP A 126 8.087 5.468 -9.748 1.00 0.00 H new ATOM 0 HE1 TRP A 126 6.089 4.502 -8.421 1.00 0.00 H new ATOM 0 HE3 TRP A 126 10.340 5.089 -5.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 5.589 3.696 -5.772 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 9.031 4.211 -3.285 1.00 0.00 H new ATOM 0 HH2 TRP A 126 6.688 3.518 -3.582 1.00 0.00 H new ATOM 2044 N GLN A 127 13.053 6.717 -9.604 1.00 0.00 N ATOM 2045 CA GLN A 127 14.200 7.600 -9.785 1.00 0.00 C ATOM 2046 C GLN A 127 14.334 8.026 -11.243 1.00 0.00 C ATOM 2047 O GLN A 127 14.930 9.059 -11.547 1.00 0.00 O ATOM 2048 CB GLN A 127 15.482 6.906 -9.323 1.00 0.00 C ATOM 2049 CG GLN A 127 16.531 7.864 -8.782 1.00 0.00 C ATOM 2050 CD GLN A 127 17.899 7.223 -8.659 1.00 0.00 C ATOM 2051 OE1 GLN A 127 18.458 6.732 -9.641 1.00 0.00 O ATOM 2052 NE2 GLN A 127 18.448 7.224 -7.450 1.00 0.00 N ATOM 0 H GLN A 127 13.280 5.807 -9.202 1.00 0.00 H new ATOM 0 HA GLN A 127 14.040 8.492 -9.179 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.233 6.179 -8.550 1.00 0.00 H new ATOM 0 HB3 GLN A 127 15.906 6.350 -10.159 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.598 8.731 -9.439 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.215 8.228 -7.804 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.950 7.642 -6.664 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.368 6.807 -7.307 1.00 0.00 H new ATOM 2061 N LYS A 128 13.776 7.223 -12.143 1.00 0.00 N ATOM 2062 CA LYS A 128 13.833 7.515 -13.570 1.00 0.00 C ATOM 2063 C LYS A 128 12.711 8.467 -13.974 1.00 0.00 C ATOM 2064 O LYS A 128 12.953 9.488 -14.618 1.00 0.00 O ATOM 2065 CB LYS A 128 13.735 6.222 -14.381 1.00 0.00 C ATOM 2066 CG LYS A 128 13.267 6.434 -15.810 1.00 0.00 C ATOM 2067 CD LYS A 128 13.361 5.153 -16.624 1.00 0.00 C ATOM 2068 CE LYS A 128 12.477 5.212 -17.860 1.00 0.00 C ATOM 2069 NZ LYS A 128 12.893 4.218 -18.887 1.00 0.00 N ATOM 0 H LYS A 128 13.279 6.364 -11.909 1.00 0.00 H new ATOM 0 HA LYS A 128 14.789 7.996 -13.780 1.00 0.00 H new ATOM 0 HB2 LYS A 128 14.711 5.737 -14.395 1.00 0.00 H new ATOM 0 HB3 LYS A 128 13.048 5.540 -13.880 1.00 0.00 H new ATOM 0 HG2 LYS A 128 12.237 6.790 -15.807 1.00 0.00 H new ATOM 0 HG3 LYS A 128 13.871 7.210 -16.280 1.00 0.00 H new ATOM 0 HD2 LYS A 128 14.396 4.986 -16.923 1.00 0.00 H new ATOM 0 HD3 LYS A 128 13.067 4.305 -16.005 1.00 0.00 H new ATOM 0 HE2 LYS A 128 11.441 5.028 -17.575 1.00 0.00 H new ATOM 0 HE3 LYS A 128 12.517 6.214 -18.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 12.266 4.290 -19.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 13.873 4.409 -19.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 12.831 3.260 -18.488 1.00 0.00 H new ATOM 2083 N ASN A 129 11.485 8.127 -13.592 1.00 0.00 N ATOM 2084 CA ASN A 129 10.327 8.952 -13.914 1.00 0.00 C ATOM 2085 C ASN A 129 10.322 10.231 -13.082 1.00 0.00 C ATOM 2086 O ASN A 129 9.403 11.043 -13.180 1.00 0.00 O ATOM 2087 CB ASN A 129 9.034 8.169 -13.675 1.00 0.00 C ATOM 2088 CG ASN A 129 8.715 7.219 -14.812 1.00 0.00 C ATOM 2089 OD1 ASN A 129 8.202 7.630 -15.854 1.00 0.00 O ATOM 2090 ND2 ASN A 129 9.017 5.941 -14.618 1.00 0.00 N ATOM 0 H ASN A 129 11.268 7.285 -13.059 1.00 0.00 H new ATOM 0 HA ASN A 129 10.388 9.225 -14.967 1.00 0.00 H new ATOM 0 HB2 ASN A 129 9.121 7.604 -12.747 1.00 0.00 H new ATOM 0 HB3 ASN A 129 8.208 8.868 -13.547 1.00 0.00 H new ATOM 0 HD21 ASN A 129 8.825 5.255 -15.348 1.00 0.00 H new ATOM 0 HD22 ASN A 129 9.441 5.645 -13.739 1.00 0.00 H new ATOM 2097 N ASN A 130 11.355 10.403 -12.265 1.00 0.00 N ATOM 2098 CA ASN A 130 11.470 11.583 -11.416 1.00 0.00 C ATOM 2099 C ASN A 130 10.329 11.639 -10.405 1.00 0.00 C ATOM 2100 O ASN A 130 9.939 12.715 -9.952 1.00 0.00 O ATOM 2101 CB ASN A 130 11.473 12.853 -12.269 1.00 0.00 C ATOM 2102 CG ASN A 130 12.693 12.944 -13.166 1.00 0.00 C ATOM 2103 OD1 ASN A 130 13.766 12.448 -12.824 1.00 0.00 O ATOM 2104 ND2 ASN A 130 12.532 13.580 -14.320 1.00 0.00 N ATOM 0 H ASN A 130 12.125 9.740 -12.173 1.00 0.00 H new ATOM 0 HA ASN A 130 12.412 11.517 -10.871 1.00 0.00 H new ATOM 0 HB2 ASN A 130 10.572 12.878 -12.882 1.00 0.00 H new ATOM 0 HB3 ASN A 130 11.439 13.726 -11.617 1.00 0.00 H new ATOM 0 HD21 ASN A 130 13.317 13.673 -14.965 1.00 0.00 H new ATOM 0 HD22 ASN A 130 11.623 13.976 -14.562 1.00 0.00 H new ATOM 2111 N VAL A 131 9.798 10.472 -10.055 1.00 0.00 N ATOM 2112 CA VAL A 131 8.702 10.387 -9.096 1.00 0.00 C ATOM 2113 C VAL A 131 9.153 10.824 -7.707 1.00 0.00 C ATOM 2114 O VAL A 131 8.481 11.617 -7.046 1.00 0.00 O ATOM 2115 CB VAL A 131 8.138 8.956 -9.014 1.00 0.00 C ATOM 2116 CG1 VAL A 131 6.883 8.925 -8.155 1.00 0.00 C ATOM 2117 CG2 VAL A 131 7.854 8.415 -10.407 1.00 0.00 C ATOM 0 H VAL A 131 10.109 9.572 -10.421 1.00 0.00 H new ATOM 0 HA VAL A 131 7.919 11.058 -9.449 1.00 0.00 H new ATOM 0 HB VAL A 131 8.886 8.316 -8.546 1.00 0.00 H new ATOM 0 HG11 VAL A 131 6.499 7.906 -8.109 1.00 0.00 H new ATOM 0 HG12 VAL A 131 7.122 9.269 -7.149 1.00 0.00 H new ATOM 0 HG13 VAL A 131 6.127 9.578 -8.591 1.00 0.00 H new ATOM 0 HG21 VAL A 131 7.456 7.403 -10.330 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.125 9.055 -10.904 1.00 0.00 H new ATOM 0 HG23 VAL A 131 8.777 8.399 -10.986 1.00 0.00 H new ATOM 2127 N PHE A 132 10.294 10.304 -7.270 1.00 0.00 N ATOM 2128 CA PHE A 132 10.835 10.640 -5.958 1.00 0.00 C ATOM 2129 C PHE A 132 12.301 11.050 -6.063 1.00 0.00 C ATOM 2130 O PHE A 132 13.027 10.584 -6.941 1.00 0.00 O ATOM 2131 CB PHE A 132 10.694 9.452 -5.004 1.00 0.00 C ATOM 2132 CG PHE A 132 9.267 9.069 -4.732 1.00 0.00 C ATOM 2133 CD1 PHE A 132 8.569 8.268 -5.621 1.00 0.00 C ATOM 2134 CD2 PHE A 132 8.624 9.509 -3.586 1.00 0.00 C ATOM 2135 CE1 PHE A 132 7.256 7.914 -5.373 1.00 0.00 C ATOM 2136 CE2 PHE A 132 7.312 9.158 -3.332 1.00 0.00 C ATOM 2137 CZ PHE A 132 6.627 8.359 -4.227 1.00 0.00 C ATOM 0 H PHE A 132 10.863 9.648 -7.805 1.00 0.00 H new ATOM 0 HA PHE A 132 10.267 11.483 -5.564 1.00 0.00 H new ATOM 0 HB2 PHE A 132 11.218 8.594 -5.425 1.00 0.00 H new ATOM 0 HB3 PHE A 132 11.183 9.694 -4.060 1.00 0.00 H new ATOM 0 HD1 PHE A 132 9.056 7.916 -6.518 1.00 0.00 H new ATOM 0 HD2 PHE A 132 9.155 10.134 -2.883 1.00 0.00 H new ATOM 0 HE1 PHE A 132 6.723 7.290 -6.075 1.00 0.00 H new ATOM 0 HE2 PHE A 132 6.823 9.508 -2.435 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.601 8.083 -4.031 1.00 0.00 H new ATOM 2147 N LYS A 133 12.730 11.927 -5.161 1.00 0.00 N ATOM 2148 CA LYS A 133 14.109 12.401 -5.150 1.00 0.00 C ATOM 2149 C LYS A 133 15.066 11.282 -4.752 1.00 0.00 C ATOM 2150 O LYS A 133 14.734 10.434 -3.924 1.00 0.00 O ATOM 2151 CB LYS A 133 14.256 13.580 -4.185 1.00 0.00 C ATOM 2152 CG LYS A 133 14.538 13.162 -2.753 1.00 0.00 C ATOM 2153 CD LYS A 133 14.670 14.367 -1.836 1.00 0.00 C ATOM 2154 CE LYS A 133 13.546 15.366 -2.064 1.00 0.00 C ATOM 2155 NZ LYS A 133 13.378 16.286 -0.904 1.00 0.00 N ATOM 0 H LYS A 133 12.142 12.324 -4.428 1.00 0.00 H new ATOM 0 HA LYS A 133 14.362 12.730 -6.158 1.00 0.00 H new ATOM 0 HB2 LYS A 133 15.064 14.224 -4.532 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.342 14.174 -4.208 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.734 12.518 -2.396 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.456 12.575 -2.718 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.660 14.038 -0.797 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.631 14.853 -2.008 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.754 15.948 -2.962 1.00 0.00 H new ATOM 0 HE3 LYS A 133 12.614 14.830 -2.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 12.603 16.951 -1.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 13.155 15.733 -0.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 14.259 16.817 -0.751 1.00 0.00 H new ATOM 2169 N SER A 134 16.255 11.288 -5.345 1.00 0.00 N ATOM 2170 CA SER A 134 17.260 10.272 -5.054 1.00 0.00 C ATOM 2171 C SER A 134 17.548 10.206 -3.557 1.00 0.00 C ATOM 2172 O SER A 134 17.863 9.144 -3.021 1.00 0.00 O ATOM 2173 CB SER A 134 18.550 10.565 -5.821 1.00 0.00 C ATOM 2174 OG SER A 134 19.218 9.366 -6.174 1.00 0.00 O ATOM 0 H SER A 134 16.546 11.985 -6.030 1.00 0.00 H new ATOM 0 HA SER A 134 16.868 9.307 -5.374 1.00 0.00 H new ATOM 0 HB2 SER A 134 18.320 11.135 -6.721 1.00 0.00 H new ATOM 0 HB3 SER A 134 19.207 11.185 -5.210 1.00 0.00 H new ATOM 0 HG SER A 134 20.039 9.581 -6.665 1.00 0.00 H new ATOM 2180 N GLU A 135 17.438 11.350 -2.889 1.00 0.00 N ATOM 2181 CA GLU A 135 17.687 11.424 -1.454 1.00 0.00 C ATOM 2182 C GLU A 135 16.659 10.603 -0.680 1.00 0.00 C ATOM 2183 O GLU A 135 16.846 10.309 0.501 1.00 0.00 O ATOM 2184 CB GLU A 135 17.654 12.879 -0.982 1.00 0.00 C ATOM 2185 CG GLU A 135 17.213 13.039 0.463 1.00 0.00 C ATOM 2186 CD GLU A 135 17.541 14.409 1.025 1.00 0.00 C ATOM 2187 OE1 GLU A 135 17.418 15.402 0.278 1.00 0.00 O ATOM 2188 OE2 GLU A 135 17.922 14.487 2.212 1.00 0.00 O ATOM 0 H GLU A 135 17.178 12.238 -3.318 1.00 0.00 H new ATOM 0 HA GLU A 135 18.677 11.010 -1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 135 18.647 13.313 -1.101 1.00 0.00 H new ATOM 0 HB3 GLU A 135 16.979 13.445 -1.624 1.00 0.00 H new ATOM 0 HG2 GLU A 135 16.138 12.870 0.532 1.00 0.00 H new ATOM 0 HG3 GLU A 135 17.695 12.275 1.073 1.00 0.00 H new ATOM 2195 N ILE A 136 15.575 10.236 -1.355 1.00 0.00 N ATOM 2196 CA ILE A 136 14.518 9.449 -0.732 1.00 0.00 C ATOM 2197 C ILE A 136 14.581 7.993 -1.180 1.00 0.00 C ATOM 2198 O ILE A 136 14.357 7.078 -0.385 1.00 0.00 O ATOM 2199 CB ILE A 136 13.125 10.016 -1.061 1.00 0.00 C ATOM 2200 CG1 ILE A 136 12.887 11.319 -0.295 1.00 0.00 C ATOM 2201 CG2 ILE A 136 12.046 8.996 -0.731 1.00 0.00 C ATOM 2202 CD1 ILE A 136 11.854 12.218 -0.938 1.00 0.00 C ATOM 0 H ILE A 136 15.406 10.471 -2.333 1.00 0.00 H new ATOM 0 HA ILE A 136 14.677 9.503 0.345 1.00 0.00 H new ATOM 0 HB ILE A 136 13.079 10.231 -2.129 1.00 0.00 H new ATOM 0 HG12 ILE A 136 12.569 11.081 0.720 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.829 11.861 -0.215 1.00 0.00 H new ATOM 0 HG21 ILE A 136 11.067 9.412 -0.969 1.00 0.00 H new ATOM 0 HG22 ILE A 136 12.209 8.092 -1.318 1.00 0.00 H new ATOM 0 HG23 ILE A 136 12.088 8.752 0.331 1.00 0.00 H new ATOM 0 HD11 ILE A 136 11.737 13.123 -0.341 1.00 0.00 H new ATOM 0 HD12 ILE A 136 12.180 12.486 -1.943 1.00 0.00 H new ATOM 0 HD13 ILE A 136 10.900 11.694 -0.994 1.00 0.00 H new ATOM 2214 N ILE A 137 14.888 7.784 -2.455 1.00 0.00 N ATOM 2215 CA ILE A 137 14.983 6.439 -3.008 1.00 0.00 C ATOM 2216 C ILE A 137 16.323 5.798 -2.667 1.00 0.00 C ATOM 2217 O ILE A 137 16.385 4.627 -2.292 1.00 0.00 O ATOM 2218 CB ILE A 137 14.803 6.445 -4.538 1.00 0.00 C ATOM 2219 CG1 ILE A 137 13.513 7.172 -4.919 1.00 0.00 C ATOM 2220 CG2 ILE A 137 14.795 5.021 -5.075 1.00 0.00 C ATOM 2221 CD1 ILE A 137 13.029 6.853 -6.317 1.00 0.00 C ATOM 0 H ILE A 137 15.075 8.530 -3.125 1.00 0.00 H new ATOM 0 HA ILE A 137 14.179 5.856 -2.559 1.00 0.00 H new ATOM 0 HB ILE A 137 15.642 6.977 -4.986 1.00 0.00 H new ATOM 0 HG12 ILE A 137 12.733 6.909 -4.204 1.00 0.00 H new ATOM 0 HG13 ILE A 137 13.673 8.247 -4.835 1.00 0.00 H new ATOM 0 HG21 ILE A 137 14.667 5.041 -6.157 1.00 0.00 H new ATOM 0 HG22 ILE A 137 15.739 4.535 -4.830 1.00 0.00 H new ATOM 0 HG23 ILE A 137 13.973 4.466 -4.623 1.00 0.00 H new ATOM 0 HD11 ILE A 137 12.110 7.404 -6.518 1.00 0.00 H new ATOM 0 HD12 ILE A 137 13.791 7.142 -7.041 1.00 0.00 H new ATOM 0 HD13 ILE A 137 12.836 5.783 -6.400 1.00 0.00 H new ATOM 2233 N GLN A 138 17.394 6.574 -2.797 1.00 0.00 N ATOM 2234 CA GLN A 138 18.735 6.081 -2.501 1.00 0.00 C ATOM 2235 C GLN A 138 18.704 5.073 -1.358 1.00 0.00 C ATOM 2236 O GLN A 138 19.184 3.946 -1.479 1.00 0.00 O ATOM 2237 CB GLN A 138 19.661 7.245 -2.146 1.00 0.00 C ATOM 2238 CG GLN A 138 20.837 6.841 -1.270 1.00 0.00 C ATOM 2239 CD GLN A 138 21.862 6.010 -2.017 1.00 0.00 C ATOM 2240 OE1 GLN A 138 22.800 6.546 -2.608 1.00 0.00 O ATOM 2241 NE2 GLN A 138 21.689 4.694 -1.992 1.00 0.00 N ATOM 0 H GLN A 138 17.360 7.546 -3.105 1.00 0.00 H new ATOM 0 HA GLN A 138 19.116 5.581 -3.391 1.00 0.00 H new ATOM 0 HB2 GLN A 138 20.040 7.691 -3.066 1.00 0.00 H new ATOM 0 HB3 GLN A 138 19.084 8.014 -1.633 1.00 0.00 H new ATOM 0 HG2 GLN A 138 21.318 7.737 -0.877 1.00 0.00 H new ATOM 0 HG3 GLN A 138 20.470 6.275 -0.414 1.00 0.00 H new ATOM 0 HE21 GLN A 138 20.897 4.293 -1.489 1.00 0.00 H new ATOM 0 HE22 GLN A 138 22.348 4.084 -2.475 1.00 0.00 H new ATOM 2250 N PRO A 139 18.126 5.485 -0.220 1.00 0.00 N ATOM 2251 CA PRO A 139 18.019 4.632 0.967 1.00 0.00 C ATOM 2252 C PRO A 139 17.035 3.484 0.769 1.00 0.00 C ATOM 2253 O PRO A 139 17.243 2.380 1.276 1.00 0.00 O ATOM 2254 CB PRO A 139 17.511 5.590 2.048 1.00 0.00 C ATOM 2255 CG PRO A 139 16.798 6.663 1.298 1.00 0.00 C ATOM 2256 CD PRO A 139 17.533 6.815 -0.005 1.00 0.00 C ATOM 0 HA PRO A 139 18.968 4.155 1.212 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.843 5.083 2.744 1.00 0.00 H new ATOM 0 HB3 PRO A 139 18.334 5.997 2.635 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.755 6.394 1.129 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.799 7.598 1.858 1.00 0.00 H new ATOM 0 HD2 PRO A 139 16.859 7.090 -0.816 1.00 0.00 H new ATOM 0 HD3 PRO A 139 18.297 7.591 0.053 1.00 0.00 H new ATOM 2264 N LEU A 140 15.964 3.749 0.030 1.00 0.00 N ATOM 2265 CA LEU A 140 14.948 2.737 -0.236 1.00 0.00 C ATOM 2266 C LEU A 140 15.535 1.570 -1.025 1.00 0.00 C ATOM 2267 O LEU A 140 15.080 0.432 -0.901 1.00 0.00 O ATOM 2268 CB LEU A 140 13.778 3.351 -1.007 1.00 0.00 C ATOM 2269 CG LEU A 140 12.901 4.330 -0.226 1.00 0.00 C ATOM 2270 CD1 LEU A 140 11.820 4.912 -1.125 1.00 0.00 C ATOM 2271 CD2 LEU A 140 12.280 3.644 0.982 1.00 0.00 C ATOM 0 H LEU A 140 15.776 4.657 -0.396 1.00 0.00 H new ATOM 0 HA LEU A 140 14.587 2.360 0.721 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.176 3.868 -1.881 1.00 0.00 H new ATOM 0 HB3 LEU A 140 13.147 2.542 -1.375 1.00 0.00 H new ATOM 0 HG LEU A 140 13.529 5.147 0.129 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.205 5.607 -0.552 1.00 0.00 H new ATOM 0 HD12 LEU A 140 12.285 5.440 -1.958 1.00 0.00 H new ATOM 0 HD13 LEU A 140 11.194 4.107 -1.510 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.659 4.356 1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 140 11.666 2.807 0.649 1.00 0.00 H new ATOM 0 HD23 LEU A 140 13.070 3.276 1.637 1.00 0.00 H new ATOM 2283 N LEU A 141 16.548 1.860 -1.834 1.00 0.00 N ATOM 2284 CA LEU A 141 17.199 0.834 -2.642 1.00 0.00 C ATOM 2285 C LEU A 141 18.048 -0.087 -1.771 1.00 0.00 C ATOM 2286 O LEU A 141 18.240 -1.259 -2.094 1.00 0.00 O ATOM 2287 CB LEU A 141 18.071 1.483 -3.718 1.00 0.00 C ATOM 2288 CG LEU A 141 17.335 2.009 -4.951 1.00 0.00 C ATOM 2289 CD1 LEU A 141 18.201 3.006 -5.705 1.00 0.00 C ATOM 2290 CD2 LEU A 141 16.928 0.858 -5.860 1.00 0.00 C ATOM 0 H LEU A 141 16.936 2.796 -1.948 1.00 0.00 H new ATOM 0 HA LEU A 141 16.423 0.237 -3.122 1.00 0.00 H new ATOM 0 HB2 LEU A 141 18.617 2.311 -3.265 1.00 0.00 H new ATOM 0 HB3 LEU A 141 18.812 0.754 -4.045 1.00 0.00 H new ATOM 0 HG LEU A 141 16.432 2.522 -4.620 1.00 0.00 H new ATOM 0 HD11 LEU A 141 17.661 3.369 -6.579 1.00 0.00 H new ATOM 0 HD12 LEU A 141 18.442 3.845 -5.053 1.00 0.00 H new ATOM 0 HD13 LEU A 141 19.122 2.519 -6.025 1.00 0.00 H new ATOM 0 HD21 LEU A 141 16.405 1.251 -6.732 1.00 0.00 H new ATOM 0 HD22 LEU A 141 17.818 0.317 -6.183 1.00 0.00 H new ATOM 0 HD23 LEU A 141 16.269 0.181 -5.317 1.00 0.00 H new ATOM 2302 N ASP A 142 18.551 0.451 -0.666 1.00 0.00 N ATOM 2303 CA ASP A 142 19.377 -0.324 0.254 1.00 0.00 C ATOM 2304 C ASP A 142 18.509 -1.150 1.198 1.00 0.00 C ATOM 2305 O ASP A 142 18.758 -2.337 1.406 1.00 0.00 O ATOM 2306 CB ASP A 142 20.289 0.604 1.059 1.00 0.00 C ATOM 2307 CG ASP A 142 21.587 -0.068 1.461 1.00 0.00 C ATOM 2308 OD1 ASP A 142 22.506 -0.134 0.618 1.00 0.00 O ATOM 2309 OD2 ASP A 142 21.684 -0.528 2.618 1.00 0.00 O ATOM 0 H ASP A 142 18.402 1.420 -0.385 1.00 0.00 H new ATOM 0 HA ASP A 142 19.993 -1.005 -0.334 1.00 0.00 H new ATOM 0 HB2 ASP A 142 20.511 1.493 0.468 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.764 0.939 1.954 1.00 0.00 H new ATOM 2314 N MET A 143 17.492 -0.513 1.768 1.00 0.00 N ATOM 2315 CA MET A 143 16.588 -1.190 2.691 1.00 0.00 C ATOM 2316 C MET A 143 16.363 -2.638 2.268 1.00 0.00 C ATOM 2317 O MET A 143 16.295 -3.536 3.107 1.00 0.00 O ATOM 2318 CB MET A 143 15.249 -0.453 2.759 1.00 0.00 C ATOM 2319 CG MET A 143 15.374 0.996 3.204 1.00 0.00 C ATOM 2320 SD MET A 143 13.939 1.563 4.135 1.00 0.00 S ATOM 2321 CE MET A 143 12.609 0.811 3.200 1.00 0.00 C ATOM 0 H MET A 143 17.273 0.470 1.607 1.00 0.00 H new ATOM 0 HA MET A 143 17.048 -1.186 3.679 1.00 0.00 H new ATOM 0 HB2 MET A 143 14.777 -0.483 1.777 1.00 0.00 H new ATOM 0 HB3 MET A 143 14.588 -0.980 3.447 1.00 0.00 H new ATOM 0 HG2 MET A 143 16.268 1.108 3.818 1.00 0.00 H new ATOM 0 HG3 MET A 143 15.508 1.631 2.328 1.00 0.00 H new ATOM 0 HE1 MET A 143 11.656 1.236 3.516 1.00 0.00 H new ATOM 0 HE2 MET A 143 12.757 1.004 2.137 1.00 0.00 H new ATOM 0 HE3 MET A 143 12.603 -0.265 3.376 1.00 0.00 H new ATOM 2331 N ALA A 144 16.248 -2.857 0.962 1.00 0.00 N ATOM 2332 CA ALA A 144 16.033 -4.197 0.429 1.00 0.00 C ATOM 2333 C ALA A 144 17.146 -5.145 0.860 1.00 0.00 C ATOM 2334 O ALA A 144 16.884 -6.260 1.311 1.00 0.00 O ATOM 2335 CB ALA A 144 15.935 -4.150 -1.089 1.00 0.00 C ATOM 0 H ALA A 144 16.300 -2.124 0.254 1.00 0.00 H new ATOM 0 HA ALA A 144 15.094 -4.576 0.832 1.00 0.00 H new ATOM 0 HB1 ALA A 144 15.775 -5.157 -1.475 1.00 0.00 H new ATOM 0 HB2 ALA A 144 15.100 -3.513 -1.380 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.860 -3.747 -1.501 1.00 0.00 H new