USER MOD reduce.3.24.130724 H: found=0, std=0, add=1209, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1210 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 146 HIS : no HD1:sc= -1.58! C(o=-1!,f=-2.7!) USER MOD Set 1.2: A 150 THR OG1 : rot 78:sc= 0.579 USER MOD Set 2.1: A 84 TYR OH : rot -72:sc= 1.14! USER MOD Set 2.2: A 127 CYS SG : rot 89:sc= 1.43 USER MOD Set 3.1: A 126 ASN : amide:sc= 0.655 K(o=0.46,f=-1.4) USER MOD Set 3.2: A 156 MET CE :methyl -132:sc= -0.199 (180deg=-3.89!) USER MOD Set 4.1: A 35 ASN : amide:sc= -12! C(o=-12!,f=-17!) USER MOD Set 4.2: A 73 ASN : amide:sc= 0.364 K(o=-12,f=-17!) USER MOD Set 5.1: A 72 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 76 LYS NZ :NH3+ 144:sc= -0.0194 (180deg=-0.203) USER MOD Set 6.1: A 25 SER OG : rot -112:sc= 1.14 USER MOD Set 6.2: A 38 THR OG1 : rot -143:sc= 1.42 USER MOD Set 7.1: A 34 THR OG1 : rot 180:sc= -0.304 USER MOD Set 7.2: A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.1: A 28 GLN : amide:sc= 0 K(o=-0.54,f=-1.1) USER MOD Set 8.2: A 32 GLN : amide:sc= -0.543 K(o=-0.54,f=-1.5) USER MOD Single : A 11 CYS SG : rot -31:sc= -0.74 USER MOD Single : A 13 SER OG : rot 80:sc= -0.141 USER MOD Single : A 19 GLN : amide:sc=-0.00552 K(o=-0.0055,f=-1.3) USER MOD Single : A 20 THR OG1 : rot -5:sc= -0.247 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 51:sc= 0.147 USER MOD Single : A 27 CYS SG : rot -140:sc= -5.78! USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl -148:sc= -6.28! (180deg=-8.77!) USER MOD Single : A 41 GLN :FLIP amide:sc= -5.24! C(o=-7.4!,f=-5.2!) USER MOD Single : A 44 HIS : no HD1:sc= -3.48! C(o=-3.5!,f=-3.4!) USER MOD Single : A 45 GLN : amide:sc= -0.711 K(o=-0.71,f=-2.8!) USER MOD Single : A 52 SER OG : rot 180:sc= -0.38 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 95:sc= 1.12 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.597 K(o=-0.6,f=-1.9!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= -0.471 (180deg=-0.471) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 THR OG1 : rot -6:sc= -0.745 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 30:sc= -1.29 USER MOD Single : A 86 HIS :FLIP no HD1:sc= -5.74! C(o=-7.8!,f=-5.7!) USER MOD Single : A 91 GLN : amide:sc= 0.109 K(o=0.11,f=-0.75) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.0264 X(o=-0.026,f=-0.29) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 THR OG1 : rot 85:sc= 1.06 USER MOD Single : A 107 CYS SG : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.941 X(o=-0.94,f=-0.82) USER MOD Single : A 123 CYS SG : rot 20:sc= -2.91! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 HIS :FLIP no HE2:sc= 0.039 F(o=-0.48,f=0.039) USER MOD Single : A 135 LYS NZ :NH3+ 138:sc= 1.03 (180deg=0.0238) USER MOD Single : A 136 ASN : amide:sc= -0.256 K(o=-0.26,f=-2.5!) USER MOD Single : A 138 MET CE :methyl 135:sc= -1.06 (180deg=-3.66!) USER MOD Single : A 139 THR OG1 : rot -38:sc= 1.11 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -2.99 K(o=-3,f=-6.6!) USER MOD Single : A 149 MET CE :methyl -110:sc= -0.271 (180deg=-3.82!) USER MOD Single : A 153 GLN : amide:sc=-0.00196 X(o=-0.002,f=-0.002) USER MOD Single : A 157 SER OG : rot 92:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 66 N LEU A 8 8.615 12.976 -0.925 1.00 0.00 N ATOM 67 CA LEU A 8 7.691 13.472 -1.938 1.00 0.00 C ATOM 68 C LEU A 8 6.250 13.403 -1.441 1.00 0.00 C ATOM 69 O LEU A 8 5.947 12.776 -0.425 1.00 0.00 O ATOM 70 CB LEU A 8 7.836 12.665 -3.229 1.00 0.00 C ATOM 71 CG LEU A 8 6.694 11.700 -3.550 1.00 0.00 C ATOM 72 CD1 LEU A 8 6.723 11.308 -5.019 1.00 0.00 C ATOM 73 CD2 LEU A 8 6.774 10.465 -2.664 1.00 0.00 C ATOM 0 HA LEU A 8 7.937 14.515 -2.139 1.00 0.00 H new ATOM 0 HB2 LEU A 8 7.940 13.363 -4.060 1.00 0.00 H new ATOM 0 HB3 LEU A 8 8.763 12.094 -3.175 1.00 0.00 H new ATOM 0 HG LEU A 8 5.749 12.206 -3.349 1.00 0.00 H new ATOM 0 HD11 LEU A 8 5.903 10.621 -5.229 1.00 0.00 H new ATOM 0 HD12 LEU A 8 6.615 12.200 -5.636 1.00 0.00 H new ATOM 0 HD13 LEU A 8 7.671 10.821 -5.247 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.954 9.790 -2.906 1.00 0.00 H new ATOM 0 HD22 LEU A 8 7.724 9.957 -2.832 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.702 10.762 -1.618 1.00 0.00 H new ATOM 85 N PRO A 9 5.339 14.060 -2.174 1.00 0.00 N ATOM 86 CA PRO A 9 3.914 14.086 -1.828 1.00 0.00 C ATOM 87 C PRO A 9 3.244 12.731 -2.031 1.00 0.00 C ATOM 88 O PRO A 9 2.580 12.215 -1.131 1.00 0.00 O ATOM 89 CB PRO A 9 3.333 15.119 -2.796 1.00 0.00 C ATOM 90 CG PRO A 9 4.264 15.115 -3.959 1.00 0.00 C ATOM 91 CD PRO A 9 5.629 14.828 -3.397 1.00 0.00 C ATOM 0 HA PRO A 9 3.754 14.328 -0.777 1.00 0.00 H new ATOM 0 HB2 PRO A 9 2.320 14.852 -3.099 1.00 0.00 H new ATOM 0 HB3 PRO A 9 3.279 16.106 -2.336 1.00 0.00 H new ATOM 0 HG2 PRO A 9 3.975 14.357 -4.687 1.00 0.00 H new ATOM 0 HG3 PRO A 9 4.248 16.075 -4.474 1.00 0.00 H new ATOM 0 HD2 PRO A 9 6.239 14.256 -4.096 1.00 0.00 H new ATOM 0 HD3 PRO A 9 6.174 15.746 -3.176 1.00 0.00 H new ATOM 99 N LEU A 10 3.423 12.159 -3.216 1.00 0.00 N ATOM 100 CA LEU A 10 2.836 10.863 -3.537 1.00 0.00 C ATOM 101 C LEU A 10 2.974 9.897 -2.364 1.00 0.00 C ATOM 102 O LEU A 10 2.161 8.988 -2.196 1.00 0.00 O ATOM 103 CB LEU A 10 3.502 10.272 -4.780 1.00 0.00 C ATOM 104 CG LEU A 10 3.163 8.815 -5.096 1.00 0.00 C ATOM 105 CD1 LEU A 10 1.660 8.638 -5.245 1.00 0.00 C ATOM 106 CD2 LEU A 10 3.883 8.361 -6.357 1.00 0.00 C ATOM 0 H LEU A 10 3.970 12.572 -3.971 1.00 0.00 H new ATOM 0 HA LEU A 10 1.775 11.013 -3.738 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.227 10.883 -5.640 1.00 0.00 H new ATOM 0 HB3 LEU A 10 4.582 10.355 -4.663 1.00 0.00 H new ATOM 0 HG LEU A 10 3.501 8.195 -4.266 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.437 7.595 -5.470 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.166 8.923 -4.316 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.298 9.269 -6.056 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.630 7.322 -6.566 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.576 8.985 -7.196 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.960 8.450 -6.213 1.00 0.00 H new ATOM 118 N CYS A 11 4.008 10.102 -1.556 1.00 0.00 N ATOM 119 CA CYS A 11 4.253 9.250 -0.397 1.00 0.00 C ATOM 120 C CYS A 11 3.946 9.994 0.899 1.00 0.00 C ATOM 121 O CYS A 11 3.444 9.408 1.858 1.00 0.00 O ATOM 122 CB CYS A 11 5.704 8.766 -0.391 1.00 0.00 C ATOM 123 SG CYS A 11 6.005 7.351 0.693 1.00 0.00 S ATOM 0 H CYS A 11 4.690 10.850 -1.682 1.00 0.00 H new ATOM 0 HA CYS A 11 3.591 8.387 -0.465 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.991 8.499 -1.408 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.349 9.589 -0.084 1.00 0.00 H new ATOM 0 HG CYS A 11 5.188 7.397 1.703 1.00 0.00 H new ATOM 129 N ASP A 12 4.254 11.286 0.920 1.00 0.00 N ATOM 130 CA ASP A 12 4.012 12.110 2.099 1.00 0.00 C ATOM 131 C ASP A 12 2.517 12.266 2.355 1.00 0.00 C ATOM 132 O ASP A 12 2.106 12.815 3.378 1.00 0.00 O ATOM 133 CB ASP A 12 4.659 13.485 1.927 1.00 0.00 C ATOM 134 CG ASP A 12 4.434 14.385 3.126 1.00 0.00 C ATOM 135 OD1 ASP A 12 4.651 13.920 4.265 1.00 0.00 O ATOM 136 OD2 ASP A 12 4.040 15.553 2.926 1.00 0.00 O ATOM 0 H ASP A 12 4.671 11.785 0.135 1.00 0.00 H new ATOM 0 HA ASP A 12 4.459 11.611 2.959 1.00 0.00 H new ATOM 0 HB2 ASP A 12 5.730 13.362 1.765 1.00 0.00 H new ATOM 0 HB3 ASP A 12 4.255 13.965 1.036 1.00 0.00 H new ATOM 141 N SER A 13 1.707 11.780 1.419 1.00 0.00 N ATOM 142 CA SER A 13 0.257 11.870 1.542 1.00 0.00 C ATOM 143 C SER A 13 -0.355 10.492 1.771 1.00 0.00 C ATOM 144 O SER A 13 -1.132 10.292 2.706 1.00 0.00 O ATOM 145 CB SER A 13 -0.344 12.505 0.286 1.00 0.00 C ATOM 146 OG SER A 13 -0.425 13.914 0.415 1.00 0.00 O ATOM 0 H SER A 13 2.031 11.320 0.568 1.00 0.00 H new ATOM 0 HA SER A 13 0.028 12.498 2.403 1.00 0.00 H new ATOM 0 HB2 SER A 13 0.266 12.251 -0.581 1.00 0.00 H new ATOM 0 HB3 SER A 13 -1.338 12.095 0.108 1.00 0.00 H new ATOM 0 HG SER A 13 0.453 14.310 0.236 1.00 0.00 H new ATOM 152 N LEU A 14 0.000 9.543 0.912 1.00 0.00 N ATOM 153 CA LEU A 14 -0.514 8.182 1.019 1.00 0.00 C ATOM 154 C LEU A 14 -0.383 7.662 2.447 1.00 0.00 C ATOM 155 O LEU A 14 -1.288 7.006 2.964 1.00 0.00 O ATOM 156 CB LEU A 14 0.233 7.257 0.056 1.00 0.00 C ATOM 157 CG LEU A 14 -0.362 7.126 -1.346 1.00 0.00 C ATOM 158 CD1 LEU A 14 0.628 6.455 -2.286 1.00 0.00 C ATOM 159 CD2 LEU A 14 -1.669 6.348 -1.301 1.00 0.00 C ATOM 0 H LEU A 14 0.642 9.691 0.133 1.00 0.00 H new ATOM 0 HA LEU A 14 -1.571 8.196 0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.258 7.615 -0.038 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.282 6.264 0.502 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.571 8.126 -1.725 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.187 6.370 -3.279 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.538 7.052 -2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.870 5.461 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -2.078 6.265 -2.308 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.485 5.351 -0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -2.381 6.870 -0.662 1.00 0.00 H new ATOM 171 N ILE A 15 0.747 7.961 3.079 1.00 0.00 N ATOM 172 CA ILE A 15 0.994 7.526 4.448 1.00 0.00 C ATOM 173 C ILE A 15 -0.174 7.888 5.359 1.00 0.00 C ATOM 174 O ILE A 15 -0.672 7.048 6.109 1.00 0.00 O ATOM 175 CB ILE A 15 2.284 8.150 5.013 1.00 0.00 C ATOM 176 CG1 ILE A 15 3.500 7.663 4.223 1.00 0.00 C ATOM 177 CG2 ILE A 15 2.433 7.812 6.488 1.00 0.00 C ATOM 178 CD1 ILE A 15 4.723 8.536 4.397 1.00 0.00 C ATOM 0 H ILE A 15 1.506 8.503 2.665 1.00 0.00 H new ATOM 0 HA ILE A 15 1.107 6.442 4.419 1.00 0.00 H new ATOM 0 HB ILE A 15 2.220 9.234 4.914 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.742 6.647 4.534 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.242 7.620 3.165 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.349 8.260 6.873 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.578 8.204 7.039 1.00 0.00 H new ATOM 0 HG23 ILE A 15 2.479 6.730 6.610 1.00 0.00 H new ATOM 0 HD11 ILE A 15 5.546 8.131 3.809 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.499 9.548 4.059 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.006 8.560 5.449 1.00 0.00 H new ATOM 190 N ILE A 16 -0.607 9.142 5.286 1.00 0.00 N ATOM 191 CA ILE A 16 -1.719 9.614 6.102 1.00 0.00 C ATOM 192 C ILE A 16 -2.953 8.741 5.908 1.00 0.00 C ATOM 193 O ILE A 16 -3.728 8.527 6.840 1.00 0.00 O ATOM 194 CB ILE A 16 -2.080 11.074 5.771 1.00 0.00 C ATOM 195 CG1 ILE A 16 -0.849 11.972 5.915 1.00 0.00 C ATOM 196 CG2 ILE A 16 -3.204 11.560 6.673 1.00 0.00 C ATOM 197 CD1 ILE A 16 -1.051 13.367 5.365 1.00 0.00 C ATOM 0 H ILE A 16 -0.205 9.849 4.671 1.00 0.00 H new ATOM 0 HA ILE A 16 -1.395 9.555 7.141 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.423 11.122 4.738 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -0.581 12.041 6.969 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -0.008 11.506 5.402 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.447 12.593 6.426 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.085 10.935 6.526 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.887 11.500 7.714 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -0.138 13.947 5.501 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -1.289 13.308 4.303 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -1.871 13.852 5.894 1.00 0.00 H new ATOM 209 N TRP A 17 -3.129 8.237 4.691 1.00 0.00 N ATOM 210 CA TRP A 17 -4.269 7.384 4.375 1.00 0.00 C ATOM 211 C TRP A 17 -4.125 6.016 5.033 1.00 0.00 C ATOM 212 O TRP A 17 -5.047 5.533 5.690 1.00 0.00 O ATOM 213 CB TRP A 17 -4.407 7.224 2.860 1.00 0.00 C ATOM 214 CG TRP A 17 -5.473 6.248 2.461 1.00 0.00 C ATOM 215 CD1 TRP A 17 -6.824 6.444 2.512 1.00 0.00 C ATOM 216 CD2 TRP A 17 -5.276 4.925 1.952 1.00 0.00 C ATOM 217 NE1 TRP A 17 -7.478 5.321 2.065 1.00 0.00 N ATOM 218 CE2 TRP A 17 -6.551 4.375 1.715 1.00 0.00 C ATOM 219 CE3 TRP A 17 -4.146 4.151 1.671 1.00 0.00 C ATOM 220 CZ2 TRP A 17 -6.725 3.089 1.212 1.00 0.00 C ATOM 221 CZ3 TRP A 17 -4.321 2.874 1.172 1.00 0.00 C ATOM 222 CH2 TRP A 17 -5.602 2.354 0.946 1.00 0.00 C ATOM 0 H TRP A 17 -2.497 8.404 3.908 1.00 0.00 H new ATOM 0 HA TRP A 17 -5.168 7.861 4.766 1.00 0.00 H new ATOM 0 HB2 TRP A 17 -4.630 8.195 2.418 1.00 0.00 H new ATOM 0 HB3 TRP A 17 -3.452 6.897 2.448 1.00 0.00 H new ATOM 0 HD1 TRP A 17 -7.307 7.348 2.853 1.00 0.00 H new ATOM 0 HE1 TRP A 17 -8.490 5.210 2.004 1.00 0.00 H new ATOM 0 HE3 TRP A 17 -3.154 4.544 1.841 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 -7.712 2.686 1.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 -3.455 2.267 0.953 1.00 0.00 H new ATOM 0 HH2 TRP A 17 -5.705 1.353 0.554 1.00 0.00 H new ATOM 233 N LEU A 18 -2.964 5.397 4.852 1.00 0.00 N ATOM 234 CA LEU A 18 -2.699 4.084 5.428 1.00 0.00 C ATOM 235 C LEU A 18 -2.827 4.120 6.948 1.00 0.00 C ATOM 236 O LEU A 18 -3.124 3.107 7.579 1.00 0.00 O ATOM 237 CB LEU A 18 -1.301 3.605 5.034 1.00 0.00 C ATOM 238 CG LEU A 18 -1.134 2.095 4.857 1.00 0.00 C ATOM 239 CD1 LEU A 18 -1.028 1.408 6.210 1.00 0.00 C ATOM 240 CD2 LEU A 18 -2.292 1.521 4.055 1.00 0.00 C ATOM 0 H LEU A 18 -2.191 5.784 4.311 1.00 0.00 H new ATOM 0 HA LEU A 18 -3.439 3.387 5.036 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.021 4.093 4.101 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -0.596 3.942 5.794 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.211 1.913 4.306 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -0.910 0.334 6.065 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.165 1.798 6.750 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -1.933 1.598 6.787 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -2.157 0.446 3.939 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.228 1.714 4.578 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -2.322 1.991 3.072 1.00 0.00 H new ATOM 252 N GLN A 19 -2.603 5.295 7.527 1.00 0.00 N ATOM 253 CA GLN A 19 -2.695 5.464 8.973 1.00 0.00 C ATOM 254 C GLN A 19 -4.058 5.014 9.487 1.00 0.00 C ATOM 255 O GLN A 19 -4.166 4.435 10.569 1.00 0.00 O ATOM 256 CB GLN A 19 -2.449 6.924 9.354 1.00 0.00 C ATOM 257 CG GLN A 19 -0.984 7.327 9.309 1.00 0.00 C ATOM 258 CD GLN A 19 -0.721 8.650 10.001 1.00 0.00 C ATOM 259 OE1 GLN A 19 -1.639 9.288 10.517 1.00 0.00 O ATOM 260 NE2 GLN A 19 0.539 9.070 10.016 1.00 0.00 N ATOM 0 H GLN A 19 -2.357 6.144 7.018 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.929 4.842 9.436 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -3.015 7.567 8.680 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -2.834 7.098 10.359 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -0.383 6.549 9.780 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -0.661 7.394 8.270 1.00 0.00 H new ATOM 0 HE21 GLN A 19 1.269 8.509 9.576 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.777 9.953 10.468 1.00 0.00 H new ATOM 269 N THR A 20 -5.099 5.283 8.705 1.00 0.00 N ATOM 270 CA THR A 20 -6.456 4.907 9.082 1.00 0.00 C ATOM 271 C THR A 20 -6.499 3.490 9.642 1.00 0.00 C ATOM 272 O THR A 20 -7.371 3.154 10.444 1.00 0.00 O ATOM 273 CB THR A 20 -7.419 5.004 7.884 1.00 0.00 C ATOM 274 OG1 THR A 20 -7.087 4.010 6.908 1.00 0.00 O ATOM 275 CG2 THR A 20 -7.358 6.385 7.251 1.00 0.00 C ATOM 0 H THR A 20 -5.028 5.760 7.806 1.00 0.00 H new ATOM 0 HA THR A 20 -6.776 5.608 9.853 1.00 0.00 H new ATOM 0 HB THR A 20 -8.433 4.833 8.246 1.00 0.00 H new ATOM 0 HG1 THR A 20 -6.273 3.539 7.184 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.047 6.429 6.407 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.640 7.136 7.989 1.00 0.00 H new ATOM 0 HG23 THR A 20 -6.344 6.581 6.902 1.00 0.00 H new ATOM 283 N PHE A 21 -5.552 2.661 9.215 1.00 0.00 N ATOM 284 CA PHE A 21 -5.482 1.279 9.673 1.00 0.00 C ATOM 285 C PHE A 21 -4.539 1.148 10.865 1.00 0.00 C ATOM 286 O PHE A 21 -3.317 1.173 10.712 1.00 0.00 O ATOM 287 CB PHE A 21 -5.015 0.366 8.537 1.00 0.00 C ATOM 288 CG PHE A 21 -5.850 0.481 7.294 1.00 0.00 C ATOM 289 CD1 PHE A 21 -5.701 1.562 6.441 1.00 0.00 C ATOM 290 CD2 PHE A 21 -6.785 -0.492 6.979 1.00 0.00 C ATOM 291 CE1 PHE A 21 -6.467 1.671 5.296 1.00 0.00 C ATOM 292 CE2 PHE A 21 -7.554 -0.389 5.835 1.00 0.00 C ATOM 293 CZ PHE A 21 -7.396 0.695 4.993 1.00 0.00 C ATOM 0 H PHE A 21 -4.822 2.923 8.552 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.481 0.976 9.987 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -3.980 0.604 8.293 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.032 -0.668 8.882 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -4.977 2.329 6.674 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.914 -1.340 7.635 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.339 2.518 4.639 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -8.278 -1.155 5.600 1.00 0.00 H new ATOM 0 HZ PHE A 21 -7.998 0.779 4.100 1.00 0.00 H new ATOM 303 N LYS A 22 -5.114 1.010 12.055 1.00 0.00 N ATOM 304 CA LYS A 22 -4.328 0.875 13.275 1.00 0.00 C ATOM 305 C LYS A 22 -3.878 -0.569 13.475 1.00 0.00 C ATOM 306 O LYS A 22 -3.786 -1.051 14.605 1.00 0.00 O ATOM 307 CB LYS A 22 -5.142 1.339 14.485 1.00 0.00 C ATOM 308 CG LYS A 22 -6.280 0.401 14.848 1.00 0.00 C ATOM 309 CD LYS A 22 -6.486 0.330 16.352 1.00 0.00 C ATOM 310 CE LYS A 22 -7.938 0.042 16.703 1.00 0.00 C ATOM 311 NZ LYS A 22 -8.081 -0.468 18.095 1.00 0.00 N ATOM 0 H LYS A 22 -6.123 0.989 12.200 1.00 0.00 H new ATOM 0 HA LYS A 22 -3.442 1.503 13.178 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -4.477 1.439 15.343 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.550 2.329 14.280 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.199 0.740 14.370 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -6.068 -0.596 14.461 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -5.848 -0.448 16.771 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -6.181 1.272 16.807 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -8.527 0.952 16.587 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -8.342 -0.691 16.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -9.085 -0.652 18.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -7.540 -1.350 18.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -7.719 0.241 18.764 1.00 0.00 H new ATOM 325 N THR A 23 -3.596 -1.255 12.372 1.00 0.00 N ATOM 326 CA THR A 23 -3.155 -2.643 12.426 1.00 0.00 C ATOM 327 C THR A 23 -2.091 -2.840 13.499 1.00 0.00 C ATOM 328 O THR A 23 -1.483 -1.878 13.968 1.00 0.00 O ATOM 329 CB THR A 23 -2.593 -3.107 11.069 1.00 0.00 C ATOM 330 OG1 THR A 23 -1.660 -2.142 10.569 1.00 0.00 O ATOM 331 CG2 THR A 23 -3.712 -3.309 10.060 1.00 0.00 C ATOM 0 H THR A 23 -3.665 -0.871 11.429 1.00 0.00 H new ATOM 0 HA THR A 23 -4.030 -3.244 12.672 1.00 0.00 H new ATOM 0 HB THR A 23 -2.084 -4.060 11.218 1.00 0.00 H new ATOM 0 HG1 THR A 23 -0.998 -1.938 11.262 1.00 0.00 H new ATOM 0 HG21 THR A 23 -3.290 -3.637 9.110 1.00 0.00 H new ATOM 0 HG22 THR A 23 -4.404 -4.066 10.430 1.00 0.00 H new ATOM 0 HG23 THR A 23 -4.246 -2.370 9.916 1.00 0.00 H new ATOM 339 N ALA A 24 -1.869 -4.093 13.884 1.00 0.00 N ATOM 340 CA ALA A 24 -0.876 -4.416 14.900 1.00 0.00 C ATOM 341 C ALA A 24 0.402 -3.609 14.694 1.00 0.00 C ATOM 342 O ALA A 24 1.144 -3.352 15.642 1.00 0.00 O ATOM 343 CB ALA A 24 -0.570 -5.906 14.884 1.00 0.00 C ATOM 0 H ALA A 24 -2.364 -4.901 13.507 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.289 -4.152 15.874 1.00 0.00 H new ATOM 0 HB1 ALA A 24 0.173 -6.133 15.648 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -1.482 -6.467 15.087 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -0.182 -6.187 13.905 1.00 0.00 H new ATOM 349 N SER A 25 0.653 -3.214 13.450 1.00 0.00 N ATOM 350 CA SER A 25 1.844 -2.441 13.119 1.00 0.00 C ATOM 351 C SER A 25 1.487 -0.983 12.846 1.00 0.00 C ATOM 352 O SER A 25 0.583 -0.674 12.069 1.00 0.00 O ATOM 353 CB SER A 25 2.547 -3.042 11.900 1.00 0.00 C ATOM 354 OG SER A 25 3.889 -2.597 11.814 1.00 0.00 O ATOM 0 H SER A 25 0.047 -3.417 12.655 1.00 0.00 H new ATOM 0 HA SER A 25 2.519 -2.478 13.974 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.525 -4.130 11.963 1.00 0.00 H new ATOM 0 HB3 SER A 25 2.010 -2.764 10.993 1.00 0.00 H new ATOM 0 HG SER A 25 3.991 -2.014 11.033 1.00 0.00 H new ATOM 360 N PRO A 26 2.213 -0.064 13.501 1.00 0.00 N ATOM 361 CA PRO A 26 1.992 1.377 13.346 1.00 0.00 C ATOM 362 C PRO A 26 2.412 1.883 11.970 1.00 0.00 C ATOM 363 O PRO A 26 2.963 1.132 11.164 1.00 0.00 O ATOM 364 CB PRO A 26 2.876 1.990 14.434 1.00 0.00 C ATOM 365 CG PRO A 26 3.946 0.981 14.667 1.00 0.00 C ATOM 366 CD PRO A 26 3.305 -0.361 14.442 1.00 0.00 C ATOM 0 HA PRO A 26 0.938 1.640 13.436 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.295 2.944 14.113 1.00 0.00 H new ATOM 0 HB3 PRO A 26 2.308 2.182 15.344 1.00 0.00 H new ATOM 0 HG2 PRO A 26 4.782 1.134 13.984 1.00 0.00 H new ATOM 0 HG3 PRO A 26 4.343 1.059 15.679 1.00 0.00 H new ATOM 0 HD2 PRO A 26 4.011 -1.079 14.024 1.00 0.00 H new ATOM 0 HD3 PRO A 26 2.929 -0.788 15.372 1.00 0.00 H new ATOM 374 N CYS A 27 2.148 3.158 11.708 1.00 0.00 N ATOM 375 CA CYS A 27 2.499 3.764 10.428 1.00 0.00 C ATOM 376 C CYS A 27 2.740 5.262 10.584 1.00 0.00 C ATOM 377 O CYS A 27 1.809 6.027 10.835 1.00 0.00 O ATOM 378 CB CYS A 27 1.391 3.517 9.403 1.00 0.00 C ATOM 379 SG CYS A 27 1.437 4.637 7.984 1.00 0.00 S ATOM 0 H CYS A 27 1.692 3.792 12.364 1.00 0.00 H new ATOM 0 HA CYS A 27 3.420 3.301 10.075 1.00 0.00 H new ATOM 0 HB2 CYS A 27 1.464 2.490 9.045 1.00 0.00 H new ATOM 0 HB3 CYS A 27 0.425 3.614 9.898 1.00 0.00 H new ATOM 0 HG CYS A 27 0.225 4.984 7.665 1.00 0.00 H new ATOM 385 N GLN A 28 3.995 5.673 10.435 1.00 0.00 N ATOM 386 CA GLN A 28 4.359 7.079 10.562 1.00 0.00 C ATOM 387 C GLN A 28 5.169 7.543 9.356 1.00 0.00 C ATOM 388 O GLN A 28 4.694 8.337 8.544 1.00 0.00 O ATOM 389 CB GLN A 28 5.157 7.308 11.847 1.00 0.00 C ATOM 390 CG GLN A 28 4.377 6.989 13.112 1.00 0.00 C ATOM 391 CD GLN A 28 5.234 7.066 14.360 1.00 0.00 C ATOM 392 OE1 GLN A 28 6.242 7.773 14.392 1.00 0.00 O ATOM 393 NE2 GLN A 28 4.837 6.338 15.397 1.00 0.00 N ATOM 0 H GLN A 28 4.777 5.052 10.226 1.00 0.00 H new ATOM 0 HA GLN A 28 3.440 7.663 10.605 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.057 6.694 11.820 1.00 0.00 H new ATOM 0 HB3 GLN A 28 5.482 8.348 11.883 1.00 0.00 H new ATOM 0 HG2 GLN A 28 3.543 7.684 13.205 1.00 0.00 H new ATOM 0 HG3 GLN A 28 3.951 5.989 13.029 1.00 0.00 H new ATOM 0 HE21 GLN A 28 3.995 5.766 15.326 1.00 0.00 H new ATOM 0 HE22 GLN A 28 5.374 6.350 16.264 1.00 0.00 H new ATOM 402 N ASP A 29 6.395 7.042 9.246 1.00 0.00 N ATOM 403 CA ASP A 29 7.272 7.405 8.138 1.00 0.00 C ATOM 404 C ASP A 29 7.385 6.259 7.138 1.00 0.00 C ATOM 405 O ASP A 29 6.720 5.232 7.275 1.00 0.00 O ATOM 406 CB ASP A 29 8.659 7.781 8.661 1.00 0.00 C ATOM 407 CG ASP A 29 9.381 8.747 7.743 1.00 0.00 C ATOM 408 OD1 ASP A 29 8.706 9.603 7.133 1.00 0.00 O ATOM 409 OD2 ASP A 29 10.621 8.648 7.633 1.00 0.00 O ATOM 0 H ASP A 29 6.804 6.384 9.910 1.00 0.00 H new ATOM 0 HA ASP A 29 6.838 8.266 7.629 1.00 0.00 H new ATOM 0 HB2 ASP A 29 8.562 8.228 9.650 1.00 0.00 H new ATOM 0 HB3 ASP A 29 9.258 6.878 8.777 1.00 0.00 H new ATOM 414 N VAL A 30 8.232 6.442 6.129 1.00 0.00 N ATOM 415 CA VAL A 30 8.432 5.424 5.105 1.00 0.00 C ATOM 416 C VAL A 30 9.347 4.313 5.606 1.00 0.00 C ATOM 417 O VAL A 30 9.221 3.158 5.199 1.00 0.00 O ATOM 418 CB VAL A 30 9.033 6.030 3.822 1.00 0.00 C ATOM 419 CG1 VAL A 30 8.410 7.386 3.529 1.00 0.00 C ATOM 420 CG2 VAL A 30 10.545 6.144 3.946 1.00 0.00 C ATOM 0 H VAL A 30 8.790 7.286 6.000 1.00 0.00 H new ATOM 0 HA VAL A 30 7.451 5.007 4.877 1.00 0.00 H new ATOM 0 HB VAL A 30 8.808 5.366 2.987 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.847 7.798 2.619 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.334 7.271 3.395 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.602 8.062 4.362 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.954 6.574 3.031 1.00 0.00 H new ATOM 0 HG22 VAL A 30 10.793 6.786 4.791 1.00 0.00 H new ATOM 0 HG23 VAL A 30 10.973 5.154 4.104 1.00 0.00 H new ATOM 430 N LYS A 31 10.270 4.669 6.494 1.00 0.00 N ATOM 431 CA LYS A 31 11.207 3.702 7.054 1.00 0.00 C ATOM 432 C LYS A 31 10.491 2.727 7.984 1.00 0.00 C ATOM 433 O LYS A 31 10.999 1.643 8.270 1.00 0.00 O ATOM 434 CB LYS A 31 12.322 4.423 7.814 1.00 0.00 C ATOM 435 CG LYS A 31 12.853 5.651 7.094 1.00 0.00 C ATOM 436 CD LYS A 31 14.285 5.959 7.500 1.00 0.00 C ATOM 437 CE LYS A 31 14.954 6.902 6.511 1.00 0.00 C ATOM 438 NZ LYS A 31 14.595 8.323 6.771 1.00 0.00 N ATOM 0 H LYS A 31 10.389 5.621 6.841 1.00 0.00 H new ATOM 0 HA LYS A 31 11.644 3.137 6.230 1.00 0.00 H new ATOM 0 HB2 LYS A 31 11.949 4.720 8.794 1.00 0.00 H new ATOM 0 HB3 LYS A 31 13.144 3.727 7.983 1.00 0.00 H new ATOM 0 HG2 LYS A 31 12.805 5.491 6.017 1.00 0.00 H new ATOM 0 HG3 LYS A 31 12.218 6.508 7.318 1.00 0.00 H new ATOM 0 HD2 LYS A 31 14.294 6.406 8.494 1.00 0.00 H new ATOM 0 HD3 LYS A 31 14.854 5.032 7.562 1.00 0.00 H new ATOM 0 HE2 LYS A 31 16.036 6.784 6.571 1.00 0.00 H new ATOM 0 HE3 LYS A 31 14.660 6.633 5.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 15.070 8.934 6.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 13.565 8.442 6.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 14.898 8.588 7.730 1.00 0.00 H new ATOM 452 N GLN A 32 9.311 3.120 8.451 1.00 0.00 N ATOM 453 CA GLN A 32 8.526 2.280 9.348 1.00 0.00 C ATOM 454 C GLN A 32 7.615 1.345 8.560 1.00 0.00 C ATOM 455 O GLN A 32 7.284 0.251 9.018 1.00 0.00 O ATOM 456 CB GLN A 32 7.693 3.146 10.294 1.00 0.00 C ATOM 457 CG GLN A 32 8.480 3.684 11.478 1.00 0.00 C ATOM 458 CD GLN A 32 7.594 4.336 12.521 1.00 0.00 C ATOM 459 OE1 GLN A 32 7.867 5.445 12.979 1.00 0.00 O ATOM 460 NE2 GLN A 32 6.524 3.648 12.902 1.00 0.00 N ATOM 0 H GLN A 32 8.877 4.015 8.223 1.00 0.00 H new ATOM 0 HA GLN A 32 9.217 1.675 9.935 1.00 0.00 H new ATOM 0 HB2 GLN A 32 7.277 3.984 9.734 1.00 0.00 H new ATOM 0 HB3 GLN A 32 6.852 2.560 10.664 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.038 2.869 11.939 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.212 4.410 11.123 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.336 2.731 12.496 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.890 4.036 13.601 1.00 0.00 H new ATOM 469 N LEU A 33 7.211 1.783 7.372 1.00 0.00 N ATOM 470 CA LEU A 33 6.337 0.986 6.519 1.00 0.00 C ATOM 471 C LEU A 33 7.150 0.140 5.545 1.00 0.00 C ATOM 472 O LEU A 33 6.677 -0.883 5.048 1.00 0.00 O ATOM 473 CB LEU A 33 5.378 1.894 5.747 1.00 0.00 C ATOM 474 CG LEU A 33 4.313 2.608 6.580 1.00 0.00 C ATOM 475 CD1 LEU A 33 3.953 3.946 5.952 1.00 0.00 C ATOM 476 CD2 LEU A 33 3.075 1.734 6.724 1.00 0.00 C ATOM 0 H LEU A 33 7.475 2.686 6.978 1.00 0.00 H new ATOM 0 HA LEU A 33 5.759 0.317 7.157 1.00 0.00 H new ATOM 0 HB2 LEU A 33 5.966 2.647 5.222 1.00 0.00 H new ATOM 0 HB3 LEU A 33 4.875 1.296 4.987 1.00 0.00 H new ATOM 0 HG LEU A 33 4.720 2.794 7.574 1.00 0.00 H new ATOM 0 HD11 LEU A 33 3.194 4.440 6.558 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.842 4.575 5.901 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.565 3.783 4.946 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.327 2.258 7.320 1.00 0.00 H new ATOM 0 HD22 LEU A 33 2.666 1.517 5.737 1.00 0.00 H new ATOM 0 HD23 LEU A 33 3.344 0.801 7.218 1.00 0.00 H new ATOM 488 N THR A 34 8.378 0.572 5.276 1.00 0.00 N ATOM 489 CA THR A 34 9.258 -0.145 4.363 1.00 0.00 C ATOM 490 C THR A 34 9.229 -1.645 4.635 1.00 0.00 C ATOM 491 O THR A 34 9.543 -2.450 3.760 1.00 0.00 O ATOM 492 CB THR A 34 10.710 0.357 4.471 1.00 0.00 C ATOM 493 OG1 THR A 34 11.035 0.626 5.840 1.00 0.00 O ATOM 494 CG2 THR A 34 10.911 1.615 3.640 1.00 0.00 C ATOM 0 H THR A 34 8.786 1.416 5.678 1.00 0.00 H new ATOM 0 HA THR A 34 8.890 0.046 3.355 1.00 0.00 H new ATOM 0 HB THR A 34 11.370 -0.421 4.088 1.00 0.00 H new ATOM 0 HG1 THR A 34 11.960 0.944 5.900 1.00 0.00 H new ATOM 0 HG21 THR A 34 11.944 1.951 3.732 1.00 0.00 H new ATOM 0 HG22 THR A 34 10.691 1.399 2.594 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.242 2.398 3.997 1.00 0.00 H new ATOM 502 N ASN A 35 8.849 -2.013 5.854 1.00 0.00 N ATOM 503 CA ASN A 35 8.779 -3.417 6.242 1.00 0.00 C ATOM 504 C ASN A 35 7.730 -4.157 5.417 1.00 0.00 C ATOM 505 O ASN A 35 8.002 -5.216 4.853 1.00 0.00 O ATOM 506 CB ASN A 35 8.453 -3.541 7.732 1.00 0.00 C ATOM 507 CG ASN A 35 8.153 -4.970 8.141 1.00 0.00 C ATOM 508 OD1 ASN A 35 8.168 -5.881 7.313 1.00 0.00 O ATOM 509 ND2 ASN A 35 7.877 -5.172 9.424 1.00 0.00 N ATOM 0 H ASN A 35 8.585 -1.358 6.590 1.00 0.00 H new ATOM 0 HA ASN A 35 9.752 -3.870 6.051 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.293 -3.167 8.317 1.00 0.00 H new ATOM 0 HB3 ASN A 35 7.595 -2.911 7.967 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.666 -6.112 9.758 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.876 -4.387 10.075 1.00 0.00 H new ATOM 516 N GLY A 36 6.529 -3.591 5.352 1.00 0.00 N ATOM 517 CA GLY A 36 5.457 -4.210 4.594 1.00 0.00 C ATOM 518 C GLY A 36 4.303 -4.648 5.473 1.00 0.00 C ATOM 519 O GLY A 36 3.139 -4.443 5.131 1.00 0.00 O ATOM 0 H GLY A 36 6.279 -2.715 5.811 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.093 -3.507 3.845 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.848 -5.074 4.056 1.00 0.00 H new ATOM 523 N VAL A 37 4.625 -5.256 6.611 1.00 0.00 N ATOM 524 CA VAL A 37 3.607 -5.725 7.542 1.00 0.00 C ATOM 525 C VAL A 37 2.429 -4.759 7.601 1.00 0.00 C ATOM 526 O VAL A 37 1.335 -5.066 7.127 1.00 0.00 O ATOM 527 CB VAL A 37 4.182 -5.904 8.960 1.00 0.00 C ATOM 528 CG1 VAL A 37 3.132 -6.487 9.893 1.00 0.00 C ATOM 529 CG2 VAL A 37 5.423 -6.783 8.924 1.00 0.00 C ATOM 0 H VAL A 37 5.584 -5.435 6.910 1.00 0.00 H new ATOM 0 HA VAL A 37 3.263 -6.691 7.173 1.00 0.00 H new ATOM 0 HB VAL A 37 4.469 -4.925 9.343 1.00 0.00 H new ATOM 0 HG11 VAL A 37 3.557 -6.606 10.890 1.00 0.00 H new ATOM 0 HG12 VAL A 37 2.275 -5.815 9.942 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.810 -7.458 9.517 1.00 0.00 H new ATOM 0 HG21 VAL A 37 5.816 -6.899 9.934 1.00 0.00 H new ATOM 0 HG22 VAL A 37 5.164 -7.762 8.521 1.00 0.00 H new ATOM 0 HG23 VAL A 37 6.179 -6.319 8.291 1.00 0.00 H new ATOM 539 N THR A 38 2.660 -3.588 8.187 1.00 0.00 N ATOM 540 CA THR A 38 1.618 -2.576 8.309 1.00 0.00 C ATOM 541 C THR A 38 0.750 -2.527 7.057 1.00 0.00 C ATOM 542 O THR A 38 -0.467 -2.362 7.141 1.00 0.00 O ATOM 543 CB THR A 38 2.219 -1.179 8.558 1.00 0.00 C ATOM 544 OG1 THR A 38 3.179 -1.241 9.618 1.00 0.00 O ATOM 545 CG2 THR A 38 1.130 -0.178 8.911 1.00 0.00 C ATOM 0 H THR A 38 3.560 -3.317 8.584 1.00 0.00 H new ATOM 0 HA THR A 38 1.003 -2.857 9.164 1.00 0.00 H new ATOM 0 HB THR A 38 2.711 -0.850 7.642 1.00 0.00 H new ATOM 0 HG1 THR A 38 3.119 -0.428 10.162 1.00 0.00 H new ATOM 0 HG21 THR A 38 1.577 0.801 9.083 1.00 0.00 H new ATOM 0 HG22 THR A 38 0.416 -0.112 8.090 1.00 0.00 H new ATOM 0 HG23 THR A 38 0.615 -0.505 9.814 1.00 0.00 H new ATOM 553 N MET A 39 1.382 -2.674 5.898 1.00 0.00 N ATOM 554 CA MET A 39 0.664 -2.649 4.628 1.00 0.00 C ATOM 555 C MET A 39 -0.118 -3.942 4.420 1.00 0.00 C ATOM 556 O MET A 39 -1.336 -3.920 4.250 1.00 0.00 O ATOM 557 CB MET A 39 1.642 -2.437 3.470 1.00 0.00 C ATOM 558 CG MET A 39 2.402 -1.124 3.549 1.00 0.00 C ATOM 559 SD MET A 39 3.267 -0.729 2.017 1.00 0.00 S ATOM 560 CE MET A 39 4.970 -0.976 2.515 1.00 0.00 C ATOM 0 H MET A 39 2.389 -2.812 5.811 1.00 0.00 H new ATOM 0 HA MET A 39 -0.042 -1.819 4.654 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.356 -3.260 3.453 1.00 0.00 H new ATOM 0 HB3 MET A 39 1.092 -2.473 2.530 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.706 -0.320 3.786 1.00 0.00 H new ATOM 0 HG3 MET A 39 3.122 -1.174 4.366 1.00 0.00 H new ATOM 0 HE1 MET A 39 5.613 -0.287 1.968 1.00 0.00 H new ATOM 0 HE2 MET A 39 5.067 -0.791 3.585 1.00 0.00 H new ATOM 0 HE3 MET A 39 5.268 -2.001 2.296 1.00 0.00 H new ATOM 570 N ALA A 40 0.592 -5.066 4.433 1.00 0.00 N ATOM 571 CA ALA A 40 -0.037 -6.367 4.247 1.00 0.00 C ATOM 572 C ALA A 40 -1.275 -6.510 5.125 1.00 0.00 C ATOM 573 O ALA A 40 -2.304 -7.021 4.684 1.00 0.00 O ATOM 574 CB ALA A 40 0.956 -7.481 4.547 1.00 0.00 C ATOM 0 H ALA A 40 1.602 -5.101 4.570 1.00 0.00 H new ATOM 0 HA ALA A 40 -0.351 -6.445 3.206 1.00 0.00 H new ATOM 0 HB1 ALA A 40 0.473 -8.447 4.404 1.00 0.00 H new ATOM 0 HB2 ALA A 40 1.809 -7.399 3.874 1.00 0.00 H new ATOM 0 HB3 ALA A 40 1.298 -7.395 5.578 1.00 0.00 H new ATOM 580 N GLN A 41 -1.168 -6.055 6.370 1.00 0.00 N ATOM 581 CA GLN A 41 -2.280 -6.134 7.310 1.00 0.00 C ATOM 582 C GLN A 41 -3.480 -5.342 6.801 1.00 0.00 C ATOM 583 O GLN A 41 -4.625 -5.646 7.137 1.00 0.00 O ATOM 584 CB GLN A 41 -1.853 -5.610 8.682 1.00 0.00 C ATOM 585 CG GLN A 41 -1.063 -6.619 9.500 1.00 0.00 C ATOM 586 CD GLN A 41 -1.059 -6.295 10.981 1.00 0.00 C ATOM 587 OE1 GLN A 41 0.130 -6.109 11.543 1.00 0.00 O flip ATOM 588 NE2 GLN A 41 -2.112 -6.212 11.613 1.00 0.00 N flip ATOM 0 H GLN A 41 -0.323 -5.628 6.750 1.00 0.00 H new ATOM 0 HA GLN A 41 -2.571 -7.180 7.403 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.250 -4.712 8.547 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -2.741 -5.316 9.242 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -1.486 -7.613 9.351 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -0.036 -6.651 9.136 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -3.003 -6.363 11.141 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -2.093 -5.993 12.609 1.00 0.00 H new ATOM 597 N VAL A 42 -3.210 -4.325 5.989 1.00 0.00 N ATOM 598 CA VAL A 42 -4.268 -3.489 5.433 1.00 0.00 C ATOM 599 C VAL A 42 -4.985 -4.199 4.289 1.00 0.00 C ATOM 600 O VAL A 42 -6.198 -4.067 4.126 1.00 0.00 O ATOM 601 CB VAL A 42 -3.713 -2.147 4.922 1.00 0.00 C ATOM 602 CG1 VAL A 42 -4.768 -1.404 4.116 1.00 0.00 C ATOM 603 CG2 VAL A 42 -3.222 -1.297 6.084 1.00 0.00 C ATOM 0 H VAL A 42 -2.268 -4.060 5.701 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.976 -3.297 6.239 1.00 0.00 H new ATOM 0 HB VAL A 42 -2.866 -2.350 4.266 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -4.357 -0.458 3.763 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -5.067 -2.011 3.261 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.637 -1.210 4.745 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -2.833 -0.352 5.705 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -4.049 -1.101 6.767 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -2.432 -1.828 6.615 1.00 0.00 H new ATOM 613 N LEU A 43 -4.227 -4.952 3.501 1.00 0.00 N ATOM 614 CA LEU A 43 -4.789 -5.684 2.371 1.00 0.00 C ATOM 615 C LEU A 43 -5.895 -6.629 2.831 1.00 0.00 C ATOM 616 O LEU A 43 -6.910 -6.789 2.153 1.00 0.00 O ATOM 617 CB LEU A 43 -3.693 -6.475 1.654 1.00 0.00 C ATOM 618 CG LEU A 43 -2.973 -5.746 0.519 1.00 0.00 C ATOM 619 CD1 LEU A 43 -3.976 -5.213 -0.493 1.00 0.00 C ATOM 620 CD2 LEU A 43 -2.116 -4.616 1.069 1.00 0.00 C ATOM 0 H LEU A 43 -3.221 -5.072 3.623 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.219 -4.960 1.678 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.951 -6.780 2.392 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.135 -7.386 1.251 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.319 -6.457 0.013 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.446 -4.697 -1.294 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -4.547 -6.042 -0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -4.655 -4.517 -0.000 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.611 -4.109 0.247 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.749 -3.905 1.600 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.373 -5.023 1.755 1.00 0.00 H new ATOM 632 N HIS A 44 -5.692 -7.251 3.988 1.00 0.00 N ATOM 633 CA HIS A 44 -6.674 -8.177 4.540 1.00 0.00 C ATOM 634 C HIS A 44 -7.991 -7.464 4.830 1.00 0.00 C ATOM 635 O HIS A 44 -9.044 -8.096 4.914 1.00 0.00 O ATOM 636 CB HIS A 44 -6.137 -8.821 5.819 1.00 0.00 C ATOM 637 CG HIS A 44 -7.125 -9.716 6.500 1.00 0.00 C ATOM 638 ND1 HIS A 44 -7.163 -11.081 6.305 1.00 0.00 N ATOM 639 CD2 HIS A 44 -8.115 -9.436 7.380 1.00 0.00 C ATOM 640 CE1 HIS A 44 -8.135 -11.600 7.034 1.00 0.00 C ATOM 641 NE2 HIS A 44 -8.727 -10.623 7.696 1.00 0.00 N ATOM 0 H HIS A 44 -4.857 -7.131 4.561 1.00 0.00 H new ATOM 0 HA HIS A 44 -6.858 -8.956 3.800 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -5.243 -9.397 5.578 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -5.833 -8.036 6.511 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -8.375 -8.460 7.762 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -8.400 -12.646 7.081 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -9.512 -10.733 8.338 1.00 0.00 H new ATOM 650 N GLN A 45 -7.924 -6.145 4.983 1.00 0.00 N ATOM 651 CA GLN A 45 -9.111 -5.348 5.265 1.00 0.00 C ATOM 652 C GLN A 45 -9.837 -4.977 3.976 1.00 0.00 C ATOM 653 O GLN A 45 -11.054 -5.131 3.872 1.00 0.00 O ATOM 654 CB GLN A 45 -8.730 -4.081 6.033 1.00 0.00 C ATOM 655 CG GLN A 45 -7.942 -4.353 7.304 1.00 0.00 C ATOM 656 CD GLN A 45 -8.183 -3.308 8.375 1.00 0.00 C ATOM 657 OE1 GLN A 45 -9.177 -2.582 8.338 1.00 0.00 O ATOM 658 NE2 GLN A 45 -7.273 -3.227 9.339 1.00 0.00 N ATOM 0 H GLN A 45 -7.060 -5.607 4.916 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.783 -5.948 5.879 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -8.141 -3.435 5.382 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -9.638 -3.534 6.288 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.213 -5.335 7.692 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.879 -4.387 7.067 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.464 -3.849 9.331 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.383 -2.543 10.088 1.00 0.00 H new ATOM 667 N ILE A 46 -9.082 -4.487 2.998 1.00 0.00 N ATOM 668 CA ILE A 46 -9.654 -4.095 1.716 1.00 0.00 C ATOM 669 C ILE A 46 -10.474 -5.229 1.110 1.00 0.00 C ATOM 670 O ILE A 46 -11.681 -5.096 0.907 1.00 0.00 O ATOM 671 CB ILE A 46 -8.560 -3.676 0.716 1.00 0.00 C ATOM 672 CG1 ILE A 46 -7.738 -2.517 1.283 1.00 0.00 C ATOM 673 CG2 ILE A 46 -9.181 -3.291 -0.618 1.00 0.00 C ATOM 674 CD1 ILE A 46 -6.453 -2.260 0.526 1.00 0.00 C ATOM 0 H ILE A 46 -8.073 -4.352 3.069 1.00 0.00 H new ATOM 0 HA ILE A 46 -10.305 -3.242 1.908 1.00 0.00 H new ATOM 0 HB ILE A 46 -7.894 -4.523 0.552 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -8.345 -1.612 1.271 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -7.500 -2.727 2.326 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.395 -2.997 -1.314 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -9.726 -4.143 -1.025 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.867 -2.457 -0.473 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -5.922 -1.425 0.983 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -5.826 -3.151 0.560 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -6.684 -2.018 -0.511 1.00 0.00 H new ATOM 686 N ASP A 47 -9.811 -6.344 0.825 1.00 0.00 N ATOM 687 CA ASP A 47 -10.478 -7.504 0.245 1.00 0.00 C ATOM 688 C ASP A 47 -10.068 -8.784 0.966 1.00 0.00 C ATOM 689 O ASP A 47 -9.221 -9.536 0.484 1.00 0.00 O ATOM 690 CB ASP A 47 -10.150 -7.615 -1.245 1.00 0.00 C ATOM 691 CG ASP A 47 -8.674 -7.421 -1.529 1.00 0.00 C ATOM 692 OD1 ASP A 47 -8.068 -6.513 -0.922 1.00 0.00 O ATOM 693 OD2 ASP A 47 -8.124 -8.175 -2.359 1.00 0.00 O ATOM 0 H ASP A 47 -8.812 -6.469 0.986 1.00 0.00 H new ATOM 0 HA ASP A 47 -11.553 -7.371 0.363 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -10.462 -8.593 -1.611 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -10.724 -6.871 -1.797 1.00 0.00 H new ATOM 698 N VAL A 48 -10.674 -9.025 2.124 1.00 0.00 N ATOM 699 CA VAL A 48 -10.372 -10.214 2.912 1.00 0.00 C ATOM 700 C VAL A 48 -10.427 -11.472 2.052 1.00 0.00 C ATOM 701 O VAL A 48 -9.667 -12.416 2.267 1.00 0.00 O ATOM 702 CB VAL A 48 -11.351 -10.370 4.091 1.00 0.00 C ATOM 703 CG1 VAL A 48 -12.696 -10.885 3.604 1.00 0.00 C ATOM 704 CG2 VAL A 48 -10.767 -11.294 5.149 1.00 0.00 C ATOM 0 H VAL A 48 -11.377 -8.413 2.537 1.00 0.00 H new ATOM 0 HA VAL A 48 -9.362 -10.087 3.302 1.00 0.00 H new ATOM 0 HB VAL A 48 -11.507 -9.391 4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -13.374 -10.989 4.451 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -13.117 -10.181 2.886 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -12.562 -11.855 3.125 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -11.472 -11.393 5.975 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -10.580 -12.275 4.712 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -9.830 -10.877 5.519 1.00 0.00 H new ATOM 714 N ALA A 49 -11.329 -11.476 1.077 1.00 0.00 N ATOM 715 CA ALA A 49 -11.481 -12.617 0.182 1.00 0.00 C ATOM 716 C ALA A 49 -10.145 -13.010 -0.438 1.00 0.00 C ATOM 717 O ALA A 49 -9.696 -14.148 -0.299 1.00 0.00 O ATOM 718 CB ALA A 49 -12.498 -12.302 -0.906 1.00 0.00 C ATOM 0 H ALA A 49 -11.966 -10.702 0.886 1.00 0.00 H new ATOM 0 HA ALA A 49 -11.842 -13.462 0.768 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.602 -13.162 -1.567 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -13.462 -12.077 -0.449 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.160 -11.441 -1.482 1.00 0.00 H new ATOM 724 N TRP A 50 -9.514 -12.063 -1.122 1.00 0.00 N ATOM 725 CA TRP A 50 -8.228 -12.312 -1.764 1.00 0.00 C ATOM 726 C TRP A 50 -7.096 -12.288 -0.743 1.00 0.00 C ATOM 727 O TRP A 50 -6.092 -12.984 -0.899 1.00 0.00 O ATOM 728 CB TRP A 50 -7.969 -11.271 -2.855 1.00 0.00 C ATOM 729 CG TRP A 50 -6.866 -11.655 -3.794 1.00 0.00 C ATOM 730 CD1 TRP A 50 -5.616 -11.109 -3.857 1.00 0.00 C ATOM 731 CD2 TRP A 50 -6.915 -12.668 -4.805 1.00 0.00 C ATOM 732 NE1 TRP A 50 -4.885 -11.722 -4.846 1.00 0.00 N ATOM 733 CE2 TRP A 50 -5.659 -12.682 -5.442 1.00 0.00 C ATOM 734 CE3 TRP A 50 -7.897 -13.566 -5.232 1.00 0.00 C ATOM 735 CZ2 TRP A 50 -5.362 -13.558 -6.483 1.00 0.00 C ATOM 736 CZ3 TRP A 50 -7.601 -14.434 -6.266 1.00 0.00 C ATOM 737 CH2 TRP A 50 -6.342 -14.425 -6.881 1.00 0.00 C ATOM 0 H TRP A 50 -9.871 -11.116 -1.247 1.00 0.00 H new ATOM 0 HA TRP A 50 -8.262 -13.303 -2.217 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -8.885 -11.118 -3.426 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -7.722 -10.318 -2.387 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -5.255 -10.313 -3.223 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.922 -11.498 -5.096 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -8.870 -13.581 -4.763 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -4.393 -13.553 -6.959 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -8.353 -15.131 -6.606 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -6.141 -15.117 -7.686 1.00 0.00 H new ATOM 748 N PHE A 51 -7.264 -11.484 0.301 1.00 0.00 N ATOM 749 CA PHE A 51 -6.255 -11.370 1.348 1.00 0.00 C ATOM 750 C PHE A 51 -6.787 -11.900 2.676 1.00 0.00 C ATOM 751 O PHE A 51 -7.298 -11.141 3.500 1.00 0.00 O ATOM 752 CB PHE A 51 -5.816 -9.913 1.506 1.00 0.00 C ATOM 753 CG PHE A 51 -5.080 -9.375 0.313 1.00 0.00 C ATOM 754 CD1 PHE A 51 -3.712 -9.555 0.187 1.00 0.00 C ATOM 755 CD2 PHE A 51 -5.756 -8.689 -0.684 1.00 0.00 C ATOM 756 CE1 PHE A 51 -3.032 -9.062 -0.911 1.00 0.00 C ATOM 757 CE2 PHE A 51 -5.082 -8.195 -1.783 1.00 0.00 C ATOM 758 CZ PHE A 51 -3.717 -8.380 -1.897 1.00 0.00 C ATOM 0 H PHE A 51 -8.089 -10.902 0.445 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.394 -11.972 1.056 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -6.695 -9.295 1.689 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -5.178 -9.828 2.385 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.171 -10.087 0.956 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -6.822 -8.539 -0.600 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -1.966 -9.210 -0.998 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.621 -7.664 -2.554 1.00 0.00 H new ATOM 0 HZ PHE A 51 -3.188 -7.992 -2.755 1.00 0.00 H new ATOM 768 N SER A 52 -6.664 -13.208 2.877 1.00 0.00 N ATOM 769 CA SER A 52 -7.136 -13.842 4.103 1.00 0.00 C ATOM 770 C SER A 52 -5.988 -14.045 5.086 1.00 0.00 C ATOM 771 O SER A 52 -4.829 -13.778 4.767 1.00 0.00 O ATOM 772 CB SER A 52 -7.795 -15.185 3.786 1.00 0.00 C ATOM 773 OG SER A 52 -8.188 -15.853 4.973 1.00 0.00 O ATOM 0 H SER A 52 -6.241 -13.850 2.206 1.00 0.00 H new ATOM 0 HA SER A 52 -7.873 -13.184 4.563 1.00 0.00 H new ATOM 0 HB2 SER A 52 -8.665 -15.025 3.150 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.101 -15.811 3.225 1.00 0.00 H new ATOM 0 HG SER A 52 -8.608 -16.708 4.743 1.00 0.00 H new ATOM 779 N GLU A 53 -6.319 -14.518 6.283 1.00 0.00 N ATOM 780 CA GLU A 53 -5.316 -14.756 7.314 1.00 0.00 C ATOM 781 C GLU A 53 -4.259 -15.744 6.828 1.00 0.00 C ATOM 782 O GLU A 53 -3.121 -15.734 7.297 1.00 0.00 O ATOM 783 CB GLU A 53 -5.977 -15.286 8.588 1.00 0.00 C ATOM 784 CG GLU A 53 -6.912 -14.287 9.249 1.00 0.00 C ATOM 785 CD GLU A 53 -7.873 -14.943 10.222 1.00 0.00 C ATOM 786 OE1 GLU A 53 -7.402 -15.675 11.117 1.00 0.00 O ATOM 787 OE2 GLU A 53 -9.095 -14.724 10.088 1.00 0.00 O ATOM 0 H GLU A 53 -7.274 -14.744 6.563 1.00 0.00 H new ATOM 0 HA GLU A 53 -4.827 -13.807 7.534 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -6.536 -16.190 8.348 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -5.201 -15.570 9.299 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -6.322 -13.537 9.776 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -7.480 -13.763 8.480 1.00 0.00 H new ATOM 794 N SER A 54 -4.646 -16.597 5.885 1.00 0.00 N ATOM 795 CA SER A 54 -3.734 -17.595 5.337 1.00 0.00 C ATOM 796 C SER A 54 -2.574 -16.928 4.604 1.00 0.00 C ATOM 797 O SER A 54 -1.470 -17.469 4.544 1.00 0.00 O ATOM 798 CB SER A 54 -4.482 -18.532 4.386 1.00 0.00 C ATOM 799 OG SER A 54 -5.414 -19.335 5.089 1.00 0.00 O ATOM 0 H SER A 54 -5.584 -16.617 5.485 1.00 0.00 H new ATOM 0 HA SER A 54 -3.330 -18.176 6.166 1.00 0.00 H new ATOM 0 HB2 SER A 54 -5.001 -17.946 3.627 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.769 -19.170 3.864 1.00 0.00 H new ATOM 0 HG SER A 54 -5.880 -19.923 4.459 1.00 0.00 H new ATOM 805 N TRP A 55 -2.834 -15.750 4.049 1.00 0.00 N ATOM 806 CA TRP A 55 -1.812 -15.007 3.319 1.00 0.00 C ATOM 807 C TRP A 55 -1.007 -14.120 4.262 1.00 0.00 C ATOM 808 O TRP A 55 0.223 -14.088 4.201 1.00 0.00 O ATOM 809 CB TRP A 55 -2.456 -14.156 2.224 1.00 0.00 C ATOM 810 CG TRP A 55 -1.502 -13.193 1.582 1.00 0.00 C ATOM 811 CD1 TRP A 55 -0.658 -13.448 0.540 1.00 0.00 C ATOM 812 CD2 TRP A 55 -1.295 -11.823 1.943 1.00 0.00 C ATOM 813 NE1 TRP A 55 0.062 -12.319 0.231 1.00 0.00 N ATOM 814 CE2 TRP A 55 -0.311 -11.309 1.077 1.00 0.00 C ATOM 815 CE3 TRP A 55 -1.846 -10.981 2.913 1.00 0.00 C ATOM 816 CZ2 TRP A 55 0.132 -9.991 1.153 1.00 0.00 C ATOM 817 CZ3 TRP A 55 -1.405 -9.674 2.988 1.00 0.00 C ATOM 818 CH2 TRP A 55 -0.425 -9.189 2.112 1.00 0.00 C ATOM 0 H TRP A 55 -3.743 -15.289 4.090 1.00 0.00 H new ATOM 0 HA TRP A 55 -1.134 -15.726 2.859 1.00 0.00 H new ATOM 0 HB2 TRP A 55 -2.868 -14.813 1.458 1.00 0.00 H new ATOM 0 HB3 TRP A 55 -3.291 -13.600 2.650 1.00 0.00 H new ATOM 0 HD1 TRP A 55 -0.569 -14.397 0.033 1.00 0.00 H new ATOM 0 HE1 TRP A 55 0.761 -12.245 -0.508 1.00 0.00 H new ATOM 0 HE3 TRP A 55 -2.603 -11.346 3.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 55 0.888 -9.615 0.479 1.00 0.00 H new ATOM 0 HZ3 TRP A 55 -1.823 -9.015 3.735 1.00 0.00 H new ATOM 0 HH2 TRP A 55 -0.103 -8.162 2.195 1.00 0.00 H new ATOM 829 N LEU A 56 -1.706 -13.402 5.134 1.00 0.00 N ATOM 830 CA LEU A 56 -1.055 -12.514 6.091 1.00 0.00 C ATOM 831 C LEU A 56 -0.258 -13.312 7.118 1.00 0.00 C ATOM 832 O LEU A 56 0.572 -12.758 7.840 1.00 0.00 O ATOM 833 CB LEU A 56 -2.095 -11.645 6.799 1.00 0.00 C ATOM 834 CG LEU A 56 -1.551 -10.643 7.818 1.00 0.00 C ATOM 835 CD1 LEU A 56 -0.953 -9.436 7.113 1.00 0.00 C ATOM 836 CD2 LEU A 56 -2.648 -10.212 8.780 1.00 0.00 C ATOM 0 H LEU A 56 -2.724 -13.417 5.198 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.366 -11.871 5.543 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -2.656 -11.096 6.043 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.803 -12.301 7.306 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.763 -11.130 8.392 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.571 -8.734 7.854 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.138 -9.760 6.466 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -1.721 -8.948 6.513 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.243 -9.499 9.498 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -3.458 -9.744 8.221 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.030 -11.084 9.311 1.00 0.00 H new ATOM 848 N SER A 57 -0.513 -14.615 7.177 1.00 0.00 N ATOM 849 CA SER A 57 0.179 -15.488 8.117 1.00 0.00 C ATOM 850 C SER A 57 1.637 -15.679 7.708 1.00 0.00 C ATOM 851 O SER A 57 2.480 -16.042 8.528 1.00 0.00 O ATOM 852 CB SER A 57 -0.522 -16.846 8.196 1.00 0.00 C ATOM 853 OG SER A 57 -1.674 -16.778 9.018 1.00 0.00 O ATOM 0 H SER A 57 -1.194 -15.089 6.584 1.00 0.00 H new ATOM 0 HA SER A 57 0.153 -15.016 9.099 1.00 0.00 H new ATOM 0 HB2 SER A 57 -0.804 -17.172 7.195 1.00 0.00 H new ATOM 0 HB3 SER A 57 0.167 -17.592 8.591 1.00 0.00 H new ATOM 0 HG SER A 57 -2.465 -16.620 8.461 1.00 0.00 H new ATOM 859 N ARG A 58 1.925 -15.431 6.435 1.00 0.00 N ATOM 860 CA ARG A 58 3.280 -15.576 5.916 1.00 0.00 C ATOM 861 C ARG A 58 4.096 -14.311 6.164 1.00 0.00 C ATOM 862 O ARG A 58 5.317 -14.308 6.007 1.00 0.00 O ATOM 863 CB ARG A 58 3.244 -15.887 4.418 1.00 0.00 C ATOM 864 CG ARG A 58 2.000 -16.642 3.982 1.00 0.00 C ATOM 865 CD ARG A 58 2.298 -17.592 2.833 1.00 0.00 C ATOM 866 NE ARG A 58 3.029 -16.932 1.754 1.00 0.00 N ATOM 867 CZ ARG A 58 3.169 -17.449 0.538 1.00 0.00 C ATOM 868 NH1 ARG A 58 2.630 -18.625 0.248 1.00 0.00 N ATOM 869 NH2 ARG A 58 3.849 -16.788 -0.391 1.00 0.00 N ATOM 0 H ARG A 58 1.239 -15.129 5.744 1.00 0.00 H new ATOM 0 HA ARG A 58 3.757 -16.404 6.441 1.00 0.00 H new ATOM 0 HB2 ARG A 58 3.306 -14.953 3.860 1.00 0.00 H new ATOM 0 HB3 ARG A 58 4.125 -16.473 4.156 1.00 0.00 H new ATOM 0 HG2 ARG A 58 1.600 -17.204 4.826 1.00 0.00 H new ATOM 0 HG3 ARG A 58 1.230 -15.932 3.678 1.00 0.00 H new ATOM 0 HD2 ARG A 58 2.880 -18.436 3.202 1.00 0.00 H new ATOM 0 HD3 ARG A 58 1.363 -17.995 2.444 1.00 0.00 H new ATOM 0 HE ARG A 58 3.455 -16.025 1.944 1.00 0.00 H new ATOM 0 HH11 ARG A 58 2.106 -19.135 0.959 1.00 0.00 H new ATOM 0 HH12 ARG A 58 2.739 -19.020 -0.686 1.00 0.00 H new ATOM 0 HH21 ARG A 58 4.264 -15.883 -0.172 1.00 0.00 H new ATOM 0 HH22 ARG A 58 3.956 -17.186 -1.324 1.00 0.00 H new ATOM 883 N ILE A 59 3.413 -13.239 6.552 1.00 0.00 N ATOM 884 CA ILE A 59 4.074 -11.969 6.823 1.00 0.00 C ATOM 885 C ILE A 59 4.608 -11.920 8.251 1.00 0.00 C ATOM 886 O ILE A 59 3.917 -12.299 9.197 1.00 0.00 O ATOM 887 CB ILE A 59 3.121 -10.780 6.602 1.00 0.00 C ATOM 888 CG1 ILE A 59 2.261 -11.012 5.358 1.00 0.00 C ATOM 889 CG2 ILE A 59 3.910 -9.485 6.473 1.00 0.00 C ATOM 890 CD1 ILE A 59 2.994 -10.755 4.060 1.00 0.00 C ATOM 0 H ILE A 59 2.402 -13.225 6.686 1.00 0.00 H new ATOM 0 HA ILE A 59 4.907 -11.892 6.124 1.00 0.00 H new ATOM 0 HB ILE A 59 2.462 -10.696 7.466 1.00 0.00 H new ATOM 0 HG12 ILE A 59 1.898 -12.040 5.364 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.385 -10.365 5.406 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.222 -8.654 6.317 1.00 0.00 H new ATOM 0 HG22 ILE A 59 4.483 -9.316 7.385 1.00 0.00 H new ATOM 0 HG23 ILE A 59 4.591 -9.557 5.625 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.323 -10.939 3.221 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.333 -9.720 4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 59 3.854 -11.421 3.990 1.00 0.00 H new ATOM 902 N LYS A 60 5.841 -11.450 8.400 1.00 0.00 N ATOM 903 CA LYS A 60 6.468 -11.347 9.712 1.00 0.00 C ATOM 904 C LYS A 60 6.749 -9.891 10.069 1.00 0.00 C ATOM 905 O LYS A 60 6.779 -9.023 9.197 1.00 0.00 O ATOM 906 CB LYS A 60 7.770 -12.151 9.742 1.00 0.00 C ATOM 907 CG LYS A 60 7.582 -13.599 10.161 1.00 0.00 C ATOM 908 CD LYS A 60 8.839 -14.163 10.801 1.00 0.00 C ATOM 909 CE LYS A 60 9.754 -14.800 9.766 1.00 0.00 C ATOM 910 NZ LYS A 60 10.997 -15.341 10.382 1.00 0.00 N ATOM 0 H LYS A 60 6.427 -11.134 7.627 1.00 0.00 H new ATOM 0 HA LYS A 60 5.778 -11.756 10.450 1.00 0.00 H new ATOM 0 HB2 LYS A 60 8.226 -12.124 8.753 1.00 0.00 H new ATOM 0 HB3 LYS A 60 8.468 -11.671 10.428 1.00 0.00 H new ATOM 0 HG2 LYS A 60 6.752 -13.670 10.864 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.315 -14.199 9.291 1.00 0.00 H new ATOM 0 HD2 LYS A 60 9.373 -13.367 11.320 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.565 -14.904 11.552 1.00 0.00 H new ATOM 0 HE2 LYS A 60 9.222 -15.603 9.256 1.00 0.00 H new ATOM 0 HE3 LYS A 60 10.016 -14.061 9.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 11.593 -15.766 9.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 11.518 -14.570 10.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 10.749 -16.065 11.086 1.00 0.00 H new ATOM 924 N ASP A 61 6.955 -9.631 11.355 1.00 0.00 N ATOM 925 CA ASP A 61 7.237 -8.280 11.827 1.00 0.00 C ATOM 926 C ASP A 61 8.548 -8.238 12.605 1.00 0.00 C ATOM 927 O ASP A 61 8.954 -7.187 13.101 1.00 0.00 O ATOM 928 CB ASP A 61 6.091 -7.775 12.706 1.00 0.00 C ATOM 929 CG ASP A 61 6.437 -6.485 13.423 1.00 0.00 C ATOM 930 OD1 ASP A 61 6.504 -5.434 12.753 1.00 0.00 O ATOM 931 OD2 ASP A 61 6.642 -6.527 14.654 1.00 0.00 O ATOM 0 H ASP A 61 6.932 -10.338 12.090 1.00 0.00 H new ATOM 0 HA ASP A 61 7.332 -7.630 10.957 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.206 -7.619 12.090 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.837 -8.539 13.441 1.00 0.00 H new ATOM 936 N ASP A 62 9.205 -9.388 12.709 1.00 0.00 N ATOM 937 CA ASP A 62 10.471 -9.483 13.427 1.00 0.00 C ATOM 938 C ASP A 62 11.516 -8.558 12.811 1.00 0.00 C ATOM 939 O ASP A 62 12.581 -8.337 13.387 1.00 0.00 O ATOM 940 CB ASP A 62 10.980 -10.925 13.419 1.00 0.00 C ATOM 941 CG ASP A 62 10.495 -11.717 14.617 1.00 0.00 C ATOM 942 OD1 ASP A 62 10.438 -11.143 15.724 1.00 0.00 O ATOM 943 OD2 ASP A 62 10.172 -12.912 14.448 1.00 0.00 O ATOM 0 H ASP A 62 8.882 -10.267 12.305 1.00 0.00 H new ATOM 0 HA ASP A 62 10.300 -9.173 14.458 1.00 0.00 H new ATOM 0 HB2 ASP A 62 10.651 -11.418 12.504 1.00 0.00 H new ATOM 0 HB3 ASP A 62 12.070 -10.922 13.406 1.00 0.00 H new ATOM 948 N VAL A 63 11.204 -8.021 11.635 1.00 0.00 N ATOM 949 CA VAL A 63 12.116 -7.121 10.940 1.00 0.00 C ATOM 950 C VAL A 63 12.809 -6.178 11.918 1.00 0.00 C ATOM 951 O VAL A 63 13.920 -5.713 11.667 1.00 0.00 O ATOM 952 CB VAL A 63 11.379 -6.287 9.876 1.00 0.00 C ATOM 953 CG1 VAL A 63 10.719 -7.195 8.849 1.00 0.00 C ATOM 954 CG2 VAL A 63 10.352 -5.375 10.531 1.00 0.00 C ATOM 0 H VAL A 63 10.327 -8.194 11.144 1.00 0.00 H new ATOM 0 HA VAL A 63 12.863 -7.745 10.449 1.00 0.00 H new ATOM 0 HB VAL A 63 12.108 -5.663 9.359 1.00 0.00 H new ATOM 0 HG11 VAL A 63 10.203 -6.588 8.105 1.00 0.00 H new ATOM 0 HG12 VAL A 63 11.480 -7.802 8.358 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.001 -7.846 9.347 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.841 -4.793 9.764 1.00 0.00 H new ATOM 0 HG22 VAL A 63 9.624 -5.978 11.075 1.00 0.00 H new ATOM 0 HG23 VAL A 63 10.854 -4.700 11.224 1.00 0.00 H new ATOM 964 N GLY A 64 12.145 -5.901 13.036 1.00 0.00 N ATOM 965 CA GLY A 64 12.712 -5.015 14.036 1.00 0.00 C ATOM 966 C GLY A 64 14.227 -4.977 13.984 1.00 0.00 C ATOM 967 O GLY A 64 14.822 -3.915 13.802 1.00 0.00 O ATOM 0 H GLY A 64 11.224 -6.274 13.267 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.321 -4.008 13.889 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.393 -5.339 15.027 1.00 0.00 H new ATOM 971 N ASP A 65 14.852 -6.138 14.146 1.00 0.00 N ATOM 972 CA ASP A 65 16.307 -6.233 14.118 1.00 0.00 C ATOM 973 C ASP A 65 16.785 -6.861 12.812 1.00 0.00 C ATOM 974 O ASP A 65 17.985 -6.990 12.577 1.00 0.00 O ATOM 975 CB ASP A 65 16.809 -7.054 15.306 1.00 0.00 C ATOM 976 CG ASP A 65 15.986 -6.823 16.559 1.00 0.00 C ATOM 977 OD1 ASP A 65 14.916 -7.452 16.691 1.00 0.00 O ATOM 978 OD2 ASP A 65 16.413 -6.012 17.407 1.00 0.00 O ATOM 0 H ASP A 65 14.374 -7.026 14.298 1.00 0.00 H new ATOM 0 HA ASP A 65 16.714 -5.224 14.186 1.00 0.00 H new ATOM 0 HB2 ASP A 65 16.784 -8.113 15.049 1.00 0.00 H new ATOM 0 HB3 ASP A 65 17.850 -6.799 15.506 1.00 0.00 H new ATOM 983 N ASN A 66 15.836 -7.251 11.967 1.00 0.00 N ATOM 984 CA ASN A 66 16.160 -7.868 10.686 1.00 0.00 C ATOM 985 C ASN A 66 15.646 -7.018 9.528 1.00 0.00 C ATOM 986 O ASN A 66 14.497 -6.576 9.532 1.00 0.00 O ATOM 987 CB ASN A 66 15.562 -9.274 10.606 1.00 0.00 C ATOM 988 CG ASN A 66 16.526 -10.340 11.091 1.00 0.00 C ATOM 989 OD1 ASN A 66 17.743 -10.181 10.997 1.00 0.00 O ATOM 990 ND2 ASN A 66 15.983 -11.434 11.612 1.00 0.00 N ATOM 0 H ASN A 66 14.837 -7.151 12.146 1.00 0.00 H new ATOM 0 HA ASN A 66 17.245 -7.938 10.609 1.00 0.00 H new ATOM 0 HB2 ASN A 66 14.651 -9.313 11.203 1.00 0.00 H new ATOM 0 HB3 ASN A 66 15.277 -9.487 9.576 1.00 0.00 H new ATOM 0 HD21 ASN A 66 16.580 -12.186 11.955 1.00 0.00 H new ATOM 0 HD22 ASN A 66 14.968 -11.522 11.670 1.00 0.00 H new ATOM 997 N TRP A 67 16.503 -6.795 8.539 1.00 0.00 N ATOM 998 CA TRP A 67 16.135 -5.998 7.373 1.00 0.00 C ATOM 999 C TRP A 67 15.707 -6.893 6.216 1.00 0.00 C ATOM 1000 O TRP A 67 15.019 -6.448 5.297 1.00 0.00 O ATOM 1001 CB TRP A 67 17.307 -5.114 6.944 1.00 0.00 C ATOM 1002 CG TRP A 67 18.531 -5.892 6.566 1.00 0.00 C ATOM 1003 CD1 TRP A 67 19.642 -6.096 7.334 1.00 0.00 C ATOM 1004 CD2 TRP A 67 18.768 -6.567 5.326 1.00 0.00 C ATOM 1005 NE1 TRP A 67 20.555 -6.857 6.646 1.00 0.00 N ATOM 1006 CE2 TRP A 67 20.043 -7.161 5.412 1.00 0.00 C ATOM 1007 CE3 TRP A 67 18.028 -6.731 4.153 1.00 0.00 C ATOM 1008 CZ2 TRP A 67 20.591 -7.902 4.369 1.00 0.00 C ATOM 1009 CZ3 TRP A 67 18.573 -7.467 3.118 1.00 0.00 C ATOM 1010 CH2 TRP A 67 19.844 -8.046 3.232 1.00 0.00 C ATOM 0 H TRP A 67 17.457 -7.154 8.520 1.00 0.00 H new ATOM 0 HA TRP A 67 15.292 -5.364 7.648 1.00 0.00 H new ATOM 0 HB2 TRP A 67 16.999 -4.501 6.097 1.00 0.00 H new ATOM 0 HB3 TRP A 67 17.555 -4.432 7.758 1.00 0.00 H new ATOM 0 HD1 TRP A 67 19.782 -5.715 8.335 1.00 0.00 H new ATOM 0 HE1 TRP A 67 21.467 -7.149 6.997 1.00 0.00 H new ATOM 0 HE3 TRP A 67 17.047 -6.290 4.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 21.571 -8.347 4.454 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 18.010 -7.598 2.206 1.00 0.00 H new ATOM 0 HH2 TRP A 67 20.242 -8.617 2.406 1.00 0.00 H new ATOM 1021 N ARG A 68 16.116 -8.156 6.267 1.00 0.00 N ATOM 1022 CA ARG A 68 15.775 -9.113 5.221 1.00 0.00 C ATOM 1023 C ARG A 68 14.296 -9.482 5.284 1.00 0.00 C ATOM 1024 O ARG A 68 13.618 -9.547 4.258 1.00 0.00 O ATOM 1025 CB ARG A 68 16.632 -10.373 5.354 1.00 0.00 C ATOM 1026 CG ARG A 68 18.127 -10.098 5.336 1.00 0.00 C ATOM 1027 CD ARG A 68 18.909 -11.300 4.830 1.00 0.00 C ATOM 1028 NE ARG A 68 18.911 -11.379 3.372 1.00 0.00 N ATOM 1029 CZ ARG A 68 19.208 -12.483 2.696 1.00 0.00 C ATOM 1030 NH1 ARG A 68 19.525 -13.596 3.343 1.00 0.00 N ATOM 1031 NH2 ARG A 68 19.188 -12.475 1.369 1.00 0.00 N ATOM 0 H ARG A 68 16.684 -8.541 7.022 1.00 0.00 H new ATOM 0 HA ARG A 68 15.975 -8.646 4.257 1.00 0.00 H new ATOM 0 HB2 ARG A 68 16.376 -10.880 6.284 1.00 0.00 H new ATOM 0 HB3 ARG A 68 16.387 -11.056 4.541 1.00 0.00 H new ATOM 0 HG2 ARG A 68 18.332 -9.236 4.701 1.00 0.00 H new ATOM 0 HG3 ARG A 68 18.463 -9.841 6.341 1.00 0.00 H new ATOM 0 HD2 ARG A 68 19.936 -11.242 5.191 1.00 0.00 H new ATOM 0 HD3 ARG A 68 18.477 -12.212 5.242 1.00 0.00 H new ATOM 0 HE ARG A 68 18.671 -10.540 2.844 1.00 0.00 H new ATOM 0 HH11 ARG A 68 19.541 -13.606 4.363 1.00 0.00 H new ATOM 0 HH12 ARG A 68 19.753 -14.442 2.821 1.00 0.00 H new ATOM 0 HH21 ARG A 68 18.944 -11.621 0.868 1.00 0.00 H new ATOM 0 HH22 ARG A 68 19.416 -13.323 0.850 1.00 0.00 H new ATOM 1045 N ILE A 69 13.802 -9.724 6.494 1.00 0.00 N ATOM 1046 CA ILE A 69 12.404 -10.086 6.690 1.00 0.00 C ATOM 1047 C ILE A 69 11.475 -9.040 6.083 1.00 0.00 C ATOM 1048 O ILE A 69 10.336 -9.339 5.723 1.00 0.00 O ATOM 1049 CB ILE A 69 12.069 -10.249 8.184 1.00 0.00 C ATOM 1050 CG1 ILE A 69 12.918 -11.362 8.801 1.00 0.00 C ATOM 1051 CG2 ILE A 69 10.587 -10.542 8.366 1.00 0.00 C ATOM 1052 CD1 ILE A 69 12.806 -11.443 10.308 1.00 0.00 C ATOM 0 H ILE A 69 14.350 -9.676 7.353 1.00 0.00 H new ATOM 0 HA ILE A 69 12.251 -11.040 6.186 1.00 0.00 H new ATOM 0 HB ILE A 69 12.300 -9.315 8.697 1.00 0.00 H new ATOM 0 HG12 ILE A 69 12.618 -12.318 8.371 1.00 0.00 H new ATOM 0 HG13 ILE A 69 13.962 -11.204 8.530 1.00 0.00 H new ATOM 0 HG21 ILE A 69 10.366 -10.655 9.427 1.00 0.00 H new ATOM 0 HG22 ILE A 69 10.001 -9.718 7.959 1.00 0.00 H new ATOM 0 HG23 ILE A 69 10.331 -11.463 7.842 1.00 0.00 H new ATOM 0 HD11 ILE A 69 13.434 -12.254 10.676 1.00 0.00 H new ATOM 0 HD12 ILE A 69 13.134 -10.501 10.748 1.00 0.00 H new ATOM 0 HD13 ILE A 69 11.769 -11.632 10.586 1.00 0.00 H new ATOM 1064 N LYS A 70 11.970 -7.812 5.970 1.00 0.00 N ATOM 1065 CA LYS A 70 11.187 -6.720 5.404 1.00 0.00 C ATOM 1066 C LYS A 70 10.845 -6.996 3.943 1.00 0.00 C ATOM 1067 O LYS A 70 9.674 -7.031 3.566 1.00 0.00 O ATOM 1068 CB LYS A 70 11.954 -5.401 5.519 1.00 0.00 C ATOM 1069 CG LYS A 70 11.829 -4.741 6.881 1.00 0.00 C ATOM 1070 CD LYS A 70 12.000 -3.234 6.788 1.00 0.00 C ATOM 1071 CE LYS A 70 13.468 -2.841 6.742 1.00 0.00 C ATOM 1072 NZ LYS A 70 13.678 -1.427 7.159 1.00 0.00 N ATOM 0 H LYS A 70 12.911 -7.548 6.263 1.00 0.00 H new ATOM 0 HA LYS A 70 10.258 -6.643 5.968 1.00 0.00 H new ATOM 0 HB2 LYS A 70 13.008 -5.584 5.309 1.00 0.00 H new ATOM 0 HB3 LYS A 70 11.591 -4.712 4.756 1.00 0.00 H new ATOM 0 HG2 LYS A 70 10.854 -4.972 7.310 1.00 0.00 H new ATOM 0 HG3 LYS A 70 12.580 -5.152 7.556 1.00 0.00 H new ATOM 0 HD2 LYS A 70 11.495 -2.864 5.896 1.00 0.00 H new ATOM 0 HD3 LYS A 70 11.522 -2.759 7.645 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.041 -3.501 7.394 1.00 0.00 H new ATOM 0 HE3 LYS A 70 13.850 -2.982 5.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 14.692 -1.199 7.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 13.152 -0.795 6.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 13.337 -1.298 8.133 1.00 0.00 H new ATOM 1086 N ALA A 71 11.875 -7.194 3.127 1.00 0.00 N ATOM 1087 CA ALA A 71 11.683 -7.470 1.708 1.00 0.00 C ATOM 1088 C ALA A 71 10.678 -8.598 1.500 1.00 0.00 C ATOM 1089 O ALA A 71 9.697 -8.441 0.773 1.00 0.00 O ATOM 1090 CB ALA A 71 13.012 -7.818 1.054 1.00 0.00 C ATOM 0 H ALA A 71 12.851 -7.169 3.424 1.00 0.00 H new ATOM 0 HA ALA A 71 11.284 -6.571 1.239 1.00 0.00 H new ATOM 0 HB1 ALA A 71 12.854 -8.022 -0.005 1.00 0.00 H new ATOM 0 HB2 ALA A 71 13.702 -6.981 1.164 1.00 0.00 H new ATOM 0 HB3 ALA A 71 13.434 -8.701 1.534 1.00 0.00 H new ATOM 1096 N SER A 72 10.928 -9.734 2.142 1.00 0.00 N ATOM 1097 CA SER A 72 10.047 -10.890 2.024 1.00 0.00 C ATOM 1098 C SER A 72 8.583 -10.460 2.034 1.00 0.00 C ATOM 1099 O SER A 72 7.793 -10.890 1.195 1.00 0.00 O ATOM 1100 CB SER A 72 10.309 -11.877 3.163 1.00 0.00 C ATOM 1101 OG SER A 72 10.014 -13.204 2.766 1.00 0.00 O ATOM 0 H SER A 72 11.734 -9.879 2.750 1.00 0.00 H new ATOM 0 HA SER A 72 10.257 -11.380 1.074 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.352 -11.810 3.473 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.701 -11.609 4.027 1.00 0.00 H new ATOM 0 HG SER A 72 10.191 -13.815 3.511 1.00 0.00 H new ATOM 1107 N ASN A 73 8.230 -9.608 2.991 1.00 0.00 N ATOM 1108 CA ASN A 73 6.861 -9.120 3.112 1.00 0.00 C ATOM 1109 C ASN A 73 6.471 -8.286 1.895 1.00 0.00 C ATOM 1110 O ASN A 73 5.492 -8.586 1.210 1.00 0.00 O ATOM 1111 CB ASN A 73 6.705 -8.287 4.386 1.00 0.00 C ATOM 1112 CG ASN A 73 7.153 -9.037 5.625 1.00 0.00 C ATOM 1113 OD1 ASN A 73 6.902 -10.234 5.764 1.00 0.00 O ATOM 1114 ND2 ASN A 73 7.819 -8.334 6.534 1.00 0.00 N ATOM 0 H ASN A 73 8.872 -9.241 3.693 1.00 0.00 H new ATOM 0 HA ASN A 73 6.198 -9.983 3.167 1.00 0.00 H new ATOM 0 HB2 ASN A 73 7.285 -7.369 4.290 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.661 -7.994 4.500 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.145 -8.785 7.389 1.00 0.00 H new ATOM 0 HD22 ASN A 73 8.005 -7.343 6.377 1.00 0.00 H new ATOM 1121 N LEU A 74 7.244 -7.238 1.631 1.00 0.00 N ATOM 1122 CA LEU A 74 6.981 -6.360 0.495 1.00 0.00 C ATOM 1123 C LEU A 74 6.663 -7.171 -0.757 1.00 0.00 C ATOM 1124 O LEU A 74 5.754 -6.831 -1.516 1.00 0.00 O ATOM 1125 CB LEU A 74 8.185 -5.453 0.237 1.00 0.00 C ATOM 1126 CG LEU A 74 8.163 -4.094 0.937 1.00 0.00 C ATOM 1127 CD1 LEU A 74 8.033 -4.270 2.442 1.00 0.00 C ATOM 1128 CD2 LEU A 74 9.416 -3.299 0.598 1.00 0.00 C ATOM 0 H LEU A 74 8.057 -6.975 2.187 1.00 0.00 H new ATOM 0 HA LEU A 74 6.115 -5.744 0.736 1.00 0.00 H new ATOM 0 HB2 LEU A 74 9.086 -5.983 0.544 1.00 0.00 H new ATOM 0 HB3 LEU A 74 8.265 -5.285 -0.837 1.00 0.00 H new ATOM 0 HG LEU A 74 7.296 -3.538 0.581 1.00 0.00 H new ATOM 0 HD11 LEU A 74 8.019 -3.292 2.923 1.00 0.00 H new ATOM 0 HD12 LEU A 74 7.107 -4.799 2.668 1.00 0.00 H new ATOM 0 HD13 LEU A 74 8.880 -4.846 2.815 1.00 0.00 H new ATOM 0 HD21 LEU A 74 9.383 -2.335 1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 74 10.297 -3.851 0.925 1.00 0.00 H new ATOM 0 HD23 LEU A 74 9.466 -3.141 -0.479 1.00 0.00 H new ATOM 1140 N LYS A 75 7.415 -8.246 -0.967 1.00 0.00 N ATOM 1141 CA LYS A 75 7.212 -9.108 -2.125 1.00 0.00 C ATOM 1142 C LYS A 75 5.765 -9.587 -2.200 1.00 0.00 C ATOM 1143 O LYS A 75 5.055 -9.303 -3.165 1.00 0.00 O ATOM 1144 CB LYS A 75 8.156 -10.311 -2.063 1.00 0.00 C ATOM 1145 CG LYS A 75 9.528 -10.038 -2.655 1.00 0.00 C ATOM 1146 CD LYS A 75 10.435 -9.336 -1.658 1.00 0.00 C ATOM 1147 CE LYS A 75 11.843 -9.167 -2.208 1.00 0.00 C ATOM 1148 NZ LYS A 75 11.955 -7.970 -3.087 1.00 0.00 N ATOM 0 H LYS A 75 8.171 -8.541 -0.350 1.00 0.00 H new ATOM 0 HA LYS A 75 7.431 -8.528 -3.021 1.00 0.00 H new ATOM 0 HB2 LYS A 75 8.272 -10.618 -1.024 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.701 -11.147 -2.593 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.985 -10.978 -2.965 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.424 -9.423 -3.549 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.020 -8.359 -1.412 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.472 -9.909 -0.732 1.00 0.00 H new ATOM 0 HE2 LYS A 75 12.548 -9.078 -1.381 1.00 0.00 H new ATOM 0 HE3 LYS A 75 12.123 -10.058 -2.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 12.929 -7.890 -3.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.301 -8.066 -3.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.713 -7.117 -2.544 1.00 0.00 H new ATOM 1162 N LYS A 76 5.334 -10.314 -1.175 1.00 0.00 N ATOM 1163 CA LYS A 76 3.971 -10.830 -1.122 1.00 0.00 C ATOM 1164 C LYS A 76 2.956 -9.700 -1.249 1.00 0.00 C ATOM 1165 O LYS A 76 1.982 -9.806 -1.995 1.00 0.00 O ATOM 1166 CB LYS A 76 3.743 -11.592 0.185 1.00 0.00 C ATOM 1167 CG LYS A 76 4.613 -12.829 0.329 1.00 0.00 C ATOM 1168 CD LYS A 76 4.929 -13.121 1.786 1.00 0.00 C ATOM 1169 CE LYS A 76 5.782 -14.373 1.931 1.00 0.00 C ATOM 1170 NZ LYS A 76 7.108 -14.219 1.272 1.00 0.00 N ATOM 0 H LYS A 76 5.909 -10.559 -0.369 1.00 0.00 H new ATOM 0 HA LYS A 76 3.834 -11.512 -1.961 1.00 0.00 H new ATOM 0 HB2 LYS A 76 3.936 -10.923 1.024 1.00 0.00 H new ATOM 0 HB3 LYS A 76 2.695 -11.886 0.246 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.105 -13.686 -0.113 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.541 -12.689 -0.225 1.00 0.00 H new ATOM 0 HD2 LYS A 76 5.452 -12.271 2.224 1.00 0.00 H new ATOM 0 HD3 LYS A 76 4.000 -13.245 2.343 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.925 -14.594 2.989 1.00 0.00 H new ATOM 0 HE3 LYS A 76 5.257 -15.223 1.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.833 -14.712 1.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.070 -14.628 0.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.348 -13.209 1.207 1.00 0.00 H new ATOM 1184 N VAL A 77 3.189 -8.616 -0.516 1.00 0.00 N ATOM 1185 CA VAL A 77 2.296 -7.464 -0.548 1.00 0.00 C ATOM 1186 C VAL A 77 2.057 -6.994 -1.978 1.00 0.00 C ATOM 1187 O VAL A 77 0.915 -6.786 -2.393 1.00 0.00 O ATOM 1188 CB VAL A 77 2.860 -6.293 0.278 1.00 0.00 C ATOM 1189 CG1 VAL A 77 1.932 -5.090 0.203 1.00 0.00 C ATOM 1190 CG2 VAL A 77 3.080 -6.717 1.722 1.00 0.00 C ATOM 0 H VAL A 77 3.989 -8.512 0.108 1.00 0.00 H new ATOM 0 HA VAL A 77 1.350 -7.785 -0.111 1.00 0.00 H new ATOM 0 HB VAL A 77 3.823 -6.005 -0.143 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.347 -4.273 0.793 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.830 -4.773 -0.835 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.953 -5.361 0.597 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.479 -5.877 2.291 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.132 -7.032 2.157 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.787 -7.546 1.754 1.00 0.00 H new ATOM 1200 N LEU A 78 3.140 -6.828 -2.729 1.00 0.00 N ATOM 1201 CA LEU A 78 3.049 -6.382 -4.116 1.00 0.00 C ATOM 1202 C LEU A 78 2.348 -7.427 -4.978 1.00 0.00 C ATOM 1203 O LEU A 78 1.378 -7.124 -5.674 1.00 0.00 O ATOM 1204 CB LEU A 78 4.444 -6.097 -4.673 1.00 0.00 C ATOM 1205 CG LEU A 78 4.543 -5.945 -6.191 1.00 0.00 C ATOM 1206 CD1 LEU A 78 3.697 -4.774 -6.667 1.00 0.00 C ATOM 1207 CD2 LEU A 78 5.993 -5.766 -6.617 1.00 0.00 C ATOM 0 H LEU A 78 4.091 -6.995 -2.402 1.00 0.00 H new ATOM 0 HA LEU A 78 2.461 -5.464 -4.140 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.818 -5.183 -4.211 1.00 0.00 H new ATOM 0 HB3 LEU A 78 5.108 -6.904 -4.365 1.00 0.00 H new ATOM 0 HG LEU A 78 4.160 -6.855 -6.653 1.00 0.00 H new ATOM 0 HD11 LEU A 78 3.780 -4.682 -7.750 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.655 -4.944 -6.396 1.00 0.00 H new ATOM 0 HD13 LEU A 78 4.049 -3.856 -6.196 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.043 -5.659 -7.701 1.00 0.00 H new ATOM 0 HD22 LEU A 78 6.403 -4.873 -6.145 1.00 0.00 H new ATOM 0 HD23 LEU A 78 6.572 -6.637 -6.311 1.00 0.00 H new ATOM 1219 N HIS A 79 2.844 -8.659 -4.926 1.00 0.00 N ATOM 1220 CA HIS A 79 2.263 -9.750 -5.701 1.00 0.00 C ATOM 1221 C HIS A 79 0.764 -9.863 -5.441 1.00 0.00 C ATOM 1222 O HIS A 79 -0.020 -10.087 -6.362 1.00 0.00 O ATOM 1223 CB HIS A 79 2.954 -11.071 -5.358 1.00 0.00 C ATOM 1224 CG HIS A 79 2.785 -12.125 -6.409 1.00 0.00 C ATOM 1225 ND1 HIS A 79 1.726 -13.008 -6.425 1.00 0.00 N ATOM 1226 CD2 HIS A 79 3.547 -12.434 -7.483 1.00 0.00 C ATOM 1227 CE1 HIS A 79 1.845 -13.816 -7.463 1.00 0.00 C ATOM 1228 NE2 HIS A 79 2.942 -13.488 -8.122 1.00 0.00 N ATOM 0 H HIS A 79 3.646 -8.927 -4.356 1.00 0.00 H new ATOM 0 HA HIS A 79 2.414 -9.533 -6.758 1.00 0.00 H new ATOM 0 HB2 HIS A 79 4.018 -10.887 -5.207 1.00 0.00 H new ATOM 0 HB3 HIS A 79 2.558 -11.444 -4.414 1.00 0.00 H new ATOM 0 HD2 HIS A 79 4.461 -11.943 -7.782 1.00 0.00 H new ATOM 0 HE1 HIS A 79 1.162 -14.610 -7.728 1.00 0.00 H new ATOM 0 HE2 HIS A 79 3.284 -13.944 -8.968 1.00 0.00 H new ATOM 1237 N GLY A 80 0.374 -9.709 -4.180 1.00 0.00 N ATOM 1238 CA GLY A 80 -1.030 -9.798 -3.821 1.00 0.00 C ATOM 1239 C GLY A 80 -1.881 -8.778 -4.552 1.00 0.00 C ATOM 1240 O GLY A 80 -2.997 -9.081 -4.975 1.00 0.00 O ATOM 0 H GLY A 80 1.005 -9.524 -3.400 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -1.396 -10.800 -4.045 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.137 -9.652 -2.746 1.00 0.00 H new ATOM 1244 N ILE A 81 -1.354 -7.567 -4.700 1.00 0.00 N ATOM 1245 CA ILE A 81 -2.074 -6.500 -5.384 1.00 0.00 C ATOM 1246 C ILE A 81 -2.027 -6.687 -6.896 1.00 0.00 C ATOM 1247 O ILE A 81 -3.060 -6.678 -7.567 1.00 0.00 O ATOM 1248 CB ILE A 81 -1.497 -5.116 -5.031 1.00 0.00 C ATOM 1249 CG1 ILE A 81 -1.885 -4.727 -3.603 1.00 0.00 C ATOM 1250 CG2 ILE A 81 -1.985 -4.071 -6.022 1.00 0.00 C ATOM 1251 CD1 ILE A 81 -0.833 -3.903 -2.894 1.00 0.00 C ATOM 0 H ILE A 81 -0.432 -7.301 -4.356 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.109 -6.550 -5.046 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.410 -5.165 -5.091 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.818 -4.165 -3.629 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -2.074 -5.633 -3.027 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -1.569 -3.098 -5.760 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -1.663 -4.344 -7.027 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -3.073 -4.020 -5.991 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.176 -3.664 -1.887 1.00 0.00 H new ATOM 0 HD12 ILE A 81 0.096 -4.471 -2.836 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -0.660 -2.980 -3.447 1.00 0.00 H new ATOM 1263 N THR A 82 -0.821 -6.859 -7.429 1.00 0.00 N ATOM 1264 CA THR A 82 -0.639 -7.049 -8.862 1.00 0.00 C ATOM 1265 C THR A 82 -1.595 -8.106 -9.403 1.00 0.00 C ATOM 1266 O THR A 82 -2.177 -7.941 -10.474 1.00 0.00 O ATOM 1267 CB THR A 82 0.807 -7.463 -9.195 1.00 0.00 C ATOM 1268 OG1 THR A 82 1.197 -8.576 -8.382 1.00 0.00 O ATOM 1269 CG2 THR A 82 1.767 -6.304 -8.970 1.00 0.00 C ATOM 0 H THR A 82 0.044 -6.871 -6.889 1.00 0.00 H new ATOM 0 HA THR A 82 -0.854 -6.092 -9.337 1.00 0.00 H new ATOM 0 HB THR A 82 0.847 -7.749 -10.246 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.495 -8.763 -7.724 1.00 0.00 H new ATOM 0 HG21 THR A 82 2.782 -6.620 -9.212 1.00 0.00 H new ATOM 0 HG22 THR A 82 1.485 -5.468 -9.610 1.00 0.00 H new ATOM 0 HG23 THR A 82 1.723 -5.992 -7.926 1.00 0.00 H new ATOM 1277 N SER A 83 -1.752 -9.193 -8.654 1.00 0.00 N ATOM 1278 CA SER A 83 -2.636 -10.280 -9.060 1.00 0.00 C ATOM 1279 C SER A 83 -4.098 -9.849 -8.980 1.00 0.00 C ATOM 1280 O SER A 83 -4.919 -10.244 -9.809 1.00 0.00 O ATOM 1281 CB SER A 83 -2.406 -11.509 -8.179 1.00 0.00 C ATOM 1282 OG SER A 83 -1.208 -12.176 -8.537 1.00 0.00 O ATOM 0 H SER A 83 -1.279 -9.344 -7.763 1.00 0.00 H new ATOM 0 HA SER A 83 -2.406 -10.536 -10.094 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.359 -11.207 -7.133 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.249 -12.193 -8.276 1.00 0.00 H new ATOM 0 HG SER A 83 -1.083 -12.957 -7.958 1.00 0.00 H new ATOM 1288 N TYR A 84 -4.415 -9.038 -7.977 1.00 0.00 N ATOM 1289 CA TYR A 84 -5.778 -8.555 -7.787 1.00 0.00 C ATOM 1290 C TYR A 84 -6.186 -7.615 -8.917 1.00 0.00 C ATOM 1291 O TYR A 84 -7.361 -7.281 -9.068 1.00 0.00 O ATOM 1292 CB TYR A 84 -5.903 -7.838 -6.442 1.00 0.00 C ATOM 1293 CG TYR A 84 -7.331 -7.529 -6.051 1.00 0.00 C ATOM 1294 CD1 TYR A 84 -8.142 -8.501 -5.479 1.00 0.00 C ATOM 1295 CD2 TYR A 84 -7.869 -6.263 -6.254 1.00 0.00 C ATOM 1296 CE1 TYR A 84 -9.447 -8.223 -5.121 1.00 0.00 C ATOM 1297 CE2 TYR A 84 -9.173 -5.976 -5.898 1.00 0.00 C ATOM 1298 CZ TYR A 84 -9.958 -6.959 -5.333 1.00 0.00 C ATOM 1299 OH TYR A 84 -11.257 -6.678 -4.977 1.00 0.00 O ATOM 0 H TYR A 84 -3.747 -8.701 -7.283 1.00 0.00 H new ATOM 0 HA TYR A 84 -6.446 -9.416 -7.797 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -5.448 -8.455 -5.667 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.337 -6.908 -6.482 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -7.745 -9.491 -5.311 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -7.257 -5.491 -6.697 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -10.064 -8.991 -4.678 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -9.575 -4.987 -6.061 1.00 0.00 H new ATOM 0 HH TYR A 84 -11.870 -7.124 -5.598 1.00 0.00 H new ATOM 1309 N TYR A 85 -5.207 -7.194 -9.709 1.00 0.00 N ATOM 1310 CA TYR A 85 -5.462 -6.291 -10.826 1.00 0.00 C ATOM 1311 C TYR A 85 -5.617 -7.068 -12.130 1.00 0.00 C ATOM 1312 O TYR A 85 -6.357 -6.660 -13.025 1.00 0.00 O ATOM 1313 CB TYR A 85 -4.327 -5.274 -10.957 1.00 0.00 C ATOM 1314 CG TYR A 85 -4.582 -3.983 -10.212 1.00 0.00 C ATOM 1315 CD1 TYR A 85 -5.506 -3.058 -10.681 1.00 0.00 C ATOM 1316 CD2 TYR A 85 -3.898 -3.689 -9.038 1.00 0.00 C ATOM 1317 CE1 TYR A 85 -5.742 -1.878 -10.004 1.00 0.00 C ATOM 1318 CE2 TYR A 85 -4.128 -2.511 -8.354 1.00 0.00 C ATOM 1319 CZ TYR A 85 -5.050 -1.609 -8.841 1.00 0.00 C ATOM 1320 OH TYR A 85 -5.283 -0.434 -8.163 1.00 0.00 O ATOM 0 H TYR A 85 -4.229 -7.463 -9.599 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.394 -5.762 -10.627 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -3.405 -5.722 -10.586 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.171 -5.050 -12.012 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.049 -3.265 -11.591 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -3.175 -4.393 -8.654 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -6.464 -1.170 -10.383 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -3.589 -2.298 -7.443 1.00 0.00 H new ATOM 0 HH TYR A 85 -6.210 -0.150 -8.309 1.00 0.00 H new ATOM 1330 N HIS A 86 -4.913 -8.191 -12.229 1.00 0.00 N ATOM 1331 CA HIS A 86 -4.972 -9.028 -13.423 1.00 0.00 C ATOM 1332 C HIS A 86 -6.017 -10.128 -13.264 1.00 0.00 C ATOM 1333 O HIS A 86 -6.526 -10.660 -14.250 1.00 0.00 O ATOM 1334 CB HIS A 86 -3.603 -9.646 -13.706 1.00 0.00 C ATOM 1335 CG HIS A 86 -2.481 -8.654 -13.676 1.00 0.00 C ATOM 1336 ND1 HIS A 86 -2.332 -7.507 -12.974 1.00 0.00 N flip ATOM 1337 CD2 HIS A 86 -1.337 -8.789 -14.435 1.00 0.00 C flip ATOM 1338 CE1 HIS A 86 -1.113 -6.975 -13.317 1.00 0.00 C flip ATOM 1339 NE2 HIS A 86 -0.532 -7.768 -14.199 1.00 0.00 N flip ATOM 0 H HIS A 86 -4.295 -8.543 -11.497 1.00 0.00 H new ATOM 0 HA HIS A 86 -5.259 -8.398 -14.265 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -3.407 -10.427 -12.971 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -3.626 -10.127 -14.684 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -1.131 -9.602 -15.116 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -0.697 -6.057 -12.928 1.00 0.00 H new ATOM 0 HE2 HIS A 86 0.382 -7.618 -14.625 1.00 0.00 H new ATOM 1348 N GLU A 87 -6.331 -10.464 -12.016 1.00 0.00 N ATOM 1349 CA GLU A 87 -7.314 -11.502 -11.730 1.00 0.00 C ATOM 1350 C GLU A 87 -8.691 -10.893 -11.478 1.00 0.00 C ATOM 1351 O GLU A 87 -9.617 -11.076 -12.268 1.00 0.00 O ATOM 1352 CB GLU A 87 -6.879 -12.327 -10.516 1.00 0.00 C ATOM 1353 CG GLU A 87 -5.531 -13.004 -10.693 1.00 0.00 C ATOM 1354 CD GLU A 87 -5.396 -14.262 -9.856 1.00 0.00 C ATOM 1355 OE1 GLU A 87 -6.306 -15.114 -9.914 1.00 0.00 O ATOM 1356 OE2 GLU A 87 -4.379 -14.393 -9.143 1.00 0.00 O ATOM 0 H GLU A 87 -5.919 -10.033 -11.188 1.00 0.00 H new ATOM 0 HA GLU A 87 -7.378 -12.155 -12.600 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -6.838 -11.678 -9.642 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -7.634 -13.087 -10.314 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.390 -13.255 -11.744 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.739 -12.305 -10.423 1.00 0.00 H new ATOM 1363 N PHE A 88 -8.817 -10.170 -10.370 1.00 0.00 N ATOM 1364 CA PHE A 88 -10.081 -9.535 -10.012 1.00 0.00 C ATOM 1365 C PHE A 88 -10.509 -8.534 -11.081 1.00 0.00 C ATOM 1366 O PHE A 88 -11.465 -8.770 -11.821 1.00 0.00 O ATOM 1367 CB PHE A 88 -9.956 -8.831 -8.659 1.00 0.00 C ATOM 1368 CG PHE A 88 -11.279 -8.553 -8.005 1.00 0.00 C ATOM 1369 CD1 PHE A 88 -12.186 -9.576 -7.782 1.00 0.00 C ATOM 1370 CD2 PHE A 88 -11.616 -7.267 -7.613 1.00 0.00 C ATOM 1371 CE1 PHE A 88 -13.404 -9.324 -7.179 1.00 0.00 C ATOM 1372 CE2 PHE A 88 -12.833 -7.008 -7.010 1.00 0.00 C ATOM 1373 CZ PHE A 88 -13.728 -8.038 -6.794 1.00 0.00 C ATOM 0 H PHE A 88 -8.061 -10.009 -9.705 1.00 0.00 H new ATOM 0 HA PHE A 88 -10.842 -10.312 -9.941 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -9.352 -9.447 -7.992 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.422 -7.891 -8.795 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -11.938 -10.583 -8.083 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -10.920 -6.458 -7.780 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -14.101 -10.131 -7.009 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -13.084 -6.002 -6.708 1.00 0.00 H new ATOM 0 HZ PHE A 88 -14.680 -7.838 -6.325 1.00 0.00 H new ATOM 1383 N LEU A 89 -9.795 -7.417 -11.157 1.00 0.00 N ATOM 1384 CA LEU A 89 -10.101 -6.378 -12.135 1.00 0.00 C ATOM 1385 C LEU A 89 -9.781 -6.852 -13.549 1.00 0.00 C ATOM 1386 O LEU A 89 -10.527 -6.580 -14.489 1.00 0.00 O ATOM 1387 CB LEU A 89 -9.312 -5.106 -11.820 1.00 0.00 C ATOM 1388 CG LEU A 89 -9.675 -4.396 -10.516 1.00 0.00 C ATOM 1389 CD1 LEU A 89 -8.801 -3.168 -10.315 1.00 0.00 C ATOM 1390 CD2 LEU A 89 -11.147 -4.012 -10.510 1.00 0.00 C ATOM 0 H LEU A 89 -9.000 -7.207 -10.553 1.00 0.00 H new ATOM 0 HA LEU A 89 -11.167 -6.160 -12.077 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -8.252 -5.358 -11.790 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.449 -4.404 -12.643 1.00 0.00 H new ATOM 0 HG LEU A 89 -9.496 -5.083 -9.689 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -9.074 -2.676 -9.382 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.754 -3.469 -10.274 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -8.947 -2.477 -11.146 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -11.388 -3.508 -9.574 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -11.352 -3.343 -11.346 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -11.758 -4.910 -10.606 1.00 0.00 H new ATOM 1402 N GLY A 90 -8.667 -7.564 -13.692 1.00 0.00 N ATOM 1403 CA GLY A 90 -8.270 -8.066 -14.995 1.00 0.00 C ATOM 1404 C GLY A 90 -7.187 -7.221 -15.636 1.00 0.00 C ATOM 1405 O GLY A 90 -6.389 -7.721 -16.428 1.00 0.00 O ATOM 0 H GLY A 90 -8.033 -7.802 -12.929 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -7.914 -9.091 -14.893 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -9.140 -8.094 -15.651 1.00 0.00 H new ATOM 1409 N GLN A 91 -7.160 -5.937 -15.294 1.00 0.00 N ATOM 1410 CA GLN A 91 -6.168 -5.021 -15.845 1.00 0.00 C ATOM 1411 C GLN A 91 -4.770 -5.369 -15.346 1.00 0.00 C ATOM 1412 O GLN A 91 -4.588 -6.337 -14.609 1.00 0.00 O ATOM 1413 CB GLN A 91 -6.512 -3.578 -15.469 1.00 0.00 C ATOM 1414 CG GLN A 91 -6.595 -3.343 -13.970 1.00 0.00 C ATOM 1415 CD GLN A 91 -7.573 -2.244 -13.604 1.00 0.00 C ATOM 1416 OE1 GLN A 91 -8.669 -2.163 -14.160 1.00 0.00 O ATOM 1417 NE2 GLN A 91 -7.182 -1.391 -12.665 1.00 0.00 N ATOM 0 H GLN A 91 -7.813 -5.508 -14.639 1.00 0.00 H new ATOM 0 HA GLN A 91 -6.182 -5.120 -16.930 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -5.760 -2.912 -15.892 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -7.466 -3.310 -15.924 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -6.893 -4.268 -13.477 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -5.606 -3.085 -13.591 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -6.265 -1.496 -12.231 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -7.799 -0.631 -12.378 1.00 0.00 H new ATOM 1426 N GLN A 92 -3.786 -4.574 -15.754 1.00 0.00 N ATOM 1427 CA GLN A 92 -2.404 -4.800 -15.349 1.00 0.00 C ATOM 1428 C GLN A 92 -1.815 -3.551 -14.701 1.00 0.00 C ATOM 1429 O GLN A 92 -2.503 -2.544 -14.535 1.00 0.00 O ATOM 1430 CB GLN A 92 -1.557 -5.210 -16.556 1.00 0.00 C ATOM 1431 CG GLN A 92 -1.435 -4.122 -17.611 1.00 0.00 C ATOM 1432 CD GLN A 92 -0.854 -4.635 -18.913 1.00 0.00 C ATOM 1433 OE1 GLN A 92 -1.469 -5.448 -19.604 1.00 0.00 O ATOM 1434 NE2 GLN A 92 0.338 -4.162 -19.257 1.00 0.00 N ATOM 0 H GLN A 92 -3.920 -3.768 -16.365 1.00 0.00 H new ATOM 0 HA GLN A 92 -2.394 -5.607 -14.616 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -0.560 -5.485 -16.213 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -1.994 -6.099 -17.011 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.419 -3.693 -17.801 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -0.805 -3.319 -17.228 1.00 0.00 H new ATOM 0 HE21 GLN A 92 0.813 -3.489 -18.655 1.00 0.00 H new ATOM 0 HE22 GLN A 92 0.779 -4.471 -20.123 1.00 0.00 H new ATOM 1443 N ILE A 93 -0.540 -3.625 -14.336 1.00 0.00 N ATOM 1444 CA ILE A 93 0.141 -2.500 -13.707 1.00 0.00 C ATOM 1445 C ILE A 93 1.384 -2.100 -14.494 1.00 0.00 C ATOM 1446 O ILE A 93 2.191 -2.948 -14.873 1.00 0.00 O ATOM 1447 CB ILE A 93 0.547 -2.828 -12.258 1.00 0.00 C ATOM 1448 CG1 ILE A 93 -0.693 -3.120 -11.411 1.00 0.00 C ATOM 1449 CG2 ILE A 93 1.345 -1.679 -11.659 1.00 0.00 C ATOM 1450 CD1 ILE A 93 -0.404 -3.216 -9.929 1.00 0.00 C ATOM 0 H ILE A 93 0.043 -4.452 -14.465 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.563 -1.668 -13.699 1.00 0.00 H new ATOM 0 HB ILE A 93 1.177 -3.718 -12.265 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -1.431 -2.335 -11.579 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -1.140 -4.055 -11.747 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.625 -1.925 -10.635 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.245 -1.513 -12.251 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.738 -0.774 -11.661 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -1.329 -3.425 -9.391 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.310 -4.020 -9.749 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.015 -2.273 -9.578 1.00 0.00 H new ATOM 1462 N SER A 94 1.533 -0.801 -14.734 1.00 0.00 N ATOM 1463 CA SER A 94 2.677 -0.287 -15.477 1.00 0.00 C ATOM 1464 C SER A 94 3.905 -0.179 -14.578 1.00 0.00 C ATOM 1465 O SER A 94 3.787 0.049 -13.375 1.00 0.00 O ATOM 1466 CB SER A 94 2.349 1.081 -16.078 1.00 0.00 C ATOM 1467 OG SER A 94 1.811 0.949 -17.383 1.00 0.00 O ATOM 0 H SER A 94 0.875 -0.085 -14.424 1.00 0.00 H new ATOM 0 HA SER A 94 2.899 -0.986 -16.283 1.00 0.00 H new ATOM 0 HB2 SER A 94 1.636 1.601 -15.438 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.251 1.692 -16.113 1.00 0.00 H new ATOM 0 HG SER A 94 1.608 1.837 -17.745 1.00 0.00 H new ATOM 1473 N GLU A 95 5.082 -0.345 -15.172 1.00 0.00 N ATOM 1474 CA GLU A 95 6.332 -0.267 -14.425 1.00 0.00 C ATOM 1475 C GLU A 95 6.409 1.033 -13.628 1.00 0.00 C ATOM 1476 O GLU A 95 7.225 1.165 -12.717 1.00 0.00 O ATOM 1477 CB GLU A 95 7.527 -0.367 -15.375 1.00 0.00 C ATOM 1478 CG GLU A 95 8.003 -1.792 -15.606 1.00 0.00 C ATOM 1479 CD GLU A 95 8.634 -1.982 -16.971 1.00 0.00 C ATOM 1480 OE1 GLU A 95 9.413 -1.102 -17.393 1.00 0.00 O ATOM 1481 OE2 GLU A 95 8.349 -3.012 -17.618 1.00 0.00 O ATOM 0 H GLU A 95 5.196 -0.534 -16.168 1.00 0.00 H new ATOM 0 HA GLU A 95 6.361 -1.104 -13.727 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.257 0.077 -16.333 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.351 0.222 -14.972 1.00 0.00 H new ATOM 0 HG2 GLU A 95 8.726 -2.059 -14.835 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.159 -2.474 -15.502 1.00 0.00 H new ATOM 1488 N GLU A 96 5.555 1.988 -13.981 1.00 0.00 N ATOM 1489 CA GLU A 96 5.528 3.277 -13.300 1.00 0.00 C ATOM 1490 C GLU A 96 4.968 3.134 -11.888 1.00 0.00 C ATOM 1491 O GLU A 96 5.338 3.884 -10.983 1.00 0.00 O ATOM 1492 CB GLU A 96 4.688 4.280 -14.094 1.00 0.00 C ATOM 1493 CG GLU A 96 5.164 4.476 -15.524 1.00 0.00 C ATOM 1494 CD GLU A 96 6.500 5.189 -15.602 1.00 0.00 C ATOM 1495 OE1 GLU A 96 7.541 4.520 -15.439 1.00 0.00 O ATOM 1496 OE2 GLU A 96 6.503 6.418 -15.826 1.00 0.00 O ATOM 0 H GLU A 96 4.873 1.894 -14.734 1.00 0.00 H new ATOM 0 HA GLU A 96 6.552 3.645 -13.231 1.00 0.00 H new ATOM 0 HB2 GLU A 96 3.652 3.942 -14.108 1.00 0.00 H new ATOM 0 HB3 GLU A 96 4.703 5.241 -13.580 1.00 0.00 H new ATOM 0 HG2 GLU A 96 5.246 3.505 -16.012 1.00 0.00 H new ATOM 0 HG3 GLU A 96 4.418 5.048 -16.076 1.00 0.00 H new ATOM 1503 N LEU A 97 4.075 2.168 -11.706 1.00 0.00 N ATOM 1504 CA LEU A 97 3.464 1.926 -10.404 1.00 0.00 C ATOM 1505 C LEU A 97 4.212 0.834 -9.645 1.00 0.00 C ATOM 1506 O LEU A 97 4.193 0.797 -8.415 1.00 0.00 O ATOM 1507 CB LEU A 97 1.996 1.531 -10.574 1.00 0.00 C ATOM 1508 CG LEU A 97 1.189 2.360 -11.573 1.00 0.00 C ATOM 1509 CD1 LEU A 97 -0.231 1.827 -11.685 1.00 0.00 C ATOM 1510 CD2 LEU A 97 1.180 3.826 -11.166 1.00 0.00 C ATOM 0 H LEU A 97 3.758 1.539 -12.444 1.00 0.00 H new ATOM 0 HA LEU A 97 3.522 2.848 -9.826 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.955 0.486 -10.883 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.508 1.595 -9.601 1.00 0.00 H new ATOM 0 HG LEU A 97 1.664 2.278 -12.551 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.790 2.430 -12.401 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -0.205 0.792 -12.024 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -0.716 1.877 -10.710 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.601 4.401 -11.889 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.730 3.927 -10.178 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.203 4.202 -11.139 1.00 0.00 H new ATOM 1522 N ILE A 98 4.870 -0.050 -10.387 1.00 0.00 N ATOM 1523 CA ILE A 98 5.626 -1.140 -9.784 1.00 0.00 C ATOM 1524 C ILE A 98 6.571 -0.622 -8.705 1.00 0.00 C ATOM 1525 O ILE A 98 7.598 -0.004 -8.988 1.00 0.00 O ATOM 1526 CB ILE A 98 6.443 -1.910 -10.839 1.00 0.00 C ATOM 1527 CG1 ILE A 98 5.518 -2.479 -11.916 1.00 0.00 C ATOM 1528 CG2 ILE A 98 7.245 -3.022 -10.180 1.00 0.00 C ATOM 1529 CD1 ILE A 98 4.544 -3.511 -11.393 1.00 0.00 C ATOM 0 H ILE A 98 4.895 -0.033 -11.407 1.00 0.00 H new ATOM 0 HA ILE A 98 4.900 -1.817 -9.334 1.00 0.00 H new ATOM 0 HB ILE A 98 7.140 -1.219 -11.313 1.00 0.00 H new ATOM 0 HG12 ILE A 98 4.959 -1.662 -12.372 1.00 0.00 H new ATOM 0 HG13 ILE A 98 6.124 -2.929 -12.703 1.00 0.00 H new ATOM 0 HG21 ILE A 98 7.817 -3.557 -10.938 1.00 0.00 H new ATOM 0 HG22 ILE A 98 7.928 -2.593 -9.446 1.00 0.00 H new ATOM 0 HG23 ILE A 98 6.566 -3.714 -9.682 1.00 0.00 H new ATOM 0 HD11 ILE A 98 3.920 -3.870 -12.212 1.00 0.00 H new ATOM 0 HD12 ILE A 98 5.096 -4.347 -10.963 1.00 0.00 H new ATOM 0 HD13 ILE A 98 3.913 -3.060 -10.627 1.00 0.00 H new ATOM 1541 N PRO A 99 6.218 -0.880 -7.437 1.00 0.00 N ATOM 1542 CA PRO A 99 7.023 -0.451 -6.289 1.00 0.00 C ATOM 1543 C PRO A 99 8.337 -1.217 -6.182 1.00 0.00 C ATOM 1544 O PRO A 99 8.343 -2.438 -6.028 1.00 0.00 O ATOM 1545 CB PRO A 99 6.124 -0.762 -5.090 1.00 0.00 C ATOM 1546 CG PRO A 99 5.231 -1.859 -5.560 1.00 0.00 C ATOM 1547 CD PRO A 99 5.008 -1.611 -7.026 1.00 0.00 C ATOM 0 HA PRO A 99 7.311 0.598 -6.363 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.711 -1.072 -4.225 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.550 0.114 -4.788 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.690 -2.834 -5.394 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.287 -1.854 -5.015 1.00 0.00 H new ATOM 0 HD2 PRO A 99 4.895 -2.544 -7.579 1.00 0.00 H new ATOM 0 HD3 PRO A 99 4.106 -1.025 -7.202 1.00 0.00 H new ATOM 1555 N ASP A 100 9.447 -0.492 -6.266 1.00 0.00 N ATOM 1556 CA ASP A 100 10.768 -1.104 -6.177 1.00 0.00 C ATOM 1557 C ASP A 100 11.062 -1.558 -4.751 1.00 0.00 C ATOM 1558 O ASP A 100 11.577 -0.789 -3.937 1.00 0.00 O ATOM 1559 CB ASP A 100 11.841 -0.120 -6.644 1.00 0.00 C ATOM 1560 CG ASP A 100 11.797 0.118 -8.141 1.00 0.00 C ATOM 1561 OD1 ASP A 100 10.696 0.386 -8.666 1.00 0.00 O ATOM 1562 OD2 ASP A 100 12.863 0.035 -8.787 1.00 0.00 O ATOM 0 H ASP A 100 9.459 0.520 -6.396 1.00 0.00 H new ATOM 0 HA ASP A 100 10.781 -1.979 -6.827 1.00 0.00 H new ATOM 0 HB2 ASP A 100 11.710 0.829 -6.124 1.00 0.00 H new ATOM 0 HB3 ASP A 100 12.824 -0.501 -6.369 1.00 0.00 H new ATOM 1567 N LEU A 101 10.731 -2.809 -4.453 1.00 0.00 N ATOM 1568 CA LEU A 101 10.958 -3.366 -3.124 1.00 0.00 C ATOM 1569 C LEU A 101 12.442 -3.341 -2.770 1.00 0.00 C ATOM 1570 O LEU A 101 12.815 -3.035 -1.639 1.00 0.00 O ATOM 1571 CB LEU A 101 10.429 -4.799 -3.053 1.00 0.00 C ATOM 1572 CG LEU A 101 9.131 -5.074 -3.813 1.00 0.00 C ATOM 1573 CD1 LEU A 101 8.639 -6.486 -3.535 1.00 0.00 C ATOM 1574 CD2 LEU A 101 8.067 -4.053 -3.438 1.00 0.00 C ATOM 0 H LEU A 101 10.304 -3.458 -5.114 1.00 0.00 H new ATOM 0 HA LEU A 101 10.421 -2.751 -2.402 1.00 0.00 H new ATOM 0 HB2 LEU A 101 11.199 -5.469 -3.436 1.00 0.00 H new ATOM 0 HB3 LEU A 101 10.274 -5.056 -2.005 1.00 0.00 H new ATOM 0 HG LEU A 101 9.331 -4.985 -4.881 1.00 0.00 H new ATOM 0 HD11 LEU A 101 7.714 -6.664 -4.084 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.394 -7.204 -3.854 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.455 -6.604 -2.467 1.00 0.00 H new ATOM 0 HD21 LEU A 101 7.150 -4.264 -3.988 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.869 -4.110 -2.368 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.419 -3.052 -3.689 1.00 0.00 H new ATOM 1586 N ASN A 102 13.284 -3.664 -3.747 1.00 0.00 N ATOM 1587 CA ASN A 102 14.727 -3.677 -3.539 1.00 0.00 C ATOM 1588 C ASN A 102 15.227 -2.301 -3.111 1.00 0.00 C ATOM 1589 O ASN A 102 16.125 -2.189 -2.277 1.00 0.00 O ATOM 1590 CB ASN A 102 15.443 -4.117 -4.818 1.00 0.00 C ATOM 1591 CG ASN A 102 15.670 -5.616 -4.866 1.00 0.00 C ATOM 1592 OD1 ASN A 102 16.174 -6.210 -3.913 1.00 0.00 O ATOM 1593 ND2 ASN A 102 15.298 -6.234 -5.981 1.00 0.00 N ATOM 0 H ASN A 102 12.991 -3.920 -4.690 1.00 0.00 H new ATOM 0 HA ASN A 102 14.948 -4.388 -2.743 1.00 0.00 H new ATOM 0 HB2 ASN A 102 14.854 -3.813 -5.684 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.402 -3.604 -4.889 1.00 0.00 H new ATOM 0 HD21 ASN A 102 15.426 -7.242 -6.073 1.00 0.00 H new ATOM 0 HD22 ASN A 102 14.884 -5.701 -6.746 1.00 0.00 H new ATOM 1600 N GLN A 103 14.639 -1.258 -3.687 1.00 0.00 N ATOM 1601 CA GLN A 103 15.026 0.111 -3.364 1.00 0.00 C ATOM 1602 C GLN A 103 14.309 0.598 -2.109 1.00 0.00 C ATOM 1603 O GLN A 103 14.642 1.649 -1.561 1.00 0.00 O ATOM 1604 CB GLN A 103 14.714 1.041 -4.538 1.00 0.00 C ATOM 1605 CG GLN A 103 15.884 1.235 -5.489 1.00 0.00 C ATOM 1606 CD GLN A 103 15.458 1.799 -6.830 1.00 0.00 C ATOM 1607 OE1 GLN A 103 15.622 1.156 -7.867 1.00 0.00 O ATOM 1608 NE2 GLN A 103 14.909 3.008 -6.817 1.00 0.00 N ATOM 0 H GLN A 103 13.894 -1.334 -4.379 1.00 0.00 H new ATOM 0 HA GLN A 103 16.099 0.124 -3.174 1.00 0.00 H new ATOM 0 HB2 GLN A 103 13.867 0.639 -5.094 1.00 0.00 H new ATOM 0 HB3 GLN A 103 14.407 2.012 -4.150 1.00 0.00 H new ATOM 0 HG2 GLN A 103 16.612 1.905 -5.032 1.00 0.00 H new ATOM 0 HG3 GLN A 103 16.384 0.279 -5.643 1.00 0.00 H new ATOM 0 HE21 GLN A 103 14.792 3.506 -5.934 1.00 0.00 H new ATOM 0 HE22 GLN A 103 14.604 3.439 -7.690 1.00 0.00 H new ATOM 1617 N ILE A 104 13.323 -0.173 -1.661 1.00 0.00 N ATOM 1618 CA ILE A 104 12.560 0.180 -0.470 1.00 0.00 C ATOM 1619 C ILE A 104 13.095 -0.544 0.761 1.00 0.00 C ATOM 1620 O ILE A 104 12.964 -0.061 1.886 1.00 0.00 O ATOM 1621 CB ILE A 104 11.066 -0.153 -0.639 1.00 0.00 C ATOM 1622 CG1 ILE A 104 10.417 0.809 -1.636 1.00 0.00 C ATOM 1623 CG2 ILE A 104 10.355 -0.093 0.704 1.00 0.00 C ATOM 1624 CD1 ILE A 104 9.108 0.302 -2.200 1.00 0.00 C ATOM 0 H ILE A 104 13.034 -1.045 -2.104 1.00 0.00 H new ATOM 0 HA ILE A 104 12.671 1.256 -0.332 1.00 0.00 H new ATOM 0 HB ILE A 104 10.976 -1.167 -1.030 1.00 0.00 H new ATOM 0 HG12 ILE A 104 10.245 1.767 -1.145 1.00 0.00 H new ATOM 0 HG13 ILE A 104 11.111 0.991 -2.457 1.00 0.00 H new ATOM 0 HG21 ILE A 104 9.300 -0.331 0.568 1.00 0.00 H new ATOM 0 HG22 ILE A 104 10.805 -0.815 1.386 1.00 0.00 H new ATOM 0 HG23 ILE A 104 10.450 0.909 1.122 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.705 1.035 -2.899 1.00 0.00 H new ATOM 0 HD12 ILE A 104 9.277 -0.641 -2.720 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.398 0.147 -1.388 1.00 0.00 H new ATOM 1636 N THR A 105 13.701 -1.707 0.539 1.00 0.00 N ATOM 1637 CA THR A 105 14.257 -2.499 1.629 1.00 0.00 C ATOM 1638 C THR A 105 15.738 -2.198 1.828 1.00 0.00 C ATOM 1639 O THR A 105 16.252 -2.278 2.943 1.00 0.00 O ATOM 1640 CB THR A 105 14.081 -4.008 1.374 1.00 0.00 C ATOM 1641 OG1 THR A 105 12.969 -4.230 0.499 1.00 0.00 O ATOM 1642 CG2 THR A 105 13.862 -4.756 2.681 1.00 0.00 C ATOM 0 H THR A 105 13.819 -2.121 -0.386 1.00 0.00 H new ATOM 0 HA THR A 105 13.709 -2.224 2.530 1.00 0.00 H new ATOM 0 HB THR A 105 14.991 -4.384 0.907 1.00 0.00 H new ATOM 0 HG1 THR A 105 13.263 -4.143 -0.432 1.00 0.00 H new ATOM 0 HG21 THR A 105 13.740 -5.820 2.476 1.00 0.00 H new ATOM 0 HG22 THR A 105 14.723 -4.609 3.333 1.00 0.00 H new ATOM 0 HG23 THR A 105 12.966 -4.376 3.172 1.00 0.00 H new ATOM 1650 N GLU A 106 16.418 -1.851 0.739 1.00 0.00 N ATOM 1651 CA GLU A 106 17.841 -1.538 0.796 1.00 0.00 C ATOM 1652 C GLU A 106 18.062 -0.033 0.920 1.00 0.00 C ATOM 1653 O GLU A 106 18.979 0.415 1.610 1.00 0.00 O ATOM 1654 CB GLU A 106 18.552 -2.068 -0.451 1.00 0.00 C ATOM 1655 CG GLU A 106 18.412 -3.569 -0.640 1.00 0.00 C ATOM 1656 CD GLU A 106 19.509 -4.153 -1.509 1.00 0.00 C ATOM 1657 OE1 GLU A 106 19.788 -3.573 -2.579 1.00 0.00 O ATOM 1658 OE2 GLU A 106 20.087 -5.189 -1.120 1.00 0.00 O ATOM 0 H GLU A 106 16.007 -1.780 -0.192 1.00 0.00 H new ATOM 0 HA GLU A 106 18.259 -2.023 1.678 1.00 0.00 H new ATOM 0 HB2 GLU A 106 18.153 -1.561 -1.329 1.00 0.00 H new ATOM 0 HB3 GLU A 106 19.611 -1.815 -0.390 1.00 0.00 H new ATOM 0 HG2 GLU A 106 18.427 -4.057 0.335 1.00 0.00 H new ATOM 0 HG3 GLU A 106 17.443 -3.786 -1.090 1.00 0.00 H new ATOM 1665 N CYS A 107 17.218 0.740 0.248 1.00 0.00 N ATOM 1666 CA CYS A 107 17.322 2.195 0.281 1.00 0.00 C ATOM 1667 C CYS A 107 16.193 2.802 1.108 1.00 0.00 C ATOM 1668 O CYS A 107 16.419 3.693 1.925 1.00 0.00 O ATOM 1669 CB CYS A 107 17.292 2.762 -1.139 1.00 0.00 C ATOM 1670 SG CYS A 107 18.928 3.033 -1.860 1.00 0.00 S ATOM 0 H CYS A 107 16.454 0.385 -0.327 1.00 0.00 H new ATOM 0 HA CYS A 107 18.271 2.456 0.748 1.00 0.00 H new ATOM 0 HB2 CYS A 107 16.733 2.080 -1.779 1.00 0.00 H new ATOM 0 HB3 CYS A 107 16.750 3.707 -1.130 1.00 0.00 H new ATOM 0 HG CYS A 107 18.799 3.511 -3.062 1.00 0.00 H new ATOM 1676 N ALA A 108 14.976 2.313 0.887 1.00 0.00 N ATOM 1677 CA ALA A 108 13.812 2.807 1.611 1.00 0.00 C ATOM 1678 C ALA A 108 13.407 4.193 1.121 1.00 0.00 C ATOM 1679 O ALA A 108 12.786 4.964 1.852 1.00 0.00 O ATOM 1680 CB ALA A 108 14.094 2.836 3.106 1.00 0.00 C ATOM 0 H ALA A 108 14.772 1.576 0.213 1.00 0.00 H new ATOM 0 HA ALA A 108 12.982 2.127 1.421 1.00 0.00 H new ATOM 0 HB1 ALA A 108 13.216 3.207 3.635 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.327 1.829 3.452 1.00 0.00 H new ATOM 0 HB3 ALA A 108 14.941 3.493 3.304 1.00 0.00 H new ATOM 1686 N ASP A 109 13.763 4.503 -0.121 1.00 0.00 N ATOM 1687 CA ASP A 109 13.436 5.796 -0.710 1.00 0.00 C ATOM 1688 C ASP A 109 11.940 6.079 -0.605 1.00 0.00 C ATOM 1689 O ASP A 109 11.103 5.189 -0.761 1.00 0.00 O ATOM 1690 CB ASP A 109 13.874 5.839 -2.175 1.00 0.00 C ATOM 1691 CG ASP A 109 14.248 7.237 -2.627 1.00 0.00 C ATOM 1692 OD1 ASP A 109 15.399 7.652 -2.379 1.00 0.00 O ATOM 1693 OD2 ASP A 109 13.389 7.917 -3.227 1.00 0.00 O ATOM 0 H ASP A 109 14.278 3.876 -0.739 1.00 0.00 H new ATOM 0 HA ASP A 109 13.973 6.566 -0.156 1.00 0.00 H new ATOM 0 HB2 ASP A 109 14.727 5.175 -2.316 1.00 0.00 H new ATOM 0 HB3 ASP A 109 13.068 5.461 -2.803 1.00 0.00 H new ATOM 1698 N PRO A 110 11.595 7.346 -0.333 1.00 0.00 N ATOM 1699 CA PRO A 110 10.199 7.775 -0.200 1.00 0.00 C ATOM 1700 C PRO A 110 9.457 7.755 -1.532 1.00 0.00 C ATOM 1701 O PRO A 110 8.244 7.555 -1.576 1.00 0.00 O ATOM 1702 CB PRO A 110 10.317 9.208 0.325 1.00 0.00 C ATOM 1703 CG PRO A 110 11.654 9.673 -0.139 1.00 0.00 C ATOM 1704 CD PRO A 110 12.540 8.458 -0.135 1.00 0.00 C ATOM 0 HA PRO A 110 9.629 7.113 0.452 1.00 0.00 H new ATOM 0 HB2 PRO A 110 9.520 9.840 -0.067 1.00 0.00 H new ATOM 0 HB3 PRO A 110 10.243 9.239 1.412 1.00 0.00 H new ATOM 0 HG2 PRO A 110 11.591 10.107 -1.137 1.00 0.00 H new ATOM 0 HG3 PRO A 110 12.049 10.446 0.520 1.00 0.00 H new ATOM 0 HD2 PRO A 110 13.283 8.500 -0.931 1.00 0.00 H new ATOM 0 HD3 PRO A 110 13.084 8.361 0.804 1.00 0.00 H new ATOM 1712 N VAL A 111 10.195 7.964 -2.618 1.00 0.00 N ATOM 1713 CA VAL A 111 9.607 7.969 -3.953 1.00 0.00 C ATOM 1714 C VAL A 111 9.127 6.577 -4.347 1.00 0.00 C ATOM 1715 O VAL A 111 8.099 6.428 -5.006 1.00 0.00 O ATOM 1716 CB VAL A 111 10.611 8.472 -5.007 1.00 0.00 C ATOM 1717 CG1 VAL A 111 9.989 8.443 -6.394 1.00 0.00 C ATOM 1718 CG2 VAL A 111 11.093 9.872 -4.658 1.00 0.00 C ATOM 0 H VAL A 111 11.201 8.132 -2.600 1.00 0.00 H new ATOM 0 HA VAL A 111 8.755 8.648 -3.921 1.00 0.00 H new ATOM 0 HB VAL A 111 11.474 7.806 -5.009 1.00 0.00 H new ATOM 0 HG11 VAL A 111 10.713 8.802 -7.125 1.00 0.00 H new ATOM 0 HG12 VAL A 111 9.699 7.422 -6.641 1.00 0.00 H new ATOM 0 HG13 VAL A 111 9.108 9.085 -6.411 1.00 0.00 H new ATOM 0 HG21 VAL A 111 11.802 10.212 -5.413 1.00 0.00 H new ATOM 0 HG22 VAL A 111 10.242 10.553 -4.627 1.00 0.00 H new ATOM 0 HG23 VAL A 111 11.581 9.856 -3.684 1.00 0.00 H new ATOM 1728 N GLU A 112 9.880 5.560 -3.938 1.00 0.00 N ATOM 1729 CA GLU A 112 9.530 4.179 -4.249 1.00 0.00 C ATOM 1730 C GLU A 112 8.441 3.668 -3.310 1.00 0.00 C ATOM 1731 O GLU A 112 7.421 3.138 -3.754 1.00 0.00 O ATOM 1732 CB GLU A 112 10.766 3.282 -4.149 1.00 0.00 C ATOM 1733 CG GLU A 112 11.776 3.512 -5.260 1.00 0.00 C ATOM 1734 CD GLU A 112 11.119 3.784 -6.599 1.00 0.00 C ATOM 1735 OE1 GLU A 112 10.744 4.948 -6.851 1.00 0.00 O ATOM 1736 OE2 GLU A 112 10.979 2.832 -7.395 1.00 0.00 O ATOM 0 H GLU A 112 10.735 5.666 -3.392 1.00 0.00 H new ATOM 0 HA GLU A 112 9.149 4.149 -5.270 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.251 3.452 -3.188 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.450 2.239 -4.167 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.416 4.354 -4.996 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.420 2.637 -5.347 1.00 0.00 H new ATOM 1743 N LEU A 113 8.663 3.832 -2.011 1.00 0.00 N ATOM 1744 CA LEU A 113 7.701 3.387 -1.008 1.00 0.00 C ATOM 1745 C LEU A 113 6.296 3.870 -1.350 1.00 0.00 C ATOM 1746 O LEU A 113 5.345 3.090 -1.359 1.00 0.00 O ATOM 1747 CB LEU A 113 8.106 3.898 0.376 1.00 0.00 C ATOM 1748 CG LEU A 113 7.470 3.181 1.568 1.00 0.00 C ATOM 1749 CD1 LEU A 113 6.056 3.690 1.804 1.00 0.00 C ATOM 1750 CD2 LEU A 113 7.466 1.676 1.345 1.00 0.00 C ATOM 0 H LEU A 113 9.500 4.270 -1.627 1.00 0.00 H new ATOM 0 HA LEU A 113 7.698 2.297 -1.000 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.189 3.821 0.467 1.00 0.00 H new ATOM 0 HB3 LEU A 113 7.855 4.957 0.438 1.00 0.00 H new ATOM 0 HG LEU A 113 8.065 3.395 2.456 1.00 0.00 H new ATOM 0 HD11 LEU A 113 5.619 3.169 2.656 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.084 4.760 2.009 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.450 3.506 0.917 1.00 0.00 H new ATOM 0 HD21 LEU A 113 7.010 1.182 2.203 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.895 1.443 0.446 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.490 1.323 1.226 1.00 0.00 H new ATOM 1762 N GLY A 114 6.172 5.164 -1.633 1.00 0.00 N ATOM 1763 CA GLY A 114 4.880 5.728 -1.974 1.00 0.00 C ATOM 1764 C GLY A 114 4.158 4.924 -3.037 1.00 0.00 C ATOM 1765 O GLY A 114 2.933 4.802 -3.008 1.00 0.00 O ATOM 0 H GLY A 114 6.944 5.831 -1.632 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.261 5.778 -1.078 1.00 0.00 H new ATOM 0 HA3 GLY A 114 5.015 6.751 -2.326 1.00 0.00 H new ATOM 1769 N ARG A 115 4.918 4.375 -3.979 1.00 0.00 N ATOM 1770 CA ARG A 115 4.343 3.580 -5.058 1.00 0.00 C ATOM 1771 C ARG A 115 3.619 2.356 -4.505 1.00 0.00 C ATOM 1772 O ARG A 115 2.491 2.058 -4.899 1.00 0.00 O ATOM 1773 CB ARG A 115 5.435 3.143 -6.036 1.00 0.00 C ATOM 1774 CG ARG A 115 6.134 4.302 -6.727 1.00 0.00 C ATOM 1775 CD ARG A 115 6.586 3.925 -8.129 1.00 0.00 C ATOM 1776 NE ARG A 115 7.347 4.996 -8.765 1.00 0.00 N ATOM 1777 CZ ARG A 115 8.200 4.798 -9.765 1.00 0.00 C ATOM 1778 NH1 ARG A 115 8.398 3.576 -10.239 1.00 0.00 N ATOM 1779 NH2 ARG A 115 8.856 5.824 -10.292 1.00 0.00 N ATOM 0 H ARG A 115 5.933 4.466 -4.017 1.00 0.00 H new ATOM 0 HA ARG A 115 3.619 4.200 -5.587 1.00 0.00 H new ATOM 0 HB2 ARG A 115 6.176 2.551 -5.499 1.00 0.00 H new ATOM 0 HB3 ARG A 115 4.995 2.493 -6.792 1.00 0.00 H new ATOM 0 HG2 ARG A 115 5.459 5.156 -6.779 1.00 0.00 H new ATOM 0 HG3 ARG A 115 6.996 4.612 -6.137 1.00 0.00 H new ATOM 0 HD2 ARG A 115 7.198 3.024 -8.083 1.00 0.00 H new ATOM 0 HD3 ARG A 115 5.715 3.688 -8.739 1.00 0.00 H new ATOM 0 HE ARG A 115 7.217 5.948 -8.423 1.00 0.00 H new ATOM 0 HH11 ARG A 115 7.895 2.785 -9.836 1.00 0.00 H new ATOM 0 HH12 ARG A 115 9.053 3.427 -11.006 1.00 0.00 H new ATOM 0 HH21 ARG A 115 8.706 6.766 -9.930 1.00 0.00 H new ATOM 0 HH22 ARG A 115 9.510 5.671 -11.059 1.00 0.00 H new ATOM 1793 N LEU A 116 4.276 1.649 -3.592 1.00 0.00 N ATOM 1794 CA LEU A 116 3.697 0.456 -2.985 1.00 0.00 C ATOM 1795 C LEU A 116 2.344 0.769 -2.354 1.00 0.00 C ATOM 1796 O LEU A 116 1.377 0.028 -2.534 1.00 0.00 O ATOM 1797 CB LEU A 116 4.645 -0.115 -1.930 1.00 0.00 C ATOM 1798 CG LEU A 116 4.312 -1.517 -1.417 1.00 0.00 C ATOM 1799 CD1 LEU A 116 4.151 -2.486 -2.578 1.00 0.00 C ATOM 1800 CD2 LEU A 116 5.390 -2.004 -0.459 1.00 0.00 C ATOM 0 H LEU A 116 5.210 1.882 -3.256 1.00 0.00 H new ATOM 0 HA LEU A 116 3.549 -0.286 -3.770 1.00 0.00 H new ATOM 0 HB2 LEU A 116 5.652 -0.132 -2.346 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.663 0.567 -1.080 1.00 0.00 H new ATOM 0 HG LEU A 116 3.367 -1.470 -0.876 1.00 0.00 H new ATOM 0 HD11 LEU A 116 3.914 -3.478 -2.194 1.00 0.00 H new ATOM 0 HD12 LEU A 116 3.344 -2.146 -3.226 1.00 0.00 H new ATOM 0 HD13 LEU A 116 5.080 -2.529 -3.147 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.137 -3.003 -0.104 1.00 0.00 H new ATOM 0 HD22 LEU A 116 6.349 -2.035 -0.976 1.00 0.00 H new ATOM 0 HD23 LEU A 116 5.457 -1.323 0.390 1.00 0.00 H new ATOM 1812 N LEU A 117 2.283 1.871 -1.615 1.00 0.00 N ATOM 1813 CA LEU A 117 1.047 2.284 -0.958 1.00 0.00 C ATOM 1814 C LEU A 117 -0.055 2.538 -1.982 1.00 0.00 C ATOM 1815 O LEU A 117 -1.211 2.178 -1.764 1.00 0.00 O ATOM 1816 CB LEU A 117 1.286 3.545 -0.125 1.00 0.00 C ATOM 1817 CG LEU A 117 2.193 3.381 1.095 1.00 0.00 C ATOM 1818 CD1 LEU A 117 2.587 4.740 1.653 1.00 0.00 C ATOM 1819 CD2 LEU A 117 1.504 2.543 2.162 1.00 0.00 C ATOM 0 H LEU A 117 3.074 2.495 -1.455 1.00 0.00 H new ATOM 0 HA LEU A 117 0.727 1.477 -0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.717 4.308 -0.773 1.00 0.00 H new ATOM 0 HB3 LEU A 117 0.321 3.922 0.213 1.00 0.00 H new ATOM 0 HG LEU A 117 3.100 2.862 0.784 1.00 0.00 H new ATOM 0 HD11 LEU A 117 3.232 4.604 2.521 1.00 0.00 H new ATOM 0 HD12 LEU A 117 3.120 5.306 0.889 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.691 5.285 1.949 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.164 2.436 3.023 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.581 3.034 2.471 1.00 0.00 H new ATOM 0 HD23 LEU A 117 1.273 1.557 1.758 1.00 0.00 H new ATOM 1831 N GLN A 118 0.313 3.159 -3.098 1.00 0.00 N ATOM 1832 CA GLN A 118 -0.645 3.460 -4.155 1.00 0.00 C ATOM 1833 C GLN A 118 -1.370 2.197 -4.608 1.00 0.00 C ATOM 1834 O GLN A 118 -2.598 2.173 -4.702 1.00 0.00 O ATOM 1835 CB GLN A 118 0.063 4.110 -5.345 1.00 0.00 C ATOM 1836 CG GLN A 118 -0.884 4.570 -6.440 1.00 0.00 C ATOM 1837 CD GLN A 118 -0.178 5.340 -7.538 1.00 0.00 C ATOM 1838 OE1 GLN A 118 1.051 5.407 -7.573 1.00 0.00 O ATOM 1839 NE2 GLN A 118 -0.952 5.928 -8.443 1.00 0.00 N ATOM 0 H GLN A 118 1.267 3.463 -3.293 1.00 0.00 H new ATOM 0 HA GLN A 118 -1.382 4.157 -3.755 1.00 0.00 H new ATOM 0 HB2 GLN A 118 0.639 4.965 -4.991 1.00 0.00 H new ATOM 0 HB3 GLN A 118 0.774 3.399 -5.766 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.382 3.702 -6.873 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.661 5.198 -6.003 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -1.967 5.847 -8.376 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -0.532 6.461 -9.205 1.00 0.00 H new ATOM 1848 N LEU A 119 -0.604 1.149 -4.888 1.00 0.00 N ATOM 1849 CA LEU A 119 -1.173 -0.119 -5.331 1.00 0.00 C ATOM 1850 C LEU A 119 -2.262 -0.591 -4.374 1.00 0.00 C ATOM 1851 O LEU A 119 -3.269 -1.160 -4.797 1.00 0.00 O ATOM 1852 CB LEU A 119 -0.078 -1.181 -5.441 1.00 0.00 C ATOM 1853 CG LEU A 119 0.530 -1.378 -6.830 1.00 0.00 C ATOM 1854 CD1 LEU A 119 0.713 -0.039 -7.527 1.00 0.00 C ATOM 1855 CD2 LEU A 119 1.857 -2.117 -6.732 1.00 0.00 C ATOM 0 H LEU A 119 0.413 1.152 -4.816 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.621 0.035 -6.313 1.00 0.00 H new ATOM 0 HB2 LEU A 119 0.723 -0.921 -4.749 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -0.489 -2.134 -5.108 1.00 0.00 H new ATOM 0 HG LEU A 119 -0.156 -1.982 -7.424 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.147 -0.199 -8.514 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -0.254 0.452 -7.631 1.00 0.00 H new ATOM 0 HD13 LEU A 119 1.378 0.591 -6.936 1.00 0.00 H new ATOM 0 HD21 LEU A 119 2.275 -2.248 -7.730 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.551 -1.540 -6.121 1.00 0.00 H new ATOM 0 HD23 LEU A 119 1.697 -3.093 -6.275 1.00 0.00 H new ATOM 1867 N ILE A 120 -2.055 -0.350 -3.084 1.00 0.00 N ATOM 1868 CA ILE A 120 -3.021 -0.748 -2.068 1.00 0.00 C ATOM 1869 C ILE A 120 -4.247 0.159 -2.090 1.00 0.00 C ATOM 1870 O ILE A 120 -5.380 -0.309 -1.972 1.00 0.00 O ATOM 1871 CB ILE A 120 -2.400 -0.718 -0.659 1.00 0.00 C ATOM 1872 CG1 ILE A 120 -1.093 -1.513 -0.637 1.00 0.00 C ATOM 1873 CG2 ILE A 120 -3.380 -1.272 0.364 1.00 0.00 C ATOM 1874 CD1 ILE A 120 -0.418 -1.530 0.717 1.00 0.00 C ATOM 0 H ILE A 120 -1.227 0.119 -2.718 1.00 0.00 H new ATOM 0 HA ILE A 120 -3.323 -1.769 -2.302 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.179 0.317 -0.398 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -1.296 -2.539 -0.946 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -0.407 -1.089 -1.370 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.926 -1.244 1.355 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -4.287 -0.668 0.363 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.630 -2.302 0.108 1.00 0.00 H new ATOM 0 HD11 ILE A 120 0.502 -2.112 0.658 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -0.183 -0.509 1.019 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -1.086 -1.981 1.451 1.00 0.00 H new ATOM 1886 N LEU A 121 -4.013 1.457 -2.243 1.00 0.00 N ATOM 1887 CA LEU A 121 -5.098 2.431 -2.283 1.00 0.00 C ATOM 1888 C LEU A 121 -5.977 2.217 -3.511 1.00 0.00 C ATOM 1889 O LEU A 121 -7.170 2.517 -3.494 1.00 0.00 O ATOM 1890 CB LEU A 121 -4.535 3.853 -2.287 1.00 0.00 C ATOM 1891 CG LEU A 121 -5.433 4.929 -2.897 1.00 0.00 C ATOM 1892 CD1 LEU A 121 -6.556 5.293 -1.939 1.00 0.00 C ATOM 1893 CD2 LEU A 121 -4.618 6.162 -3.259 1.00 0.00 C ATOM 0 H LEU A 121 -3.081 1.860 -2.341 1.00 0.00 H new ATOM 0 HA LEU A 121 -5.710 2.292 -1.392 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.310 4.136 -1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -3.590 3.846 -2.830 1.00 0.00 H new ATOM 0 HG LEU A 121 -5.876 4.530 -3.809 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -7.185 6.060 -2.390 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -7.157 4.408 -1.730 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.132 5.672 -1.009 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.274 6.917 -3.692 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.146 6.562 -2.362 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -3.850 5.891 -3.983 1.00 0.00 H new ATOM 1905 N GLY A 122 -5.379 1.692 -4.577 1.00 0.00 N ATOM 1906 CA GLY A 122 -6.122 1.444 -5.798 1.00 0.00 C ATOM 1907 C GLY A 122 -7.037 0.241 -5.685 1.00 0.00 C ATOM 1908 O GLY A 122 -8.176 0.273 -6.154 1.00 0.00 O ATOM 0 H GLY A 122 -4.393 1.434 -4.616 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -6.714 2.325 -6.045 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -5.423 1.289 -6.620 1.00 0.00 H new ATOM 1912 N CYS A 123 -6.540 -0.822 -5.065 1.00 0.00 N ATOM 1913 CA CYS A 123 -7.320 -2.043 -4.895 1.00 0.00 C ATOM 1914 C CYS A 123 -8.536 -1.792 -4.008 1.00 0.00 C ATOM 1915 O CYS A 123 -9.529 -2.514 -4.081 1.00 0.00 O ATOM 1916 CB CYS A 123 -6.453 -3.148 -4.290 1.00 0.00 C ATOM 1917 SG CYS A 123 -5.286 -3.891 -5.455 1.00 0.00 S ATOM 0 H CYS A 123 -5.600 -0.864 -4.671 1.00 0.00 H new ATOM 0 HA CYS A 123 -7.668 -2.362 -5.878 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -5.897 -2.738 -3.447 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -7.102 -3.929 -3.894 1.00 0.00 H new ATOM 0 HG CYS A 123 -5.097 -3.082 -6.455 1.00 0.00 H new ATOM 1923 N ALA A 124 -8.449 -0.764 -3.171 1.00 0.00 N ATOM 1924 CA ALA A 124 -9.541 -0.417 -2.270 1.00 0.00 C ATOM 1925 C ALA A 124 -10.572 0.462 -2.971 1.00 0.00 C ATOM 1926 O ALA A 124 -11.777 0.252 -2.835 1.00 0.00 O ATOM 1927 CB ALA A 124 -9.002 0.282 -1.031 1.00 0.00 C ATOM 0 H ALA A 124 -7.633 -0.156 -3.098 1.00 0.00 H new ATOM 0 HA ALA A 124 -10.036 -1.339 -1.966 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -9.829 0.535 -0.367 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -8.310 -0.381 -0.512 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -8.481 1.193 -1.325 1.00 0.00 H new ATOM 1933 N VAL A 125 -10.090 1.450 -3.719 1.00 0.00 N ATOM 1934 CA VAL A 125 -10.969 2.361 -4.441 1.00 0.00 C ATOM 1935 C VAL A 125 -11.604 1.674 -5.645 1.00 0.00 C ATOM 1936 O VAL A 125 -12.318 2.302 -6.425 1.00 0.00 O ATOM 1937 CB VAL A 125 -10.210 3.613 -4.919 1.00 0.00 C ATOM 1938 CG1 VAL A 125 -9.749 4.444 -3.731 1.00 0.00 C ATOM 1939 CG2 VAL A 125 -9.030 3.218 -5.794 1.00 0.00 C ATOM 0 H VAL A 125 -9.095 1.639 -3.840 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.751 2.664 -3.745 1.00 0.00 H new ATOM 0 HB VAL A 125 -10.888 4.222 -5.516 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.215 5.324 -4.088 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -10.615 4.757 -3.148 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -9.086 3.847 -3.104 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -8.505 4.115 -6.123 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -8.349 2.587 -5.223 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -9.390 2.669 -6.664 1.00 0.00 H new ATOM 1949 N ASN A 126 -11.338 0.380 -5.789 1.00 0.00 N ATOM 1950 CA ASN A 126 -11.883 -0.393 -6.899 1.00 0.00 C ATOM 1951 C ASN A 126 -12.532 -1.680 -6.399 1.00 0.00 C ATOM 1952 O ASN A 126 -12.549 -2.692 -7.100 1.00 0.00 O ATOM 1953 CB ASN A 126 -10.781 -0.723 -7.908 1.00 0.00 C ATOM 1954 CG ASN A 126 -10.409 0.469 -8.768 1.00 0.00 C ATOM 1955 OD1 ASN A 126 -11.174 0.882 -9.640 1.00 0.00 O ATOM 1956 ND2 ASN A 126 -9.228 1.027 -8.527 1.00 0.00 N ATOM 0 H ASN A 126 -10.749 -0.155 -5.151 1.00 0.00 H new ATOM 0 HA ASN A 126 -12.646 0.211 -7.389 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -9.897 -1.073 -7.375 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -11.112 -1.541 -8.549 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -8.923 1.831 -9.075 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -8.626 0.651 -7.794 1.00 0.00 H new ATOM 1963 N CYS A 127 -13.064 -1.633 -5.183 1.00 0.00 N ATOM 1964 CA CYS A 127 -13.715 -2.796 -4.588 1.00 0.00 C ATOM 1965 C CYS A 127 -15.141 -2.462 -4.162 1.00 0.00 C ATOM 1966 O CYS A 127 -15.607 -1.338 -4.347 1.00 0.00 O ATOM 1967 CB CYS A 127 -12.913 -3.293 -3.384 1.00 0.00 C ATOM 1968 SG CYS A 127 -13.050 -5.073 -3.091 1.00 0.00 S ATOM 0 H CYS A 127 -13.058 -0.803 -4.590 1.00 0.00 H new ATOM 0 HA CYS A 127 -13.755 -3.584 -5.340 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -11.863 -3.039 -3.530 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -13.248 -2.762 -2.493 1.00 0.00 H new ATOM 0 HG CYS A 127 -12.126 -5.696 -3.762 1.00 0.00 H new ATOM 1974 N GLU A 128 -15.828 -3.447 -3.593 1.00 0.00 N ATOM 1975 CA GLU A 128 -17.203 -3.258 -3.143 1.00 0.00 C ATOM 1976 C GLU A 128 -17.253 -2.367 -1.906 1.00 0.00 C ATOM 1977 O GLU A 128 -18.107 -1.488 -1.793 1.00 0.00 O ATOM 1978 CB GLU A 128 -17.854 -4.609 -2.840 1.00 0.00 C ATOM 1979 CG GLU A 128 -17.045 -5.474 -1.889 1.00 0.00 C ATOM 1980 CD GLU A 128 -17.749 -6.771 -1.538 1.00 0.00 C ATOM 1981 OE1 GLU A 128 -17.881 -7.634 -2.431 1.00 0.00 O ATOM 1982 OE2 GLU A 128 -18.167 -6.923 -0.371 1.00 0.00 O ATOM 0 H GLU A 128 -15.456 -4.383 -3.433 1.00 0.00 H new ATOM 0 HA GLU A 128 -17.757 -2.768 -3.944 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -18.842 -4.439 -2.412 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -18.000 -5.150 -3.775 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -16.079 -5.700 -2.342 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -16.846 -4.914 -0.975 1.00 0.00 H new ATOM 1989 N LYS A 129 -16.331 -2.601 -0.978 1.00 0.00 N ATOM 1990 CA LYS A 129 -16.267 -1.820 0.252 1.00 0.00 C ATOM 1991 C LYS A 129 -15.527 -0.506 0.025 1.00 0.00 C ATOM 1992 O LYS A 129 -15.462 0.343 0.914 1.00 0.00 O ATOM 1993 CB LYS A 129 -15.575 -2.624 1.355 1.00 0.00 C ATOM 1994 CG LYS A 129 -16.287 -3.920 1.702 1.00 0.00 C ATOM 1995 CD LYS A 129 -16.047 -4.318 3.149 1.00 0.00 C ATOM 1996 CE LYS A 129 -17.031 -3.633 4.086 1.00 0.00 C ATOM 1997 NZ LYS A 129 -17.181 -4.374 5.369 1.00 0.00 N ATOM 0 H LYS A 129 -15.617 -3.326 -1.054 1.00 0.00 H new ATOM 0 HA LYS A 129 -17.287 -1.593 0.562 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -14.556 -2.852 1.042 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -15.503 -2.008 2.251 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -17.357 -3.806 1.528 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -15.939 -4.715 1.042 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -16.139 -5.399 3.250 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -15.028 -4.057 3.435 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -16.691 -2.618 4.290 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -18.002 -3.552 3.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -17.859 -3.876 5.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -17.529 -5.335 5.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -16.259 -4.429 5.848 1.00 0.00 H new ATOM 2011 N LYS A 130 -14.972 -0.344 -1.171 1.00 0.00 N ATOM 2012 CA LYS A 130 -14.238 0.868 -1.516 1.00 0.00 C ATOM 2013 C LYS A 130 -14.846 2.086 -0.828 1.00 0.00 C ATOM 2014 O LYS A 130 -14.128 2.917 -0.272 1.00 0.00 O ATOM 2015 CB LYS A 130 -14.238 1.073 -3.033 1.00 0.00 C ATOM 2016 CG LYS A 130 -15.467 1.801 -3.549 1.00 0.00 C ATOM 2017 CD LYS A 130 -15.313 2.188 -5.010 1.00 0.00 C ATOM 2018 CE LYS A 130 -15.849 1.104 -5.933 1.00 0.00 C ATOM 2019 NZ LYS A 130 -15.834 1.533 -7.359 1.00 0.00 N ATOM 0 H LYS A 130 -15.016 -1.037 -1.918 1.00 0.00 H new ATOM 0 HA LYS A 130 -13.211 0.753 -1.170 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -13.348 1.635 -3.315 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -14.170 0.101 -3.522 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -16.344 1.165 -3.431 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -15.639 2.696 -2.951 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -15.843 3.122 -5.198 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -14.261 2.368 -5.231 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -15.250 0.201 -5.819 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -16.868 0.849 -5.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -16.207 0.767 -7.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -16.426 2.380 -7.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -14.858 1.752 -7.645 1.00 0.00 H new ATOM 2033 N GLN A 131 -16.171 2.184 -0.869 1.00 0.00 N ATOM 2034 CA GLN A 131 -16.873 3.301 -0.249 1.00 0.00 C ATOM 2035 C GLN A 131 -16.436 3.481 1.201 1.00 0.00 C ATOM 2036 O GLN A 131 -16.133 4.592 1.634 1.00 0.00 O ATOM 2037 CB GLN A 131 -18.385 3.080 -0.314 1.00 0.00 C ATOM 2038 CG GLN A 131 -18.917 2.928 -1.730 1.00 0.00 C ATOM 2039 CD GLN A 131 -20.266 3.593 -1.921 1.00 0.00 C ATOM 2040 OE1 GLN A 131 -21.302 3.040 -1.549 1.00 0.00 O ATOM 2041 NE2 GLN A 131 -20.261 4.786 -2.504 1.00 0.00 N ATOM 0 H GLN A 131 -16.779 1.504 -1.325 1.00 0.00 H new ATOM 0 HA GLN A 131 -16.621 4.207 -0.801 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -18.638 2.188 0.258 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.888 3.920 0.166 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.202 3.358 -2.431 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.001 1.868 -1.971 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -19.379 5.207 -2.796 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -21.139 5.281 -2.659 1.00 0.00 H new ATOM 2050 N GLU A 132 -16.406 2.380 1.946 1.00 0.00 N ATOM 2051 CA GLU A 132 -16.006 2.418 3.348 1.00 0.00 C ATOM 2052 C GLU A 132 -14.663 3.124 3.512 1.00 0.00 C ATOM 2053 O GLU A 132 -14.368 3.683 4.569 1.00 0.00 O ATOM 2054 CB GLU A 132 -15.922 1.000 3.916 1.00 0.00 C ATOM 2055 CG GLU A 132 -16.252 0.916 5.397 1.00 0.00 C ATOM 2056 CD GLU A 132 -15.096 1.350 6.277 1.00 0.00 C ATOM 2057 OE1 GLU A 132 -13.948 1.360 5.786 1.00 0.00 O ATOM 2058 OE2 GLU A 132 -15.339 1.678 7.457 1.00 0.00 O ATOM 0 H GLU A 132 -16.654 1.452 1.603 1.00 0.00 H new ATOM 0 HA GLU A 132 -16.761 2.978 3.899 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -16.605 0.355 3.363 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -14.916 0.612 3.754 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -17.119 1.541 5.608 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -16.529 -0.108 5.646 1.00 0.00 H new ATOM 2065 N HIS A 133 -13.853 3.093 2.459 1.00 0.00 N ATOM 2066 CA HIS A 133 -12.541 3.730 2.486 1.00 0.00 C ATOM 2067 C HIS A 133 -12.618 5.158 1.954 1.00 0.00 C ATOM 2068 O HIS A 133 -12.090 6.087 2.564 1.00 0.00 O ATOM 2069 CB HIS A 133 -11.540 2.919 1.661 1.00 0.00 C ATOM 2070 CG HIS A 133 -11.453 1.481 2.071 1.00 0.00 C ATOM 2071 ND1 HIS A 133 -12.334 0.464 1.925 1.00 0.00 N flip ATOM 2072 CD2 HIS A 133 -10.357 0.948 2.715 1.00 0.00 C flip ATOM 2073 CE1 HIS A 133 -11.760 -0.654 2.477 1.00 0.00 C flip ATOM 2074 NE2 HIS A 133 -10.567 -0.336 2.947 1.00 0.00 N flip ATOM 0 H HIS A 133 -14.081 2.634 1.577 1.00 0.00 H new ATOM 0 HA HIS A 133 -12.203 3.765 3.522 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -11.821 2.972 0.609 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -10.554 3.374 1.751 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -13.253 0.518 1.486 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -9.466 1.494 2.987 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.211 -1.635 2.520 1.00 0.00 H new ATOM 2083 N ILE A 134 -13.279 5.323 0.813 1.00 0.00 N ATOM 2084 CA ILE A 134 -13.426 6.637 0.199 1.00 0.00 C ATOM 2085 C ILE A 134 -13.696 7.708 1.251 1.00 0.00 C ATOM 2086 O ILE A 134 -13.171 8.819 1.171 1.00 0.00 O ATOM 2087 CB ILE A 134 -14.566 6.651 -0.836 1.00 0.00 C ATOM 2088 CG1 ILE A 134 -14.056 6.170 -2.196 1.00 0.00 C ATOM 2089 CG2 ILE A 134 -15.160 8.047 -0.950 1.00 0.00 C ATOM 2090 CD1 ILE A 134 -13.598 4.729 -2.194 1.00 0.00 C ATOM 0 H ILE A 134 -13.721 4.563 0.295 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.485 6.856 -0.306 1.00 0.00 H new ATOM 0 HB ILE A 134 -15.349 5.970 -0.502 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.848 6.290 -2.935 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -13.228 6.806 -2.510 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -15.965 8.041 -1.685 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -15.555 8.354 0.018 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -14.386 8.747 -1.265 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -13.250 4.456 -3.190 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -12.784 4.607 -1.479 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -14.429 4.083 -1.911 1.00 0.00 H new ATOM 2102 N LYS A 135 -14.515 7.366 2.239 1.00 0.00 N ATOM 2103 CA LYS A 135 -14.854 8.296 3.310 1.00 0.00 C ATOM 2104 C LYS A 135 -13.619 8.652 4.131 1.00 0.00 C ATOM 2105 O LYS A 135 -13.453 9.795 4.555 1.00 0.00 O ATOM 2106 CB LYS A 135 -15.926 7.691 4.219 1.00 0.00 C ATOM 2107 CG LYS A 135 -15.476 6.428 4.933 1.00 0.00 C ATOM 2108 CD LYS A 135 -16.558 5.895 5.858 1.00 0.00 C ATOM 2109 CE LYS A 135 -15.978 4.976 6.922 1.00 0.00 C ATOM 2110 NZ LYS A 135 -16.987 4.002 7.424 1.00 0.00 N ATOM 0 H LYS A 135 -14.957 6.450 2.321 1.00 0.00 H new ATOM 0 HA LYS A 135 -15.243 9.207 2.856 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -16.222 8.432 4.961 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -16.811 7.466 3.623 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -15.217 5.666 4.198 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -14.574 6.636 5.508 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -17.072 6.728 6.337 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -17.303 5.354 5.275 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -15.126 4.436 6.510 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -15.605 5.574 7.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -16.545 3.066 7.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -17.345 4.318 8.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -17.776 3.941 6.749 1.00 0.00 H new ATOM 2124 N ASN A 136 -12.754 7.667 4.350 1.00 0.00 N ATOM 2125 CA ASN A 136 -11.533 7.877 5.119 1.00 0.00 C ATOM 2126 C ASN A 136 -10.664 8.954 4.476 1.00 0.00 C ATOM 2127 O ASN A 136 -9.912 9.649 5.160 1.00 0.00 O ATOM 2128 CB ASN A 136 -10.745 6.571 5.233 1.00 0.00 C ATOM 2129 CG ASN A 136 -11.098 5.790 6.485 1.00 0.00 C ATOM 2130 OD1 ASN A 136 -11.702 6.326 7.414 1.00 0.00 O ATOM 2131 ND2 ASN A 136 -10.721 4.517 6.514 1.00 0.00 N ATOM 0 H ASN A 136 -12.876 6.715 4.005 1.00 0.00 H new ATOM 0 HA ASN A 136 -11.815 8.211 6.118 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -10.941 5.954 4.356 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -9.678 6.793 5.235 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -10.930 3.942 7.330 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -10.222 4.115 5.720 1.00 0.00 H new ATOM 2138 N ILE A 137 -10.774 9.086 3.159 1.00 0.00 N ATOM 2139 CA ILE A 137 -9.999 10.079 2.424 1.00 0.00 C ATOM 2140 C ILE A 137 -10.537 11.485 2.667 1.00 0.00 C ATOM 2141 O ILE A 137 -9.785 12.398 3.006 1.00 0.00 O ATOM 2142 CB ILE A 137 -10.007 9.792 0.911 1.00 0.00 C ATOM 2143 CG1 ILE A 137 -9.205 8.525 0.606 1.00 0.00 C ATOM 2144 CG2 ILE A 137 -9.445 10.979 0.144 1.00 0.00 C ATOM 2145 CD1 ILE A 137 -10.061 7.284 0.479 1.00 0.00 C ATOM 0 H ILE A 137 -11.392 8.519 2.579 1.00 0.00 H new ATOM 0 HA ILE A 137 -8.975 10.016 2.792 1.00 0.00 H new ATOM 0 HB ILE A 137 -11.037 9.633 0.591 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -8.650 8.670 -0.321 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -8.470 8.371 1.396 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -9.457 10.761 -0.924 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -10.054 11.861 0.341 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -8.420 11.167 0.464 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -9.426 6.425 0.263 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -10.596 7.114 1.413 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -10.778 7.418 -0.331 1.00 0.00 H new ATOM 2157 N MET A 138 -11.844 11.651 2.491 1.00 0.00 N ATOM 2158 CA MET A 138 -12.484 12.946 2.694 1.00 0.00 C ATOM 2159 C MET A 138 -12.134 13.516 4.065 1.00 0.00 C ATOM 2160 O MET A 138 -11.963 14.726 4.221 1.00 0.00 O ATOM 2161 CB MET A 138 -14.002 12.816 2.555 1.00 0.00 C ATOM 2162 CG MET A 138 -14.440 12.198 1.237 1.00 0.00 C ATOM 2163 SD MET A 138 -13.992 13.209 -0.187 1.00 0.00 S ATOM 2164 CE MET A 138 -12.408 12.496 -0.623 1.00 0.00 C ATOM 0 H MET A 138 -12.480 10.906 2.208 1.00 0.00 H new ATOM 0 HA MET A 138 -12.114 13.630 1.930 1.00 0.00 H new ATOM 0 HB2 MET A 138 -14.383 12.209 3.376 1.00 0.00 H new ATOM 0 HB3 MET A 138 -14.454 13.803 2.652 1.00 0.00 H new ATOM 0 HG2 MET A 138 -13.987 11.212 1.134 1.00 0.00 H new ATOM 0 HG3 MET A 138 -15.520 12.053 1.249 1.00 0.00 H new ATOM 0 HE1 MET A 138 -12.360 12.350 -1.702 1.00 0.00 H new ATOM 0 HE2 MET A 138 -11.608 13.168 -0.312 1.00 0.00 H new ATOM 0 HE3 MET A 138 -12.291 11.536 -0.121 1.00 0.00 H new ATOM 2174 N THR A 139 -12.030 12.637 5.058 1.00 0.00 N ATOM 2175 CA THR A 139 -11.702 13.054 6.415 1.00 0.00 C ATOM 2176 C THR A 139 -10.286 13.613 6.493 1.00 0.00 C ATOM 2177 O THR A 139 -10.015 14.541 7.255 1.00 0.00 O ATOM 2178 CB THR A 139 -11.835 11.884 7.409 1.00 0.00 C ATOM 2179 OG1 THR A 139 -10.874 10.868 7.101 1.00 0.00 O ATOM 2180 CG2 THR A 139 -13.236 11.293 7.366 1.00 0.00 C ATOM 0 H THR A 139 -12.168 11.633 4.947 1.00 0.00 H new ATOM 0 HA THR A 139 -12.413 13.835 6.686 1.00 0.00 H new ATOM 0 HB THR A 139 -11.650 12.267 8.413 1.00 0.00 H new ATOM 0 HG1 THR A 139 -10.781 10.790 6.129 1.00 0.00 H new ATOM 0 HG21 THR A 139 -13.305 10.469 8.076 1.00 0.00 H new ATOM 0 HG22 THR A 139 -13.963 12.061 7.629 1.00 0.00 H new ATOM 0 HG23 THR A 139 -13.445 10.925 6.362 1.00 0.00 H new ATOM 2188 N LEU A 140 -9.386 13.044 5.698 1.00 0.00 N ATOM 2189 CA LEU A 140 -7.996 13.486 5.676 1.00 0.00 C ATOM 2190 C LEU A 140 -7.908 14.991 5.444 1.00 0.00 C ATOM 2191 O LEU A 140 -8.924 15.660 5.253 1.00 0.00 O ATOM 2192 CB LEU A 140 -7.221 12.744 4.586 1.00 0.00 C ATOM 2193 CG LEU A 140 -7.132 11.226 4.742 1.00 0.00 C ATOM 2194 CD1 LEU A 140 -6.070 10.655 3.815 1.00 0.00 C ATOM 2195 CD2 LEU A 140 -6.836 10.854 6.187 1.00 0.00 C ATOM 0 H LEU A 140 -9.594 12.276 5.060 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.553 13.259 6.646 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.685 12.964 3.624 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -6.208 13.146 4.551 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.095 10.796 4.467 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.021 9.573 3.940 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.325 10.890 2.782 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.102 11.092 4.058 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.776 9.769 6.279 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -5.887 11.297 6.490 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.632 11.229 6.830 1.00 0.00 H new ATOM 2207 N GLU A 141 -6.687 15.517 5.459 1.00 0.00 N ATOM 2208 CA GLU A 141 -6.467 16.943 5.248 1.00 0.00 C ATOM 2209 C GLU A 141 -6.562 17.295 3.766 1.00 0.00 C ATOM 2210 O GLU A 141 -6.016 16.593 2.915 1.00 0.00 O ATOM 2211 CB GLU A 141 -5.099 17.357 5.795 1.00 0.00 C ATOM 2212 CG GLU A 141 -4.709 18.782 5.443 1.00 0.00 C ATOM 2213 CD GLU A 141 -5.441 19.812 6.283 1.00 0.00 C ATOM 2214 OE1 GLU A 141 -5.069 19.987 7.462 1.00 0.00 O ATOM 2215 OE2 GLU A 141 -6.385 20.441 5.761 1.00 0.00 O ATOM 0 H GLU A 141 -5.836 14.977 5.615 1.00 0.00 H new ATOM 0 HA GLU A 141 -7.245 17.488 5.784 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -5.102 17.248 6.879 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -4.341 16.676 5.408 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -3.635 18.905 5.579 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -4.919 18.962 4.389 1.00 0.00 H new ATOM 2222 N GLU A 142 -7.260 18.386 3.467 1.00 0.00 N ATOM 2223 CA GLU A 142 -7.428 18.830 2.088 1.00 0.00 C ATOM 2224 C GLU A 142 -6.206 18.469 1.248 1.00 0.00 C ATOM 2225 O GLU A 142 -6.244 17.535 0.446 1.00 0.00 O ATOM 2226 CB GLU A 142 -7.664 20.341 2.041 1.00 0.00 C ATOM 2227 CG GLU A 142 -9.130 20.724 1.925 1.00 0.00 C ATOM 2228 CD GLU A 142 -9.442 22.049 2.593 1.00 0.00 C ATOM 2229 OE1 GLU A 142 -8.876 22.316 3.674 1.00 0.00 O ATOM 2230 OE2 GLU A 142 -10.252 22.818 2.035 1.00 0.00 O ATOM 0 H GLU A 142 -7.718 18.978 4.160 1.00 0.00 H new ATOM 0 HA GLU A 142 -8.297 18.320 1.672 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -7.249 20.793 2.942 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -7.120 20.759 1.194 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -9.405 20.779 0.872 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -9.742 19.942 2.374 1.00 0.00 H new ATOM 2237 N SER A 143 -5.123 19.217 1.437 1.00 0.00 N ATOM 2238 CA SER A 143 -3.891 18.979 0.694 1.00 0.00 C ATOM 2239 C SER A 143 -3.649 17.484 0.507 1.00 0.00 C ATOM 2240 O SER A 143 -3.261 17.036 -0.572 1.00 0.00 O ATOM 2241 CB SER A 143 -2.703 19.614 1.419 1.00 0.00 C ATOM 2242 OG SER A 143 -1.532 19.561 0.623 1.00 0.00 O ATOM 0 H SER A 143 -5.074 19.992 2.098 1.00 0.00 H new ATOM 0 HA SER A 143 -3.994 19.438 -0.289 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.934 20.651 1.663 1.00 0.00 H new ATOM 0 HB3 SER A 143 -2.529 19.096 2.362 1.00 0.00 H new ATOM 0 HG SER A 143 -0.788 19.975 1.108 1.00 0.00 H new ATOM 2248 N VAL A 144 -3.880 16.717 1.568 1.00 0.00 N ATOM 2249 CA VAL A 144 -3.688 15.273 1.523 1.00 0.00 C ATOM 2250 C VAL A 144 -4.688 14.615 0.579 1.00 0.00 C ATOM 2251 O VAL A 144 -4.307 13.875 -0.327 1.00 0.00 O ATOM 2252 CB VAL A 144 -3.829 14.644 2.922 1.00 0.00 C ATOM 2253 CG1 VAL A 144 -3.457 13.169 2.884 1.00 0.00 C ATOM 2254 CG2 VAL A 144 -2.971 15.393 3.931 1.00 0.00 C ATOM 0 H VAL A 144 -4.200 17.072 2.469 1.00 0.00 H new ATOM 0 HA VAL A 144 -2.677 15.100 1.155 1.00 0.00 H new ATOM 0 HB VAL A 144 -4.870 14.724 3.234 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -3.563 12.741 3.881 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -4.117 12.645 2.193 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -2.425 13.063 2.551 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -3.082 14.936 4.914 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -1.926 15.346 3.625 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -3.289 16.434 3.977 1.00 0.00 H new ATOM 2264 N GLN A 145 -5.970 14.890 0.798 1.00 0.00 N ATOM 2265 CA GLN A 145 -7.026 14.324 -0.033 1.00 0.00 C ATOM 2266 C GLN A 145 -6.665 14.421 -1.512 1.00 0.00 C ATOM 2267 O GLN A 145 -6.985 13.531 -2.300 1.00 0.00 O ATOM 2268 CB GLN A 145 -8.351 15.042 0.229 1.00 0.00 C ATOM 2269 CG GLN A 145 -9.055 14.576 1.493 1.00 0.00 C ATOM 2270 CD GLN A 145 -9.856 15.680 2.155 1.00 0.00 C ATOM 2271 OE1 GLN A 145 -9.348 16.403 3.013 1.00 0.00 O ATOM 2272 NE2 GLN A 145 -11.116 15.816 1.760 1.00 0.00 N ATOM 0 H GLN A 145 -6.302 15.501 1.544 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.134 13.271 0.228 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -8.166 16.114 0.300 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -9.013 14.888 -0.623 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -9.719 13.746 1.250 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -8.315 14.196 2.198 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -11.496 15.195 1.046 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -11.704 16.542 2.171 1.00 0.00 H new ATOM 2281 N HIS A 146 -5.997 15.509 -1.883 1.00 0.00 N ATOM 2282 CA HIS A 146 -5.592 15.723 -3.268 1.00 0.00 C ATOM 2283 C HIS A 146 -4.691 14.591 -3.751 1.00 0.00 C ATOM 2284 O HIS A 146 -5.040 13.857 -4.675 1.00 0.00 O ATOM 2285 CB HIS A 146 -4.869 17.063 -3.409 1.00 0.00 C ATOM 2286 CG HIS A 146 -3.861 17.086 -4.516 1.00 0.00 C ATOM 2287 ND1 HIS A 146 -4.061 16.459 -5.729 1.00 0.00 N ATOM 2288 CD2 HIS A 146 -2.640 17.665 -4.590 1.00 0.00 C ATOM 2289 CE1 HIS A 146 -3.006 16.652 -6.500 1.00 0.00 C ATOM 2290 NE2 HIS A 146 -2.129 17.381 -5.833 1.00 0.00 N ATOM 0 H HIS A 146 -5.725 16.256 -1.244 1.00 0.00 H new ATOM 0 HA HIS A 146 -6.490 15.737 -3.886 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -5.606 17.847 -3.583 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -4.370 17.298 -2.469 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -2.157 18.243 -3.816 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -2.881 16.277 -7.505 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -1.220 17.684 -6.184 1.00 0.00 H new ATOM 2299 N VAL A 147 -3.528 14.457 -3.121 1.00 0.00 N ATOM 2300 CA VAL A 147 -2.576 13.415 -3.486 1.00 0.00 C ATOM 2301 C VAL A 147 -3.224 12.036 -3.435 1.00 0.00 C ATOM 2302 O VAL A 147 -3.025 11.210 -4.326 1.00 0.00 O ATOM 2303 CB VAL A 147 -1.347 13.427 -2.559 1.00 0.00 C ATOM 2304 CG1 VAL A 147 -0.405 12.284 -2.905 1.00 0.00 C ATOM 2305 CG2 VAL A 147 -0.628 14.766 -2.645 1.00 0.00 C ATOM 0 H VAL A 147 -3.223 15.057 -2.355 1.00 0.00 H new ATOM 0 HA VAL A 147 -2.254 13.625 -4.506 1.00 0.00 H new ATOM 0 HB VAL A 147 -1.687 13.288 -1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 147 0.458 12.309 -2.239 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -0.927 11.334 -2.787 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -0.070 12.388 -3.937 1.00 0.00 H new ATOM 0 HG21 VAL A 147 0.238 14.757 -1.983 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -0.300 14.938 -3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -1.307 15.564 -2.343 1.00 0.00 H new ATOM 2315 N VAL A 148 -4.002 11.793 -2.385 1.00 0.00 N ATOM 2316 CA VAL A 148 -4.682 10.514 -2.217 1.00 0.00 C ATOM 2317 C VAL A 148 -5.686 10.273 -3.339 1.00 0.00 C ATOM 2318 O VAL A 148 -5.809 9.159 -3.846 1.00 0.00 O ATOM 2319 CB VAL A 148 -5.414 10.441 -0.864 1.00 0.00 C ATOM 2320 CG1 VAL A 148 -6.437 9.315 -0.869 1.00 0.00 C ATOM 2321 CG2 VAL A 148 -4.418 10.262 0.272 1.00 0.00 C ATOM 0 H VAL A 148 -4.177 12.465 -1.638 1.00 0.00 H new ATOM 0 HA VAL A 148 -3.914 9.741 -2.249 1.00 0.00 H new ATOM 0 HB VAL A 148 -5.944 11.380 -0.707 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -6.944 9.279 0.095 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -7.169 9.492 -1.657 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -5.932 8.366 -1.049 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -4.953 10.212 1.220 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -3.858 9.339 0.123 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -3.729 11.106 0.288 1.00 0.00 H new ATOM 2331 N MET A 149 -6.400 11.327 -3.722 1.00 0.00 N ATOM 2332 CA MET A 149 -7.392 11.230 -4.787 1.00 0.00 C ATOM 2333 C MET A 149 -6.718 11.124 -6.151 1.00 0.00 C ATOM 2334 O MET A 149 -7.229 10.468 -7.059 1.00 0.00 O ATOM 2335 CB MET A 149 -8.322 12.444 -4.757 1.00 0.00 C ATOM 2336 CG MET A 149 -9.334 12.408 -3.623 1.00 0.00 C ATOM 2337 SD MET A 149 -10.873 11.594 -4.091 1.00 0.00 S ATOM 2338 CE MET A 149 -10.511 9.899 -3.639 1.00 0.00 C ATOM 0 H MET A 149 -6.310 12.256 -3.312 1.00 0.00 H new ATOM 0 HA MET A 149 -7.979 10.327 -4.622 1.00 0.00 H new ATOM 0 HB2 MET A 149 -7.721 13.349 -4.668 1.00 0.00 H new ATOM 0 HB3 MET A 149 -8.854 12.507 -5.706 1.00 0.00 H new ATOM 0 HG2 MET A 149 -8.898 11.889 -2.769 1.00 0.00 H new ATOM 0 HG3 MET A 149 -9.550 13.427 -3.301 1.00 0.00 H new ATOM 0 HE1 MET A 149 -10.403 9.297 -4.541 1.00 0.00 H new ATOM 0 HE2 MET A 149 -9.584 9.865 -3.067 1.00 0.00 H new ATOM 0 HE3 MET A 149 -11.326 9.502 -3.033 1.00 0.00 H new ATOM 2348 N THR A 150 -5.566 11.774 -6.289 1.00 0.00 N ATOM 2349 CA THR A 150 -4.823 11.754 -7.542 1.00 0.00 C ATOM 2350 C THR A 150 -4.342 10.346 -7.874 1.00 0.00 C ATOM 2351 O THR A 150 -4.520 9.867 -8.994 1.00 0.00 O ATOM 2352 CB THR A 150 -3.608 12.700 -7.490 1.00 0.00 C ATOM 2353 OG1 THR A 150 -4.047 14.051 -7.312 1.00 0.00 O ATOM 2354 CG2 THR A 150 -2.784 12.593 -8.764 1.00 0.00 C ATOM 0 H THR A 150 -5.128 12.321 -5.548 1.00 0.00 H new ATOM 0 HA THR A 150 -5.507 12.094 -8.320 1.00 0.00 H new ATOM 0 HB THR A 150 -2.983 12.407 -6.646 1.00 0.00 H new ATOM 0 HG1 THR A 150 -4.284 14.197 -6.372 1.00 0.00 H new ATOM 0 HG21 THR A 150 -1.932 13.270 -8.704 1.00 0.00 H new ATOM 0 HG22 THR A 150 -2.427 11.570 -8.882 1.00 0.00 H new ATOM 0 HG23 THR A 150 -3.402 12.862 -9.621 1.00 0.00 H new ATOM 2362 N ALA A 151 -3.734 9.687 -6.893 1.00 0.00 N ATOM 2363 CA ALA A 151 -3.230 8.332 -7.081 1.00 0.00 C ATOM 2364 C ALA A 151 -4.240 7.470 -7.831 1.00 0.00 C ATOM 2365 O ALA A 151 -3.889 6.773 -8.783 1.00 0.00 O ATOM 2366 CB ALA A 151 -2.892 7.704 -5.737 1.00 0.00 C ATOM 0 H ALA A 151 -3.579 10.069 -5.960 1.00 0.00 H new ATOM 0 HA ALA A 151 -2.322 8.388 -7.682 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -2.517 6.692 -5.892 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -2.129 8.301 -5.238 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -3.788 7.668 -5.117 1.00 0.00 H new ATOM 2372 N ILE A 152 -5.494 7.522 -7.395 1.00 0.00 N ATOM 2373 CA ILE A 152 -6.554 6.746 -8.026 1.00 0.00 C ATOM 2374 C ILE A 152 -6.574 6.967 -9.535 1.00 0.00 C ATOM 2375 O ILE A 152 -6.519 6.014 -10.312 1.00 0.00 O ATOM 2376 CB ILE A 152 -7.936 7.105 -7.448 1.00 0.00 C ATOM 2377 CG1 ILE A 152 -8.048 6.624 -6.000 1.00 0.00 C ATOM 2378 CG2 ILE A 152 -9.041 6.499 -8.300 1.00 0.00 C ATOM 2379 CD1 ILE A 152 -7.666 7.676 -4.982 1.00 0.00 C ATOM 0 H ILE A 152 -5.801 8.093 -6.608 1.00 0.00 H new ATOM 0 HA ILE A 152 -6.343 5.697 -7.817 1.00 0.00 H new ATOM 0 HB ILE A 152 -8.048 8.189 -7.461 1.00 0.00 H new ATOM 0 HG12 ILE A 152 -9.072 6.302 -5.811 1.00 0.00 H new ATOM 0 HG13 ILE A 152 -7.409 5.751 -5.865 1.00 0.00 H new ATOM 0 HG21 ILE A 152 -10.011 6.762 -7.878 1.00 0.00 H new ATOM 0 HG22 ILE A 152 -8.970 6.886 -9.317 1.00 0.00 H new ATOM 0 HG23 ILE A 152 -8.934 5.414 -8.316 1.00 0.00 H new ATOM 0 HD11 ILE A 152 -7.769 7.265 -3.978 1.00 0.00 H new ATOM 0 HD12 ILE A 152 -6.632 7.981 -5.145 1.00 0.00 H new ATOM 0 HD13 ILE A 152 -8.321 8.541 -5.089 1.00 0.00 H new ATOM 2391 N GLN A 153 -6.652 8.230 -9.941 1.00 0.00 N ATOM 2392 CA GLN A 153 -6.677 8.576 -11.358 1.00 0.00 C ATOM 2393 C GLN A 153 -5.495 7.952 -12.092 1.00 0.00 C ATOM 2394 O GLN A 153 -5.635 7.468 -13.214 1.00 0.00 O ATOM 2395 CB GLN A 153 -6.659 10.095 -11.534 1.00 0.00 C ATOM 2396 CG GLN A 153 -7.622 10.826 -10.612 1.00 0.00 C ATOM 2397 CD GLN A 153 -9.025 10.255 -10.662 1.00 0.00 C ATOM 2398 OE1 GLN A 153 -9.598 10.079 -11.738 1.00 0.00 O ATOM 2399 NE2 GLN A 153 -9.586 9.960 -9.496 1.00 0.00 N ATOM 0 H GLN A 153 -6.699 9.030 -9.310 1.00 0.00 H new ATOM 0 HA GLN A 153 -7.597 8.179 -11.787 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -5.648 10.461 -11.354 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -6.906 10.336 -12.568 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -7.249 10.774 -9.589 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -7.653 11.880 -10.887 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -9.075 10.122 -8.628 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -10.529 9.571 -9.467 1.00 0.00 H new ATOM 2408 N GLU A 154 -4.331 7.968 -11.450 1.00 0.00 N ATOM 2409 CA GLU A 154 -3.124 7.405 -12.044 1.00 0.00 C ATOM 2410 C GLU A 154 -3.223 5.885 -12.141 1.00 0.00 C ATOM 2411 O GLU A 154 -2.758 5.282 -13.108 1.00 0.00 O ATOM 2412 CB GLU A 154 -1.894 7.795 -11.221 1.00 0.00 C ATOM 2413 CG GLU A 154 -0.605 7.162 -11.716 1.00 0.00 C ATOM 2414 CD GLU A 154 0.108 8.017 -12.746 1.00 0.00 C ATOM 2415 OE1 GLU A 154 -0.444 8.196 -13.852 1.00 0.00 O ATOM 2416 OE2 GLU A 154 1.216 8.507 -12.446 1.00 0.00 O ATOM 0 H GLU A 154 -4.198 8.364 -10.520 1.00 0.00 H new ATOM 0 HA GLU A 154 -3.023 7.810 -13.051 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -1.786 8.879 -11.237 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -2.055 7.506 -10.183 1.00 0.00 H new ATOM 0 HG2 GLU A 154 0.059 6.990 -10.869 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -0.827 6.187 -12.150 1.00 0.00 H new ATOM 2423 N LEU A 155 -3.832 5.273 -11.131 1.00 0.00 N ATOM 2424 CA LEU A 155 -3.993 3.823 -11.101 1.00 0.00 C ATOM 2425 C LEU A 155 -4.872 3.349 -12.253 1.00 0.00 C ATOM 2426 O LEU A 155 -4.569 2.352 -12.908 1.00 0.00 O ATOM 2427 CB LEU A 155 -4.601 3.386 -9.767 1.00 0.00 C ATOM 2428 CG LEU A 155 -3.629 3.263 -8.594 1.00 0.00 C ATOM 2429 CD1 LEU A 155 -4.359 3.449 -7.273 1.00 0.00 C ATOM 2430 CD2 LEU A 155 -2.919 1.918 -8.628 1.00 0.00 C ATOM 0 H LEU A 155 -4.222 5.758 -10.323 1.00 0.00 H new ATOM 0 HA LEU A 155 -3.008 3.370 -11.210 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -5.379 4.099 -9.495 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -5.088 2.422 -9.911 1.00 0.00 H new ATOM 0 HG LEU A 155 -2.880 4.049 -8.685 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -3.650 3.358 -6.450 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -4.820 4.437 -7.248 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -5.131 2.686 -7.173 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -2.231 1.848 -7.785 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -3.655 1.116 -8.563 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -2.362 1.824 -9.560 1.00 0.00 H new ATOM 2442 N MET A 156 -5.961 4.071 -12.497 1.00 0.00 N ATOM 2443 CA MET A 156 -6.882 3.725 -13.573 1.00 0.00 C ATOM 2444 C MET A 156 -6.255 4.004 -14.935 1.00 0.00 C ATOM 2445 O MET A 156 -6.455 3.249 -15.887 1.00 0.00 O ATOM 2446 CB MET A 156 -8.187 4.510 -13.428 1.00 0.00 C ATOM 2447 CG MET A 156 -8.731 4.528 -12.009 1.00 0.00 C ATOM 2448 SD MET A 156 -10.527 4.681 -11.956 1.00 0.00 S ATOM 2449 CE MET A 156 -10.839 4.408 -10.213 1.00 0.00 C ATOM 0 H MET A 156 -6.227 4.899 -11.964 1.00 0.00 H new ATOM 0 HA MET A 156 -7.099 2.659 -13.504 1.00 0.00 H new ATOM 0 HB2 MET A 156 -8.023 5.536 -13.758 1.00 0.00 H new ATOM 0 HB3 MET A 156 -8.937 4.078 -14.090 1.00 0.00 H new ATOM 0 HG2 MET A 156 -8.433 3.612 -11.498 1.00 0.00 H new ATOM 0 HG3 MET A 156 -8.283 5.358 -11.463 1.00 0.00 H new ATOM 0 HE1 MET A 156 -11.644 3.683 -10.097 1.00 0.00 H new ATOM 0 HE2 MET A 156 -9.936 4.027 -9.737 1.00 0.00 H new ATOM 0 HE3 MET A 156 -11.127 5.348 -9.743 1.00 0.00 H new ATOM 2459 N SER A 157 -5.498 5.093 -15.021 1.00 0.00 N ATOM 2460 CA SER A 157 -4.845 5.474 -16.269 1.00 0.00 C ATOM 2461 C SER A 157 -3.806 4.435 -16.677 1.00 0.00 C ATOM 2462 O SER A 157 -3.740 4.027 -17.837 1.00 0.00 O ATOM 2463 CB SER A 157 -4.183 6.845 -16.124 1.00 0.00 C ATOM 2464 OG SER A 157 -5.114 7.817 -15.682 1.00 0.00 O ATOM 0 H SER A 157 -5.321 5.727 -14.242 1.00 0.00 H new ATOM 0 HA SER A 157 -5.606 5.526 -17.048 1.00 0.00 H new ATOM 0 HB2 SER A 157 -3.357 6.780 -15.416 1.00 0.00 H new ATOM 0 HB3 SER A 157 -3.760 7.151 -17.081 1.00 0.00 H new ATOM 0 HG SER A 157 -5.096 7.866 -14.703 1.00 0.00 H new