USER MOD reduce.3.24.130724 H: found=0, std=0, add=983, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 859 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 52 THR OG1 : rot 144:sc= 0.00701 USER MOD Set 1.2: A 132 SER OG : rot 180:sc= -0.686 USER MOD Set 2.1: A 98 THR OG1 : rot 180:sc= -0.301 USER MOD Set 2.2: A 129 HIS : no HD1:sc= -2.52 K(o=-2.8,f=-0.64) USER MOD Set 3.1: A 105 SER OG : rot 160:sc=-0.00199 USER MOD Set 3.2: A 121 ASN : amide:sc= -1.35! K(o=-1.4!,f=-0.7) USER MOD Set 4.1: A 80 SER OG : rot 180:sc= -1.04 USER MOD Set 4.2: A 81 GLN : amide:sc= -1.12 K(o=-2.2,f=2.1) USER MOD Single : A 8 ASN : amide:sc= -4.22! C(o=-4.2!,f=-6.1!) USER MOD Single : A 9 LYS NZ :NH3+ -130:sc= 0.708 (180deg=-0.821) USER MOD Single : A 11 LYS NZ :NH3+ -165:sc= -0.182 (180deg=-0.783) USER MOD Single : A 17 THR OG1 : rot 85:sc= 0.696! USER MOD Single : A 19 ASN : amide:sc= -9.06! C(o=-9.1!,f=-22!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 0.844 K(o=0.84,f=-1.3) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0.0165 USER MOD Single : A 33 GLN : amide:sc= -2.19 K(o=-2.2,f=-3!) USER MOD Single : A 34 TYR OH : rot 180:sc=-0.00056 USER MOD Single : A 35 LYS NZ :NH3+ -114:sc= -0.0376 (180deg=-0.547) USER MOD Single : A 38 ASN : amide:sc= -5.22! K(o=-5.2!,f=-0.74) USER MOD Single : A 39 SER OG : rot -16:sc= 0.282! USER MOD Single : A 41 ASN : amide:sc= -4.6! K(o=-4.6!,f=-0.85) USER MOD Single : A 44 LYS NZ :NH3+ 170:sc= -2.37! (180deg=-2.51!) USER MOD Single : A 47 LYS NZ :NH3+ 158:sc= -0.056 (180deg=-0.386) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.586 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -80:sc= -2.16 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 136:sc= 1.02 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 27:sc= 0.591 USER MOD Single : A 73 LYS NZ :NH3+ -152:sc= -0.215 (180deg=-1.65!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -1.86! K(o=-1.9!,f=-0.056) USER MOD Single : A 87 THR OG1 : rot 67:sc= 0.694 USER MOD Single : A 91 GLN : amide:sc= 0.182 K(o=0.18,f=-0.51) USER MOD Single : A 93 MET CE :methyl -118:sc= -0.521 (180deg=-5.26!) USER MOD Single : A 97 SER OG : rot -70:sc= -0.0307 USER MOD Single : A 102 TYR OH : rot -51:sc= 0.0759 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 150:sc= -2.87 USER MOD Single : A 123 THR OG1 : rot 160:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -128:sc= 0 (180deg=-2.58!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 103 N GLU A 7 98.941 21.306 9.871 1.00 1.00 N ATOM 104 CA GLU A 7 98.339 20.204 10.618 1.00 1.00 C ATOM 105 C GLU A 7 98.845 18.875 10.086 1.00 1.00 C ATOM 106 O GLU A 7 99.347 18.035 10.820 1.00 1.00 O ATOM 107 CB GLU A 7 96.820 20.242 10.494 1.00 1.00 C ATOM 108 CG GLU A 7 96.322 21.679 10.561 1.00 1.00 C ATOM 109 CD GLU A 7 94.798 21.708 10.527 1.00 1.00 C ATOM 110 OE1 GLU A 7 94.246 22.796 10.539 1.00 1.00 O ATOM 111 OE2 GLU A 7 94.205 20.642 10.490 1.00 1.00 O ATOM 0 HA GLU A 7 98.618 20.311 11.666 1.00 1.00 H new ATOM 0 HB2 GLU A 7 96.513 19.787 9.552 1.00 1.00 H new ATOM 0 HB3 GLU A 7 96.368 19.655 11.294 1.00 1.00 H new ATOM 0 HG2 GLU A 7 96.682 22.155 11.473 1.00 1.00 H new ATOM 0 HG3 GLU A 7 96.723 22.250 9.724 1.00 1.00 H new ATOM 118 N ASN A 8 98.723 18.714 8.790 1.00 1.00 N ATOM 119 CA ASN A 8 99.176 17.497 8.133 1.00 1.00 C ATOM 120 C ASN A 8 100.652 17.328 8.407 1.00 1.00 C ATOM 121 O ASN A 8 101.163 16.217 8.550 1.00 1.00 O ATOM 122 CB ASN A 8 98.944 17.632 6.638 1.00 1.00 C ATOM 123 CG ASN A 8 97.456 17.673 6.346 1.00 1.00 C ATOM 124 OD1 ASN A 8 96.640 17.374 7.216 1.00 1.00 O ATOM 125 ND2 ASN A 8 97.059 18.009 5.157 1.00 1.00 N ATOM 0 H ASN A 8 98.314 19.407 8.163 1.00 1.00 H new ATOM 0 HA ASN A 8 98.630 16.631 8.507 1.00 1.00 H new ATOM 0 HB2 ASN A 8 99.421 18.540 6.268 1.00 1.00 H new ATOM 0 HB3 ASN A 8 99.403 16.794 6.113 1.00 1.00 H new ATOM 0 HD21 ASN A 8 96.063 18.027 4.938 1.00 1.00 H new ATOM 0 HD22 ASN A 8 97.743 18.256 4.442 1.00 1.00 H new ATOM 132 N LYS A 9 101.317 18.461 8.483 1.00 1.00 N ATOM 133 CA LYS A 9 102.743 18.501 8.748 1.00 1.00 C ATOM 134 C LYS A 9 103.066 17.995 10.155 1.00 1.00 C ATOM 135 O LYS A 9 103.926 17.145 10.327 1.00 1.00 O ATOM 136 CB LYS A 9 103.198 19.964 8.571 1.00 1.00 C ATOM 137 CG LYS A 9 104.394 20.324 9.456 1.00 1.00 C ATOM 138 CD LYS A 9 104.874 21.742 9.143 1.00 1.00 C ATOM 139 CE LYS A 9 106.097 22.068 10.010 1.00 1.00 C ATOM 140 NZ LYS A 9 107.312 21.462 9.395 1.00 1.00 N ATOM 0 H LYS A 9 100.888 19.379 8.364 1.00 1.00 H new ATOM 0 HA LYS A 9 103.272 17.845 8.057 1.00 1.00 H new ATOM 0 HB2 LYS A 9 103.460 20.134 7.527 1.00 1.00 H new ATOM 0 HB3 LYS A 9 102.366 20.629 8.804 1.00 1.00 H new ATOM 0 HG2 LYS A 9 104.113 20.251 10.507 1.00 1.00 H new ATOM 0 HG3 LYS A 9 105.204 19.613 9.292 1.00 1.00 H new ATOM 0 HD2 LYS A 9 105.130 21.826 8.087 1.00 1.00 H new ATOM 0 HD3 LYS A 9 104.076 22.459 9.336 1.00 1.00 H new ATOM 0 HE2 LYS A 9 106.219 23.148 10.096 1.00 1.00 H new ATOM 0 HE3 LYS A 9 105.955 21.682 11.019 1.00 1.00 H new ATOM 0 HZ1 LYS A 9 107.834 20.924 10.116 1.00 1.00 H new ATOM 0 HZ2 LYS A 9 107.029 20.824 8.624 1.00 1.00 H new ATOM 0 HZ3 LYS A 9 107.921 22.215 9.016 1.00 1.00 H new ATOM 154 N VAL A 10 102.396 18.533 11.163 1.00 1.00 N ATOM 155 CA VAL A 10 102.688 18.122 12.528 1.00 1.00 C ATOM 156 C VAL A 10 102.286 16.680 12.777 1.00 1.00 C ATOM 157 O VAL A 10 103.065 15.899 13.325 1.00 1.00 O ATOM 158 CB VAL A 10 102.005 19.058 13.524 1.00 1.00 C ATOM 159 CG1 VAL A 10 102.165 18.510 14.926 1.00 1.00 C ATOM 160 CG2 VAL A 10 102.650 20.443 13.429 1.00 1.00 C ATOM 0 H VAL A 10 101.665 19.237 11.067 1.00 1.00 H new ATOM 0 HA VAL A 10 103.766 18.187 12.672 1.00 1.00 H new ATOM 0 HB VAL A 10 100.943 19.134 13.293 1.00 1.00 H new ATOM 0 HG11 VAL A 10 101.677 19.178 15.636 1.00 1.00 H new ATOM 0 HG12 VAL A 10 101.708 17.522 14.985 1.00 1.00 H new ATOM 0 HG13 VAL A 10 103.225 18.434 15.168 1.00 1.00 H new ATOM 0 HG21 VAL A 10 102.169 21.118 14.137 1.00 1.00 H new ATOM 0 HG22 VAL A 10 103.711 20.367 13.665 1.00 1.00 H new ATOM 0 HG23 VAL A 10 102.530 20.832 12.418 1.00 1.00 H new ATOM 164 N LYS A 11 101.090 16.319 12.360 1.00 1.00 N ATOM 165 CA LYS A 11 100.641 14.959 12.537 1.00 1.00 C ATOM 166 C LYS A 11 101.567 14.063 11.743 1.00 1.00 C ATOM 167 O LYS A 11 101.910 12.966 12.170 1.00 1.00 O ATOM 168 CB LYS A 11 99.199 14.796 12.064 1.00 1.00 C ATOM 169 CG LYS A 11 98.210 15.366 13.104 1.00 1.00 C ATOM 170 CD LYS A 11 98.092 16.884 12.952 1.00 1.00 C ATOM 171 CE LYS A 11 97.321 17.461 14.139 1.00 1.00 C ATOM 172 NZ LYS A 11 96.245 16.512 14.544 1.00 1.00 N ATOM 0 H LYS A 11 100.422 16.940 11.903 1.00 1.00 H new ATOM 0 HA LYS A 11 100.665 14.690 13.593 1.00 1.00 H new ATOM 0 HB2 LYS A 11 99.065 15.307 11.111 1.00 1.00 H new ATOM 0 HB3 LYS A 11 98.985 13.741 11.893 1.00 1.00 H new ATOM 0 HG2 LYS A 11 97.231 14.904 12.976 1.00 1.00 H new ATOM 0 HG3 LYS A 11 98.549 15.120 14.110 1.00 1.00 H new ATOM 0 HD2 LYS A 11 99.084 17.332 12.898 1.00 1.00 H new ATOM 0 HD3 LYS A 11 97.581 17.127 12.021 1.00 1.00 H new ATOM 0 HE2 LYS A 11 97.998 17.637 14.975 1.00 1.00 H new ATOM 0 HE3 LYS A 11 96.888 18.425 13.871 1.00 1.00 H new ATOM 0 HZ1 LYS A 11 95.570 16.999 15.167 1.00 1.00 H new ATOM 0 HZ2 LYS A 11 95.749 16.168 13.697 1.00 1.00 H new ATOM 0 HZ3 LYS A 11 96.665 15.706 15.050 1.00 1.00 H new ATOM 186 N GLY A 12 101.969 14.565 10.581 1.00 1.00 N ATOM 187 CA GLY A 12 102.870 13.827 9.701 1.00 1.00 C ATOM 188 C GLY A 12 104.304 13.809 10.223 1.00 1.00 C ATOM 189 O GLY A 12 104.955 12.767 10.227 1.00 1.00 O ATOM 0 H GLY A 12 101.686 15.478 10.226 1.00 1.00 H new ATOM 0 HA2 GLY A 12 102.512 12.803 9.594 1.00 1.00 H new ATOM 0 HA3 GLY A 12 102.853 14.276 8.708 1.00 1.00 H new ATOM 193 N GLU A 13 104.804 14.951 10.677 1.00 1.00 N ATOM 194 CA GLU A 13 106.163 14.987 11.202 1.00 1.00 C ATOM 195 C GLU A 13 106.246 14.048 12.388 1.00 1.00 C ATOM 196 O GLU A 13 107.260 13.399 12.615 1.00 1.00 O ATOM 197 CB GLU A 13 106.557 16.405 11.643 1.00 1.00 C ATOM 198 CG GLU A 13 106.907 17.259 10.426 1.00 1.00 C ATOM 199 CD GLU A 13 107.228 18.684 10.864 1.00 1.00 C ATOM 200 OE1 GLU A 13 108.202 19.229 10.369 1.00 1.00 O ATOM 201 OE2 GLU A 13 106.494 19.211 11.683 1.00 1.00 O ATOM 0 H GLU A 13 104.306 15.841 10.693 1.00 1.00 H new ATOM 0 HA GLU A 13 106.852 14.678 10.415 1.00 1.00 H new ATOM 0 HB2 GLU A 13 105.736 16.864 12.194 1.00 1.00 H new ATOM 0 HB3 GLU A 13 107.409 16.359 12.321 1.00 1.00 H new ATOM 0 HG2 GLU A 13 107.762 16.829 9.903 1.00 1.00 H new ATOM 0 HG3 GLU A 13 106.074 17.265 9.724 1.00 1.00 H new ATOM 208 N ALA A 14 105.149 13.979 13.125 1.00 1.00 N ATOM 209 CA ALA A 14 105.063 13.120 14.285 1.00 1.00 C ATOM 210 C ALA A 14 104.946 11.673 13.846 1.00 1.00 C ATOM 211 O ALA A 14 105.476 10.762 14.483 1.00 1.00 O ATOM 212 CB ALA A 14 103.845 13.504 15.125 1.00 1.00 C ATOM 0 H ALA A 14 104.302 14.514 12.935 1.00 1.00 H new ATOM 0 HA ALA A 14 105.965 13.240 14.885 1.00 1.00 H new ATOM 0 HB1 ALA A 14 103.785 12.854 15.998 1.00 1.00 H new ATOM 0 HB2 ALA A 14 103.939 14.540 15.450 1.00 1.00 H new ATOM 0 HB3 ALA A 14 102.941 13.393 14.527 1.00 1.00 H new ATOM 218 N PHE A 15 104.233 11.483 12.748 1.00 1.00 N ATOM 219 CA PHE A 15 104.012 10.164 12.192 1.00 1.00 C ATOM 220 C PHE A 15 105.329 9.529 11.809 1.00 1.00 C ATOM 221 O PHE A 15 105.619 8.401 12.200 1.00 1.00 O ATOM 222 CB PHE A 15 103.121 10.338 10.975 1.00 1.00 C ATOM 223 CG PHE A 15 102.681 9.021 10.414 1.00 1.00 C ATOM 224 CD1 PHE A 15 103.290 8.528 9.263 1.00 1.00 C ATOM 225 CD2 PHE A 15 101.622 8.327 11.006 1.00 1.00 C ATOM 226 CE1 PHE A 15 102.843 7.337 8.700 1.00 1.00 C ATOM 227 CE2 PHE A 15 101.181 7.126 10.451 1.00 1.00 C ATOM 228 CZ PHE A 15 101.791 6.632 9.295 1.00 1.00 C ATOM 0 H PHE A 15 103.794 12.238 12.221 1.00 1.00 H new ATOM 0 HA PHE A 15 103.537 9.507 12.921 1.00 1.00 H new ATOM 0 HB2 PHE A 15 102.246 10.928 11.247 1.00 1.00 H new ATOM 0 HB3 PHE A 15 103.657 10.898 10.209 1.00 1.00 H new ATOM 0 HD1 PHE A 15 104.107 9.069 8.809 1.00 1.00 H new ATOM 0 HD2 PHE A 15 101.146 8.720 11.892 1.00 1.00 H new ATOM 0 HE1 PHE A 15 103.308 6.956 7.803 1.00 1.00 H new ATOM 0 HE2 PHE A 15 100.372 6.580 10.913 1.00 1.00 H new ATOM 0 HZ PHE A 15 101.450 5.704 8.860 1.00 1.00 H new ATOM 238 N LEU A 16 106.136 10.268 11.067 1.00 1.00 N ATOM 239 CA LEU A 16 107.440 9.763 10.665 1.00 1.00 C ATOM 240 C LEU A 16 108.318 9.604 11.891 1.00 1.00 C ATOM 241 O LEU A 16 109.081 8.646 12.003 1.00 1.00 O ATOM 242 CB LEU A 16 108.111 10.711 9.662 1.00 1.00 C ATOM 243 CG LEU A 16 107.486 10.553 8.251 1.00 1.00 C ATOM 244 CD1 LEU A 16 106.312 11.533 8.051 1.00 1.00 C ATOM 245 CD2 LEU A 16 108.562 10.808 7.196 1.00 1.00 C ATOM 0 H LEU A 16 105.917 11.207 10.734 1.00 1.00 H new ATOM 0 HA LEU A 16 107.305 8.796 10.180 1.00 1.00 H new ATOM 0 HB2 LEU A 16 108.002 11.742 10.000 1.00 1.00 H new ATOM 0 HB3 LEU A 16 109.180 10.502 9.617 1.00 1.00 H new ATOM 0 HG LEU A 16 107.098 9.539 8.151 1.00 1.00 H new ATOM 0 HD11 LEU A 16 105.893 11.400 7.054 1.00 1.00 H new ATOM 0 HD12 LEU A 16 105.542 11.336 8.797 1.00 1.00 H new ATOM 0 HD13 LEU A 16 106.670 12.557 8.161 1.00 1.00 H new ATOM 0 HD21 LEU A 16 108.130 10.699 6.201 1.00 1.00 H new ATOM 0 HD22 LEU A 16 108.953 11.819 7.312 1.00 1.00 H new ATOM 0 HD23 LEU A 16 109.372 10.089 7.321 1.00 1.00 H new ATOM 257 N THR A 17 108.195 10.549 12.809 1.00 1.00 N ATOM 258 CA THR A 17 108.980 10.498 14.030 1.00 1.00 C ATOM 259 C THR A 17 108.637 9.240 14.808 1.00 1.00 C ATOM 260 O THR A 17 109.511 8.571 15.356 1.00 1.00 O ATOM 261 CB THR A 17 108.718 11.724 14.905 1.00 1.00 C ATOM 262 OG1 THR A 17 108.906 12.907 14.145 1.00 1.00 O ATOM 263 CG2 THR A 17 109.683 11.717 16.077 1.00 1.00 C ATOM 0 H THR A 17 107.568 11.350 12.734 1.00 1.00 H new ATOM 0 HA THR A 17 110.035 10.488 13.755 1.00 1.00 H new ATOM 0 HB THR A 17 107.692 11.694 15.272 1.00 1.00 H new ATOM 0 HG1 THR A 17 108.082 13.117 13.657 1.00 1.00 H new ATOM 0 HG21 THR A 17 109.500 12.590 16.704 1.00 1.00 H new ATOM 0 HG22 THR A 17 109.536 10.811 16.664 1.00 1.00 H new ATOM 0 HG23 THR A 17 110.707 11.746 15.705 1.00 1.00 H new ATOM 271 N GLU A 18 107.348 8.938 14.869 1.00 1.00 N ATOM 272 CA GLU A 18 106.876 7.774 15.583 1.00 1.00 C ATOM 273 C GLU A 18 107.143 6.484 14.809 1.00 1.00 C ATOM 274 O GLU A 18 107.573 5.485 15.384 1.00 1.00 O ATOM 275 CB GLU A 18 105.387 7.927 15.882 1.00 1.00 C ATOM 276 CG GLU A 18 104.893 6.732 16.697 1.00 1.00 C ATOM 277 CD GLU A 18 103.442 6.947 17.112 1.00 1.00 C ATOM 278 OE1 GLU A 18 102.813 5.982 17.513 1.00 1.00 O ATOM 279 OE2 GLU A 18 102.984 8.073 17.026 1.00 1.00 O ATOM 0 H GLU A 18 106.612 9.490 14.428 1.00 1.00 H new ATOM 0 HA GLU A 18 107.428 7.702 16.520 1.00 1.00 H new ATOM 0 HB2 GLU A 18 105.211 8.851 16.433 1.00 1.00 H new ATOM 0 HB3 GLU A 18 104.826 7.999 14.950 1.00 1.00 H new ATOM 0 HG2 GLU A 18 104.980 5.819 16.108 1.00 1.00 H new ATOM 0 HG3 GLU A 18 105.517 6.601 17.581 1.00 1.00 H new ATOM 286 N ASN A 19 106.860 6.505 13.508 1.00 1.00 N ATOM 287 CA ASN A 19 107.046 5.311 12.672 1.00 1.00 C ATOM 288 C ASN A 19 108.461 4.789 12.716 1.00 1.00 C ATOM 289 O ASN A 19 108.690 3.591 12.879 1.00 1.00 O ATOM 290 CB ASN A 19 106.726 5.704 11.213 1.00 1.00 C ATOM 291 CG ASN A 19 107.672 5.059 10.193 1.00 1.00 C ATOM 292 OD1 ASN A 19 108.878 5.306 10.211 1.00 1.00 O ATOM 293 ND2 ASN A 19 107.194 4.279 9.294 1.00 1.00 N ATOM 0 H ASN A 19 106.505 7.322 13.011 1.00 1.00 H new ATOM 0 HA ASN A 19 106.389 4.527 13.049 1.00 1.00 H new ATOM 0 HB2 ASN A 19 105.701 5.415 10.982 1.00 1.00 H new ATOM 0 HB3 ASN A 19 106.781 6.788 11.115 1.00 1.00 H new ATOM 0 HD21 ASN A 19 107.813 3.865 8.597 1.00 1.00 H new ATOM 0 HD22 ASN A 19 106.195 4.073 9.277 1.00 1.00 H new ATOM 300 N LYS A 20 109.395 5.678 12.516 1.00 1.00 N ATOM 301 CA LYS A 20 110.778 5.256 12.472 1.00 1.00 C ATOM 302 C LYS A 20 111.158 4.583 13.779 1.00 1.00 C ATOM 303 O LYS A 20 112.020 3.705 13.817 1.00 1.00 O ATOM 304 CB LYS A 20 111.706 6.437 12.201 1.00 1.00 C ATOM 305 CG LYS A 20 111.578 7.447 13.333 1.00 1.00 C ATOM 306 CD LYS A 20 112.264 8.758 12.939 1.00 1.00 C ATOM 307 CE LYS A 20 113.772 8.547 12.816 1.00 1.00 C ATOM 308 NZ LYS A 20 114.458 9.871 12.810 1.00 1.00 N ATOM 0 H LYS A 20 109.236 6.677 12.383 1.00 1.00 H new ATOM 0 HA LYS A 20 110.890 4.543 11.655 1.00 1.00 H new ATOM 0 HB2 LYS A 20 112.737 6.093 12.120 1.00 1.00 H new ATOM 0 HB3 LYS A 20 111.450 6.905 11.250 1.00 1.00 H new ATOM 0 HG2 LYS A 20 110.526 7.628 13.553 1.00 1.00 H new ATOM 0 HG3 LYS A 20 112.030 7.048 14.241 1.00 1.00 H new ATOM 0 HD2 LYS A 20 111.861 9.118 11.992 1.00 1.00 H new ATOM 0 HD3 LYS A 20 112.056 9.525 13.686 1.00 1.00 H new ATOM 0 HE2 LYS A 20 114.135 7.941 13.646 1.00 1.00 H new ATOM 0 HE3 LYS A 20 114.001 8.002 11.900 1.00 1.00 H new ATOM 0 HZ1 LYS A 20 115.485 9.730 12.726 1.00 1.00 H new ATOM 0 HZ2 LYS A 20 114.119 10.434 12.004 1.00 1.00 H new ATOM 0 HZ3 LYS A 20 114.249 10.374 13.696 1.00 1.00 H new ATOM 322 N ASN A 21 110.500 5.008 14.847 1.00 1.00 N ATOM 323 CA ASN A 21 110.754 4.459 16.172 1.00 1.00 C ATOM 324 C ASN A 21 110.008 3.147 16.385 1.00 1.00 C ATOM 325 O ASN A 21 110.438 2.301 17.167 1.00 1.00 O ATOM 326 CB ASN A 21 110.332 5.483 17.231 1.00 1.00 C ATOM 327 CG ASN A 21 111.408 6.555 17.391 1.00 1.00 C ATOM 328 OD1 ASN A 21 112.449 6.305 18.002 1.00 1.00 O ATOM 329 ND2 ASN A 21 111.222 7.737 16.874 1.00 1.00 N ATOM 0 H ASN A 21 109.784 5.734 14.822 1.00 1.00 H new ATOM 0 HA ASN A 21 111.820 4.250 16.261 1.00 1.00 H new ATOM 0 HB2 ASN A 21 109.388 5.946 16.943 1.00 1.00 H new ATOM 0 HB3 ASN A 21 110.164 4.982 18.184 1.00 1.00 H new ATOM 0 HD21 ASN A 21 111.938 8.456 16.975 1.00 1.00 H new ATOM 0 HD22 ASN A 21 110.360 7.943 16.369 1.00 1.00 H new ATOM 336 N LYS A 22 108.873 2.999 15.719 1.00 1.00 N ATOM 337 CA LYS A 22 108.068 1.802 15.886 1.00 1.00 C ATOM 338 C LYS A 22 108.837 0.524 15.474 1.00 1.00 C ATOM 339 O LYS A 22 109.644 0.567 14.545 1.00 1.00 O ATOM 340 CB LYS A 22 106.772 1.946 15.078 1.00 1.00 C ATOM 341 CG LYS A 22 105.777 2.911 15.783 1.00 1.00 C ATOM 342 CD LYS A 22 104.332 2.413 15.620 1.00 1.00 C ATOM 343 CE LYS A 22 103.906 2.537 14.159 1.00 1.00 C ATOM 344 NZ LYS A 22 102.720 1.668 13.915 1.00 1.00 N ATOM 0 H LYS A 22 108.493 3.684 15.066 1.00 1.00 H new ATOM 0 HA LYS A 22 107.827 1.695 16.944 1.00 1.00 H new ATOM 0 HB2 LYS A 22 107.001 2.320 14.080 1.00 1.00 H new ATOM 0 HB3 LYS A 22 106.308 0.968 14.952 1.00 1.00 H new ATOM 0 HG2 LYS A 22 106.024 2.986 16.842 1.00 1.00 H new ATOM 0 HG3 LYS A 22 105.872 3.912 15.361 1.00 1.00 H new ATOM 0 HD2 LYS A 22 104.256 1.375 15.944 1.00 1.00 H new ATOM 0 HD3 LYS A 22 103.663 2.995 16.254 1.00 1.00 H new ATOM 0 HE2 LYS A 22 103.665 3.574 13.925 1.00 1.00 H new ATOM 0 HE3 LYS A 22 104.726 2.245 13.503 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 102.428 1.751 12.920 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 102.966 0.679 14.123 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 101.938 1.967 14.532 1.00 1.00 H new ATOM 358 N PRO A 23 108.613 -0.610 16.141 1.00 1.00 N ATOM 359 CA PRO A 23 109.317 -1.903 15.819 1.00 1.00 C ATOM 360 C PRO A 23 109.148 -2.382 14.371 1.00 1.00 C ATOM 361 O PRO A 23 108.115 -2.161 13.737 1.00 1.00 O ATOM 362 CB PRO A 23 108.697 -2.933 16.781 1.00 1.00 C ATOM 363 CG PRO A 23 108.109 -2.132 17.890 1.00 1.00 C ATOM 364 CD PRO A 23 107.683 -0.796 17.282 1.00 1.00 C ATOM 0 HA PRO A 23 110.392 -1.768 15.934 1.00 1.00 H new ATOM 0 HB2 PRO A 23 107.935 -3.530 16.280 1.00 1.00 H new ATOM 0 HB3 PRO A 23 109.451 -3.626 17.154 1.00 1.00 H new ATOM 0 HG2 PRO A 23 107.256 -2.647 18.331 1.00 1.00 H new ATOM 0 HG3 PRO A 23 108.837 -1.981 18.687 1.00 1.00 H new ATOM 0 HD2 PRO A 23 106.645 -0.821 16.951 1.00 1.00 H new ATOM 0 HD3 PRO A 23 107.768 0.017 18.003 1.00 1.00 H new ATOM 372 N GLY A 24 110.180 -3.070 13.882 1.00 1.00 N ATOM 373 CA GLY A 24 110.182 -3.634 12.533 1.00 1.00 C ATOM 374 C GLY A 24 110.398 -2.574 11.480 1.00 1.00 C ATOM 375 O GLY A 24 110.784 -2.881 10.354 1.00 1.00 O ATOM 0 H GLY A 24 111.035 -3.251 14.408 1.00 1.00 H new ATOM 0 HA2 GLY A 24 110.966 -4.388 12.456 1.00 1.00 H new ATOM 0 HA3 GLY A 24 109.234 -4.140 12.350 1.00 1.00 H new ATOM 379 N VAL A 25 110.134 -1.331 11.837 1.00 1.00 N ATOM 380 CA VAL A 25 110.288 -0.251 10.882 1.00 1.00 C ATOM 381 C VAL A 25 111.754 0.126 10.759 1.00 1.00 C ATOM 382 O VAL A 25 112.429 0.372 11.759 1.00 1.00 O ATOM 383 CB VAL A 25 109.523 0.994 11.345 1.00 1.00 C ATOM 384 CG1 VAL A 25 109.624 2.101 10.300 1.00 1.00 C ATOM 385 CG2 VAL A 25 108.056 0.669 11.579 1.00 1.00 C ATOM 0 H VAL A 25 109.817 -1.047 12.764 1.00 1.00 H new ATOM 0 HA VAL A 25 109.896 -0.594 9.925 1.00 1.00 H new ATOM 0 HB VAL A 25 109.971 1.331 12.280 1.00 1.00 H new ATOM 0 HG11 VAL A 25 109.075 2.978 10.644 1.00 1.00 H new ATOM 0 HG12 VAL A 25 110.671 2.364 10.149 1.00 1.00 H new ATOM 0 HG13 VAL A 25 109.198 1.753 9.359 1.00 1.00 H new ATOM 0 HG21 VAL A 25 107.532 1.567 11.907 1.00 1.00 H new ATOM 0 HG22 VAL A 25 107.611 0.308 10.652 1.00 1.00 H new ATOM 0 HG23 VAL A 25 107.972 -0.101 12.346 1.00 1.00 H new ATOM 389 N VAL A 26 112.220 0.229 9.529 1.00 1.00 N ATOM 390 CA VAL A 26 113.599 0.649 9.265 1.00 1.00 C ATOM 391 C VAL A 26 113.555 1.967 8.516 1.00 1.00 C ATOM 392 O VAL A 26 112.972 2.045 7.440 1.00 1.00 O ATOM 393 CB VAL A 26 114.330 -0.399 8.427 1.00 1.00 C ATOM 394 CG1 VAL A 26 115.754 0.058 8.154 1.00 1.00 C ATOM 395 CG2 VAL A 26 114.351 -1.723 9.169 1.00 1.00 C ATOM 0 H VAL A 26 111.671 0.030 8.692 1.00 1.00 H new ATOM 0 HA VAL A 26 114.136 0.762 10.207 1.00 1.00 H new ATOM 0 HB VAL A 26 113.808 -0.525 7.479 1.00 1.00 H new ATOM 0 HG11 VAL A 26 116.269 -0.694 7.556 1.00 1.00 H new ATOM 0 HG12 VAL A 26 115.735 1.003 7.611 1.00 1.00 H new ATOM 0 HG13 VAL A 26 116.280 0.193 9.099 1.00 1.00 H new ATOM 0 HG21 VAL A 26 114.873 -2.468 8.569 1.00 1.00 H new ATOM 0 HG22 VAL A 26 114.866 -1.598 10.121 1.00 1.00 H new ATOM 0 HG23 VAL A 26 113.329 -2.055 9.351 1.00 1.00 H new ATOM 399 N VAL A 27 114.154 3.012 9.092 1.00 1.00 N ATOM 400 CA VAL A 27 114.139 4.333 8.460 1.00 1.00 C ATOM 401 C VAL A 27 115.364 4.549 7.611 1.00 1.00 C ATOM 402 O VAL A 27 116.455 4.068 7.916 1.00 1.00 O ATOM 403 CB VAL A 27 114.005 5.447 9.516 1.00 1.00 C ATOM 404 CG1 VAL A 27 115.133 5.333 10.513 1.00 1.00 C ATOM 405 CG2 VAL A 27 114.020 6.844 8.871 1.00 1.00 C ATOM 0 H VAL A 27 114.649 2.971 9.983 1.00 1.00 H new ATOM 0 HA VAL A 27 113.268 4.375 7.806 1.00 1.00 H new ATOM 0 HB VAL A 27 113.047 5.323 10.020 1.00 1.00 H new ATOM 0 HG11 VAL A 27 115.039 6.121 11.260 1.00 1.00 H new ATOM 0 HG12 VAL A 27 115.088 4.360 11.003 1.00 1.00 H new ATOM 0 HG13 VAL A 27 116.087 5.435 9.996 1.00 1.00 H new ATOM 0 HG21 VAL A 27 113.923 7.604 9.646 1.00 1.00 H new ATOM 0 HG22 VAL A 27 114.959 6.988 8.337 1.00 1.00 H new ATOM 0 HG23 VAL A 27 113.188 6.931 8.172 1.00 1.00 H new ATOM 409 N LEU A 28 115.158 5.284 6.520 1.00 1.00 N ATOM 410 CA LEU A 28 116.239 5.580 5.583 1.00 1.00 C ATOM 411 C LEU A 28 116.563 7.070 5.597 1.00 1.00 C ATOM 412 O LEU A 28 115.770 7.870 6.095 1.00 1.00 O ATOM 413 CB LEU A 28 115.821 5.158 4.169 1.00 1.00 C ATOM 414 CG LEU A 28 115.528 3.659 4.115 1.00 1.00 C ATOM 415 CD1 LEU A 28 114.935 3.332 2.745 1.00 1.00 C ATOM 416 CD2 LEU A 28 116.821 2.858 4.306 1.00 1.00 C ATOM 0 H LEU A 28 114.255 5.684 6.264 1.00 1.00 H new ATOM 0 HA LEU A 28 117.128 5.025 5.884 1.00 1.00 H new ATOM 0 HB2 LEU A 28 114.937 5.717 3.864 1.00 1.00 H new ATOM 0 HB3 LEU A 28 116.613 5.404 3.462 1.00 1.00 H new ATOM 0 HG LEU A 28 114.830 3.395 4.910 1.00 1.00 H new ATOM 0 HD11 LEU A 28 114.719 2.265 2.687 1.00 1.00 H new ATOM 0 HD12 LEU A 28 114.014 3.897 2.603 1.00 1.00 H new ATOM 0 HD13 LEU A 28 115.649 3.600 1.966 1.00 1.00 H new ATOM 0 HD21 LEU A 28 116.598 1.792 4.265 1.00 1.00 H new ATOM 0 HD22 LEU A 28 117.526 3.112 3.515 1.00 1.00 H new ATOM 0 HD23 LEU A 28 117.259 3.100 5.274 1.00 1.00 H new ATOM 428 N PRO A 29 117.706 7.473 5.077 1.00 1.00 N ATOM 429 CA PRO A 29 118.095 8.905 5.066 1.00 1.00 C ATOM 430 C PRO A 29 117.091 9.745 4.287 1.00 1.00 C ATOM 431 O PRO A 29 116.873 10.919 4.590 1.00 1.00 O ATOM 432 CB PRO A 29 119.481 8.923 4.404 1.00 1.00 C ATOM 433 CG PRO A 29 119.981 7.525 4.532 1.00 1.00 C ATOM 434 CD PRO A 29 118.746 6.645 4.446 1.00 1.00 C ATOM 0 HA PRO A 29 118.115 9.335 6.067 1.00 1.00 H new ATOM 0 HB2 PRO A 29 119.417 9.226 3.359 1.00 1.00 H new ATOM 0 HB3 PRO A 29 120.147 9.629 4.900 1.00 1.00 H new ATOM 0 HG2 PRO A 29 120.689 7.287 3.738 1.00 1.00 H new ATOM 0 HG3 PRO A 29 120.502 7.379 5.478 1.00 1.00 H new ATOM 0 HD2 PRO A 29 118.496 6.400 3.414 1.00 1.00 H new ATOM 0 HD3 PRO A 29 118.885 5.701 4.973 1.00 1.00 H new ATOM 442 N SER A 30 116.482 9.127 3.278 1.00 1.00 N ATOM 443 CA SER A 30 115.505 9.823 2.458 1.00 1.00 C ATOM 444 C SER A 30 114.245 10.099 3.266 1.00 1.00 C ATOM 445 O SER A 30 113.388 10.881 2.859 1.00 1.00 O ATOM 446 CB SER A 30 115.168 8.986 1.219 1.00 1.00 C ATOM 447 OG SER A 30 116.341 8.321 0.773 1.00 1.00 O ATOM 0 H SER A 30 116.648 8.156 3.014 1.00 1.00 H new ATOM 0 HA SER A 30 115.928 10.774 2.135 1.00 1.00 H new ATOM 0 HB2 SER A 30 114.391 8.259 1.456 1.00 1.00 H new ATOM 0 HB3 SER A 30 114.775 9.626 0.429 1.00 1.00 H new ATOM 0 HG SER A 30 116.131 7.783 -0.018 1.00 1.00 H new ATOM 453 N GLY A 31 114.142 9.443 4.417 1.00 1.00 N ATOM 454 CA GLY A 31 112.988 9.605 5.291 1.00 1.00 C ATOM 455 C GLY A 31 111.982 8.496 5.041 1.00 1.00 C ATOM 456 O GLY A 31 110.971 8.393 5.734 1.00 1.00 O ATOM 0 H GLY A 31 114.846 8.793 4.766 1.00 1.00 H new ATOM 0 HA2 GLY A 31 113.307 9.589 6.333 1.00 1.00 H new ATOM 0 HA3 GLY A 31 112.523 10.575 5.115 1.00 1.00 H new ATOM 460 N LEU A 32 112.272 7.653 4.052 1.00 1.00 N ATOM 461 CA LEU A 32 111.381 6.548 3.733 1.00 1.00 C ATOM 462 C LEU A 32 111.587 5.449 4.760 1.00 1.00 C ATOM 463 O LEU A 32 112.720 5.109 5.099 1.00 1.00 O ATOM 464 CB LEU A 32 111.669 6.028 2.302 1.00 1.00 C ATOM 465 CG LEU A 32 110.696 4.905 1.826 1.00 1.00 C ATOM 466 CD1 LEU A 32 111.130 3.517 2.294 1.00 1.00 C ATOM 467 CD2 LEU A 32 109.261 5.194 2.268 1.00 1.00 C ATOM 0 H LEU A 32 113.105 7.715 3.467 1.00 1.00 H new ATOM 0 HA LEU A 32 110.344 6.881 3.764 1.00 1.00 H new ATOM 0 HB2 LEU A 32 111.612 6.864 1.605 1.00 1.00 H new ATOM 0 HB3 LEU A 32 112.691 5.650 2.263 1.00 1.00 H new ATOM 0 HG LEU A 32 110.733 4.905 0.737 1.00 1.00 H new ATOM 0 HD11 LEU A 32 110.418 2.773 1.935 1.00 1.00 H new ATOM 0 HD12 LEU A 32 112.120 3.293 1.898 1.00 1.00 H new ATOM 0 HD13 LEU A 32 111.161 3.494 3.383 1.00 1.00 H new ATOM 0 HD21 LEU A 32 108.606 4.395 1.922 1.00 1.00 H new ATOM 0 HD22 LEU A 32 109.220 5.252 3.356 1.00 1.00 H new ATOM 0 HD23 LEU A 32 108.933 6.142 1.842 1.00 1.00 H new ATOM 479 N GLN A 33 110.489 4.901 5.264 1.00 1.00 N ATOM 480 CA GLN A 33 110.547 3.846 6.266 1.00 1.00 C ATOM 481 C GLN A 33 109.774 2.622 5.831 1.00 1.00 C ATOM 482 O GLN A 33 108.701 2.738 5.245 1.00 1.00 O ATOM 483 CB GLN A 33 109.934 4.373 7.552 1.00 1.00 C ATOM 484 CG GLN A 33 110.752 5.561 8.068 1.00 1.00 C ATOM 485 CD GLN A 33 110.032 6.876 7.886 1.00 1.00 C ATOM 486 OE1 GLN A 33 109.063 6.974 7.135 1.00 1.00 O ATOM 487 NE2 GLN A 33 110.470 7.903 8.532 1.00 1.00 N ATOM 0 H GLN A 33 109.543 5.172 4.993 1.00 1.00 H new ATOM 0 HA GLN A 33 111.589 3.560 6.407 1.00 1.00 H new ATOM 0 HB2 GLN A 33 108.903 4.679 7.375 1.00 1.00 H new ATOM 0 HB3 GLN A 33 109.908 3.584 8.303 1.00 1.00 H new ATOM 0 HG2 GLN A 33 110.974 5.414 9.125 1.00 1.00 H new ATOM 0 HG3 GLN A 33 111.707 5.597 7.544 1.00 1.00 H new ATOM 0 HE21 GLN A 33 111.274 7.810 9.152 1.00 1.00 H new ATOM 0 HE22 GLN A 33 110.012 8.808 8.423 1.00 1.00 H new ATOM 496 N TYR A 34 110.311 1.438 6.140 1.00 1.00 N ATOM 497 CA TYR A 34 109.626 0.200 5.787 1.00 1.00 C ATOM 498 C TYR A 34 109.665 -0.814 6.913 1.00 1.00 C ATOM 499 O TYR A 34 110.662 -0.960 7.618 1.00 1.00 O ATOM 500 CB TYR A 34 110.220 -0.405 4.513 1.00 1.00 C ATOM 501 CG TYR A 34 111.672 -0.742 4.725 1.00 1.00 C ATOM 502 CD1 TYR A 34 112.006 -1.911 5.401 1.00 1.00 C ATOM 503 CD2 TYR A 34 112.679 0.097 4.234 1.00 1.00 C ATOM 504 CE1 TYR A 34 113.348 -2.255 5.594 1.00 1.00 C ATOM 505 CE2 TYR A 34 114.024 -0.242 4.427 1.00 1.00 C ATOM 506 CZ TYR A 34 114.359 -1.420 5.107 1.00 1.00 C ATOM 507 OH TYR A 34 115.685 -1.757 5.295 1.00 1.00 O ATOM 0 H TYR A 34 111.200 1.315 6.624 1.00 1.00 H new ATOM 0 HA TYR A 34 108.582 0.455 5.607 1.00 1.00 H new ATOM 0 HB2 TYR A 34 109.667 -1.303 4.236 1.00 1.00 H new ATOM 0 HB3 TYR A 34 110.119 0.299 3.687 1.00 1.00 H new ATOM 0 HD1 TYR A 34 111.226 -2.556 5.778 1.00 1.00 H new ATOM 0 HD2 TYR A 34 112.419 1.004 3.708 1.00 1.00 H new ATOM 0 HE1 TYR A 34 113.603 -3.164 6.118 1.00 1.00 H new ATOM 0 HE2 TYR A 34 114.803 0.405 4.052 1.00 1.00 H new ATOM 0 HH TYR A 34 116.257 -1.070 4.894 1.00 1.00 H new ATOM 517 N LYS A 35 108.548 -1.530 7.045 1.00 1.00 N ATOM 518 CA LYS A 35 108.394 -2.566 8.047 1.00 1.00 C ATOM 519 C LYS A 35 108.004 -3.846 7.349 1.00 1.00 C ATOM 520 O LYS A 35 107.036 -3.891 6.591 1.00 1.00 O ATOM 521 CB LYS A 35 107.322 -2.166 9.069 1.00 1.00 C ATOM 522 CG LYS A 35 107.465 -2.977 10.361 1.00 1.00 C ATOM 523 CD LYS A 35 106.111 -3.408 10.974 1.00 1.00 C ATOM 524 CE LYS A 35 105.305 -4.246 10.011 1.00 1.00 C ATOM 525 NZ LYS A 35 104.431 -5.167 10.792 1.00 1.00 N ATOM 0 H LYS A 35 107.726 -1.402 6.454 1.00 1.00 H new ATOM 0 HA LYS A 35 109.332 -2.706 8.584 1.00 1.00 H new ATOM 0 HB2 LYS A 35 107.406 -1.102 9.292 1.00 1.00 H new ATOM 0 HB3 LYS A 35 106.331 -2.325 8.643 1.00 1.00 H new ATOM 0 HG2 LYS A 35 108.062 -3.866 10.158 1.00 1.00 H new ATOM 0 HG3 LYS A 35 108.014 -2.385 11.093 1.00 1.00 H new ATOM 0 HD2 LYS A 35 106.289 -3.974 11.888 1.00 1.00 H new ATOM 0 HD3 LYS A 35 105.539 -2.523 11.253 1.00 1.00 H new ATOM 0 HE2 LYS A 35 104.700 -3.606 9.368 1.00 1.00 H new ATOM 0 HE3 LYS A 35 105.968 -4.816 9.360 1.00 1.00 H new ATOM 0 HZ1 LYS A 35 104.730 -6.150 10.630 1.00 1.00 H new ATOM 0 HZ2 LYS A 35 104.509 -4.944 11.805 1.00 1.00 H new ATOM 0 HZ3 LYS A 35 103.444 -5.051 10.487 1.00 1.00 H new ATOM 539 N VAL A 36 108.786 -4.874 7.588 1.00 1.00 N ATOM 540 CA VAL A 36 108.541 -6.167 6.946 1.00 1.00 C ATOM 541 C VAL A 36 107.462 -6.954 7.688 1.00 1.00 C ATOM 542 O VAL A 36 107.649 -7.385 8.822 1.00 1.00 O ATOM 543 CB VAL A 36 109.849 -6.971 6.871 1.00 1.00 C ATOM 544 CG1 VAL A 36 110.526 -6.999 8.233 1.00 1.00 C ATOM 545 CG2 VAL A 36 109.566 -8.410 6.406 1.00 1.00 C ATOM 0 H VAL A 36 109.591 -4.852 8.214 1.00 1.00 H new ATOM 0 HA VAL A 36 108.180 -5.988 5.933 1.00 1.00 H new ATOM 0 HB VAL A 36 110.510 -6.488 6.151 1.00 1.00 H new ATOM 0 HG11 VAL A 36 111.451 -7.571 8.168 1.00 1.00 H new ATOM 0 HG12 VAL A 36 110.751 -5.980 8.549 1.00 1.00 H new ATOM 0 HG13 VAL A 36 109.861 -7.466 8.960 1.00 1.00 H new ATOM 0 HG21 VAL A 36 110.501 -8.967 6.358 1.00 1.00 H new ATOM 0 HG22 VAL A 36 108.891 -8.894 7.112 1.00 1.00 H new ATOM 0 HG23 VAL A 36 109.105 -8.389 5.419 1.00 1.00 H new ATOM 549 N ILE A 37 106.324 -7.154 7.037 1.00 1.00 N ATOM 550 CA ILE A 37 105.256 -7.913 7.661 1.00 1.00 C ATOM 551 C ILE A 37 105.578 -9.387 7.599 1.00 1.00 C ATOM 552 O ILE A 37 105.346 -10.142 8.543 1.00 1.00 O ATOM 553 CB ILE A 37 103.909 -7.698 6.946 1.00 1.00 C ATOM 554 CG1 ILE A 37 103.783 -6.249 6.459 1.00 1.00 C ATOM 555 CG2 ILE A 37 102.759 -8.037 7.917 1.00 1.00 C ATOM 556 CD1 ILE A 37 103.988 -5.268 7.591 1.00 1.00 C ATOM 0 H ILE A 37 106.121 -6.809 6.099 1.00 1.00 H new ATOM 0 HA ILE A 37 105.174 -7.568 8.692 1.00 1.00 H new ATOM 0 HB ILE A 37 103.856 -8.354 6.077 1.00 1.00 H new ATOM 0 HG12 ILE A 37 104.517 -6.062 5.675 1.00 1.00 H new ATOM 0 HG13 ILE A 37 102.799 -6.096 6.017 1.00 1.00 H new ATOM 0 HG21 ILE A 37 101.803 -7.886 7.415 1.00 1.00 H new ATOM 0 HG22 ILE A 37 102.844 -9.077 8.232 1.00 1.00 H new ATOM 0 HG23 ILE A 37 102.817 -7.387 8.790 1.00 1.00 H new ATOM 0 HD11 ILE A 37 103.892 -4.250 7.212 1.00 1.00 H new ATOM 0 HD12 ILE A 37 103.237 -5.440 8.362 1.00 1.00 H new ATOM 0 HD13 ILE A 37 104.982 -5.405 8.016 1.00 1.00 H new ATOM 563 N ASN A 38 106.080 -9.783 6.445 1.00 1.00 N ATOM 564 CA ASN A 38 106.407 -11.165 6.188 1.00 1.00 C ATOM 565 C ASN A 38 107.658 -11.243 5.330 1.00 1.00 C ATOM 566 O ASN A 38 107.738 -10.593 4.291 1.00 1.00 O ATOM 567 CB ASN A 38 105.237 -11.808 5.449 1.00 1.00 C ATOM 568 CG ASN A 38 103.988 -11.774 6.330 1.00 1.00 C ATOM 569 OD1 ASN A 38 103.696 -12.741 7.033 1.00 1.00 O ATOM 570 ND2 ASN A 38 103.233 -10.704 6.340 1.00 1.00 N ATOM 0 H ASN A 38 106.271 -9.155 5.664 1.00 1.00 H new ATOM 0 HA ASN A 38 106.590 -11.688 7.127 1.00 1.00 H new ATOM 0 HB2 ASN A 38 105.049 -11.278 4.515 1.00 1.00 H new ATOM 0 HB3 ASN A 38 105.481 -12.838 5.188 1.00 1.00 H new ATOM 0 HD21 ASN A 38 102.402 -10.672 6.931 1.00 1.00 H new ATOM 0 HD22 ASN A 38 103.476 -9.903 5.757 1.00 1.00 H new ATOM 577 N SER A 39 108.634 -12.031 5.760 1.00 1.00 N ATOM 578 CA SER A 39 109.870 -12.175 4.998 1.00 1.00 C ATOM 579 C SER A 39 109.748 -13.336 4.024 1.00 1.00 C ATOM 580 O SER A 39 109.384 -14.448 4.407 1.00 1.00 O ATOM 581 CB SER A 39 111.049 -12.415 5.935 1.00 1.00 C ATOM 582 OG SER A 39 111.205 -13.812 6.152 1.00 1.00 O ATOM 0 H SER A 39 108.597 -12.575 6.622 1.00 1.00 H new ATOM 0 HA SER A 39 110.043 -11.253 4.442 1.00 1.00 H new ATOM 0 HB2 SER A 39 111.960 -11.999 5.505 1.00 1.00 H new ATOM 0 HB3 SER A 39 110.883 -11.905 6.884 1.00 1.00 H new ATOM 0 HG SER A 39 110.392 -14.280 5.867 1.00 1.00 H new ATOM 588 N GLY A 40 110.061 -13.070 2.761 1.00 1.00 N ATOM 589 CA GLY A 40 109.995 -14.085 1.717 1.00 1.00 C ATOM 590 C GLY A 40 111.376 -14.314 1.125 1.00 1.00 C ATOM 591 O GLY A 40 111.718 -15.424 0.719 1.00 1.00 O ATOM 0 H GLY A 40 110.365 -12.153 2.434 1.00 1.00 H new ATOM 0 HA2 GLY A 40 109.608 -15.017 2.129 1.00 1.00 H new ATOM 0 HA3 GLY A 40 109.303 -13.770 0.936 1.00 1.00 H new ATOM 595 N ASN A 41 112.166 -13.249 1.088 1.00 1.00 N ATOM 596 CA ASN A 41 113.515 -13.326 0.554 1.00 1.00 C ATOM 597 C ASN A 41 113.510 -13.848 -0.878 1.00 1.00 C ATOM 598 O ASN A 41 114.453 -14.510 -1.310 1.00 1.00 O ATOM 599 CB ASN A 41 114.354 -14.229 1.451 1.00 1.00 C ATOM 600 CG ASN A 41 114.292 -13.712 2.885 1.00 1.00 C ATOM 601 OD1 ASN A 41 114.941 -14.267 3.773 1.00 1.00 O ATOM 602 ND2 ASN A 41 113.538 -12.681 3.170 1.00 1.00 N ATOM 0 H ASN A 41 111.895 -12.324 1.421 1.00 1.00 H new ATOM 0 HA ASN A 41 113.948 -12.326 0.535 1.00 1.00 H new ATOM 0 HB2 ASN A 41 113.983 -15.253 1.405 1.00 1.00 H new ATOM 0 HB3 ASN A 41 115.387 -14.248 1.103 1.00 1.00 H new ATOM 0 HD21 ASN A 41 113.487 -12.336 4.128 1.00 1.00 H new ATOM 0 HD22 ASN A 41 113.001 -12.223 2.434 1.00 1.00 H new ATOM 609 N GLY A 42 112.444 -13.534 -1.616 1.00 1.00 N ATOM 610 CA GLY A 42 112.324 -13.965 -3.002 1.00 1.00 C ATOM 611 C GLY A 42 112.894 -12.936 -3.956 1.00 1.00 C ATOM 612 O GLY A 42 113.657 -12.049 -3.574 1.00 1.00 O ATOM 0 H GLY A 42 111.656 -12.984 -1.275 1.00 1.00 H new ATOM 0 HA2 GLY A 42 112.844 -14.913 -3.135 1.00 1.00 H new ATOM 0 HA3 GLY A 42 111.275 -14.141 -3.240 1.00 1.00 H new ATOM 616 N VAL A 43 112.476 -13.065 -5.200 1.00 1.00 N ATOM 617 CA VAL A 43 112.886 -12.158 -6.249 1.00 1.00 C ATOM 618 C VAL A 43 112.277 -10.792 -5.997 1.00 1.00 C ATOM 619 O VAL A 43 111.569 -10.601 -5.021 1.00 1.00 O ATOM 620 CB VAL A 43 112.476 -12.692 -7.633 1.00 1.00 C ATOM 621 CG1 VAL A 43 113.063 -14.083 -7.821 1.00 1.00 C ATOM 622 CG2 VAL A 43 110.957 -12.765 -7.783 1.00 1.00 C ATOM 0 H VAL A 43 111.843 -13.802 -5.510 1.00 1.00 H new ATOM 0 HA VAL A 43 113.973 -12.074 -6.240 1.00 1.00 H new ATOM 0 HB VAL A 43 112.857 -12.006 -8.389 1.00 1.00 H new ATOM 0 HG11 VAL A 43 112.777 -14.469 -8.799 1.00 1.00 H new ATOM 0 HG12 VAL A 43 114.150 -14.031 -7.754 1.00 1.00 H new ATOM 0 HG13 VAL A 43 112.683 -14.746 -7.044 1.00 1.00 H new ATOM 0 HG21 VAL A 43 110.707 -13.147 -8.773 1.00 1.00 H new ATOM 0 HG22 VAL A 43 110.548 -13.431 -7.023 1.00 1.00 H new ATOM 0 HG23 VAL A 43 110.531 -11.769 -7.660 1.00 1.00 H new ATOM 626 N LYS A 44 112.546 -9.870 -6.901 1.00 1.00 N ATOM 627 CA LYS A 44 112.029 -8.502 -6.815 1.00 1.00 C ATOM 628 C LYS A 44 112.616 -7.669 -7.957 1.00 1.00 C ATOM 629 O LYS A 44 113.650 -8.022 -8.523 1.00 1.00 O ATOM 630 CB LYS A 44 112.330 -7.838 -5.434 1.00 1.00 C ATOM 631 CG LYS A 44 113.818 -7.426 -5.254 1.00 1.00 C ATOM 632 CD LYS A 44 114.627 -8.561 -4.580 1.00 1.00 C ATOM 633 CE LYS A 44 114.632 -8.403 -3.050 1.00 1.00 C ATOM 634 NZ LYS A 44 115.031 -9.699 -2.438 1.00 1.00 N ATOM 0 H LYS A 44 113.129 -10.040 -7.720 1.00 1.00 H new ATOM 0 HA LYS A 44 110.944 -8.544 -6.908 1.00 1.00 H new ATOM 0 HB2 LYS A 44 111.701 -6.955 -5.320 1.00 1.00 H new ATOM 0 HB3 LYS A 44 112.055 -8.531 -4.639 1.00 1.00 H new ATOM 0 HG2 LYS A 44 114.254 -7.190 -6.225 1.00 1.00 H new ATOM 0 HG3 LYS A 44 113.879 -6.522 -4.649 1.00 1.00 H new ATOM 0 HD2 LYS A 44 114.198 -9.526 -4.848 1.00 1.00 H new ATOM 0 HD3 LYS A 44 115.651 -8.553 -4.953 1.00 1.00 H new ATOM 0 HE2 LYS A 44 115.325 -7.616 -2.754 1.00 1.00 H new ATOM 0 HE3 LYS A 44 113.644 -8.107 -2.697 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 115.203 -9.564 -1.421 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 114.270 -10.395 -2.571 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 115.900 -10.045 -2.893 1.00 1.00 H new ATOM 648 N PRO A 45 111.925 -6.623 -8.361 1.00 1.00 N ATOM 649 CA PRO A 45 112.331 -5.783 -9.526 1.00 1.00 C ATOM 650 C PRO A 45 113.295 -4.652 -9.220 1.00 1.00 C ATOM 651 O PRO A 45 113.353 -4.148 -8.107 1.00 1.00 O ATOM 652 CB PRO A 45 110.992 -5.220 -10.018 1.00 1.00 C ATOM 653 CG PRO A 45 110.093 -5.181 -8.817 1.00 1.00 C ATOM 654 CD PRO A 45 110.688 -6.101 -7.747 1.00 1.00 C ATOM 0 HA PRO A 45 112.887 -6.382 -10.247 1.00 1.00 H new ATOM 0 HB2 PRO A 45 111.120 -4.224 -10.442 1.00 1.00 H new ATOM 0 HB3 PRO A 45 110.569 -5.848 -10.802 1.00 1.00 H new ATOM 0 HG2 PRO A 45 110.008 -4.162 -8.438 1.00 1.00 H new ATOM 0 HG3 PRO A 45 109.088 -5.507 -9.083 1.00 1.00 H new ATOM 0 HD2 PRO A 45 110.900 -5.556 -6.827 1.00 1.00 H new ATOM 0 HD3 PRO A 45 110.001 -6.907 -7.489 1.00 1.00 H new ATOM 662 N GLY A 46 113.994 -4.219 -10.266 1.00 1.00 N ATOM 663 CA GLY A 46 114.898 -3.090 -10.167 1.00 1.00 C ATOM 664 C GLY A 46 114.127 -1.830 -10.490 1.00 1.00 C ATOM 665 O GLY A 46 112.978 -1.876 -10.926 1.00 1.00 O ATOM 0 H GLY A 46 113.947 -4.639 -11.194 1.00 1.00 H new ATOM 0 HA2 GLY A 46 115.320 -3.029 -9.164 1.00 1.00 H new ATOM 0 HA3 GLY A 46 115.733 -3.211 -10.857 1.00 1.00 H new ATOM 669 N LYS A 47 114.781 -0.725 -10.294 1.00 1.00 N ATOM 670 CA LYS A 47 114.202 0.570 -10.577 1.00 1.00 C ATOM 671 C LYS A 47 113.533 0.598 -11.940 1.00 1.00 C ATOM 672 O LYS A 47 112.651 1.420 -12.182 1.00 1.00 O ATOM 673 CB LYS A 47 115.302 1.638 -10.533 1.00 1.00 C ATOM 674 CG LYS A 47 116.319 1.421 -11.678 1.00 1.00 C ATOM 675 CD LYS A 47 116.958 0.032 -11.559 1.00 1.00 C ATOM 676 CE LYS A 47 118.224 -0.059 -12.379 1.00 1.00 C ATOM 677 NZ LYS A 47 119.296 0.758 -11.744 1.00 1.00 N ATOM 0 H LYS A 47 115.734 -0.687 -9.933 1.00 1.00 H new ATOM 0 HA LYS A 47 113.443 0.773 -9.822 1.00 1.00 H new ATOM 0 HB2 LYS A 47 114.857 2.629 -10.618 1.00 1.00 H new ATOM 0 HB3 LYS A 47 115.815 1.600 -9.572 1.00 1.00 H new ATOM 0 HG2 LYS A 47 115.820 1.519 -12.642 1.00 1.00 H new ATOM 0 HG3 LYS A 47 117.091 2.190 -11.640 1.00 1.00 H new ATOM 0 HD2 LYS A 47 117.183 -0.179 -10.514 1.00 1.00 H new ATOM 0 HD3 LYS A 47 116.250 -0.727 -11.893 1.00 1.00 H new ATOM 0 HE2 LYS A 47 118.544 -1.098 -12.457 1.00 1.00 H new ATOM 0 HE3 LYS A 47 118.038 0.294 -13.393 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 120.226 0.419 -12.063 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 119.179 1.755 -12.015 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 119.232 0.671 -10.710 1.00 1.00 H new ATOM 691 N SER A 48 113.983 -0.269 -12.840 1.00 1.00 N ATOM 692 CA SER A 48 113.444 -0.290 -14.209 1.00 1.00 C ATOM 693 C SER A 48 112.563 -1.506 -14.495 1.00 1.00 C ATOM 694 O SER A 48 111.911 -1.559 -15.537 1.00 1.00 O ATOM 695 CB SER A 48 114.612 -0.262 -15.192 1.00 1.00 C ATOM 696 OG SER A 48 115.152 1.052 -15.238 1.00 1.00 O ATOM 0 H SER A 48 114.710 -0.961 -12.657 1.00 1.00 H new ATOM 0 HA SER A 48 112.806 0.587 -14.323 1.00 1.00 H new ATOM 0 HB2 SER A 48 115.379 -0.973 -14.884 1.00 1.00 H new ATOM 0 HB3 SER A 48 114.276 -0.565 -16.184 1.00 1.00 H new ATOM 0 HG SER A 48 115.904 1.075 -15.867 1.00 1.00 H new ATOM 702 N ASP A 49 112.526 -2.477 -13.591 1.00 1.00 N ATOM 703 CA ASP A 49 111.685 -3.660 -13.826 1.00 1.00 C ATOM 704 C ASP A 49 110.266 -3.358 -13.368 1.00 1.00 C ATOM 705 O ASP A 49 110.035 -2.356 -12.694 1.00 1.00 O ATOM 706 CB ASP A 49 112.236 -4.871 -13.087 1.00 1.00 C ATOM 707 CG ASP A 49 113.535 -5.339 -13.737 1.00 1.00 C ATOM 708 OD1 ASP A 49 113.832 -4.873 -14.824 1.00 1.00 O ATOM 709 OD2 ASP A 49 114.211 -6.156 -13.137 1.00 1.00 O ATOM 0 H ASP A 49 113.047 -2.479 -12.714 1.00 1.00 H new ATOM 0 HA ASP A 49 111.684 -3.893 -14.891 1.00 1.00 H new ATOM 0 HB2 ASP A 49 112.414 -4.618 -12.042 1.00 1.00 H new ATOM 0 HB3 ASP A 49 111.503 -5.678 -13.099 1.00 1.00 H new ATOM 714 N THR A 50 109.310 -4.214 -13.737 1.00 1.00 N ATOM 715 CA THR A 50 107.912 -4.000 -13.345 1.00 1.00 C ATOM 716 C THR A 50 107.525 -4.981 -12.257 1.00 1.00 C ATOM 717 O THR A 50 108.090 -6.069 -12.152 1.00 1.00 O ATOM 718 CB THR A 50 106.983 -4.099 -14.564 1.00 1.00 C ATOM 719 OG1 THR A 50 107.533 -3.361 -15.642 1.00 1.00 O ATOM 720 CG2 THR A 50 105.606 -3.549 -14.224 1.00 1.00 C ATOM 0 H THR A 50 109.473 -5.050 -14.298 1.00 1.00 H new ATOM 0 HA THR A 50 107.804 -2.993 -12.943 1.00 1.00 H new ATOM 0 HB THR A 50 106.886 -5.147 -14.848 1.00 1.00 H new ATOM 0 HG1 THR A 50 106.940 -3.427 -16.420 1.00 1.00 H new ATOM 0 HG21 THR A 50 104.958 -3.625 -15.097 1.00 1.00 H new ATOM 0 HG22 THR A 50 105.177 -4.123 -13.403 1.00 1.00 H new ATOM 0 HG23 THR A 50 105.695 -2.504 -13.928 1.00 1.00 H new ATOM 728 N VAL A 51 106.599 -4.552 -11.402 1.00 1.00 N ATOM 729 CA VAL A 51 106.181 -5.356 -10.256 1.00 1.00 C ATOM 730 C VAL A 51 104.675 -5.551 -10.210 1.00 1.00 C ATOM 731 O VAL A 51 103.931 -4.797 -10.822 1.00 1.00 O ATOM 732 CB VAL A 51 106.649 -4.645 -8.976 1.00 1.00 C ATOM 733 CG1 VAL A 51 105.773 -3.439 -8.632 1.00 1.00 C ATOM 734 CG2 VAL A 51 106.673 -5.644 -7.821 1.00 1.00 C ATOM 0 H VAL A 51 106.124 -3.653 -11.481 1.00 1.00 H new ATOM 0 HA VAL A 51 106.629 -6.346 -10.344 1.00 1.00 H new ATOM 0 HB VAL A 51 107.655 -4.262 -9.149 1.00 1.00 H new ATOM 0 HG11 VAL A 51 106.142 -2.969 -7.720 1.00 1.00 H new ATOM 0 HG12 VAL A 51 105.807 -2.720 -9.450 1.00 1.00 H new ATOM 0 HG13 VAL A 51 104.745 -3.768 -8.480 1.00 1.00 H new ATOM 0 HG21 VAL A 51 107.005 -5.142 -6.912 1.00 1.00 H new ATOM 0 HG22 VAL A 51 105.672 -6.047 -7.668 1.00 1.00 H new ATOM 0 HG23 VAL A 51 107.360 -6.457 -8.057 1.00 1.00 H new ATOM 738 N THR A 52 104.236 -6.550 -9.436 1.00 1.00 N ATOM 739 CA THR A 52 102.807 -6.816 -9.263 1.00 1.00 C ATOM 740 C THR A 52 102.518 -6.936 -7.767 1.00 1.00 C ATOM 741 O THR A 52 103.119 -7.772 -7.092 1.00 1.00 O ATOM 742 CB THR A 52 102.447 -8.109 -9.983 1.00 1.00 C ATOM 743 OG1 THR A 52 102.680 -7.958 -11.377 1.00 1.00 O ATOM 744 CG2 THR A 52 100.986 -8.445 -9.741 1.00 1.00 C ATOM 0 H THR A 52 104.848 -7.184 -8.922 1.00 1.00 H new ATOM 0 HA THR A 52 102.210 -6.007 -9.684 1.00 1.00 H new ATOM 0 HB THR A 52 103.067 -8.919 -9.598 1.00 1.00 H new ATOM 0 HG1 THR A 52 103.019 -8.801 -11.745 1.00 1.00 H new ATOM 0 HG21 THR A 52 100.735 -9.371 -10.259 1.00 1.00 H new ATOM 0 HG22 THR A 52 100.813 -8.569 -8.672 1.00 1.00 H new ATOM 0 HG23 THR A 52 100.359 -7.637 -10.119 1.00 1.00 H new ATOM 752 N VAL A 53 101.644 -6.070 -7.232 1.00 1.00 N ATOM 753 CA VAL A 53 101.374 -6.080 -5.784 1.00 1.00 C ATOM 754 C VAL A 53 99.949 -5.656 -5.405 1.00 1.00 C ATOM 755 O VAL A 53 99.256 -5.007 -6.188 1.00 1.00 O ATOM 756 CB VAL A 53 102.321 -5.063 -5.138 1.00 1.00 C ATOM 757 CG1 VAL A 53 103.759 -5.359 -5.555 1.00 1.00 C ATOM 758 CG2 VAL A 53 101.956 -3.618 -5.593 1.00 1.00 C ATOM 0 H VAL A 53 101.124 -5.371 -7.762 1.00 1.00 H new ATOM 0 HA VAL A 53 101.512 -7.106 -5.443 1.00 1.00 H new ATOM 0 HB VAL A 53 102.222 -5.139 -4.055 1.00 1.00 H new ATOM 0 HG11 VAL A 53 104.428 -4.633 -5.093 1.00 1.00 H new ATOM 0 HG12 VAL A 53 104.033 -6.363 -5.230 1.00 1.00 H new ATOM 0 HG13 VAL A 53 103.844 -5.292 -6.640 1.00 1.00 H new ATOM 0 HG21 VAL A 53 102.637 -2.907 -5.126 1.00 1.00 H new ATOM 0 HG22 VAL A 53 102.042 -3.545 -6.677 1.00 1.00 H new ATOM 0 HG23 VAL A 53 100.933 -3.390 -5.294 1.00 1.00 H new ATOM 762 N GLU A 54 99.579 -5.917 -4.139 1.00 1.00 N ATOM 763 CA GLU A 54 98.285 -5.455 -3.594 1.00 1.00 C ATOM 764 C GLU A 54 98.617 -4.515 -2.430 1.00 1.00 C ATOM 765 O GLU A 54 99.685 -4.653 -1.836 1.00 1.00 O ATOM 766 CB GLU A 54 97.403 -6.596 -3.050 1.00 1.00 C ATOM 767 CG GLU A 54 97.351 -7.812 -3.994 1.00 1.00 C ATOM 768 CD GLU A 54 97.109 -9.108 -3.214 1.00 1.00 C ATOM 769 OE1 GLU A 54 97.150 -10.160 -3.832 1.00 1.00 O ATOM 770 OE2 GLU A 54 96.880 -9.032 -2.018 1.00 1.00 O ATOM 0 H GLU A 54 100.151 -6.441 -3.477 1.00 1.00 H new ATOM 0 HA GLU A 54 97.723 -4.980 -4.398 1.00 1.00 H new ATOM 0 HB2 GLU A 54 97.784 -6.912 -2.079 1.00 1.00 H new ATOM 0 HB3 GLU A 54 96.392 -6.223 -2.890 1.00 1.00 H new ATOM 0 HG2 GLU A 54 96.557 -7.672 -4.728 1.00 1.00 H new ATOM 0 HG3 GLU A 54 98.287 -7.887 -4.547 1.00 1.00 H new ATOM 777 N TYR A 55 97.758 -3.535 -2.104 1.00 1.00 N ATOM 778 CA TYR A 55 98.119 -2.627 -1.020 1.00 1.00 C ATOM 779 C TYR A 55 96.949 -1.810 -0.457 1.00 1.00 C ATOM 780 O TYR A 55 95.941 -1.595 -1.125 1.00 1.00 O ATOM 781 CB TYR A 55 99.152 -1.653 -1.579 1.00 1.00 C ATOM 782 CG TYR A 55 98.561 -1.006 -2.811 1.00 1.00 C ATOM 783 CD1 TYR A 55 97.678 0.069 -2.682 1.00 1.00 C ATOM 784 CD2 TYR A 55 98.868 -1.501 -4.080 1.00 1.00 C ATOM 785 CE1 TYR A 55 97.100 0.650 -3.813 1.00 1.00 C ATOM 786 CE2 TYR A 55 98.294 -0.916 -5.214 1.00 1.00 C ATOM 787 CZ TYR A 55 97.410 0.158 -5.081 1.00 1.00 C ATOM 788 OH TYR A 55 96.840 0.728 -6.201 1.00 1.00 O ATOM 0 H TYR A 55 96.858 -3.361 -2.551 1.00 1.00 H new ATOM 0 HA TYR A 55 98.489 -3.237 -0.196 1.00 1.00 H new ATOM 0 HB2 TYR A 55 99.406 -0.897 -0.835 1.00 1.00 H new ATOM 0 HB3 TYR A 55 100.075 -2.177 -1.828 1.00 1.00 H new ATOM 0 HD1 TYR A 55 97.441 0.453 -1.701 1.00 1.00 H new ATOM 0 HD2 TYR A 55 99.547 -2.334 -4.186 1.00 1.00 H new ATOM 0 HE1 TYR A 55 96.415 1.478 -3.706 1.00 1.00 H new ATOM 0 HE2 TYR A 55 98.535 -1.296 -6.196 1.00 1.00 H new ATOM 0 HH TYR A 55 97.163 0.267 -7.003 1.00 1.00 H new ATOM 798 N THR A 56 97.144 -1.285 0.769 1.00 1.00 N ATOM 799 CA THR A 56 96.151 -0.403 1.406 1.00 1.00 C ATOM 800 C THR A 56 96.813 0.924 1.730 1.00 1.00 C ATOM 801 O THR A 56 97.886 0.959 2.307 1.00 1.00 O ATOM 802 CB THR A 56 95.494 -1.032 2.656 1.00 1.00 C ATOM 803 OG1 THR A 56 94.448 -1.894 2.248 1.00 1.00 O ATOM 804 CG2 THR A 56 94.885 0.048 3.562 1.00 1.00 C ATOM 0 H THR A 56 97.976 -1.456 1.334 1.00 1.00 H new ATOM 0 HA THR A 56 95.333 -0.246 0.702 1.00 1.00 H new ATOM 0 HB THR A 56 96.264 -1.575 3.205 1.00 1.00 H new ATOM 0 HG1 THR A 56 93.649 -1.365 2.042 1.00 1.00 H new ATOM 0 HG21 THR A 56 94.430 -0.422 4.433 1.00 1.00 H new ATOM 0 HG22 THR A 56 95.667 0.734 3.887 1.00 1.00 H new ATOM 0 HG23 THR A 56 94.125 0.600 3.009 1.00 1.00 H new ATOM 812 N GLY A 57 96.172 2.023 1.338 1.00 1.00 N ATOM 813 CA GLY A 57 96.743 3.356 1.579 1.00 1.00 C ATOM 814 C GLY A 57 95.918 4.158 2.569 1.00 1.00 C ATOM 815 O GLY A 57 94.689 4.175 2.496 1.00 1.00 O ATOM 0 H GLY A 57 95.271 2.024 0.859 1.00 1.00 H new ATOM 0 HA2 GLY A 57 97.761 3.252 1.956 1.00 1.00 H new ATOM 0 HA3 GLY A 57 96.806 3.899 0.636 1.00 1.00 H new ATOM 819 N ARG A 58 96.600 4.843 3.497 1.00 1.00 N ATOM 820 CA ARG A 58 95.901 5.657 4.481 1.00 1.00 C ATOM 821 C ARG A 58 96.708 6.886 4.892 1.00 1.00 C ATOM 822 O ARG A 58 97.902 6.996 4.615 1.00 1.00 O ATOM 823 CB ARG A 58 95.525 4.821 5.717 1.00 1.00 C ATOM 824 CG ARG A 58 96.722 4.654 6.691 1.00 1.00 C ATOM 825 CD ARG A 58 96.238 4.127 8.049 1.00 1.00 C ATOM 826 NE ARG A 58 96.159 2.672 8.038 1.00 1.00 N ATOM 827 CZ ARG A 58 95.662 2.006 9.073 1.00 1.00 C ATOM 828 NH1 ARG A 58 95.203 2.661 10.105 1.00 1.00 N ATOM 829 NH2 ARG A 58 95.626 0.701 9.060 1.00 1.00 N ATOM 0 H ARG A 58 97.617 4.846 3.581 1.00 1.00 H new ATOM 0 HA ARG A 58 94.986 6.013 4.007 1.00 1.00 H new ATOM 0 HB2 ARG A 58 94.696 5.299 6.239 1.00 1.00 H new ATOM 0 HB3 ARG A 58 95.177 3.838 5.398 1.00 1.00 H new ATOM 0 HG2 ARG A 58 97.452 3.965 6.266 1.00 1.00 H new ATOM 0 HG3 ARG A 58 97.227 5.611 6.824 1.00 1.00 H new ATOM 0 HD2 ARG A 58 96.919 4.453 8.835 1.00 1.00 H new ATOM 0 HD3 ARG A 58 95.259 4.548 8.280 1.00 1.00 H new ATOM 0 HE ARG A 58 96.491 2.157 7.222 1.00 1.00 H new ATOM 0 HH11 ARG A 58 95.227 3.681 10.114 1.00 1.00 H new ATOM 0 HH12 ARG A 58 94.820 2.153 10.902 1.00 1.00 H new ATOM 0 HH21 ARG A 58 95.981 0.189 8.252 1.00 1.00 H new ATOM 0 HH22 ARG A 58 95.243 0.193 9.858 1.00 1.00 H new ATOM 843 N LEU A 59 96.020 7.793 5.575 1.00 1.00 N ATOM 844 CA LEU A 59 96.623 9.030 6.075 1.00 1.00 C ATOM 845 C LEU A 59 97.261 8.824 7.450 1.00 1.00 C ATOM 846 O LEU A 59 97.001 7.837 8.139 1.00 1.00 O ATOM 847 CB LEU A 59 95.528 10.111 6.199 1.00 1.00 C ATOM 848 CG LEU A 59 95.519 11.066 4.993 1.00 1.00 C ATOM 849 CD1 LEU A 59 94.851 10.395 3.803 1.00 1.00 C ATOM 850 CD2 LEU A 59 94.748 12.349 5.330 1.00 1.00 C ATOM 0 H LEU A 59 95.030 7.695 5.799 1.00 1.00 H new ATOM 0 HA LEU A 59 97.398 9.337 5.373 1.00 1.00 H new ATOM 0 HB2 LEU A 59 94.554 9.631 6.288 1.00 1.00 H new ATOM 0 HB3 LEU A 59 95.686 10.683 7.113 1.00 1.00 H new ATOM 0 HG LEU A 59 96.552 11.315 4.749 1.00 1.00 H new ATOM 0 HD11 LEU A 59 94.849 11.078 2.954 1.00 1.00 H new ATOM 0 HD12 LEU A 59 95.400 9.491 3.540 1.00 1.00 H new ATOM 0 HD13 LEU A 59 93.825 10.134 4.061 1.00 1.00 H new ATOM 0 HD21 LEU A 59 94.752 13.013 4.466 1.00 1.00 H new ATOM 0 HD22 LEU A 59 93.720 12.098 5.590 1.00 1.00 H new ATOM 0 HD23 LEU A 59 95.224 12.849 6.174 1.00 1.00 H new ATOM 862 N ILE A 60 98.070 9.800 7.840 1.00 1.00 N ATOM 863 CA ILE A 60 98.730 9.786 9.142 1.00 1.00 C ATOM 864 C ILE A 60 97.700 9.757 10.252 1.00 1.00 C ATOM 865 O ILE A 60 97.967 9.320 11.371 1.00 1.00 O ATOM 866 CB ILE A 60 99.604 11.045 9.328 1.00 1.00 C ATOM 867 CG1 ILE A 60 98.782 12.344 9.569 1.00 1.00 C ATOM 868 CG2 ILE A 60 100.491 11.247 8.109 1.00 1.00 C ATOM 869 CD1 ILE A 60 97.988 12.748 8.338 1.00 1.00 C ATOM 0 H ILE A 60 98.287 10.617 7.270 1.00 1.00 H new ATOM 0 HA ILE A 60 99.356 8.895 9.185 1.00 1.00 H new ATOM 0 HB ILE A 60 100.200 10.867 10.223 1.00 1.00 H new ATOM 0 HG12 ILE A 60 98.101 12.193 10.407 1.00 1.00 H new ATOM 0 HG13 ILE A 60 99.456 13.154 9.848 1.00 1.00 H new ATOM 0 HG21 ILE A 60 101.104 12.137 8.249 1.00 1.00 H new ATOM 0 HG22 ILE A 60 101.137 10.378 7.981 1.00 1.00 H new ATOM 0 HG23 ILE A 60 99.869 11.370 7.223 1.00 1.00 H new ATOM 0 HD11 ILE A 60 97.428 13.659 8.549 1.00 1.00 H new ATOM 0 HD12 ILE A 60 98.671 12.925 7.507 1.00 1.00 H new ATOM 0 HD13 ILE A 60 97.295 11.949 8.074 1.00 1.00 H new ATOM 876 N ASP A 61 96.538 10.281 9.923 1.00 1.00 N ATOM 877 CA ASP A 61 95.434 10.396 10.868 1.00 1.00 C ATOM 878 C ASP A 61 94.495 9.203 10.773 1.00 1.00 C ATOM 879 O ASP A 61 93.491 9.139 11.481 1.00 1.00 O ATOM 880 CB ASP A 61 94.668 11.688 10.587 1.00 1.00 C ATOM 881 CG ASP A 61 93.791 12.050 11.779 1.00 1.00 C ATOM 882 OD1 ASP A 61 92.653 12.431 11.561 1.00 1.00 O ATOM 883 OD2 ASP A 61 94.269 11.941 12.897 1.00 1.00 O ATOM 0 H ASP A 61 96.326 10.641 8.993 1.00 1.00 H new ATOM 0 HA ASP A 61 95.842 10.416 11.879 1.00 1.00 H new ATOM 0 HB2 ASP A 61 95.369 12.498 10.383 1.00 1.00 H new ATOM 0 HB3 ASP A 61 94.052 11.567 9.696 1.00 1.00 H new ATOM 888 N GLY A 62 94.833 8.247 9.914 1.00 1.00 N ATOM 889 CA GLY A 62 94.014 7.050 9.762 1.00 1.00 C ATOM 890 C GLY A 62 92.964 7.188 8.661 1.00 1.00 C ATOM 891 O GLY A 62 92.227 6.239 8.388 1.00 1.00 O ATOM 0 H GLY A 62 95.660 8.276 9.318 1.00 1.00 H new ATOM 0 HA2 GLY A 62 94.659 6.200 9.539 1.00 1.00 H new ATOM 0 HA3 GLY A 62 93.517 6.833 10.707 1.00 1.00 H new ATOM 895 N THR A 63 92.884 8.353 8.021 1.00 1.00 N ATOM 896 CA THR A 63 91.898 8.532 6.957 1.00 1.00 C ATOM 897 C THR A 63 92.267 7.687 5.747 1.00 1.00 C ATOM 898 O THR A 63 93.160 8.043 4.981 1.00 1.00 O ATOM 899 CB THR A 63 91.799 10.002 6.529 1.00 1.00 C ATOM 900 OG1 THR A 63 91.791 10.835 7.680 1.00 1.00 O ATOM 901 CG2 THR A 63 90.510 10.208 5.737 1.00 1.00 C ATOM 0 H THR A 63 93.471 9.165 8.212 1.00 1.00 H new ATOM 0 HA THR A 63 90.932 8.215 7.349 1.00 1.00 H new ATOM 0 HB THR A 63 92.656 10.260 5.907 1.00 1.00 H new ATOM 0 HG1 THR A 63 91.729 11.773 7.404 1.00 1.00 H new ATOM 0 HG21 THR A 63 90.434 11.251 5.430 1.00 1.00 H new ATOM 0 HG22 THR A 63 90.520 9.570 4.854 1.00 1.00 H new ATOM 0 HG23 THR A 63 89.654 9.950 6.361 1.00 1.00 H new ATOM 909 N VAL A 64 91.569 6.570 5.566 1.00 1.00 N ATOM 910 CA VAL A 64 91.843 5.711 4.426 1.00 1.00 C ATOM 911 C VAL A 64 91.306 6.347 3.175 1.00 1.00 C ATOM 912 O VAL A 64 90.120 6.665 3.079 1.00 1.00 O ATOM 913 CB VAL A 64 91.247 4.321 4.633 1.00 1.00 C ATOM 914 CG1 VAL A 64 91.533 3.422 3.424 1.00 1.00 C ATOM 915 CG2 VAL A 64 91.872 3.712 5.872 1.00 1.00 C ATOM 0 H VAL A 64 90.824 6.245 6.182 1.00 1.00 H new ATOM 0 HA VAL A 64 92.922 5.592 4.325 1.00 1.00 H new ATOM 0 HB VAL A 64 90.167 4.406 4.749 1.00 1.00 H new ATOM 0 HG11 VAL A 64 91.099 2.436 3.593 1.00 1.00 H new ATOM 0 HG12 VAL A 64 91.093 3.864 2.530 1.00 1.00 H new ATOM 0 HG13 VAL A 64 92.610 3.326 3.289 1.00 1.00 H new ATOM 0 HG21 VAL A 64 91.458 2.717 6.037 1.00 1.00 H new ATOM 0 HG22 VAL A 64 92.951 3.638 5.737 1.00 1.00 H new ATOM 0 HG23 VAL A 64 91.657 4.342 6.735 1.00 1.00 H new ATOM 919 N PHE A 65 92.205 6.549 2.217 1.00 1.00 N ATOM 920 CA PHE A 65 91.837 7.180 0.956 1.00 1.00 C ATOM 921 C PHE A 65 92.020 6.236 -0.214 1.00 1.00 C ATOM 922 O PHE A 65 91.589 6.525 -1.330 1.00 1.00 O ATOM 923 CB PHE A 65 92.643 8.454 0.767 1.00 1.00 C ATOM 924 CG PHE A 65 94.096 8.175 0.459 1.00 1.00 C ATOM 925 CD1 PHE A 65 94.941 7.728 1.473 1.00 1.00 C ATOM 926 CD2 PHE A 65 94.606 8.412 -0.825 1.00 1.00 C ATOM 927 CE1 PHE A 65 96.301 7.511 1.214 1.00 1.00 C ATOM 928 CE2 PHE A 65 95.964 8.193 -1.088 1.00 1.00 C ATOM 929 CZ PHE A 65 96.814 7.744 -0.066 1.00 1.00 C ATOM 0 H PHE A 65 93.188 6.286 2.289 1.00 1.00 H new ATOM 0 HA PHE A 65 90.778 7.435 0.993 1.00 1.00 H new ATOM 0 HB2 PHE A 65 92.208 9.039 -0.043 1.00 1.00 H new ATOM 0 HB3 PHE A 65 92.576 9.061 1.670 1.00 1.00 H new ATOM 0 HD1 PHE A 65 94.546 7.548 2.462 1.00 1.00 H new ATOM 0 HD2 PHE A 65 93.953 8.763 -1.610 1.00 1.00 H new ATOM 0 HE1 PHE A 65 96.953 7.164 2.002 1.00 1.00 H new ATOM 0 HE2 PHE A 65 96.357 8.370 -2.078 1.00 1.00 H new ATOM 0 HZ PHE A 65 97.862 7.579 -0.267 1.00 1.00 H new ATOM 939 N ASP A 66 92.630 5.091 0.048 1.00 1.00 N ATOM 940 CA ASP A 66 92.822 4.100 -1.001 1.00 1.00 C ATOM 941 C ASP A 66 93.035 2.716 -0.420 1.00 1.00 C ATOM 942 O ASP A 66 93.547 2.567 0.690 1.00 1.00 O ATOM 943 CB ASP A 66 94.016 4.464 -1.876 1.00 1.00 C ATOM 944 CG ASP A 66 93.985 3.643 -3.165 1.00 1.00 C ATOM 945 OD1 ASP A 66 95.046 3.400 -3.719 1.00 1.00 O ATOM 946 OD2 ASP A 66 92.901 3.266 -3.580 1.00 1.00 O ATOM 0 H ASP A 66 92.996 4.826 0.963 1.00 1.00 H new ATOM 0 HA ASP A 66 91.916 4.092 -1.607 1.00 1.00 H new ATOM 0 HB2 ASP A 66 93.995 5.528 -2.112 1.00 1.00 H new ATOM 0 HB3 ASP A 66 94.944 4.276 -1.337 1.00 1.00 H new ATOM 951 N SER A 67 92.661 1.701 -1.194 1.00 1.00 N ATOM 952 CA SER A 67 92.839 0.331 -0.755 1.00 1.00 C ATOM 953 C SER A 67 92.833 -0.640 -1.929 1.00 1.00 C ATOM 954 O SER A 67 92.248 -0.364 -2.976 1.00 1.00 O ATOM 955 CB SER A 67 91.776 -0.034 0.273 1.00 1.00 C ATOM 956 OG SER A 67 90.496 -0.046 -0.346 1.00 1.00 O ATOM 0 H SER A 67 92.238 1.804 -2.117 1.00 1.00 H new ATOM 0 HA SER A 67 93.818 0.250 -0.282 1.00 1.00 H new ATOM 0 HB2 SER A 67 91.992 -1.012 0.703 1.00 1.00 H new ATOM 0 HB3 SER A 67 91.788 0.684 1.093 1.00 1.00 H new ATOM 0 HG SER A 67 89.814 -0.283 0.317 1.00 1.00 H new ATOM 962 N THR A 68 93.511 -1.777 -1.748 1.00 1.00 N ATOM 963 CA THR A 68 93.601 -2.787 -2.805 1.00 1.00 C ATOM 964 C THR A 68 93.875 -4.161 -2.212 1.00 1.00 C ATOM 965 O THR A 68 93.325 -5.164 -2.660 1.00 1.00 O ATOM 966 CB THR A 68 94.724 -2.424 -3.782 1.00 1.00 C ATOM 967 OG1 THR A 68 94.496 -1.125 -4.309 1.00 1.00 O ATOM 968 CG2 THR A 68 94.779 -3.440 -4.921 1.00 1.00 C ATOM 0 H THR A 68 94.001 -2.020 -0.887 1.00 1.00 H new ATOM 0 HA THR A 68 92.649 -2.813 -3.335 1.00 1.00 H new ATOM 0 HB THR A 68 95.675 -2.438 -3.250 1.00 1.00 H new ATOM 0 HG1 THR A 68 95.335 -0.619 -4.307 1.00 1.00 H new ATOM 0 HG21 THR A 68 95.581 -3.172 -5.609 1.00 1.00 H new ATOM 0 HG22 THR A 68 94.967 -4.433 -4.514 1.00 1.00 H new ATOM 0 HG23 THR A 68 93.828 -3.441 -5.454 1.00 1.00 H new ATOM 976 N GLU A 69 94.721 -4.204 -1.196 1.00 1.00 N ATOM 977 CA GLU A 69 95.034 -5.466 -0.554 1.00 1.00 C ATOM 978 C GLU A 69 93.797 -6.002 0.128 1.00 1.00 C ATOM 979 O GLU A 69 93.630 -7.213 0.271 1.00 1.00 O ATOM 980 CB GLU A 69 96.212 -5.317 0.396 1.00 1.00 C ATOM 981 CG GLU A 69 95.919 -4.284 1.468 1.00 1.00 C ATOM 982 CD GLU A 69 95.133 -4.900 2.624 1.00 1.00 C ATOM 983 OE1 GLU A 69 94.906 -4.203 3.597 1.00 1.00 O ATOM 984 OE2 GLU A 69 94.782 -6.065 2.524 1.00 1.00 O ATOM 0 H GLU A 69 95.196 -3.391 -0.804 1.00 1.00 H new ATOM 0 HA GLU A 69 95.342 -6.193 -1.305 1.00 1.00 H new ATOM 0 HB2 GLU A 69 96.432 -6.278 0.862 1.00 1.00 H new ATOM 0 HB3 GLU A 69 97.100 -5.024 -0.164 1.00 1.00 H new ATOM 0 HG2 GLU A 69 96.854 -3.867 1.841 1.00 1.00 H new ATOM 0 HG3 GLU A 69 95.352 -3.459 1.037 1.00 1.00 H new ATOM 991 N LYS A 70 92.909 -5.097 0.516 1.00 1.00 N ATOM 992 CA LYS A 70 91.676 -5.513 1.138 1.00 1.00 C ATOM 993 C LYS A 70 90.954 -6.431 0.169 1.00 1.00 C ATOM 994 O LYS A 70 90.475 -7.505 0.537 1.00 1.00 O ATOM 995 CB LYS A 70 90.821 -4.291 1.463 1.00 1.00 C ATOM 996 CG LYS A 70 91.557 -3.421 2.478 1.00 1.00 C ATOM 997 CD LYS A 70 91.597 -4.114 3.851 1.00 1.00 C ATOM 998 CE LYS A 70 91.976 -3.107 4.936 1.00 1.00 C ATOM 999 NZ LYS A 70 91.734 -3.719 6.273 1.00 1.00 N ATOM 0 H LYS A 70 93.022 -4.089 0.410 1.00 1.00 H new ATOM 0 HA LYS A 70 91.873 -6.040 2.071 1.00 1.00 H new ATOM 0 HB2 LYS A 70 90.619 -3.721 0.556 1.00 1.00 H new ATOM 0 HB3 LYS A 70 89.857 -4.603 1.864 1.00 1.00 H new ATOM 0 HG2 LYS A 70 92.572 -3.227 2.132 1.00 1.00 H new ATOM 0 HG3 LYS A 70 91.060 -2.455 2.566 1.00 1.00 H new ATOM 0 HD2 LYS A 70 90.624 -4.552 4.074 1.00 1.00 H new ATOM 0 HD3 LYS A 70 92.318 -4.931 3.834 1.00 1.00 H new ATOM 0 HE2 LYS A 70 93.024 -2.823 4.836 1.00 1.00 H new ATOM 0 HE3 LYS A 70 91.387 -2.196 4.827 1.00 1.00 H new ATOM 0 HZ1 LYS A 70 91.990 -3.039 7.017 1.00 1.00 H new ATOM 0 HZ2 LYS A 70 90.729 -3.969 6.363 1.00 1.00 H new ATOM 0 HZ3 LYS A 70 92.315 -4.576 6.373 1.00 1.00 H new ATOM 1013 N THR A 71 90.946 -6.017 -1.090 1.00 1.00 N ATOM 1014 CA THR A 71 90.354 -6.822 -2.144 1.00 1.00 C ATOM 1015 C THR A 71 91.282 -7.997 -2.446 1.00 1.00 C ATOM 1016 O THR A 71 90.829 -9.084 -2.804 1.00 1.00 O ATOM 1017 CB THR A 71 90.120 -5.975 -3.405 1.00 1.00 C ATOM 1018 OG1 THR A 71 91.224 -5.109 -3.610 1.00 1.00 O ATOM 1019 CG2 THR A 71 88.843 -5.148 -3.247 1.00 1.00 C ATOM 0 H THR A 71 91.342 -5.131 -1.404 1.00 1.00 H new ATOM 0 HA THR A 71 89.385 -7.199 -1.816 1.00 1.00 H new ATOM 0 HB THR A 71 90.014 -6.637 -4.264 1.00 1.00 H new ATOM 0 HG1 THR A 71 92.027 -5.503 -3.210 1.00 1.00 H new ATOM 0 HG21 THR A 71 88.683 -4.550 -4.144 1.00 1.00 H new ATOM 0 HG22 THR A 71 87.994 -5.815 -3.099 1.00 1.00 H new ATOM 0 HG23 THR A 71 88.941 -4.489 -2.384 1.00 1.00 H new ATOM 1027 N GLY A 72 92.588 -7.771 -2.273 1.00 1.00 N ATOM 1028 CA GLY A 72 93.575 -8.818 -2.498 1.00 1.00 C ATOM 1029 C GLY A 72 93.918 -8.963 -3.970 1.00 1.00 C ATOM 1030 O GLY A 72 94.445 -9.993 -4.388 1.00 1.00 O ATOM 0 H GLY A 72 92.979 -6.876 -1.979 1.00 1.00 H new ATOM 0 HA2 GLY A 72 94.480 -8.591 -1.935 1.00 1.00 H new ATOM 0 HA3 GLY A 72 93.192 -9.766 -2.119 1.00 1.00 H new ATOM 1034 N LYS A 73 93.606 -7.939 -4.762 1.00 1.00 N ATOM 1035 CA LYS A 73 93.885 -7.994 -6.204 1.00 1.00 C ATOM 1036 C LYS A 73 95.140 -7.191 -6.550 1.00 1.00 C ATOM 1037 O LYS A 73 95.160 -5.975 -6.373 1.00 1.00 O ATOM 1038 CB LYS A 73 92.667 -7.438 -6.974 1.00 1.00 C ATOM 1039 CG LYS A 73 91.665 -8.556 -7.310 1.00 1.00 C ATOM 1040 CD LYS A 73 90.846 -8.960 -6.050 1.00 1.00 C ATOM 1041 CE LYS A 73 90.860 -10.480 -5.859 1.00 1.00 C ATOM 1042 NZ LYS A 73 90.636 -11.154 -7.170 1.00 1.00 N ATOM 0 H LYS A 73 93.168 -7.075 -4.442 1.00 1.00 H new ATOM 0 HA LYS A 73 94.062 -9.030 -6.492 1.00 1.00 H new ATOM 0 HB2 LYS A 73 92.174 -6.672 -6.376 1.00 1.00 H new ATOM 0 HB3 LYS A 73 93.003 -6.958 -7.893 1.00 1.00 H new ATOM 0 HG2 LYS A 73 90.989 -8.221 -8.097 1.00 1.00 H new ATOM 0 HG3 LYS A 73 92.198 -9.424 -7.697 1.00 1.00 H new ATOM 0 HD2 LYS A 73 91.263 -8.474 -5.168 1.00 1.00 H new ATOM 0 HD3 LYS A 73 89.818 -8.611 -6.151 1.00 1.00 H new ATOM 0 HE2 LYS A 73 91.814 -10.794 -5.436 1.00 1.00 H new ATOM 0 HE3 LYS A 73 90.085 -10.774 -5.151 1.00 1.00 H new ATOM 0 HZ1 LYS A 73 90.185 -12.078 -7.013 1.00 1.00 H new ATOM 0 HZ2 LYS A 73 90.019 -10.563 -7.763 1.00 1.00 H new ATOM 0 HZ3 LYS A 73 91.548 -11.292 -7.650 1.00 1.00 H new ATOM 1056 N PRO A 74 96.203 -7.837 -7.023 1.00 1.00 N ATOM 1057 CA PRO A 74 97.463 -7.129 -7.360 1.00 1.00 C ATOM 1058 C PRO A 74 97.318 -6.070 -8.447 1.00 1.00 C ATOM 1059 O PRO A 74 96.471 -6.160 -9.334 1.00 1.00 O ATOM 1060 CB PRO A 74 98.425 -8.239 -7.809 1.00 1.00 C ATOM 1061 CG PRO A 74 97.849 -9.496 -7.278 1.00 1.00 C ATOM 1062 CD PRO A 74 96.358 -9.292 -7.276 1.00 1.00 C ATOM 0 HA PRO A 74 97.816 -6.568 -6.495 1.00 1.00 H new ATOM 0 HB2 PRO A 74 98.507 -8.272 -8.895 1.00 1.00 H new ATOM 0 HB3 PRO A 74 99.429 -8.071 -7.419 1.00 1.00 H new ATOM 0 HG2 PRO A 74 98.127 -10.347 -7.900 1.00 1.00 H new ATOM 0 HG3 PRO A 74 98.217 -9.702 -6.273 1.00 1.00 H new ATOM 0 HD2 PRO A 74 95.913 -9.583 -8.227 1.00 1.00 H new ATOM 0 HD3 PRO A 74 95.873 -9.887 -6.502 1.00 1.00 H new ATOM 1070 N ALA A 75 98.203 -5.084 -8.363 1.00 1.00 N ATOM 1071 CA ALA A 75 98.267 -3.988 -9.325 1.00 1.00 C ATOM 1072 C ALA A 75 99.675 -3.961 -9.909 1.00 1.00 C ATOM 1073 O ALA A 75 100.615 -4.397 -9.248 1.00 1.00 O ATOM 1074 CB ALA A 75 97.968 -2.655 -8.635 1.00 1.00 C ATOM 0 H ALA A 75 98.901 -5.021 -7.622 1.00 1.00 H new ATOM 0 HA ALA A 75 97.527 -4.137 -10.111 1.00 1.00 H new ATOM 0 HB1 ALA A 75 98.020 -1.848 -9.365 1.00 1.00 H new ATOM 0 HB2 ALA A 75 96.969 -2.687 -8.199 1.00 1.00 H new ATOM 0 HB3 ALA A 75 98.702 -2.480 -7.848 1.00 1.00 H new ATOM 1080 N THR A 76 99.832 -3.476 -11.140 1.00 1.00 N ATOM 1081 CA THR A 76 101.157 -3.442 -11.772 1.00 1.00 C ATOM 1082 C THR A 76 101.710 -2.032 -11.888 1.00 1.00 C ATOM 1083 O THR A 76 101.044 -1.120 -12.378 1.00 1.00 O ATOM 1084 CB THR A 76 101.081 -4.081 -13.157 1.00 1.00 C ATOM 1085 OG1 THR A 76 102.180 -3.644 -13.944 1.00 1.00 O ATOM 1086 CG2 THR A 76 99.770 -3.691 -13.843 1.00 1.00 C ATOM 0 H THR A 76 99.074 -3.106 -11.714 1.00 1.00 H new ATOM 0 HA THR A 76 101.837 -4.005 -11.133 1.00 1.00 H new ATOM 0 HB THR A 76 101.118 -5.165 -13.052 1.00 1.00 H new ATOM 0 HG1 THR A 76 102.131 -4.056 -14.832 1.00 1.00 H new ATOM 0 HG21 THR A 76 99.725 -4.151 -14.830 1.00 1.00 H new ATOM 0 HG22 THR A 76 98.928 -4.036 -13.243 1.00 1.00 H new ATOM 0 HG23 THR A 76 99.722 -2.607 -13.946 1.00 1.00 H new ATOM 1094 N PHE A 77 102.964 -1.880 -11.454 1.00 1.00 N ATOM 1095 CA PHE A 77 103.655 -0.601 -11.524 1.00 1.00 C ATOM 1096 C PHE A 77 105.078 -0.813 -11.955 1.00 1.00 C ATOM 1097 O PHE A 77 105.717 -1.792 -11.576 1.00 1.00 O ATOM 1098 CB PHE A 77 103.755 0.082 -10.166 1.00 1.00 C ATOM 1099 CG PHE A 77 102.398 0.295 -9.556 1.00 1.00 C ATOM 1100 CD1 PHE A 77 102.114 -0.264 -8.312 1.00 1.00 C ATOM 1101 CD2 PHE A 77 101.428 1.053 -10.223 1.00 1.00 C ATOM 1102 CE1 PHE A 77 100.857 -0.068 -7.731 1.00 1.00 C ATOM 1103 CE2 PHE A 77 100.179 1.253 -9.646 1.00 1.00 C ATOM 1104 CZ PHE A 77 99.888 0.694 -8.397 1.00 1.00 C ATOM 0 H PHE A 77 103.519 -2.634 -11.049 1.00 1.00 H new ATOM 0 HA PHE A 77 103.080 0.009 -12.221 1.00 1.00 H new ATOM 0 HB2 PHE A 77 104.365 -0.524 -9.496 1.00 1.00 H new ATOM 0 HB3 PHE A 77 104.260 1.041 -10.276 1.00 1.00 H new ATOM 0 HD1 PHE A 77 102.863 -0.848 -7.797 1.00 1.00 H new ATOM 0 HD2 PHE A 77 101.651 1.483 -11.188 1.00 1.00 H new ATOM 0 HE1 PHE A 77 100.633 -0.504 -6.769 1.00 1.00 H new ATOM 0 HE2 PHE A 77 99.433 1.840 -10.162 1.00 1.00 H new ATOM 0 HZ PHE A 77 98.919 0.849 -7.947 1.00 1.00 H new ATOM 1114 N GLN A 78 105.602 0.159 -12.654 1.00 1.00 N ATOM 1115 CA GLN A 78 106.996 0.122 -13.026 1.00 1.00 C ATOM 1116 C GLN A 78 107.748 0.811 -11.919 1.00 1.00 C ATOM 1117 O GLN A 78 107.411 1.931 -11.537 1.00 1.00 O ATOM 1118 CB GLN A 78 107.251 0.814 -14.361 1.00 1.00 C ATOM 1119 CG GLN A 78 106.783 -0.092 -15.495 1.00 1.00 C ATOM 1120 CD GLN A 78 107.208 0.480 -16.839 1.00 1.00 C ATOM 1121 OE1 GLN A 78 106.599 0.190 -17.868 1.00 1.00 O ATOM 1122 NE2 GLN A 78 108.223 1.283 -16.881 1.00 1.00 N ATOM 0 H GLN A 78 105.091 0.981 -12.976 1.00 1.00 H new ATOM 0 HA GLN A 78 107.325 -0.909 -13.156 1.00 1.00 H new ATOM 0 HB2 GLN A 78 106.721 1.766 -14.398 1.00 1.00 H new ATOM 0 HB3 GLN A 78 108.312 1.036 -14.472 1.00 1.00 H new ATOM 0 HG2 GLN A 78 107.202 -1.090 -15.368 1.00 1.00 H new ATOM 0 HG3 GLN A 78 105.698 -0.195 -15.463 1.00 1.00 H new ATOM 0 HE21 GLN A 78 108.723 1.519 -16.024 1.00 1.00 H new ATOM 0 HE22 GLN A 78 108.523 1.680 -17.771 1.00 1.00 H new ATOM 1131 N VAL A 79 108.728 0.133 -11.360 1.00 1.00 N ATOM 1132 CA VAL A 79 109.448 0.712 -10.258 1.00 1.00 C ATOM 1133 C VAL A 79 109.976 2.094 -10.642 1.00 1.00 C ATOM 1134 O VAL A 79 110.149 2.947 -9.783 1.00 1.00 O ATOM 1135 CB VAL A 79 110.643 -0.165 -9.845 1.00 1.00 C ATOM 1136 CG1 VAL A 79 111.252 0.394 -8.575 1.00 1.00 C ATOM 1137 CG2 VAL A 79 110.223 -1.596 -9.561 1.00 1.00 C ATOM 0 H VAL A 79 109.035 -0.797 -11.645 1.00 1.00 H new ATOM 0 HA VAL A 79 108.754 0.788 -9.421 1.00 1.00 H new ATOM 0 HB VAL A 79 111.354 -0.161 -10.671 1.00 1.00 H new ATOM 0 HG11 VAL A 79 112.100 -0.222 -8.276 1.00 1.00 H new ATOM 0 HG12 VAL A 79 111.590 1.415 -8.752 1.00 1.00 H new ATOM 0 HG13 VAL A 79 110.505 0.392 -7.782 1.00 1.00 H new ATOM 0 HG21 VAL A 79 111.096 -2.181 -9.273 1.00 1.00 H new ATOM 0 HG22 VAL A 79 109.495 -1.607 -8.750 1.00 1.00 H new ATOM 0 HG23 VAL A 79 109.776 -2.028 -10.456 1.00 1.00 H new ATOM 1141 N SER A 80 110.251 2.315 -11.929 1.00 1.00 N ATOM 1142 CA SER A 80 110.796 3.600 -12.348 1.00 1.00 C ATOM 1143 C SER A 80 109.745 4.691 -12.329 1.00 1.00 C ATOM 1144 O SER A 80 110.069 5.872 -12.198 1.00 1.00 O ATOM 1145 CB SER A 80 111.391 3.488 -13.752 1.00 1.00 C ATOM 1146 OG SER A 80 111.340 4.758 -14.391 1.00 1.00 O ATOM 0 H SER A 80 110.109 1.638 -12.679 1.00 1.00 H new ATOM 0 HA SER A 80 111.577 3.870 -11.637 1.00 1.00 H new ATOM 0 HB2 SER A 80 112.422 3.139 -13.695 1.00 1.00 H new ATOM 0 HB3 SER A 80 110.837 2.753 -14.336 1.00 1.00 H new ATOM 0 HG SER A 80 111.722 4.687 -15.291 1.00 1.00 H new ATOM 1152 N GLN A 81 108.486 4.304 -12.471 1.00 1.00 N ATOM 1153 CA GLN A 81 107.402 5.281 -12.477 1.00 1.00 C ATOM 1154 C GLN A 81 106.698 5.358 -11.135 1.00 1.00 C ATOM 1155 O GLN A 81 105.963 6.307 -10.893 1.00 1.00 O ATOM 1156 CB GLN A 81 106.368 4.915 -13.538 1.00 1.00 C ATOM 1157 CG GLN A 81 107.049 4.711 -14.889 1.00 1.00 C ATOM 1158 CD GLN A 81 107.951 5.894 -15.227 1.00 1.00 C ATOM 1159 OE1 GLN A 81 107.509 7.041 -15.206 1.00 1.00 O ATOM 1160 NE2 GLN A 81 109.202 5.680 -15.528 1.00 1.00 N ATOM 0 H GLN A 81 108.190 3.334 -12.582 1.00 1.00 H new ATOM 0 HA GLN A 81 107.852 6.250 -12.695 1.00 1.00 H new ATOM 0 HB2 GLN A 81 105.843 4.005 -13.246 1.00 1.00 H new ATOM 0 HB3 GLN A 81 105.620 5.704 -13.615 1.00 1.00 H new ATOM 0 HG2 GLN A 81 107.637 3.794 -14.870 1.00 1.00 H new ATOM 0 HG3 GLN A 81 106.295 4.590 -15.667 1.00 1.00 H new ATOM 0 HE21 GLN A 81 109.567 4.728 -15.545 1.00 1.00 H new ATOM 0 HE22 GLN A 81 109.815 6.465 -15.746 1.00 1.00 H new ATOM 1169 N VAL A 82 106.902 4.359 -10.278 1.00 1.00 N ATOM 1170 CA VAL A 82 106.228 4.326 -8.991 1.00 1.00 C ATOM 1171 C VAL A 82 106.659 5.476 -8.088 1.00 1.00 C ATOM 1172 O VAL A 82 107.653 6.152 -8.355 1.00 1.00 O ATOM 1173 CB VAL A 82 106.424 2.938 -8.379 1.00 1.00 C ATOM 1174 CG1 VAL A 82 107.652 2.892 -7.521 1.00 1.00 C ATOM 1175 CG2 VAL A 82 105.207 2.537 -7.563 1.00 1.00 C ATOM 0 H VAL A 82 107.524 3.570 -10.454 1.00 1.00 H new ATOM 0 HA VAL A 82 105.158 4.485 -9.122 1.00 1.00 H new ATOM 0 HB VAL A 82 106.551 2.230 -9.198 1.00 1.00 H new ATOM 0 HG11 VAL A 82 107.765 1.893 -7.100 1.00 1.00 H new ATOM 0 HG12 VAL A 82 108.527 3.132 -8.125 1.00 1.00 H new ATOM 0 HG13 VAL A 82 107.559 3.618 -6.713 1.00 1.00 H new ATOM 0 HG21 VAL A 82 105.366 1.547 -7.136 1.00 1.00 H new ATOM 0 HG22 VAL A 82 105.053 3.258 -6.760 1.00 1.00 H new ATOM 0 HG23 VAL A 82 104.328 2.518 -8.207 1.00 1.00 H new ATOM 1179 N ILE A 83 105.881 5.711 -7.034 1.00 1.00 N ATOM 1180 CA ILE A 83 106.179 6.812 -6.119 1.00 1.00 C ATOM 1181 C ILE A 83 107.622 6.655 -5.622 1.00 1.00 C ATOM 1182 O ILE A 83 108.113 5.530 -5.530 1.00 1.00 O ATOM 1183 CB ILE A 83 105.161 6.846 -4.932 1.00 1.00 C ATOM 1184 CG1 ILE A 83 104.085 5.793 -5.161 1.00 1.00 C ATOM 1185 CG2 ILE A 83 104.484 8.227 -4.840 1.00 1.00 C ATOM 1186 CD1 ILE A 83 102.994 5.912 -4.095 1.00 1.00 C ATOM 0 H ILE A 83 105.053 5.165 -6.794 1.00 1.00 H new ATOM 0 HA ILE A 83 106.081 7.764 -6.641 1.00 1.00 H new ATOM 0 HB ILE A 83 105.701 6.646 -4.006 1.00 1.00 H new ATOM 0 HG12 ILE A 83 103.650 5.917 -6.153 1.00 1.00 H new ATOM 0 HG13 ILE A 83 104.528 4.797 -5.129 1.00 1.00 H new ATOM 0 HG21 ILE A 83 103.779 8.232 -4.009 1.00 1.00 H new ATOM 0 HG22 ILE A 83 105.242 8.994 -4.678 1.00 1.00 H new ATOM 0 HG23 ILE A 83 103.952 8.434 -5.768 1.00 1.00 H new ATOM 0 HD11 ILE A 83 102.231 5.154 -4.270 1.00 1.00 H new ATOM 0 HD12 ILE A 83 103.432 5.765 -3.108 1.00 1.00 H new ATOM 0 HD13 ILE A 83 102.541 6.902 -4.147 1.00 1.00 H new ATOM 1193 N PRO A 84 108.331 7.725 -5.323 1.00 1.00 N ATOM 1194 CA PRO A 84 109.745 7.608 -4.870 1.00 1.00 C ATOM 1195 C PRO A 84 109.898 6.624 -3.728 1.00 1.00 C ATOM 1196 O PRO A 84 110.840 5.833 -3.693 1.00 1.00 O ATOM 1197 CB PRO A 84 110.092 9.019 -4.394 1.00 1.00 C ATOM 1198 CG PRO A 84 109.187 9.923 -5.153 1.00 1.00 C ATOM 1199 CD PRO A 84 107.897 9.139 -5.365 1.00 1.00 C ATOM 0 HA PRO A 84 110.394 7.240 -5.665 1.00 1.00 H new ATOM 0 HB2 PRO A 84 109.939 9.120 -3.320 1.00 1.00 H new ATOM 0 HB3 PRO A 84 111.138 9.254 -4.590 1.00 1.00 H new ATOM 0 HG2 PRO A 84 108.999 10.843 -4.599 1.00 1.00 H new ATOM 0 HG3 PRO A 84 109.631 10.210 -6.106 1.00 1.00 H new ATOM 0 HD2 PRO A 84 107.165 9.356 -4.587 1.00 1.00 H new ATOM 0 HD3 PRO A 84 107.431 9.386 -6.319 1.00 1.00 H new ATOM 1207 N GLY A 85 108.974 6.690 -2.785 1.00 1.00 N ATOM 1208 CA GLY A 85 109.045 5.803 -1.642 1.00 1.00 C ATOM 1209 C GLY A 85 108.994 4.353 -2.089 1.00 1.00 C ATOM 1210 O GLY A 85 109.794 3.517 -1.669 1.00 1.00 O ATOM 0 H GLY A 85 108.183 7.334 -2.788 1.00 1.00 H new ATOM 0 HA2 GLY A 85 109.966 5.987 -1.089 1.00 1.00 H new ATOM 0 HA3 GLY A 85 108.218 6.009 -0.962 1.00 1.00 H new ATOM 1214 N TRP A 86 108.032 4.084 -2.949 1.00 1.00 N ATOM 1215 CA TRP A 86 107.820 2.752 -3.495 1.00 1.00 C ATOM 1216 C TRP A 86 109.002 2.319 -4.373 1.00 1.00 C ATOM 1217 O TRP A 86 109.351 1.146 -4.419 1.00 1.00 O ATOM 1218 CB TRP A 86 106.535 2.776 -4.335 1.00 1.00 C ATOM 1219 CG TRP A 86 105.306 2.526 -3.507 1.00 1.00 C ATOM 1220 CD1 TRP A 86 104.820 3.309 -2.520 1.00 1.00 C ATOM 1221 CD2 TRP A 86 104.369 1.437 -3.636 1.00 1.00 C ATOM 1222 NE1 TRP A 86 103.669 2.745 -2.016 1.00 1.00 N ATOM 1223 CE2 TRP A 86 103.347 1.591 -2.680 1.00 1.00 C ATOM 1224 CE3 TRP A 86 104.320 0.338 -4.479 1.00 1.00 C ATOM 1225 CZ2 TRP A 86 102.312 0.676 -2.572 1.00 1.00 C ATOM 1226 CZ3 TRP A 86 103.283 -0.575 -4.382 1.00 1.00 C ATOM 1227 CH2 TRP A 86 102.273 -0.413 -3.429 1.00 1.00 C ATOM 0 H TRP A 86 107.372 4.782 -3.292 1.00 1.00 H new ATOM 0 HA TRP A 86 107.733 2.038 -2.676 1.00 1.00 H new ATOM 0 HB2 TRP A 86 106.446 3.743 -4.830 1.00 1.00 H new ATOM 0 HB3 TRP A 86 106.602 2.021 -5.119 1.00 1.00 H new ATOM 0 HD1 TRP A 86 105.264 4.233 -2.179 1.00 1.00 H new ATOM 0 HE1 TRP A 86 103.126 3.137 -1.247 1.00 1.00 H new ATOM 0 HE3 TRP A 86 105.096 0.193 -5.216 1.00 1.00 H new ATOM 0 HZ2 TRP A 86 101.542 0.810 -1.826 1.00 1.00 H new ATOM 0 HZ3 TRP A 86 103.254 -1.423 -5.051 1.00 1.00 H new ATOM 0 HH2 TRP A 86 101.469 -1.131 -3.361 1.00 1.00 H new ATOM 1238 N THR A 87 109.594 3.265 -5.092 1.00 1.00 N ATOM 1239 CA THR A 87 110.697 2.946 -5.988 1.00 1.00 C ATOM 1240 C THR A 87 111.782 2.143 -5.280 1.00 1.00 C ATOM 1241 O THR A 87 112.173 1.072 -5.743 1.00 1.00 O ATOM 1242 CB THR A 87 111.304 4.252 -6.514 1.00 1.00 C ATOM 1243 OG1 THR A 87 110.271 5.069 -7.044 1.00 1.00 O ATOM 1244 CG2 THR A 87 112.334 3.959 -7.607 1.00 1.00 C ATOM 0 H THR A 87 109.331 4.250 -5.073 1.00 1.00 H new ATOM 0 HA THR A 87 110.307 2.341 -6.807 1.00 1.00 H new ATOM 0 HB THR A 87 111.801 4.768 -5.693 1.00 1.00 H new ATOM 0 HG1 THR A 87 109.680 5.360 -6.319 1.00 1.00 H new ATOM 0 HG21 THR A 87 112.756 4.896 -7.970 1.00 1.00 H new ATOM 0 HG22 THR A 87 113.130 3.337 -7.199 1.00 1.00 H new ATOM 0 HG23 THR A 87 111.851 3.435 -8.432 1.00 1.00 H new ATOM 1252 N GLU A 88 112.275 2.666 -4.174 1.00 1.00 N ATOM 1253 CA GLU A 88 113.328 1.991 -3.426 1.00 1.00 C ATOM 1254 C GLU A 88 112.821 0.744 -2.699 1.00 1.00 C ATOM 1255 O GLU A 88 113.515 -0.266 -2.632 1.00 1.00 O ATOM 1256 CB GLU A 88 113.944 2.961 -2.416 1.00 1.00 C ATOM 1257 CG GLU A 88 115.169 2.311 -1.764 1.00 1.00 C ATOM 1258 CD GLU A 88 115.813 3.280 -0.779 1.00 1.00 C ATOM 1259 OE1 GLU A 88 115.438 4.440 -0.786 1.00 1.00 O ATOM 1260 OE2 GLU A 88 116.680 2.848 -0.038 1.00 1.00 O ATOM 0 H GLU A 88 111.968 3.552 -3.772 1.00 1.00 H new ATOM 0 HA GLU A 88 114.080 1.665 -4.144 1.00 1.00 H new ATOM 0 HB2 GLU A 88 114.232 3.887 -2.914 1.00 1.00 H new ATOM 0 HB3 GLU A 88 113.210 3.224 -1.654 1.00 1.00 H new ATOM 0 HG2 GLU A 88 114.874 1.397 -1.248 1.00 1.00 H new ATOM 0 HG3 GLU A 88 115.890 2.026 -2.530 1.00 1.00 H new ATOM 1267 N ALA A 89 111.634 0.838 -2.117 1.00 1.00 N ATOM 1268 CA ALA A 89 111.074 -0.272 -1.345 1.00 1.00 C ATOM 1269 C ALA A 89 110.899 -1.569 -2.147 1.00 1.00 C ATOM 1270 O ALA A 89 111.263 -2.644 -1.670 1.00 1.00 O ATOM 1271 CB ALA A 89 109.720 0.135 -0.781 1.00 1.00 C ATOM 0 H ALA A 89 111.039 1.665 -2.162 1.00 1.00 H new ATOM 0 HA ALA A 89 111.795 -0.482 -0.555 1.00 1.00 H new ATOM 0 HB1 ALA A 89 109.302 -0.691 -0.206 1.00 1.00 H new ATOM 0 HB2 ALA A 89 109.842 1.003 -0.133 1.00 1.00 H new ATOM 0 HB3 ALA A 89 109.045 0.385 -1.600 1.00 1.00 H new ATOM 1277 N LEU A 90 110.309 -1.483 -3.336 1.00 1.00 N ATOM 1278 CA LEU A 90 110.066 -2.685 -4.136 1.00 1.00 C ATOM 1279 C LEU A 90 111.379 -3.397 -4.411 1.00 1.00 C ATOM 1280 O LEU A 90 111.467 -4.624 -4.348 1.00 1.00 O ATOM 1281 CB LEU A 90 109.456 -2.299 -5.480 1.00 1.00 C ATOM 1282 CG LEU A 90 108.134 -1.561 -5.275 1.00 1.00 C ATOM 1283 CD1 LEU A 90 107.796 -0.826 -6.563 1.00 1.00 C ATOM 1284 CD2 LEU A 90 107.019 -2.541 -4.942 1.00 1.00 C ATOM 0 H LEU A 90 109.994 -0.612 -3.763 1.00 1.00 H new ATOM 0 HA LEU A 90 109.389 -3.335 -3.582 1.00 1.00 H new ATOM 0 HB2 LEU A 90 110.150 -1.667 -6.033 1.00 1.00 H new ATOM 0 HB3 LEU A 90 109.291 -3.193 -6.081 1.00 1.00 H new ATOM 0 HG LEU A 90 108.232 -0.860 -4.446 1.00 1.00 H new ATOM 0 HD11 LEU A 90 106.854 -0.291 -6.440 1.00 1.00 H new ATOM 0 HD12 LEU A 90 108.589 -0.116 -6.796 1.00 1.00 H new ATOM 0 HD13 LEU A 90 107.702 -1.544 -7.378 1.00 1.00 H new ATOM 0 HD21 LEU A 90 106.086 -1.996 -4.800 1.00 1.00 H new ATOM 0 HD22 LEU A 90 106.903 -3.252 -5.760 1.00 1.00 H new ATOM 0 HD23 LEU A 90 107.268 -3.079 -4.027 1.00 1.00 H new ATOM 1296 N GLN A 91 112.391 -2.609 -4.730 1.00 1.00 N ATOM 1297 CA GLN A 91 113.701 -3.142 -5.035 1.00 1.00 C ATOM 1298 C GLN A 91 114.281 -3.846 -3.819 1.00 1.00 C ATOM 1299 O GLN A 91 115.145 -4.714 -3.944 1.00 1.00 O ATOM 1300 CB GLN A 91 114.619 -1.999 -5.450 1.00 1.00 C ATOM 1301 CG GLN A 91 114.023 -1.310 -6.673 1.00 1.00 C ATOM 1302 CD GLN A 91 114.858 -0.093 -7.056 1.00 1.00 C ATOM 1303 OE1 GLN A 91 116.081 -0.186 -7.156 1.00 1.00 O ATOM 1304 NE2 GLN A 91 114.267 1.048 -7.278 1.00 1.00 N ATOM 0 H GLN A 91 112.326 -1.592 -4.784 1.00 1.00 H new ATOM 0 HA GLN A 91 113.614 -3.863 -5.848 1.00 1.00 H new ATOM 0 HB2 GLN A 91 114.729 -1.287 -4.632 1.00 1.00 H new ATOM 0 HB3 GLN A 91 115.615 -2.379 -5.678 1.00 1.00 H new ATOM 0 HG2 GLN A 91 113.982 -2.009 -7.508 1.00 1.00 H new ATOM 0 HG3 GLN A 91 112.998 -1.004 -6.463 1.00 1.00 H new ATOM 0 HE21 GLN A 91 113.253 1.122 -7.194 1.00 1.00 H new ATOM 0 HE22 GLN A 91 114.819 1.866 -7.535 1.00 1.00 H new ATOM 1313 N LEU A 92 113.804 -3.457 -2.640 1.00 1.00 N ATOM 1314 CA LEU A 92 114.282 -4.050 -1.392 1.00 1.00 C ATOM 1315 C LEU A 92 113.307 -5.081 -0.866 1.00 1.00 C ATOM 1316 O LEU A 92 113.641 -5.819 0.049 1.00 1.00 O ATOM 1317 CB LEU A 92 114.454 -2.969 -0.324 1.00 1.00 C ATOM 1318 CG LEU A 92 115.490 -1.928 -0.757 1.00 1.00 C ATOM 1319 CD1 LEU A 92 115.512 -0.810 0.269 1.00 1.00 C ATOM 1320 CD2 LEU A 92 116.876 -2.559 -0.863 1.00 1.00 C ATOM 0 H LEU A 92 113.091 -2.738 -2.521 1.00 1.00 H new ATOM 0 HA LEU A 92 115.237 -4.530 -1.606 1.00 1.00 H new ATOM 0 HB2 LEU A 92 113.497 -2.480 -0.139 1.00 1.00 H new ATOM 0 HB3 LEU A 92 114.764 -3.427 0.615 1.00 1.00 H new ATOM 0 HG LEU A 92 115.219 -1.535 -1.737 1.00 1.00 H new ATOM 0 HD11 LEU A 92 116.246 -0.060 -0.026 1.00 1.00 H new ATOM 0 HD12 LEU A 92 114.526 -0.350 0.327 1.00 1.00 H new ATOM 0 HD13 LEU A 92 115.780 -1.216 1.244 1.00 1.00 H new ATOM 0 HD21 LEU A 92 117.597 -1.803 -1.172 1.00 1.00 H new ATOM 0 HD22 LEU A 92 117.167 -2.963 0.107 1.00 1.00 H new ATOM 0 HD23 LEU A 92 116.855 -3.362 -1.599 1.00 1.00 H new ATOM 1332 N MET A 93 112.102 -5.115 -1.425 1.00 1.00 N ATOM 1333 CA MET A 93 111.085 -6.064 -0.966 1.00 1.00 C ATOM 1334 C MET A 93 111.152 -7.400 -1.742 1.00 1.00 C ATOM 1335 O MET A 93 110.745 -7.447 -2.903 1.00 1.00 O ATOM 1336 CB MET A 93 109.699 -5.447 -1.164 1.00 1.00 C ATOM 1337 CG MET A 93 108.634 -6.420 -0.653 1.00 1.00 C ATOM 1338 SD MET A 93 107.081 -5.536 -0.352 1.00 1.00 S ATOM 1339 CE MET A 93 106.557 -5.315 -2.070 1.00 1.00 C ATOM 0 H MET A 93 111.805 -4.506 -2.187 1.00 1.00 H new ATOM 0 HA MET A 93 111.273 -6.273 0.087 1.00 1.00 H new ATOM 0 HB2 MET A 93 109.630 -4.500 -0.628 1.00 1.00 H new ATOM 0 HB3 MET A 93 109.533 -5.229 -2.219 1.00 1.00 H new ATOM 0 HG2 MET A 93 108.475 -7.214 -1.383 1.00 1.00 H new ATOM 0 HG3 MET A 93 108.975 -6.896 0.266 1.00 1.00 H new ATOM 0 HE1 MET A 93 106.498 -4.251 -2.298 1.00 1.00 H new ATOM 0 HE2 MET A 93 107.279 -5.790 -2.735 1.00 1.00 H new ATOM 0 HE3 MET A 93 105.578 -5.771 -2.213 1.00 1.00 H new ATOM 1349 N PRO A 94 111.623 -8.491 -1.142 1.00 1.00 N ATOM 1350 CA PRO A 94 111.685 -9.824 -1.823 1.00 1.00 C ATOM 1351 C PRO A 94 110.303 -10.398 -2.103 1.00 1.00 C ATOM 1352 O PRO A 94 109.357 -10.169 -1.351 1.00 1.00 O ATOM 1353 CB PRO A 94 112.475 -10.716 -0.846 1.00 1.00 C ATOM 1354 CG PRO A 94 113.090 -9.784 0.141 1.00 1.00 C ATOM 1355 CD PRO A 94 112.148 -8.605 0.225 1.00 1.00 C ATOM 0 HA PRO A 94 112.158 -9.752 -2.803 1.00 1.00 H new ATOM 0 HB2 PRO A 94 111.819 -11.433 -0.352 1.00 1.00 H new ATOM 0 HB3 PRO A 94 113.238 -11.291 -1.370 1.00 1.00 H new ATOM 0 HG2 PRO A 94 113.207 -10.263 1.113 1.00 1.00 H new ATOM 0 HG3 PRO A 94 114.083 -9.471 -0.181 1.00 1.00 H new ATOM 0 HD2 PRO A 94 111.351 -8.778 0.948 1.00 1.00 H new ATOM 0 HD3 PRO A 94 112.667 -7.697 0.533 1.00 1.00 H new ATOM 1363 N ALA A 95 110.199 -11.145 -3.193 1.00 1.00 N ATOM 1364 CA ALA A 95 108.929 -11.743 -3.563 1.00 1.00 C ATOM 1365 C ALA A 95 108.500 -12.769 -2.545 1.00 1.00 C ATOM 1366 O ALA A 95 109.300 -13.571 -2.062 1.00 1.00 O ATOM 1367 CB ALA A 95 108.998 -12.361 -4.951 1.00 1.00 C ATOM 0 H ALA A 95 110.970 -11.349 -3.829 1.00 1.00 H new ATOM 0 HA ALA A 95 108.182 -10.950 -3.584 1.00 1.00 H new ATOM 0 HB1 ALA A 95 108.033 -12.801 -5.202 1.00 1.00 H new ATOM 0 HB2 ALA A 95 109.246 -11.590 -5.681 1.00 1.00 H new ATOM 0 HB3 ALA A 95 109.765 -13.135 -4.967 1.00 1.00 H new ATOM 1373 N GLY A 96 107.224 -12.702 -2.198 1.00 1.00 N ATOM 1374 CA GLY A 96 106.658 -13.579 -1.203 1.00 1.00 C ATOM 1375 C GLY A 96 106.648 -12.837 0.115 1.00 1.00 C ATOM 1376 O GLY A 96 105.923 -13.191 1.046 1.00 1.00 O ATOM 0 H GLY A 96 106.560 -12.040 -2.600 1.00 1.00 H new ATOM 0 HA2 GLY A 96 105.647 -13.873 -1.484 1.00 1.00 H new ATOM 0 HA3 GLY A 96 107.245 -14.494 -1.122 1.00 1.00 H new ATOM 1380 N SER A 97 107.465 -11.782 0.174 1.00 1.00 N ATOM 1381 CA SER A 97 107.558 -10.960 1.365 1.00 1.00 C ATOM 1382 C SER A 97 106.556 -9.819 1.309 1.00 1.00 C ATOM 1383 O SER A 97 106.438 -9.125 0.300 1.00 1.00 O ATOM 1384 CB SER A 97 108.974 -10.389 1.485 1.00 1.00 C ATOM 1385 OG SER A 97 109.037 -9.161 0.774 1.00 1.00 O ATOM 0 H SER A 97 108.068 -11.484 -0.593 1.00 1.00 H new ATOM 0 HA SER A 97 107.334 -11.580 2.233 1.00 1.00 H new ATOM 0 HB2 SER A 97 109.229 -10.231 2.533 1.00 1.00 H new ATOM 0 HB3 SER A 97 109.700 -11.095 1.083 1.00 1.00 H new ATOM 0 HG SER A 97 108.981 -9.337 -0.188 1.00 1.00 H new ATOM 1391 N THR A 98 105.847 -9.623 2.416 1.00 1.00 N ATOM 1392 CA THR A 98 104.861 -8.555 2.522 1.00 1.00 C ATOM 1393 C THR A 98 105.380 -7.482 3.452 1.00 1.00 C ATOM 1394 O THR A 98 105.602 -7.739 4.633 1.00 1.00 O ATOM 1395 CB THR A 98 103.548 -9.099 3.069 1.00 1.00 C ATOM 1396 OG1 THR A 98 103.068 -10.131 2.218 1.00 1.00 O ATOM 1397 CG2 THR A 98 102.529 -7.972 3.133 1.00 1.00 C ATOM 0 H THR A 98 105.938 -10.194 3.256 1.00 1.00 H new ATOM 0 HA THR A 98 104.688 -8.137 1.530 1.00 1.00 H new ATOM 0 HB THR A 98 103.707 -9.505 4.068 1.00 1.00 H new ATOM 0 HG1 THR A 98 102.224 -10.481 2.572 1.00 1.00 H new ATOM 0 HG21 THR A 98 101.587 -8.355 3.524 1.00 1.00 H new ATOM 0 HG22 THR A 98 102.899 -7.183 3.788 1.00 1.00 H new ATOM 0 HG23 THR A 98 102.370 -7.568 2.133 1.00 1.00 H new ATOM 1405 N TRP A 99 105.612 -6.281 2.909 1.00 1.00 N ATOM 1406 CA TRP A 99 106.141 -5.169 3.704 1.00 1.00 C ATOM 1407 C TRP A 99 105.131 -4.033 3.797 1.00 1.00 C ATOM 1408 O TRP A 99 104.161 -3.965 3.043 1.00 1.00 O ATOM 1409 CB TRP A 99 107.403 -4.568 3.056 1.00 1.00 C ATOM 1410 CG TRP A 99 108.594 -5.477 3.127 1.00 1.00 C ATOM 1411 CD1 TRP A 99 108.605 -6.785 3.487 1.00 1.00 C ATOM 1412 CD2 TRP A 99 109.972 -5.131 2.834 1.00 1.00 C ATOM 1413 NE1 TRP A 99 109.895 -7.264 3.412 1.00 1.00 N ATOM 1414 CE2 TRP A 99 110.781 -6.277 3.018 1.00 1.00 C ATOM 1415 CE3 TRP A 99 110.590 -3.935 2.422 1.00 1.00 C ATOM 1416 CZ2 TRP A 99 112.158 -6.239 2.802 1.00 1.00 C ATOM 1417 CZ3 TRP A 99 111.976 -3.891 2.208 1.00 1.00 C ATOM 1418 CH2 TRP A 99 112.759 -5.042 2.396 1.00 1.00 C ATOM 0 H TRP A 99 105.443 -6.056 1.929 1.00 1.00 H new ATOM 0 HA TRP A 99 106.365 -5.581 4.688 1.00 1.00 H new ATOM 0 HB2 TRP A 99 107.192 -4.337 2.012 1.00 1.00 H new ATOM 0 HB3 TRP A 99 107.643 -3.626 3.549 1.00 1.00 H new ATOM 0 HD1 TRP A 99 107.740 -7.359 3.785 1.00 1.00 H new ATOM 0 HE1 TRP A 99 110.163 -8.226 3.621 1.00 1.00 H new ATOM 0 HE3 TRP A 99 109.994 -3.047 2.270 1.00 1.00 H new ATOM 0 HZ2 TRP A 99 112.756 -7.126 2.947 1.00 1.00 H new ATOM 0 HZ3 TRP A 99 112.443 -2.968 1.897 1.00 1.00 H new ATOM 0 HH2 TRP A 99 113.825 -5.003 2.227 1.00 1.00 H new ATOM 1429 N GLU A 100 105.441 -3.104 4.691 1.00 1.00 N ATOM 1430 CA GLU A 100 104.658 -1.893 4.880 1.00 1.00 C ATOM 1431 C GLU A 100 105.630 -0.737 4.796 1.00 1.00 C ATOM 1432 O GLU A 100 106.657 -0.768 5.467 1.00 1.00 O ATOM 1433 CB GLU A 100 103.955 -1.881 6.253 1.00 1.00 C ATOM 1434 CG GLU A 100 102.540 -2.434 6.118 1.00 1.00 C ATOM 1435 CD GLU A 100 101.836 -2.427 7.472 1.00 1.00 C ATOM 1436 OE1 GLU A 100 100.705 -2.881 7.536 1.00 1.00 O ATOM 1437 OE2 GLU A 100 102.442 -1.970 8.427 1.00 1.00 O ATOM 0 H GLU A 100 106.249 -3.171 5.310 1.00 1.00 H new ATOM 0 HA GLU A 100 103.878 -1.828 4.122 1.00 1.00 H new ATOM 0 HB2 GLU A 100 104.522 -2.479 6.966 1.00 1.00 H new ATOM 0 HB3 GLU A 100 103.921 -0.864 6.645 1.00 1.00 H new ATOM 0 HG2 GLU A 100 101.975 -1.835 5.404 1.00 1.00 H new ATOM 0 HG3 GLU A 100 102.575 -3.450 5.724 1.00 1.00 H new ATOM 1444 N ILE A 101 105.326 0.278 3.983 1.00 1.00 N ATOM 1445 CA ILE A 101 106.220 1.417 3.861 1.00 1.00 C ATOM 1446 C ILE A 101 105.458 2.692 4.123 1.00 1.00 C ATOM 1447 O ILE A 101 104.317 2.864 3.697 1.00 1.00 O ATOM 1448 CB ILE A 101 106.948 1.410 2.500 1.00 1.00 C ATOM 1449 CG1 ILE A 101 106.137 2.075 1.380 1.00 1.00 C ATOM 1450 CG2 ILE A 101 107.230 -0.045 2.129 1.00 1.00 C ATOM 1451 CD1 ILE A 101 106.999 2.123 0.126 1.00 1.00 C ATOM 0 H ILE A 101 104.482 0.329 3.412 1.00 1.00 H new ATOM 0 HA ILE A 101 107.004 1.348 4.615 1.00 1.00 H new ATOM 0 HB ILE A 101 107.866 1.989 2.602 1.00 1.00 H new ATOM 0 HG12 ILE A 101 105.222 1.514 1.190 1.00 1.00 H new ATOM 0 HG13 ILE A 101 105.839 3.081 1.674 1.00 1.00 H new ATOM 0 HG21 ILE A 101 107.745 -0.082 1.169 1.00 1.00 H new ATOM 0 HG22 ILE A 101 107.857 -0.501 2.895 1.00 1.00 H new ATOM 0 HG23 ILE A 101 106.289 -0.591 2.057 1.00 1.00 H new ATOM 0 HD11 ILE A 101 106.439 2.593 -0.683 1.00 1.00 H new ATOM 0 HD12 ILE A 101 107.901 2.701 0.327 1.00 1.00 H new ATOM 0 HD13 ILE A 101 107.275 1.109 -0.165 1.00 1.00 H new ATOM 1458 N TYR A 102 106.106 3.569 4.869 1.00 1.00 N ATOM 1459 CA TYR A 102 105.527 4.830 5.262 1.00 1.00 C ATOM 1460 C TYR A 102 106.267 5.889 4.473 1.00 1.00 C ATOM 1461 O TYR A 102 107.438 6.169 4.724 1.00 1.00 O ATOM 1462 CB TYR A 102 105.730 5.035 6.773 1.00 1.00 C ATOM 1463 CG TYR A 102 105.205 3.837 7.575 1.00 1.00 C ATOM 1464 CD1 TYR A 102 105.625 2.524 7.287 1.00 1.00 C ATOM 1465 CD2 TYR A 102 104.298 4.043 8.626 1.00 1.00 C ATOM 1466 CE1 TYR A 102 105.146 1.449 8.028 1.00 1.00 C ATOM 1467 CE2 TYR A 102 103.820 2.958 9.371 1.00 1.00 C ATOM 1468 CZ TYR A 102 104.244 1.660 9.072 1.00 1.00 C ATOM 1469 OH TYR A 102 103.771 0.591 9.806 1.00 1.00 O ATOM 0 H TYR A 102 107.053 3.421 5.218 1.00 1.00 H new ATOM 0 HA TYR A 102 104.456 4.874 5.064 1.00 1.00 H new ATOM 0 HB2 TYR A 102 106.790 5.179 6.983 1.00 1.00 H new ATOM 0 HB3 TYR A 102 105.215 5.942 7.091 1.00 1.00 H new ATOM 0 HD1 TYR A 102 106.325 2.350 6.483 1.00 1.00 H new ATOM 0 HD2 TYR A 102 103.967 5.044 8.861 1.00 1.00 H new ATOM 0 HE1 TYR A 102 105.473 0.447 7.795 1.00 1.00 H new ATOM 0 HE2 TYR A 102 103.122 3.124 10.178 1.00 1.00 H new ATOM 0 HH TYR A 102 103.433 -0.099 9.198 1.00 1.00 H new ATOM 1479 N VAL A 103 105.601 6.391 3.443 1.00 1.00 N ATOM 1480 CA VAL A 103 106.221 7.327 2.522 1.00 1.00 C ATOM 1481 C VAL A 103 106.066 8.799 2.891 1.00 1.00 C ATOM 1482 O VAL A 103 104.961 9.336 2.837 1.00 1.00 O ATOM 1483 CB VAL A 103 105.644 7.145 1.123 1.00 1.00 C ATOM 1484 CG1 VAL A 103 106.539 7.870 0.119 1.00 1.00 C ATOM 1485 CG2 VAL A 103 105.566 5.660 0.773 1.00 1.00 C ATOM 0 H VAL A 103 104.631 6.164 3.226 1.00 1.00 H new ATOM 0 HA VAL A 103 107.284 7.091 2.571 1.00 1.00 H new ATOM 0 HB VAL A 103 104.637 7.562 1.088 1.00 1.00 H new ATOM 0 HG11 VAL A 103 106.134 7.746 -0.885 1.00 1.00 H new ATOM 0 HG12 VAL A 103 106.578 8.931 0.366 1.00 1.00 H new ATOM 0 HG13 VAL A 103 107.545 7.451 0.159 1.00 1.00 H new ATOM 0 HG21 VAL A 103 105.152 5.544 -0.229 1.00 1.00 H new ATOM 0 HG22 VAL A 103 106.565 5.226 0.806 1.00 1.00 H new ATOM 0 HG23 VAL A 103 104.925 5.150 1.492 1.00 1.00 H new ATOM 1489 N PRO A 104 107.153 9.480 3.185 1.00 1.00 N ATOM 1490 CA PRO A 104 107.103 10.933 3.473 1.00 1.00 C ATOM 1491 C PRO A 104 106.347 11.658 2.360 1.00 1.00 C ATOM 1492 O PRO A 104 106.411 11.253 1.200 1.00 1.00 O ATOM 1493 CB PRO A 104 108.583 11.354 3.491 1.00 1.00 C ATOM 1494 CG PRO A 104 109.365 10.106 3.782 1.00 1.00 C ATOM 1495 CD PRO A 104 108.521 8.936 3.301 1.00 1.00 C ATOM 0 HA PRO A 104 106.590 11.171 4.405 1.00 1.00 H new ATOM 0 HB2 PRO A 104 108.878 11.785 2.534 1.00 1.00 H new ATOM 0 HB3 PRO A 104 108.763 12.114 4.252 1.00 1.00 H new ATOM 0 HG2 PRO A 104 110.327 10.125 3.270 1.00 1.00 H new ATOM 0 HG3 PRO A 104 109.573 10.020 4.849 1.00 1.00 H new ATOM 0 HD2 PRO A 104 108.879 8.558 2.343 1.00 1.00 H new ATOM 0 HD3 PRO A 104 108.558 8.105 4.006 1.00 1.00 H new ATOM 1503 N SER A 105 105.617 12.706 2.712 1.00 1.00 N ATOM 1504 CA SER A 105 104.848 13.431 1.714 1.00 1.00 C ATOM 1505 C SER A 105 105.723 13.824 0.527 1.00 1.00 C ATOM 1506 O SER A 105 105.269 13.810 -0.617 1.00 1.00 O ATOM 1507 CB SER A 105 104.220 14.680 2.329 1.00 1.00 C ATOM 1508 OG SER A 105 105.250 15.587 2.709 1.00 1.00 O ATOM 0 H SER A 105 105.541 13.068 3.663 1.00 1.00 H new ATOM 0 HA SER A 105 104.057 12.771 1.358 1.00 1.00 H new ATOM 0 HB2 SER A 105 103.549 15.154 1.613 1.00 1.00 H new ATOM 0 HB3 SER A 105 103.620 14.409 3.198 1.00 1.00 H new ATOM 0 HG SER A 105 104.876 16.488 2.798 1.00 1.00 H new ATOM 1514 N GLY A 106 106.977 14.166 0.798 1.00 1.00 N ATOM 1515 CA GLY A 106 107.895 14.547 -0.269 1.00 1.00 C ATOM 1516 C GLY A 106 108.172 13.370 -1.191 1.00 1.00 C ATOM 1517 O GLY A 106 108.397 13.542 -2.389 1.00 1.00 O ATOM 0 H GLY A 106 107.378 14.188 1.736 1.00 1.00 H new ATOM 0 HA2 GLY A 106 107.471 15.371 -0.842 1.00 1.00 H new ATOM 0 HA3 GLY A 106 108.830 14.906 0.161 1.00 1.00 H new ATOM 1521 N LEU A 107 108.166 12.171 -0.618 1.00 1.00 N ATOM 1522 CA LEU A 107 108.431 10.955 -1.386 1.00 1.00 C ATOM 1523 C LEU A 107 107.133 10.252 -1.760 1.00 1.00 C ATOM 1524 O LEU A 107 107.171 9.166 -2.328 1.00 1.00 O ATOM 1525 CB LEU A 107 109.283 9.974 -0.562 1.00 1.00 C ATOM 1526 CG LEU A 107 110.611 10.620 -0.126 1.00 1.00 C ATOM 1527 CD1 LEU A 107 111.491 9.556 0.532 1.00 1.00 C ATOM 1528 CD2 LEU A 107 111.352 11.215 -1.331 1.00 1.00 C ATOM 0 H LEU A 107 107.981 12.013 0.373 1.00 1.00 H new ATOM 0 HA LEU A 107 108.963 11.252 -2.290 1.00 1.00 H new ATOM 0 HB2 LEU A 107 108.725 9.654 0.318 1.00 1.00 H new ATOM 0 HB3 LEU A 107 109.487 9.081 -1.152 1.00 1.00 H new ATOM 0 HG LEU A 107 110.395 11.423 0.579 1.00 1.00 H new ATOM 0 HD11 LEU A 107 112.434 10.006 0.844 1.00 1.00 H new ATOM 0 HD12 LEU A 107 110.978 9.147 1.403 1.00 1.00 H new ATOM 0 HD13 LEU A 107 111.689 8.756 -0.181 1.00 1.00 H new ATOM 0 HD21 LEU A 107 112.287 11.665 -0.997 1.00 1.00 H new ATOM 0 HD22 LEU A 107 111.566 10.426 -2.052 1.00 1.00 H new ATOM 0 HD23 LEU A 107 110.730 11.977 -1.801 1.00 1.00 H new ATOM 1540 N ALA A 108 105.981 10.835 -1.398 1.00 1.00 N ATOM 1541 CA ALA A 108 104.694 10.203 -1.677 1.00 1.00 C ATOM 1542 C ALA A 108 103.920 10.931 -2.768 1.00 1.00 C ATOM 1543 O ALA A 108 104.209 10.763 -3.940 1.00 1.00 O ATOM 1544 CB ALA A 108 103.831 10.154 -0.422 1.00 1.00 C ATOM 0 H ALA A 108 105.919 11.732 -0.917 1.00 1.00 H new ATOM 0 HA ALA A 108 104.917 9.193 -2.020 1.00 1.00 H new ATOM 0 HB1 ALA A 108 102.878 9.679 -0.654 1.00 1.00 H new ATOM 0 HB2 ALA A 108 104.344 9.580 0.350 1.00 1.00 H new ATOM 0 HB3 ALA A 108 103.653 11.168 -0.063 1.00 1.00 H new ATOM 1550 N TYR A 109 102.895 11.703 -2.379 1.00 1.00 N ATOM 1551 CA TYR A 109 102.049 12.397 -3.350 1.00 1.00 C ATOM 1552 C TYR A 109 102.341 13.889 -3.451 1.00 1.00 C ATOM 1553 O TYR A 109 101.684 14.592 -4.218 1.00 1.00 O ATOM 1554 CB TYR A 109 100.575 12.127 -3.016 1.00 1.00 C ATOM 1555 CG TYR A 109 100.238 10.789 -3.611 1.00 1.00 C ATOM 1556 CD1 TYR A 109 100.220 9.653 -2.815 1.00 1.00 C ATOM 1557 CD2 TYR A 109 100.031 10.686 -4.986 1.00 1.00 C ATOM 1558 CE1 TYR A 109 100.005 8.413 -3.384 1.00 1.00 C ATOM 1559 CE2 TYR A 109 99.802 9.450 -5.559 1.00 1.00 C ATOM 1560 CZ TYR A 109 99.798 8.300 -4.760 1.00 1.00 C ATOM 1561 OH TYR A 109 99.614 7.058 -5.327 1.00 1.00 O ATOM 0 H TYR A 109 102.636 11.860 -1.405 1.00 1.00 H new ATOM 0 HA TYR A 109 102.279 11.998 -4.338 1.00 1.00 H new ATOM 0 HB2 TYR A 109 100.417 12.122 -1.938 1.00 1.00 H new ATOM 0 HB3 TYR A 109 99.935 12.907 -3.429 1.00 1.00 H new ATOM 0 HD1 TYR A 109 100.374 9.738 -1.749 1.00 1.00 H new ATOM 0 HD2 TYR A 109 100.050 11.572 -5.603 1.00 1.00 H new ATOM 0 HE1 TYR A 109 99.997 7.529 -2.763 1.00 1.00 H new ATOM 0 HE2 TYR A 109 99.626 9.371 -6.622 1.00 1.00 H new ATOM 0 HH TYR A 109 99.482 7.156 -6.293 1.00 1.00 H new ATOM 1571 N GLY A 110 103.358 14.369 -2.729 1.00 1.00 N ATOM 1572 CA GLY A 110 103.741 15.785 -2.822 1.00 1.00 C ATOM 1573 C GLY A 110 103.483 16.578 -1.543 1.00 1.00 C ATOM 1574 O GLY A 110 102.797 16.117 -0.631 1.00 1.00 O ATOM 0 H GLY A 110 103.922 13.813 -2.086 1.00 1.00 H new ATOM 0 HA2 GLY A 110 104.800 15.850 -3.071 1.00 1.00 H new ATOM 0 HA3 GLY A 110 103.192 16.247 -3.642 1.00 1.00 H new ATOM 1578 N PRO A 111 104.031 17.773 -1.487 1.00 1.00 N ATOM 1579 CA PRO A 111 103.888 18.705 -0.327 1.00 1.00 C ATOM 1580 C PRO A 111 102.518 19.376 -0.306 1.00 1.00 C ATOM 1581 O PRO A 111 102.097 19.918 0.711 1.00 1.00 O ATOM 1582 CB PRO A 111 104.994 19.726 -0.575 1.00 1.00 C ATOM 1583 CG PRO A 111 105.092 19.802 -2.058 1.00 1.00 C ATOM 1584 CD PRO A 111 104.856 18.379 -2.552 1.00 1.00 C ATOM 0 HA PRO A 111 103.968 18.200 0.635 1.00 1.00 H new ATOM 0 HB2 PRO A 111 104.746 20.695 -0.142 1.00 1.00 H new ATOM 0 HB3 PRO A 111 105.937 19.409 -0.129 1.00 1.00 H new ATOM 0 HG2 PRO A 111 104.350 20.488 -2.466 1.00 1.00 H new ATOM 0 HG3 PRO A 111 106.070 20.169 -2.369 1.00 1.00 H new ATOM 0 HD2 PRO A 111 104.341 18.368 -3.513 1.00 1.00 H new ATOM 0 HD3 PRO A 111 105.794 17.841 -2.687 1.00 1.00 H new ATOM 1592 N ARG A 112 101.837 19.339 -1.447 1.00 1.00 N ATOM 1593 CA ARG A 112 100.511 19.943 -1.578 1.00 1.00 C ATOM 1594 C ARG A 112 99.442 18.863 -1.560 1.00 1.00 C ATOM 1595 O ARG A 112 99.750 17.676 -1.643 1.00 1.00 O ATOM 1596 CB ARG A 112 100.410 20.714 -2.898 1.00 1.00 C ATOM 1597 CG ARG A 112 101.236 22.001 -2.826 1.00 1.00 C ATOM 1598 CD ARG A 112 101.127 22.731 -4.166 1.00 1.00 C ATOM 1599 NE ARG A 112 101.843 24.001 -4.123 1.00 1.00 N ATOM 1600 CZ ARG A 112 101.872 24.804 -5.182 1.00 1.00 C ATOM 1601 NH1 ARG A 112 101.258 24.452 -6.278 1.00 1.00 N ATOM 1602 NH2 ARG A 112 102.510 25.941 -5.128 1.00 1.00 N ATOM 0 H ARG A 112 102.181 18.896 -2.299 1.00 1.00 H new ATOM 0 HA ARG A 112 100.360 20.625 -0.742 1.00 1.00 H new ATOM 0 HB2 ARG A 112 100.765 20.091 -3.719 1.00 1.00 H new ATOM 0 HB3 ARG A 112 99.368 20.954 -3.108 1.00 1.00 H new ATOM 0 HG2 ARG A 112 100.874 22.638 -2.019 1.00 1.00 H new ATOM 0 HG3 ARG A 112 102.278 21.769 -2.606 1.00 1.00 H new ATOM 0 HD2 ARG A 112 101.534 22.105 -4.960 1.00 1.00 H new ATOM 0 HD3 ARG A 112 100.078 22.907 -4.405 1.00 1.00 H new ATOM 0 HE ARG A 112 102.328 24.277 -3.269 1.00 1.00 H new ATOM 0 HH11 ARG A 112 100.758 23.564 -6.320 1.00 1.00 H new ATOM 0 HH12 ARG A 112 101.278 25.065 -7.093 1.00 1.00 H new ATOM 0 HH21 ARG A 112 102.989 26.217 -4.271 1.00 1.00 H new ATOM 0 HH22 ARG A 112 102.530 26.554 -5.943 1.00 1.00 H new ATOM 1616 N SER A 113 98.185 19.277 -1.458 1.00 1.00 N ATOM 1617 CA SER A 113 97.091 18.323 -1.452 1.00 1.00 C ATOM 1618 C SER A 113 96.878 17.779 -2.857 1.00 1.00 C ATOM 1619 O SER A 113 96.307 18.459 -3.710 1.00 1.00 O ATOM 1620 CB SER A 113 95.814 19.001 -0.960 1.00 1.00 C ATOM 1621 OG SER A 113 96.152 19.958 0.030 1.00 1.00 O ATOM 0 H SER A 113 97.903 20.254 -1.379 1.00 1.00 H new ATOM 0 HA SER A 113 97.337 17.500 -0.782 1.00 1.00 H new ATOM 0 HB2 SER A 113 95.300 19.484 -1.791 1.00 1.00 H new ATOM 0 HB3 SER A 113 95.129 18.260 -0.549 1.00 1.00 H new ATOM 0 HG SER A 113 95.503 20.692 0.010 1.00 1.00 H new ATOM 1627 N VAL A 114 97.344 16.555 -3.100 1.00 1.00 N ATOM 1628 CA VAL A 114 97.198 15.937 -4.426 1.00 1.00 C ATOM 1629 C VAL A 114 96.226 14.762 -4.372 1.00 1.00 C ATOM 1630 O VAL A 114 96.599 13.624 -4.658 1.00 1.00 O ATOM 1631 CB VAL A 114 98.556 15.460 -4.948 1.00 1.00 C ATOM 1632 CG1 VAL A 114 98.440 15.122 -6.437 1.00 1.00 C ATOM 1633 CG2 VAL A 114 99.609 16.561 -4.760 1.00 1.00 C ATOM 0 H VAL A 114 97.820 15.975 -2.410 1.00 1.00 H new ATOM 0 HA VAL A 114 96.800 16.691 -5.106 1.00 1.00 H new ATOM 0 HB VAL A 114 98.859 14.574 -4.390 1.00 1.00 H new ATOM 0 HG11 VAL A 114 99.406 14.782 -6.809 1.00 1.00 H new ATOM 0 HG12 VAL A 114 97.701 14.333 -6.574 1.00 1.00 H new ATOM 0 HG13 VAL A 114 98.130 16.010 -6.989 1.00 1.00 H new ATOM 0 HG21 VAL A 114 100.571 16.212 -5.134 1.00 1.00 H new ATOM 0 HG22 VAL A 114 99.307 17.452 -5.311 1.00 1.00 H new ATOM 0 HG23 VAL A 114 99.698 16.803 -3.701 1.00 1.00 H new ATOM 1637 N GLY A 115 94.978 15.038 -4.007 1.00 1.00 N ATOM 1638 CA GLY A 115 93.974 13.981 -3.932 1.00 1.00 C ATOM 1639 C GLY A 115 92.758 14.411 -3.114 1.00 1.00 C ATOM 1640 O GLY A 115 92.714 15.515 -2.572 1.00 1.00 O ATOM 0 H GLY A 115 94.641 15.969 -3.762 1.00 1.00 H new ATOM 0 HA2 GLY A 115 93.657 13.709 -4.939 1.00 1.00 H new ATOM 0 HA3 GLY A 115 94.416 13.091 -3.485 1.00 1.00 H new ATOM 1644 N GLY A 116 91.780 13.514 -3.027 1.00 1.00 N ATOM 1645 CA GLY A 116 90.557 13.774 -2.269 1.00 1.00 C ATOM 1646 C GLY A 116 90.877 14.153 -0.819 1.00 1.00 C ATOM 1647 O GLY A 116 91.269 15.290 -0.554 1.00 1.00 O ATOM 0 H GLY A 116 91.810 12.597 -3.473 1.00 1.00 H new ATOM 0 HA2 GLY A 116 89.996 14.579 -2.743 1.00 1.00 H new ATOM 0 HA3 GLY A 116 89.920 12.889 -2.285 1.00 1.00 H new ATOM 1651 N PRO A 117 90.696 13.253 0.129 1.00 1.00 N ATOM 1652 CA PRO A 117 90.946 13.542 1.575 1.00 1.00 C ATOM 1653 C PRO A 117 92.406 13.903 1.835 1.00 1.00 C ATOM 1654 O PRO A 117 92.734 14.473 2.875 1.00 1.00 O ATOM 1655 CB PRO A 117 90.560 12.242 2.279 1.00 1.00 C ATOM 1656 CG PRO A 117 90.757 11.219 1.230 1.00 1.00 C ATOM 1657 CD PRO A 117 90.260 11.860 -0.043 1.00 1.00 C ATOM 0 HA PRO A 117 90.376 14.400 1.932 1.00 1.00 H new ATOM 0 HB2 PRO A 117 91.189 12.053 3.149 1.00 1.00 H new ATOM 0 HB3 PRO A 117 89.528 12.265 2.630 1.00 1.00 H new ATOM 0 HG2 PRO A 117 91.807 10.938 1.146 1.00 1.00 H new ATOM 0 HG3 PRO A 117 90.200 10.310 1.457 1.00 1.00 H new ATOM 0 HD2 PRO A 117 90.698 11.401 -0.929 1.00 1.00 H new ATOM 0 HD3 PRO A 117 89.178 11.780 -0.145 1.00 1.00 H new ATOM 1665 N ILE A 118 93.279 13.586 0.881 1.00 1.00 N ATOM 1666 CA ILE A 118 94.684 13.913 1.052 1.00 1.00 C ATOM 1667 C ILE A 118 94.804 15.425 1.044 1.00 1.00 C ATOM 1668 O ILE A 118 94.463 16.083 0.062 1.00 1.00 O ATOM 1669 CB ILE A 118 95.560 13.351 -0.079 1.00 1.00 C ATOM 1670 CG1 ILE A 118 95.374 11.827 -0.214 1.00 1.00 C ATOM 1671 CG2 ILE A 118 97.023 13.633 0.274 1.00 1.00 C ATOM 1672 CD1 ILE A 118 94.172 11.474 -1.107 1.00 1.00 C ATOM 0 H ILE A 118 93.044 13.116 0.007 1.00 1.00 H new ATOM 0 HA ILE A 118 95.030 13.471 1.986 1.00 1.00 H new ATOM 0 HB ILE A 118 95.276 13.821 -1.020 1.00 1.00 H new ATOM 0 HG12 ILE A 118 96.279 11.386 -0.632 1.00 1.00 H new ATOM 0 HG13 ILE A 118 95.233 11.389 0.774 1.00 1.00 H new ATOM 0 HG21 ILE A 118 97.669 13.244 -0.513 1.00 1.00 H new ATOM 0 HG22 ILE A 118 97.174 14.708 0.369 1.00 1.00 H new ATOM 0 HG23 ILE A 118 97.270 13.148 1.218 1.00 1.00 H new ATOM 0 HD11 ILE A 118 94.076 10.390 -1.176 1.00 1.00 H new ATOM 0 HD12 ILE A 118 93.263 11.892 -0.675 1.00 1.00 H new ATOM 0 HD13 ILE A 118 94.325 11.889 -2.103 1.00 1.00 H new ATOM 1679 N GLY A 119 95.256 15.968 2.160 1.00 1.00 N ATOM 1680 CA GLY A 119 95.389 17.402 2.316 1.00 1.00 C ATOM 1681 C GLY A 119 96.785 17.885 1.957 1.00 1.00 C ATOM 1682 O GLY A 119 97.604 17.134 1.438 1.00 1.00 O ATOM 0 H GLY A 119 95.539 15.429 2.979 1.00 1.00 H new ATOM 0 HA2 GLY A 119 94.657 17.905 1.684 1.00 1.00 H new ATOM 0 HA3 GLY A 119 95.163 17.677 3.346 1.00 1.00 H new ATOM 1686 N PRO A 120 97.069 19.122 2.250 1.00 1.00 N ATOM 1687 CA PRO A 120 98.410 19.717 1.989 1.00 1.00 C ATOM 1688 C PRO A 120 99.488 19.093 2.882 1.00 1.00 C ATOM 1689 O PRO A 120 99.224 18.756 4.031 1.00 1.00 O ATOM 1690 CB PRO A 120 98.229 21.204 2.312 1.00 1.00 C ATOM 1691 CG PRO A 120 97.031 21.271 3.207 1.00 1.00 C ATOM 1692 CD PRO A 120 96.139 20.090 2.856 1.00 1.00 C ATOM 0 HA PRO A 120 98.743 19.544 0.966 1.00 1.00 H new ATOM 0 HB2 PRO A 120 99.112 21.609 2.806 1.00 1.00 H new ATOM 0 HB3 PRO A 120 98.075 21.788 1.404 1.00 1.00 H new ATOM 0 HG2 PRO A 120 97.331 21.229 4.254 1.00 1.00 H new ATOM 0 HG3 PRO A 120 96.498 22.211 3.066 1.00 1.00 H new ATOM 0 HD2 PRO A 120 95.652 19.679 3.740 1.00 1.00 H new ATOM 0 HD3 PRO A 120 95.349 20.376 2.161 1.00 1.00 H new ATOM 1700 N ASN A 121 100.698 18.961 2.352 1.00 1.00 N ATOM 1701 CA ASN A 121 101.811 18.396 3.120 1.00 1.00 C ATOM 1702 C ASN A 121 101.349 17.177 3.906 1.00 1.00 C ATOM 1703 O ASN A 121 101.585 17.064 5.110 1.00 1.00 O ATOM 1704 CB ASN A 121 102.381 19.448 4.078 1.00 1.00 C ATOM 1705 CG ASN A 121 103.791 19.055 4.508 1.00 1.00 C ATOM 1706 OD1 ASN A 121 104.692 19.893 4.529 1.00 1.00 O ATOM 1707 ND2 ASN A 121 104.036 17.821 4.852 1.00 1.00 N ATOM 0 H ASN A 121 100.937 19.235 1.399 1.00 1.00 H new ATOM 0 HA ASN A 121 102.591 18.090 2.423 1.00 1.00 H new ATOM 0 HB2 ASN A 121 102.399 20.423 3.591 1.00 1.00 H new ATOM 0 HB3 ASN A 121 101.738 19.541 4.953 1.00 1.00 H new ATOM 0 HD21 ASN A 121 104.976 17.549 5.139 1.00 1.00 H new ATOM 0 HD22 ASN A 121 103.288 17.128 4.834 1.00 1.00 H new ATOM 1714 N GLU A 122 100.663 16.289 3.211 1.00 1.00 N ATOM 1715 CA GLU A 122 100.114 15.079 3.809 1.00 1.00 C ATOM 1716 C GLU A 122 100.984 13.871 3.504 1.00 1.00 C ATOM 1717 O GLU A 122 101.323 13.605 2.350 1.00 1.00 O ATOM 1718 CB GLU A 122 98.725 14.898 3.229 1.00 1.00 C ATOM 1719 CG GLU A 122 97.814 14.071 4.118 1.00 1.00 C ATOM 1720 CD GLU A 122 97.414 14.866 5.355 1.00 1.00 C ATOM 1721 OE1 GLU A 122 96.363 15.484 5.321 1.00 1.00 O ATOM 1722 OE2 GLU A 122 98.159 14.843 6.317 1.00 1.00 O ATOM 0 H GLU A 122 100.469 16.383 2.214 1.00 1.00 H new ATOM 0 HA GLU A 122 100.078 15.171 4.895 1.00 1.00 H new ATOM 0 HB2 GLU A 122 98.274 15.877 3.067 1.00 1.00 H new ATOM 0 HB3 GLU A 122 98.804 14.419 2.253 1.00 1.00 H new ATOM 0 HG2 GLU A 122 96.923 13.777 3.563 1.00 1.00 H new ATOM 0 HG3 GLU A 122 98.321 13.153 4.416 1.00 1.00 H new ATOM 1729 N THR A 123 101.328 13.143 4.553 1.00 1.00 N ATOM 1730 CA THR A 123 102.150 11.944 4.420 1.00 1.00 C ATOM 1731 C THR A 123 101.248 10.729 4.243 1.00 1.00 C ATOM 1732 O THR A 123 100.291 10.540 4.992 1.00 1.00 O ATOM 1733 CB THR A 123 103.032 11.792 5.662 1.00 1.00 C ATOM 1734 OG1 THR A 123 103.968 12.860 5.701 1.00 1.00 O ATOM 1735 CG2 THR A 123 103.792 10.465 5.620 1.00 1.00 C ATOM 0 H THR A 123 101.052 13.359 5.511 1.00 1.00 H new ATOM 0 HA THR A 123 102.794 12.028 3.545 1.00 1.00 H new ATOM 0 HB THR A 123 102.399 11.810 6.549 1.00 1.00 H new ATOM 0 HG1 THR A 123 104.309 12.963 6.614 1.00 1.00 H new ATOM 0 HG21 THR A 123 104.414 10.374 6.510 1.00 1.00 H new ATOM 0 HG22 THR A 123 103.081 9.639 5.588 1.00 1.00 H new ATOM 0 HG23 THR A 123 104.423 10.435 4.732 1.00 1.00 H new ATOM 1743 N LEU A 124 101.554 9.906 3.244 1.00 1.00 N ATOM 1744 CA LEU A 124 100.761 8.704 2.969 1.00 1.00 C ATOM 1745 C LEU A 124 101.588 7.448 3.248 1.00 1.00 C ATOM 1746 O LEU A 124 102.802 7.433 3.045 1.00 1.00 O ATOM 1747 CB LEU A 124 100.336 8.658 1.490 1.00 1.00 C ATOM 1748 CG LEU A 124 99.471 9.871 1.057 1.00 1.00 C ATOM 1749 CD1 LEU A 124 98.489 10.276 2.143 1.00 1.00 C ATOM 1750 CD2 LEU A 124 100.352 11.066 0.721 1.00 1.00 C ATOM 0 H LEU A 124 102.342 10.046 2.611 1.00 1.00 H new ATOM 0 HA LEU A 124 99.882 8.738 3.613 1.00 1.00 H new ATOM 0 HB2 LEU A 124 101.228 8.616 0.865 1.00 1.00 H new ATOM 0 HB3 LEU A 124 99.777 7.740 1.309 1.00 1.00 H new ATOM 0 HG LEU A 124 98.911 9.563 0.174 1.00 1.00 H new ATOM 0 HD11 LEU A 124 97.901 11.129 1.803 1.00 1.00 H new ATOM 0 HD12 LEU A 124 97.824 9.441 2.362 1.00 1.00 H new ATOM 0 HD13 LEU A 124 99.036 10.550 3.045 1.00 1.00 H new ATOM 0 HD21 LEU A 124 99.726 11.906 0.420 1.00 1.00 H new ATOM 0 HD22 LEU A 124 100.937 11.345 1.598 1.00 1.00 H new ATOM 0 HD23 LEU A 124 101.025 10.804 -0.095 1.00 1.00 H new ATOM 1762 N ILE A 125 100.907 6.388 3.684 1.00 1.00 N ATOM 1763 CA ILE A 125 101.541 5.103 3.963 1.00 1.00 C ATOM 1764 C ILE A 125 100.811 4.030 3.192 1.00 1.00 C ATOM 1765 O ILE A 125 99.590 4.071 3.086 1.00 1.00 O ATOM 1766 CB ILE A 125 101.446 4.776 5.465 1.00 1.00 C ATOM 1767 CG1 ILE A 125 101.623 3.249 5.698 1.00 1.00 C ATOM 1768 CG2 ILE A 125 100.075 5.212 5.981 1.00 1.00 C ATOM 1769 CD1 ILE A 125 101.656 2.913 7.178 1.00 1.00 C ATOM 0 H ILE A 125 99.901 6.398 3.853 1.00 1.00 H new ATOM 0 HA ILE A 125 102.590 5.149 3.670 1.00 1.00 H new ATOM 0 HB ILE A 125 102.235 5.306 5.998 1.00 1.00 H new ATOM 0 HG12 ILE A 125 100.806 2.710 5.219 1.00 1.00 H new ATOM 0 HG13 ILE A 125 102.546 2.912 5.227 1.00 1.00 H new ATOM 0 HG21 ILE A 125 99.997 4.985 7.044 1.00 1.00 H new ATOM 0 HG22 ILE A 125 99.953 6.285 5.829 1.00 1.00 H new ATOM 0 HG23 ILE A 125 99.295 4.678 5.438 1.00 1.00 H new ATOM 0 HD11 ILE A 125 101.781 1.838 7.304 1.00 1.00 H new ATOM 0 HD12 ILE A 125 102.489 3.433 7.651 1.00 1.00 H new ATOM 0 HD13 ILE A 125 100.722 3.227 7.643 1.00 1.00 H new ATOM 1776 N PHE A 126 101.553 3.046 2.691 1.00 1.00 N ATOM 1777 CA PHE A 126 100.928 1.945 1.974 1.00 1.00 C ATOM 1778 C PHE A 126 101.478 0.599 2.422 1.00 1.00 C ATOM 1779 O PHE A 126 102.648 0.483 2.785 1.00 1.00 O ATOM 1780 CB PHE A 126 101.155 2.099 0.479 1.00 1.00 C ATOM 1781 CG PHE A 126 101.043 3.552 0.113 1.00 1.00 C ATOM 1782 CD1 PHE A 126 99.887 4.036 -0.511 1.00 1.00 C ATOM 1783 CD2 PHE A 126 102.095 4.418 0.411 1.00 1.00 C ATOM 1784 CE1 PHE A 126 99.789 5.392 -0.834 1.00 1.00 C ATOM 1785 CE2 PHE A 126 101.995 5.770 0.085 1.00 1.00 C ATOM 1786 CZ PHE A 126 100.845 6.254 -0.534 1.00 1.00 C ATOM 0 H PHE A 126 102.569 2.990 2.767 1.00 1.00 H new ATOM 0 HA PHE A 126 99.861 1.975 2.197 1.00 1.00 H new ATOM 0 HB2 PHE A 126 102.139 1.717 0.207 1.00 1.00 H new ATOM 0 HB3 PHE A 126 100.421 1.514 -0.075 1.00 1.00 H new ATOM 0 HD1 PHE A 126 99.074 3.364 -0.742 1.00 1.00 H new ATOM 0 HD2 PHE A 126 102.985 4.042 0.893 1.00 1.00 H new ATOM 0 HE1 PHE A 126 98.899 5.772 -1.314 1.00 1.00 H new ATOM 0 HE2 PHE A 126 102.809 6.442 0.312 1.00 1.00 H new ATOM 0 HZ PHE A 126 100.770 7.302 -0.783 1.00 1.00 H new ATOM 1796 N LYS A 127 100.632 -0.433 2.345 1.00 1.00 N ATOM 1797 CA LYS A 127 101.043 -1.775 2.690 1.00 1.00 C ATOM 1798 C LYS A 127 101.322 -2.464 1.384 1.00 1.00 C ATOM 1799 O LYS A 127 100.485 -2.443 0.505 1.00 1.00 O ATOM 1800 CB LYS A 127 99.941 -2.532 3.476 1.00 1.00 C ATOM 1801 CG LYS A 127 98.855 -1.579 3.979 1.00 1.00 C ATOM 1802 CD LYS A 127 99.421 -0.601 5.022 1.00 1.00 C ATOM 1803 CE LYS A 127 98.309 0.337 5.497 1.00 1.00 C ATOM 1804 NZ LYS A 127 98.855 1.270 6.523 1.00 1.00 N ATOM 0 H LYS A 127 99.660 -0.353 2.045 1.00 1.00 H new ATOM 0 HA LYS A 127 101.918 -1.755 3.340 1.00 1.00 H new ATOM 0 HB2 LYS A 127 99.492 -3.291 2.835 1.00 1.00 H new ATOM 0 HB3 LYS A 127 100.389 -3.053 4.322 1.00 1.00 H new ATOM 0 HG2 LYS A 127 98.439 -1.021 3.140 1.00 1.00 H new ATOM 0 HG3 LYS A 127 98.038 -2.152 4.418 1.00 1.00 H new ATOM 0 HD2 LYS A 127 99.833 -1.152 5.868 1.00 1.00 H new ATOM 0 HD3 LYS A 127 100.238 -0.024 4.589 1.00 1.00 H new ATOM 0 HE2 LYS A 127 97.908 0.900 4.654 1.00 1.00 H new ATOM 0 HE3 LYS A 127 97.485 -0.240 5.916 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 98.253 1.244 7.371 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 99.822 0.981 6.775 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 98.871 2.237 6.140 1.00 1.00 H new ATOM 1818 N ILE A 128 102.518 -3.008 1.214 1.00 1.00 N ATOM 1819 CA ILE A 128 102.859 -3.620 -0.074 1.00 1.00 C ATOM 1820 C ILE A 128 103.161 -5.107 0.035 1.00 1.00 C ATOM 1821 O ILE A 128 104.102 -5.532 0.706 1.00 1.00 O ATOM 1822 CB ILE A 128 104.041 -2.859 -0.698 1.00 1.00 C ATOM 1823 CG1 ILE A 128 103.873 -1.358 -0.380 1.00 1.00 C ATOM 1824 CG2 ILE A 128 104.015 -3.065 -2.216 1.00 1.00 C ATOM 1825 CD1 ILE A 128 104.980 -0.515 -1.024 1.00 1.00 C ATOM 0 H ILE A 128 103.251 -3.042 1.922 1.00 1.00 H new ATOM 0 HA ILE A 128 101.986 -3.542 -0.721 1.00 1.00 H new ATOM 0 HB ILE A 128 104.987 -3.222 -0.297 1.00 1.00 H new ATOM 0 HG12 ILE A 128 102.901 -1.017 -0.737 1.00 1.00 H new ATOM 0 HG13 ILE A 128 103.885 -1.211 0.700 1.00 1.00 H new ATOM 0 HG21 ILE A 128 104.849 -2.530 -2.670 1.00 1.00 H new ATOM 0 HG22 ILE A 128 104.101 -4.128 -2.440 1.00 1.00 H new ATOM 0 HG23 ILE A 128 103.077 -2.684 -2.619 1.00 1.00 H new ATOM 0 HD11 ILE A 128 104.827 0.536 -0.777 1.00 1.00 H new ATOM 0 HD12 ILE A 128 105.950 -0.839 -0.647 1.00 1.00 H new ATOM 0 HD13 ILE A 128 104.951 -0.642 -2.106 1.00 1.00 H new ATOM 1832 N HIS A 129 102.339 -5.880 -0.674 1.00 1.00 N ATOM 1833 CA HIS A 129 102.463 -7.332 -0.737 1.00 1.00 C ATOM 1834 C HIS A 129 102.938 -7.716 -2.127 1.00 1.00 C ATOM 1835 O HIS A 129 102.350 -7.288 -3.119 1.00 1.00 O ATOM 1836 CB HIS A 129 101.106 -7.980 -0.464 1.00 1.00 C ATOM 1837 CG HIS A 129 101.194 -9.457 -0.722 1.00 1.00 C ATOM 1838 ND1 HIS A 129 100.137 -10.156 -1.272 1.00 1.00 N ATOM 1839 CD2 HIS A 129 102.222 -10.369 -0.583 1.00 1.00 C ATOM 1840 CE1 HIS A 129 100.537 -11.420 -1.458 1.00 1.00 C ATOM 1841 NE2 HIS A 129 101.798 -11.609 -1.065 1.00 1.00 N ATOM 0 H HIS A 129 101.563 -5.511 -1.224 1.00 1.00 H new ATOM 0 HA HIS A 129 103.176 -7.676 0.012 1.00 1.00 H new ATOM 0 HB2 HIS A 129 100.805 -7.798 0.568 1.00 1.00 H new ATOM 0 HB3 HIS A 129 100.343 -7.534 -1.102 1.00 1.00 H new ATOM 0 HD2 HIS A 129 103.196 -10.157 -0.168 1.00 1.00 H new ATOM 0 HE1 HIS A 129 99.913 -12.195 -1.877 1.00 1.00 H new ATOM 0 HE2 HIS A 129 102.337 -12.474 -1.108 1.00 1.00 H new ATOM 1849 N LEU A 130 104.016 -8.497 -2.214 1.00 1.00 N ATOM 1850 CA LEU A 130 104.545 -8.873 -3.527 1.00 1.00 C ATOM 1851 C LEU A 130 104.047 -10.251 -3.986 1.00 1.00 C ATOM 1852 O LEU A 130 104.423 -11.278 -3.422 1.00 1.00 O ATOM 1853 CB LEU A 130 106.087 -8.851 -3.499 1.00 1.00 C ATOM 1854 CG LEU A 130 106.634 -8.040 -4.680 1.00 1.00 C ATOM 1855 CD1 LEU A 130 108.162 -7.959 -4.604 1.00 1.00 C ATOM 1856 CD2 LEU A 130 106.235 -8.704 -6.003 1.00 1.00 C ATOM 0 H LEU A 130 104.528 -8.873 -1.416 1.00 1.00 H new ATOM 0 HA LEU A 130 104.178 -8.141 -4.246 1.00 1.00 H new ATOM 0 HB2 LEU A 130 106.433 -8.417 -2.561 1.00 1.00 H new ATOM 0 HB3 LEU A 130 106.472 -9.870 -3.541 1.00 1.00 H new ATOM 0 HG LEU A 130 106.214 -7.035 -4.632 1.00 1.00 H new ATOM 0 HD11 LEU A 130 108.538 -7.381 -5.448 1.00 1.00 H new ATOM 0 HD12 LEU A 130 108.455 -7.474 -3.673 1.00 1.00 H new ATOM 0 HD13 LEU A 130 108.582 -8.964 -4.637 1.00 1.00 H new ATOM 0 HD21 LEU A 130 106.628 -8.121 -6.836 1.00 1.00 H new ATOM 0 HD22 LEU A 130 106.645 -9.713 -6.042 1.00 1.00 H new ATOM 0 HD23 LEU A 130 105.148 -8.751 -6.074 1.00 1.00 H new ATOM 1868 N ILE A 131 103.210 -10.257 -5.027 1.00 1.00 N ATOM 1869 CA ILE A 131 102.675 -11.497 -5.578 1.00 1.00 C ATOM 1870 C ILE A 131 103.535 -11.999 -6.746 1.00 1.00 C ATOM 1871 O ILE A 131 103.839 -13.188 -6.827 1.00 1.00 O ATOM 1872 CB ILE A 131 101.235 -11.260 -6.045 1.00 1.00 C ATOM 1873 CG1 ILE A 131 100.325 -10.987 -4.834 1.00 1.00 C ATOM 1874 CG2 ILE A 131 100.719 -12.507 -6.755 1.00 1.00 C ATOM 1875 CD1 ILE A 131 100.353 -9.523 -4.434 1.00 1.00 C ATOM 0 H ILE A 131 102.890 -9.414 -5.503 1.00 1.00 H new ATOM 0 HA ILE A 131 102.689 -12.262 -4.802 1.00 1.00 H new ATOM 0 HB ILE A 131 101.224 -10.404 -6.719 1.00 1.00 H new ATOM 0 HG12 ILE A 131 99.303 -11.280 -5.073 1.00 1.00 H new ATOM 0 HG13 ILE A 131 100.644 -11.601 -3.992 1.00 1.00 H new ATOM 0 HG21 ILE A 131 99.695 -12.339 -7.087 1.00 1.00 H new ATOM 0 HG22 ILE A 131 101.350 -12.722 -7.618 1.00 1.00 H new ATOM 0 HG23 ILE A 131 100.743 -13.353 -6.068 1.00 1.00 H new ATOM 0 HD11 ILE A 131 99.699 -9.368 -3.576 1.00 1.00 H new ATOM 0 HD12 ILE A 131 101.371 -9.237 -4.171 1.00 1.00 H new ATOM 0 HD13 ILE A 131 100.009 -8.911 -5.268 1.00 1.00 H new ATOM 1882 N SER A 132 103.922 -11.096 -7.653 1.00 1.00 N ATOM 1883 CA SER A 132 104.743 -11.488 -8.806 1.00 1.00 C ATOM 1884 C SER A 132 105.599 -10.314 -9.286 1.00 1.00 C ATOM 1885 O SER A 132 105.313 -9.157 -8.980 1.00 1.00 O ATOM 1886 CB SER A 132 103.847 -11.988 -9.943 1.00 1.00 C ATOM 1887 OG SER A 132 103.409 -10.887 -10.725 1.00 1.00 O ATOM 0 H SER A 132 103.686 -10.105 -7.615 1.00 1.00 H new ATOM 0 HA SER A 132 105.409 -12.294 -8.497 1.00 1.00 H new ATOM 0 HB2 SER A 132 104.394 -12.695 -10.567 1.00 1.00 H new ATOM 0 HB3 SER A 132 102.988 -12.521 -9.535 1.00 1.00 H new ATOM 0 HG SER A 132 102.837 -11.209 -11.453 1.00 1.00 H new ATOM 1893 N VAL A 133 106.687 -10.629 -10.004 1.00 1.00 N ATOM 1894 CA VAL A 133 107.624 -9.606 -10.488 1.00 1.00 C ATOM 1895 C VAL A 133 107.929 -9.784 -11.970 1.00 1.00 C ATOM 1896 O VAL A 133 108.115 -10.903 -12.448 1.00 1.00 O ATOM 1897 CB VAL A 133 108.933 -9.704 -9.703 1.00 1.00 C ATOM 1898 CG1 VAL A 133 109.887 -8.599 -10.155 1.00 1.00 C ATOM 1899 CG2 VAL A 133 108.619 -9.532 -8.231 1.00 1.00 C ATOM 0 H VAL A 133 106.939 -11.583 -10.262 1.00 1.00 H new ATOM 0 HA VAL A 133 107.159 -8.631 -10.343 1.00 1.00 H new ATOM 0 HB VAL A 133 109.404 -10.671 -9.878 1.00 1.00 H new ATOM 0 HG11 VAL A 133 110.819 -8.671 -9.594 1.00 1.00 H new ATOM 0 HG12 VAL A 133 110.094 -8.710 -11.219 1.00 1.00 H new ATOM 0 HG13 VAL A 133 109.429 -7.627 -9.974 1.00 1.00 H new ATOM 0 HG21 VAL A 133 109.540 -9.599 -7.652 1.00 1.00 H new ATOM 0 HG22 VAL A 133 108.158 -8.558 -8.069 1.00 1.00 H new ATOM 0 HG23 VAL A 133 107.932 -10.316 -7.911 1.00 1.00 H new ATOM 1903 N LYS A 134 108.003 -8.666 -12.686 1.00 1.00 N ATOM 1904 CA LYS A 134 108.314 -8.685 -14.105 1.00 1.00 C ATOM 1905 C LYS A 134 109.818 -8.499 -14.311 1.00 1.00 C ATOM 1906 O LYS A 134 110.631 -8.886 -13.474 1.00 1.00 O ATOM 1907 CB LYS A 134 107.586 -7.538 -14.798 1.00 1.00 C ATOM 1908 CG LYS A 134 107.324 -7.875 -16.281 1.00 1.00 C ATOM 1909 CD LYS A 134 105.996 -8.626 -16.408 1.00 1.00 C ATOM 1910 CE LYS A 134 105.857 -9.238 -17.817 1.00 1.00 C ATOM 1911 NZ LYS A 134 104.432 -9.162 -18.245 1.00 1.00 N ATOM 0 H LYS A 134 107.851 -7.734 -12.302 1.00 1.00 H new ATOM 0 HA LYS A 134 107.999 -9.641 -14.523 1.00 1.00 H new ATOM 0 HB2 LYS A 134 106.641 -7.342 -14.292 1.00 1.00 H new ATOM 0 HB3 LYS A 134 108.181 -6.627 -14.726 1.00 1.00 H new ATOM 0 HG2 LYS A 134 107.295 -6.960 -16.873 1.00 1.00 H new ATOM 0 HG3 LYS A 134 108.137 -8.484 -16.676 1.00 1.00 H new ATOM 0 HD2 LYS A 134 105.943 -9.413 -15.656 1.00 1.00 H new ATOM 0 HD3 LYS A 134 105.166 -7.945 -16.217 1.00 1.00 H new ATOM 0 HE2 LYS A 134 106.491 -8.702 -18.524 1.00 1.00 H new ATOM 0 HE3 LYS A 134 106.193 -10.275 -17.811 1.00 1.00 H new ATOM 0 HZ1 LYS A 134 104.332 -9.573 -19.195 1.00 1.00 H new ATOM 0 HZ2 LYS A 134 103.839 -9.692 -17.574 1.00 1.00 H new ATOM 0 HZ3 LYS A 134 104.128 -8.168 -18.265 1.00 1.00 H new