USER MOD reduce.3.24.130724 H: found=0, std=0, add=810, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 815 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 108 SER OG : rot 180:sc= 1.01 USER MOD Set 1.2: A 124 THR OG1 : rot -94:sc= 1.21 USER MOD Set 2.1: A 95 CYS SG : rot -169:sc= -1.92 USER MOD Set 2.2: A 97 GLN : amide:sc= -1.53 K(o=-3.5,f=-5!) USER MOD Single : A 4 SER OG : rot 2:sc= 1 USER MOD Single : A 6 ASN : amide:sc= -2.33 K(o=-2.3,f=-3.4) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -1.91 X(o=-1.9,f=-2.1) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -1.71 K(o=-1.7,f=-2.4) USER MOD Single : A 49 THR OG1 : rot 169:sc= -0.513 USER MOD Single : A 51 TYR OH : rot -13:sc= -2.46 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN :FLIP amide:sc= -1.01 F(o=-4.1!,f=-1) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 CYS SG : rot 30:sc= 0.277 USER MOD Single : A 82 LYS NZ :NH3+ -147:sc= -0.114 (180deg=-1.54!) USER MOD Single : A 83 SER OG : rot 129:sc= -0.0411 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= -0.106 USER MOD Single : A 91 ASN : amide:sc= -1.55 K(o=-1.6,f=-8!) USER MOD Single : A 92 LYS NZ :NH3+ 172:sc= 0.0834 (180deg=0.0533) USER MOD Single : A 93 MET CE :methyl 175:sc= -3.96! (180deg=-4.01!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0399 USER MOD Single : A 110 THR OG1 : rot 47:sc= 0.639 USER MOD Single : A 122 THR OG1 : rot 180:sc= -1.31 USER MOD Single : A 123 MET CE :methyl -165:sc= -0.542 (180deg=-1.08) USER MOD Single : A 130 CYS SG : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 180:sc= -1.45 USER MOD Single : A 134 TYR OH : rot 180:sc= -2.51 USER MOD ----------------------------------------------------------------- ATOM 31 N PHE A 3 -12.998 3.029 5.806 1.00 0.00 N ATOM 32 CA PHE A 3 -12.071 3.209 4.655 1.00 0.00 C ATOM 33 C PHE A 3 -12.841 3.664 3.410 1.00 0.00 C ATOM 34 O PHE A 3 -12.253 4.142 2.457 1.00 0.00 O ATOM 35 CB PHE A 3 -11.398 1.881 4.338 1.00 0.00 C ATOM 36 CG PHE A 3 -10.638 1.341 5.531 1.00 0.00 C ATOM 37 CD1 PHE A 3 -11.311 0.886 6.678 1.00 0.00 C ATOM 38 CD2 PHE A 3 -9.252 1.219 5.451 1.00 0.00 C ATOM 39 CE1 PHE A 3 -10.602 0.308 7.723 1.00 0.00 C ATOM 40 CE2 PHE A 3 -8.538 0.656 6.511 1.00 0.00 C ATOM 41 CZ PHE A 3 -9.222 0.190 7.648 1.00 0.00 C ATOM 0 HA PHE A 3 -11.331 3.963 4.923 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -12.151 1.156 4.027 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -10.714 2.010 3.499 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -12.384 0.986 6.747 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -8.730 1.560 4.569 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -11.127 -0.051 8.596 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -7.462 0.579 6.458 1.00 0.00 H new ATOM 0 HZ PHE A 3 -8.673 -0.259 8.462 1.00 0.00 H new ATOM 51 N SER A 4 -14.142 3.506 3.397 1.00 0.00 N ATOM 52 CA SER A 4 -14.935 3.913 2.197 1.00 0.00 C ATOM 53 C SER A 4 -14.777 5.418 1.958 1.00 0.00 C ATOM 54 O SER A 4 -15.285 6.228 2.712 1.00 0.00 O ATOM 55 CB SER A 4 -16.413 3.587 2.421 1.00 0.00 C ATOM 56 OG SER A 4 -16.973 4.523 3.333 1.00 0.00 O ATOM 0 H SER A 4 -14.688 3.113 4.164 1.00 0.00 H new ATOM 0 HA SER A 4 -14.570 3.368 1.327 1.00 0.00 H new ATOM 0 HB2 SER A 4 -16.951 3.620 1.474 1.00 0.00 H new ATOM 0 HB3 SER A 4 -16.518 2.575 2.812 1.00 0.00 H new ATOM 0 HG SER A 4 -16.291 5.178 3.590 1.00 0.00 H new ATOM 62 N GLY A 5 -14.078 5.801 0.917 1.00 0.00 N ATOM 63 CA GLY A 5 -13.893 7.255 0.635 1.00 0.00 C ATOM 64 C GLY A 5 -12.647 7.466 -0.211 1.00 0.00 C ATOM 65 O GLY A 5 -11.707 6.697 -0.160 1.00 0.00 O ATOM 0 H GLY A 5 -13.629 5.170 0.253 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -14.767 7.647 0.114 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -13.805 7.807 1.571 1.00 0.00 H new ATOM 69 N ASN A 6 -12.631 8.527 -0.959 1.00 0.00 N ATOM 70 CA ASN A 6 -11.453 8.849 -1.796 1.00 0.00 C ATOM 71 C ASN A 6 -10.409 9.443 -0.866 1.00 0.00 C ATOM 72 O ASN A 6 -10.761 10.008 0.155 1.00 0.00 O ATOM 73 CB ASN A 6 -11.867 9.861 -2.867 1.00 0.00 C ATOM 74 CG ASN A 6 -11.280 9.461 -4.223 1.00 0.00 C ATOM 75 OD1 ASN A 6 -11.960 8.877 -5.043 1.00 0.00 O ATOM 76 ND2 ASN A 6 -10.039 9.751 -4.496 1.00 0.00 N ATOM 0 H ASN A 6 -13.398 9.195 -1.026 1.00 0.00 H new ATOM 0 HA ASN A 6 -11.053 7.969 -2.300 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -12.954 9.909 -2.932 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -11.520 10.857 -2.591 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -9.640 9.488 -5.397 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -9.467 10.241 -3.809 1.00 0.00 H new ATOM 83 N TRP A 7 -9.139 9.289 -1.155 1.00 0.00 N ATOM 84 CA TRP A 7 -8.125 9.825 -0.200 1.00 0.00 C ATOM 85 C TRP A 7 -7.080 10.696 -0.867 1.00 0.00 C ATOM 86 O TRP A 7 -6.523 10.363 -1.896 1.00 0.00 O ATOM 87 CB TRP A 7 -7.424 8.658 0.465 1.00 0.00 C ATOM 88 CG TRP A 7 -8.425 7.804 1.153 1.00 0.00 C ATOM 89 CD1 TRP A 7 -8.998 6.697 0.640 1.00 0.00 C ATOM 90 CD2 TRP A 7 -8.997 7.998 2.461 1.00 0.00 C ATOM 91 NE1 TRP A 7 -9.850 6.161 1.589 1.00 0.00 N ATOM 92 CE2 TRP A 7 -9.891 6.941 2.731 1.00 0.00 C ATOM 93 CE3 TRP A 7 -8.807 8.980 3.432 1.00 0.00 C ATOM 94 CZ2 TRP A 7 -10.580 6.866 3.943 1.00 0.00 C ATOM 95 CZ3 TRP A 7 -9.498 8.930 4.641 1.00 0.00 C ATOM 96 CH2 TRP A 7 -10.387 7.872 4.905 1.00 0.00 C ATOM 0 H TRP A 7 -8.770 8.829 -1.987 1.00 0.00 H new ATOM 0 HA TRP A 7 -8.656 10.448 0.520 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -6.882 8.074 -0.279 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -6.688 9.023 1.181 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -8.821 6.296 -0.347 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -10.381 5.299 1.463 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -8.116 9.789 3.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -11.253 6.045 4.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -9.351 9.706 5.378 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -10.919 7.833 5.844 1.00 0.00 H new ATOM 107 N LYS A 8 -6.792 11.805 -0.242 1.00 0.00 N ATOM 108 CA LYS A 8 -5.755 12.719 -0.771 1.00 0.00 C ATOM 109 C LYS A 8 -4.444 12.405 -0.049 1.00 0.00 C ATOM 110 O LYS A 8 -4.455 11.861 1.042 1.00 0.00 O ATOM 111 CB LYS A 8 -6.152 14.179 -0.508 1.00 0.00 C ATOM 112 CG LYS A 8 -7.649 14.372 -0.775 1.00 0.00 C ATOM 113 CD LYS A 8 -7.949 14.076 -2.245 1.00 0.00 C ATOM 114 CE LYS A 8 -7.359 15.182 -3.122 1.00 0.00 C ATOM 115 NZ LYS A 8 -7.804 14.991 -4.531 1.00 0.00 N ATOM 0 H LYS A 8 -7.239 12.115 0.621 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.645 12.582 -1.847 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.921 14.447 0.523 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.571 14.843 -1.148 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.232 13.710 -0.134 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -7.944 15.393 -0.531 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.527 13.111 -2.526 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -9.026 14.010 -2.401 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.678 16.158 -2.758 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.271 15.162 -3.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -7.403 15.743 -5.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.478 14.065 -4.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.842 15.031 -4.576 1.00 0.00 H new ATOM 129 N ILE A 9 -3.320 12.729 -0.639 1.00 0.00 N ATOM 130 CA ILE A 9 -2.018 12.431 0.028 1.00 0.00 C ATOM 131 C ILE A 9 -1.760 13.471 1.129 1.00 0.00 C ATOM 132 O ILE A 9 -2.064 14.639 0.986 1.00 0.00 O ATOM 133 CB ILE A 9 -0.887 12.387 -1.040 1.00 0.00 C ATOM 134 CG1 ILE A 9 0.055 11.212 -0.737 1.00 0.00 C ATOM 135 CG2 ILE A 9 -0.071 13.691 -1.096 1.00 0.00 C ATOM 136 CD1 ILE A 9 0.717 11.399 0.632 1.00 0.00 C ATOM 0 H ILE A 9 -3.249 13.185 -1.549 1.00 0.00 H new ATOM 0 HA ILE A 9 -2.044 11.453 0.508 1.00 0.00 H new ATOM 0 HB ILE A 9 -1.365 12.260 -2.012 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -0.503 10.276 -0.753 1.00 0.00 H new ATOM 0 HG13 ILE A 9 0.819 11.141 -1.511 1.00 0.00 H new ATOM 0 HG21 ILE A 9 0.703 13.603 -1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -0.731 14.523 -1.343 1.00 0.00 H new ATOM 0 HG23 ILE A 9 0.393 13.872 -0.126 1.00 0.00 H new ATOM 0 HD11 ILE A 9 1.382 10.559 0.833 1.00 0.00 H new ATOM 0 HD12 ILE A 9 1.292 12.325 0.635 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -0.051 11.447 1.404 1.00 0.00 H new ATOM 148 N ILE A 10 -1.207 13.031 2.219 1.00 0.00 N ATOM 149 CA ILE A 10 -0.920 13.935 3.359 1.00 0.00 C ATOM 150 C ILE A 10 0.287 13.361 4.119 1.00 0.00 C ATOM 151 O ILE A 10 0.210 12.309 4.717 1.00 0.00 O ATOM 152 CB ILE A 10 -2.182 14.005 4.246 1.00 0.00 C ATOM 153 CG1 ILE A 10 -3.229 14.896 3.560 1.00 0.00 C ATOM 154 CG2 ILE A 10 -1.870 14.585 5.632 1.00 0.00 C ATOM 155 CD1 ILE A 10 -4.209 14.033 2.756 1.00 0.00 C ATOM 0 H ILE A 10 -0.936 12.059 2.370 1.00 0.00 H new ATOM 0 HA ILE A 10 -0.676 14.947 3.035 1.00 0.00 H new ATOM 0 HB ILE A 10 -2.559 12.991 4.377 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -3.771 15.475 4.308 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -2.735 15.610 2.901 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -2.783 14.618 6.227 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.134 13.956 6.132 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.471 15.594 5.523 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.947 14.674 2.274 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -3.663 13.474 1.997 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.715 13.337 3.425 1.00 0.00 H new ATOM 167 N ARG A 11 1.399 14.044 4.064 1.00 0.00 N ATOM 168 CA ARG A 11 2.643 13.571 4.751 1.00 0.00 C ATOM 169 C ARG A 11 3.097 12.241 4.146 1.00 0.00 C ATOM 170 O ARG A 11 2.392 11.251 4.197 1.00 0.00 O ATOM 171 CB ARG A 11 2.388 13.399 6.254 1.00 0.00 C ATOM 172 CG ARG A 11 2.488 14.761 6.945 1.00 0.00 C ATOM 173 CD ARG A 11 1.366 15.671 6.442 1.00 0.00 C ATOM 174 NE ARG A 11 1.149 16.778 7.415 1.00 0.00 N ATOM 175 CZ ARG A 11 0.312 17.739 7.135 1.00 0.00 C ATOM 176 NH1 ARG A 11 -0.970 17.555 7.300 1.00 0.00 N ATOM 177 NH2 ARG A 11 0.756 18.883 6.691 1.00 0.00 N ATOM 0 H ARG A 11 1.502 14.927 3.563 1.00 0.00 H new ATOM 0 HA ARG A 11 3.426 14.316 4.610 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.401 12.966 6.420 1.00 0.00 H new ATOM 0 HB3 ARG A 11 3.115 12.708 6.681 1.00 0.00 H new ATOM 0 HG2 ARG A 11 2.415 14.639 8.026 1.00 0.00 H new ATOM 0 HG3 ARG A 11 3.458 15.214 6.740 1.00 0.00 H new ATOM 0 HD2 ARG A 11 1.624 16.078 5.464 1.00 0.00 H new ATOM 0 HD3 ARG A 11 0.447 15.098 6.316 1.00 0.00 H new ATOM 0 HE ARG A 11 1.655 16.785 8.301 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -1.316 16.661 7.647 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -1.625 18.306 7.081 1.00 0.00 H new ATOM 0 HH21 ARG A 11 1.758 19.026 6.563 1.00 0.00 H new ATOM 0 HH22 ARG A 11 0.101 19.634 6.472 1.00 0.00 H new ATOM 191 N SER A 12 4.275 12.215 3.570 1.00 0.00 N ATOM 192 CA SER A 12 4.782 10.954 2.955 1.00 0.00 C ATOM 193 C SER A 12 6.247 10.718 3.374 1.00 0.00 C ATOM 194 O SER A 12 6.503 10.113 4.398 1.00 0.00 O ATOM 195 CB SER A 12 4.658 11.050 1.429 1.00 0.00 C ATOM 196 OG SER A 12 5.224 9.889 0.837 1.00 0.00 O ATOM 0 H SER A 12 4.905 13.014 3.501 1.00 0.00 H new ATOM 0 HA SER A 12 4.189 10.108 3.303 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.610 11.144 1.143 1.00 0.00 H new ATOM 0 HB3 SER A 12 5.168 11.942 1.067 1.00 0.00 H new ATOM 0 HG SER A 12 5.144 9.947 -0.138 1.00 0.00 H new ATOM 202 N GLU A 13 7.213 11.179 2.601 1.00 0.00 N ATOM 203 CA GLU A 13 8.651 10.966 2.971 1.00 0.00 C ATOM 204 C GLU A 13 8.915 9.474 3.211 1.00 0.00 C ATOM 205 O GLU A 13 8.817 8.996 4.325 1.00 0.00 O ATOM 206 CB GLU A 13 8.968 11.750 4.246 1.00 0.00 C ATOM 207 CG GLU A 13 10.460 12.088 4.280 1.00 0.00 C ATOM 208 CD GLU A 13 10.727 13.109 5.387 1.00 0.00 C ATOM 209 OE1 GLU A 13 10.600 14.292 5.118 1.00 0.00 O ATOM 210 OE2 GLU A 13 11.055 12.691 6.485 1.00 0.00 O ATOM 0 H GLU A 13 7.064 11.692 1.732 1.00 0.00 H new ATOM 0 HA GLU A 13 9.286 11.315 2.157 1.00 0.00 H new ATOM 0 HB2 GLU A 13 8.376 12.665 4.280 1.00 0.00 H new ATOM 0 HB3 GLU A 13 8.697 11.163 5.123 1.00 0.00 H new ATOM 0 HG2 GLU A 13 11.044 11.185 4.455 1.00 0.00 H new ATOM 0 HG3 GLU A 13 10.775 12.489 3.317 1.00 0.00 H new ATOM 217 N ASN A 14 9.243 8.740 2.176 1.00 0.00 N ATOM 218 CA ASN A 14 9.506 7.277 2.345 1.00 0.00 C ATOM 219 C ASN A 14 10.051 6.670 1.046 1.00 0.00 C ATOM 220 O ASN A 14 10.858 5.767 1.088 1.00 0.00 O ATOM 221 CB ASN A 14 8.203 6.564 2.726 1.00 0.00 C ATOM 222 CG ASN A 14 8.153 6.347 4.241 1.00 0.00 C ATOM 223 OD1 ASN A 14 7.244 6.808 4.902 1.00 0.00 O ATOM 224 ND2 ASN A 14 9.099 5.660 4.821 1.00 0.00 N ATOM 0 H ASN A 14 9.340 9.090 1.223 1.00 0.00 H new ATOM 0 HA ASN A 14 10.248 7.147 3.133 1.00 0.00 H new ATOM 0 HB2 ASN A 14 7.346 7.157 2.406 1.00 0.00 H new ATOM 0 HB3 ASN A 14 8.138 5.606 2.210 1.00 0.00 H new ATOM 0 HD21 ASN A 14 9.075 5.510 5.830 1.00 0.00 H new ATOM 0 HD22 ASN A 14 9.862 5.273 4.266 1.00 0.00 H new ATOM 231 N PHE A 15 9.603 7.140 -0.103 1.00 0.00 N ATOM 232 CA PHE A 15 10.076 6.569 -1.417 1.00 0.00 C ATOM 233 C PHE A 15 11.600 6.397 -1.439 1.00 0.00 C ATOM 234 O PHE A 15 12.096 5.358 -1.826 1.00 0.00 O ATOM 235 CB PHE A 15 9.661 7.482 -2.576 1.00 0.00 C ATOM 236 CG PHE A 15 9.669 6.683 -3.865 1.00 0.00 C ATOM 237 CD1 PHE A 15 10.879 6.210 -4.393 1.00 0.00 C ATOM 238 CD2 PHE A 15 8.467 6.403 -4.527 1.00 0.00 C ATOM 239 CE1 PHE A 15 10.883 5.463 -5.578 1.00 0.00 C ATOM 240 CE2 PHE A 15 8.474 5.653 -5.711 1.00 0.00 C ATOM 241 CZ PHE A 15 9.683 5.183 -6.235 1.00 0.00 C ATOM 0 H PHE A 15 8.926 7.899 -0.188 1.00 0.00 H new ATOM 0 HA PHE A 15 9.611 5.590 -1.531 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.668 7.892 -2.394 1.00 0.00 H new ATOM 0 HB3 PHE A 15 10.346 8.327 -2.653 1.00 0.00 H new ATOM 0 HD1 PHE A 15 11.809 6.422 -3.886 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.533 6.766 -4.124 1.00 0.00 H new ATOM 0 HE1 PHE A 15 11.816 5.103 -5.985 1.00 0.00 H new ATOM 0 HE2 PHE A 15 7.546 5.438 -6.219 1.00 0.00 H new ATOM 0 HZ PHE A 15 9.688 4.604 -7.147 1.00 0.00 H new ATOM 251 N GLU A 16 12.341 7.387 -1.028 1.00 0.00 N ATOM 252 CA GLU A 16 13.826 7.246 -1.032 1.00 0.00 C ATOM 253 C GLU A 16 14.219 6.263 0.056 1.00 0.00 C ATOM 254 O GLU A 16 15.121 5.463 -0.112 1.00 0.00 O ATOM 255 CB GLU A 16 14.490 8.601 -0.776 1.00 0.00 C ATOM 256 CG GLU A 16 13.950 9.642 -1.765 1.00 0.00 C ATOM 257 CD GLU A 16 13.636 10.945 -1.023 1.00 0.00 C ATOM 258 OE1 GLU A 16 14.570 11.667 -0.714 1.00 0.00 O ATOM 259 OE2 GLU A 16 12.468 11.197 -0.778 1.00 0.00 O ATOM 0 H GLU A 16 11.987 8.283 -0.691 1.00 0.00 H new ATOM 0 HA GLU A 16 14.158 6.882 -2.004 1.00 0.00 H new ATOM 0 HB2 GLU A 16 14.296 8.923 0.247 1.00 0.00 H new ATOM 0 HB3 GLU A 16 15.571 8.512 -0.882 1.00 0.00 H new ATOM 0 HG2 GLU A 16 14.683 9.827 -2.550 1.00 0.00 H new ATOM 0 HG3 GLU A 16 13.051 9.264 -2.252 1.00 0.00 H new ATOM 266 N GLU A 17 13.519 6.288 1.158 1.00 0.00 N ATOM 267 CA GLU A 17 13.809 5.324 2.255 1.00 0.00 C ATOM 268 C GLU A 17 13.627 3.895 1.719 1.00 0.00 C ATOM 269 O GLU A 17 14.155 2.949 2.266 1.00 0.00 O ATOM 270 CB GLU A 17 12.833 5.567 3.403 1.00 0.00 C ATOM 271 CG GLU A 17 13.237 4.722 4.609 1.00 0.00 C ATOM 272 CD GLU A 17 12.818 5.435 5.896 1.00 0.00 C ATOM 273 OE1 GLU A 17 11.626 5.560 6.120 1.00 0.00 O ATOM 274 OE2 GLU A 17 13.698 5.843 6.637 1.00 0.00 O ATOM 0 H GLU A 17 12.756 6.938 1.345 1.00 0.00 H new ATOM 0 HA GLU A 17 14.830 5.456 2.612 1.00 0.00 H new ATOM 0 HB2 GLU A 17 12.828 6.623 3.672 1.00 0.00 H new ATOM 0 HB3 GLU A 17 11.820 5.313 3.092 1.00 0.00 H new ATOM 0 HG2 GLU A 17 12.764 3.741 4.554 1.00 0.00 H new ATOM 0 HG3 GLU A 17 14.314 4.557 4.606 1.00 0.00 H new ATOM 281 N LEU A 18 12.884 3.743 0.643 1.00 0.00 N ATOM 282 CA LEU A 18 12.659 2.400 0.054 1.00 0.00 C ATOM 283 C LEU A 18 13.887 1.980 -0.717 1.00 0.00 C ATOM 284 O LEU A 18 14.367 0.877 -0.572 1.00 0.00 O ATOM 285 CB LEU A 18 11.479 2.438 -0.925 1.00 0.00 C ATOM 286 CG LEU A 18 10.335 3.333 -0.440 1.00 0.00 C ATOM 287 CD1 LEU A 18 9.117 3.065 -1.312 1.00 0.00 C ATOM 288 CD2 LEU A 18 9.965 3.059 1.014 1.00 0.00 C ATOM 0 H LEU A 18 12.423 4.508 0.150 1.00 0.00 H new ATOM 0 HA LEU A 18 12.449 1.700 0.862 1.00 0.00 H new ATOM 0 HB2 LEU A 18 11.828 2.795 -1.894 1.00 0.00 H new ATOM 0 HB3 LEU A 18 11.104 1.426 -1.075 1.00 0.00 H new ATOM 0 HG LEU A 18 10.662 4.371 -0.510 1.00 0.00 H new ATOM 0 HD11 LEU A 18 8.289 3.693 -0.983 1.00 0.00 H new ATOM 0 HD12 LEU A 18 9.356 3.293 -2.351 1.00 0.00 H new ATOM 0 HD13 LEU A 18 8.833 2.016 -1.227 1.00 0.00 H new ATOM 0 HD21 LEU A 18 9.149 3.718 1.312 1.00 0.00 H new ATOM 0 HD22 LEU A 18 9.650 2.021 1.120 1.00 0.00 H new ATOM 0 HD23 LEU A 18 10.831 3.242 1.650 1.00 0.00 H new ATOM 300 N LEU A 19 14.397 2.850 -1.540 1.00 0.00 N ATOM 301 CA LEU A 19 15.604 2.492 -2.319 1.00 0.00 C ATOM 302 C LEU A 19 16.862 2.674 -1.445 1.00 0.00 C ATOM 303 O LEU A 19 17.972 2.443 -1.885 1.00 0.00 O ATOM 304 CB LEU A 19 15.691 3.370 -3.576 1.00 0.00 C ATOM 305 CG LEU A 19 14.371 3.337 -4.397 1.00 0.00 C ATOM 306 CD1 LEU A 19 13.596 2.017 -4.209 1.00 0.00 C ATOM 307 CD2 LEU A 19 13.481 4.514 -3.977 1.00 0.00 C ATOM 0 H LEU A 19 14.030 3.788 -1.704 1.00 0.00 H new ATOM 0 HA LEU A 19 15.540 1.448 -2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 19 15.913 4.397 -3.287 1.00 0.00 H new ATOM 0 HB3 LEU A 19 16.516 3.029 -4.201 1.00 0.00 H new ATOM 0 HG LEU A 19 14.638 3.414 -5.451 1.00 0.00 H new ATOM 0 HD11 LEU A 19 12.682 2.044 -4.803 1.00 0.00 H new ATOM 0 HD12 LEU A 19 14.216 1.182 -4.534 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.341 1.891 -3.157 1.00 0.00 H new ATOM 0 HD21 LEU A 19 12.555 4.493 -4.551 1.00 0.00 H new ATOM 0 HD22 LEU A 19 13.251 4.435 -2.914 1.00 0.00 H new ATOM 0 HD23 LEU A 19 14.004 5.451 -4.166 1.00 0.00 H new ATOM 319 N LYS A 20 16.691 3.082 -0.205 1.00 0.00 N ATOM 320 CA LYS A 20 17.844 3.274 0.712 1.00 0.00 C ATOM 321 C LYS A 20 17.930 2.082 1.675 1.00 0.00 C ATOM 322 O LYS A 20 18.983 1.756 2.188 1.00 0.00 O ATOM 323 CB LYS A 20 17.611 4.553 1.515 1.00 0.00 C ATOM 324 CG LYS A 20 18.259 5.731 0.793 1.00 0.00 C ATOM 325 CD LYS A 20 18.500 6.871 1.784 1.00 0.00 C ATOM 326 CE LYS A 20 19.760 6.580 2.602 1.00 0.00 C ATOM 327 NZ LYS A 20 19.728 7.374 3.863 1.00 0.00 N ATOM 0 H LYS A 20 15.782 3.291 0.208 1.00 0.00 H new ATOM 0 HA LYS A 20 18.771 3.347 0.143 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.542 4.730 1.636 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.032 4.449 2.515 1.00 0.00 H new ATOM 0 HG2 LYS A 20 19.202 5.421 0.344 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.616 6.071 -0.019 1.00 0.00 H new ATOM 0 HD2 LYS A 20 18.611 7.814 1.249 1.00 0.00 H new ATOM 0 HD3 LYS A 20 17.641 6.979 2.446 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.820 5.516 2.831 1.00 0.00 H new ATOM 0 HE3 LYS A 20 20.649 6.832 2.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 20.584 7.177 4.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 19.690 8.388 3.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 18.887 7.112 4.417 1.00 0.00 H new ATOM 341 N VAL A 21 16.818 1.439 1.921 1.00 0.00 N ATOM 342 CA VAL A 21 16.786 0.276 2.844 1.00 0.00 C ATOM 343 C VAL A 21 16.859 -1.015 2.030 1.00 0.00 C ATOM 344 O VAL A 21 17.403 -2.010 2.472 1.00 0.00 O ATOM 345 CB VAL A 21 15.486 0.325 3.645 1.00 0.00 C ATOM 346 CG1 VAL A 21 15.436 1.629 4.435 1.00 0.00 C ATOM 347 CG2 VAL A 21 14.277 0.258 2.705 1.00 0.00 C ATOM 0 H VAL A 21 15.916 1.679 1.511 1.00 0.00 H new ATOM 0 HA VAL A 21 17.634 0.308 3.528 1.00 0.00 H new ATOM 0 HB VAL A 21 15.454 -0.528 4.323 1.00 0.00 H new ATOM 0 HG11 VAL A 21 14.511 1.671 5.009 1.00 0.00 H new ATOM 0 HG12 VAL A 21 16.287 1.676 5.114 1.00 0.00 H new ATOM 0 HG13 VAL A 21 15.474 2.473 3.747 1.00 0.00 H new ATOM 0 HG21 VAL A 21 13.358 0.294 3.291 1.00 0.00 H new ATOM 0 HG22 VAL A 21 14.303 1.104 2.018 1.00 0.00 H new ATOM 0 HG23 VAL A 21 14.309 -0.672 2.137 1.00 0.00 H new ATOM 357 N LEU A 22 16.341 -0.990 0.827 1.00 0.00 N ATOM 358 CA LEU A 22 16.405 -2.193 -0.046 1.00 0.00 C ATOM 359 C LEU A 22 17.885 -2.497 -0.349 1.00 0.00 C ATOM 360 O LEU A 22 18.228 -3.577 -0.791 1.00 0.00 O ATOM 361 CB LEU A 22 15.551 -1.940 -1.329 1.00 0.00 C ATOM 362 CG LEU A 22 16.334 -1.356 -2.537 1.00 0.00 C ATOM 363 CD1 LEU A 22 17.273 -0.218 -2.121 1.00 0.00 C ATOM 364 CD2 LEU A 22 17.140 -2.463 -3.217 1.00 0.00 C ATOM 0 H LEU A 22 15.875 -0.182 0.414 1.00 0.00 H new ATOM 0 HA LEU A 22 15.984 -3.071 0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.093 -2.881 -1.633 1.00 0.00 H new ATOM 0 HB3 LEU A 22 14.739 -1.257 -1.078 1.00 0.00 H new ATOM 0 HG LEU A 22 15.602 -0.944 -3.232 1.00 0.00 H new ATOM 0 HD11 LEU A 22 17.799 0.159 -2.998 1.00 0.00 H new ATOM 0 HD12 LEU A 22 16.692 0.588 -1.672 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.997 -0.590 -1.396 1.00 0.00 H new ATOM 0 HD21 LEU A 22 17.687 -2.047 -4.063 1.00 0.00 H new ATOM 0 HD22 LEU A 22 17.845 -2.890 -2.504 1.00 0.00 H new ATOM 0 HD23 LEU A 22 16.463 -3.242 -3.569 1.00 0.00 H new ATOM 643 N VAL A 41 -5.458 8.142 -4.387 1.00 0.00 N ATOM 644 CA VAL A 41 -6.142 6.818 -4.355 1.00 0.00 C ATOM 645 C VAL A 41 -7.654 7.013 -4.201 1.00 0.00 C ATOM 646 O VAL A 41 -8.127 8.108 -3.972 1.00 0.00 O ATOM 647 CB VAL A 41 -5.565 5.982 -3.184 1.00 0.00 C ATOM 648 CG1 VAL A 41 -6.263 6.300 -1.853 1.00 0.00 C ATOM 649 CG2 VAL A 41 -5.714 4.487 -3.496 1.00 0.00 C ATOM 0 HA VAL A 41 -5.968 6.285 -5.289 1.00 0.00 H new ATOM 0 HB VAL A 41 -4.512 6.242 -3.079 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.828 5.692 -1.060 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.130 7.356 -1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.327 6.078 -1.938 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.308 3.901 -2.672 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -6.769 4.246 -3.627 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -5.171 4.250 -4.411 1.00 0.00 H new ATOM 659 N GLU A 42 -8.397 5.945 -4.283 1.00 0.00 N ATOM 660 CA GLU A 42 -9.866 6.038 -4.099 1.00 0.00 C ATOM 661 C GLU A 42 -10.378 4.698 -3.581 1.00 0.00 C ATOM 662 O GLU A 42 -10.324 3.694 -4.267 1.00 0.00 O ATOM 663 CB GLU A 42 -10.554 6.394 -5.418 1.00 0.00 C ATOM 664 CG GLU A 42 -10.192 5.363 -6.484 1.00 0.00 C ATOM 665 CD GLU A 42 -10.223 6.020 -7.865 1.00 0.00 C ATOM 666 OE1 GLU A 42 -9.572 7.038 -8.030 1.00 0.00 O ATOM 667 OE2 GLU A 42 -10.899 5.493 -8.734 1.00 0.00 O ATOM 0 H GLU A 42 -8.044 5.007 -4.471 1.00 0.00 H new ATOM 0 HA GLU A 42 -10.094 6.825 -3.380 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -11.635 6.423 -5.279 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -10.248 7.389 -5.742 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.201 4.954 -6.287 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.893 4.529 -6.451 1.00 0.00 H new ATOM 674 N ILE A 43 -10.861 4.677 -2.368 1.00 0.00 N ATOM 675 CA ILE A 43 -11.363 3.406 -1.786 1.00 0.00 C ATOM 676 C ILE A 43 -12.865 3.293 -2.014 1.00 0.00 C ATOM 677 O ILE A 43 -13.586 4.272 -2.056 1.00 0.00 O ATOM 678 CB ILE A 43 -11.061 3.361 -0.285 1.00 0.00 C ATOM 679 CG1 ILE A 43 -9.546 3.488 -0.061 1.00 0.00 C ATOM 680 CG2 ILE A 43 -11.562 2.039 0.313 1.00 0.00 C ATOM 681 CD1 ILE A 43 -8.810 2.313 -0.713 1.00 0.00 C ATOM 0 H ILE A 43 -10.928 5.490 -1.756 1.00 0.00 H new ATOM 0 HA ILE A 43 -10.862 2.570 -2.273 1.00 0.00 H new ATOM 0 HB ILE A 43 -11.572 4.189 0.206 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -9.187 4.428 -0.480 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -9.331 3.513 1.007 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -11.343 2.016 1.380 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -12.638 1.956 0.162 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -11.061 1.205 -0.178 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -7.738 2.417 -0.546 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -9.157 1.378 -0.274 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -9.011 2.307 -1.784 1.00 0.00 H new ATOM 693 N LYS A 44 -13.322 2.088 -2.158 1.00 0.00 N ATOM 694 CA LYS A 44 -14.764 1.831 -2.390 1.00 0.00 C ATOM 695 C LYS A 44 -15.087 0.515 -1.693 1.00 0.00 C ATOM 696 O LYS A 44 -14.653 -0.533 -2.119 1.00 0.00 O ATOM 697 CB LYS A 44 -14.994 1.716 -3.900 1.00 0.00 C ATOM 698 CG LYS A 44 -14.411 2.949 -4.597 1.00 0.00 C ATOM 699 CD LYS A 44 -15.062 3.124 -5.964 1.00 0.00 C ATOM 700 CE LYS A 44 -14.728 1.930 -6.863 1.00 0.00 C ATOM 701 NZ LYS A 44 -15.930 1.564 -7.664 1.00 0.00 N ATOM 0 H LYS A 44 -12.743 1.249 -2.124 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.399 2.628 -2.003 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -14.523 0.811 -4.283 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -16.060 1.635 -4.112 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.579 3.837 -3.987 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.332 2.839 -4.709 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -16.143 3.214 -5.852 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -14.712 4.047 -6.427 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.898 2.179 -7.524 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -14.409 1.082 -6.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.706 0.753 -8.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.709 1.310 -7.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -16.215 2.373 -8.252 1.00 0.00 H new ATOM 715 N GLN A 45 -15.785 0.555 -0.590 1.00 0.00 N ATOM 716 CA GLN A 45 -16.039 -0.720 0.144 1.00 0.00 C ATOM 717 C GLN A 45 -17.453 -0.814 0.704 1.00 0.00 C ATOM 718 O GLN A 45 -18.089 0.169 1.031 1.00 0.00 O ATOM 719 CB GLN A 45 -15.041 -0.823 1.299 1.00 0.00 C ATOM 720 CG GLN A 45 -15.025 0.482 2.113 1.00 0.00 C ATOM 721 CD GLN A 45 -15.382 0.192 3.575 1.00 0.00 C ATOM 722 OE1 GLN A 45 -14.766 0.722 4.479 1.00 0.00 O ATOM 723 NE2 GLN A 45 -16.358 -0.631 3.845 1.00 0.00 N ATOM 0 H GLN A 45 -16.183 1.396 -0.172 1.00 0.00 H new ATOM 0 HA GLN A 45 -15.920 -1.537 -0.567 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -15.308 -1.659 1.945 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -14.044 -1.028 0.909 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -14.040 0.944 2.055 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -15.735 1.193 1.691 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -16.875 -1.076 3.086 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -16.604 -0.830 4.815 1.00 0.00 H new ATOM 732 N GLU A 46 -17.924 -2.025 0.833 1.00 0.00 N ATOM 733 CA GLU A 46 -19.273 -2.278 1.391 1.00 0.00 C ATOM 734 C GLU A 46 -19.156 -3.402 2.427 1.00 0.00 C ATOM 735 O GLU A 46 -19.276 -4.569 2.103 1.00 0.00 O ATOM 736 CB GLU A 46 -20.208 -2.713 0.266 1.00 0.00 C ATOM 737 CG GLU A 46 -21.654 -2.447 0.677 1.00 0.00 C ATOM 738 CD GLU A 46 -22.551 -2.468 -0.562 1.00 0.00 C ATOM 739 OE1 GLU A 46 -22.515 -3.454 -1.279 1.00 0.00 O ATOM 740 OE2 GLU A 46 -23.259 -1.496 -0.773 1.00 0.00 O ATOM 0 H GLU A 46 -17.413 -2.867 0.567 1.00 0.00 H new ATOM 0 HA GLU A 46 -19.671 -1.377 1.857 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -19.972 -2.169 -0.649 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -20.068 -3.773 0.051 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -21.985 -3.202 1.391 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -21.729 -1.481 1.177 1.00 0.00 H new ATOM 747 N GLY A 47 -18.900 -3.059 3.664 1.00 0.00 N ATOM 748 CA GLY A 47 -18.754 -4.105 4.722 1.00 0.00 C ATOM 749 C GLY A 47 -17.352 -4.716 4.637 1.00 0.00 C ATOM 750 O GLY A 47 -16.365 -4.008 4.564 1.00 0.00 O ATOM 0 H GLY A 47 -18.786 -2.098 3.988 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -18.914 -3.667 5.707 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -19.510 -4.880 4.591 1.00 0.00 H new ATOM 754 N ASP A 48 -17.257 -6.024 4.641 1.00 0.00 N ATOM 755 CA ASP A 48 -15.923 -6.682 4.556 1.00 0.00 C ATOM 756 C ASP A 48 -15.408 -6.678 3.112 1.00 0.00 C ATOM 757 O ASP A 48 -14.314 -7.138 2.849 1.00 0.00 O ATOM 758 CB ASP A 48 -16.037 -8.117 5.049 1.00 0.00 C ATOM 759 CG ASP A 48 -17.118 -8.854 4.256 1.00 0.00 C ATOM 760 OD1 ASP A 48 -16.979 -8.947 3.047 1.00 0.00 O ATOM 761 OD2 ASP A 48 -18.067 -9.312 4.870 1.00 0.00 O ATOM 0 H ASP A 48 -18.050 -6.663 4.700 1.00 0.00 H new ATOM 0 HA ASP A 48 -15.219 -6.129 5.178 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -15.080 -8.627 4.937 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -16.281 -8.128 6.111 1.00 0.00 H new ATOM 766 N THR A 49 -16.164 -6.149 2.178 1.00 0.00 N ATOM 767 CA THR A 49 -15.683 -6.104 0.771 1.00 0.00 C ATOM 768 C THR A 49 -14.979 -4.766 0.555 1.00 0.00 C ATOM 769 O THR A 49 -15.444 -3.741 1.014 1.00 0.00 O ATOM 770 CB THR A 49 -16.879 -6.220 -0.176 1.00 0.00 C ATOM 771 OG1 THR A 49 -17.584 -7.422 0.099 1.00 0.00 O ATOM 772 CG2 THR A 49 -16.396 -6.231 -1.627 1.00 0.00 C ATOM 0 H THR A 49 -17.089 -5.749 2.334 1.00 0.00 H new ATOM 0 HA THR A 49 -14.995 -6.926 0.573 1.00 0.00 H new ATOM 0 HB THR A 49 -17.539 -5.366 -0.026 1.00 0.00 H new ATOM 0 HG1 THR A 49 -18.441 -7.415 -0.377 1.00 0.00 H new ATOM 0 HG21 THR A 49 -17.253 -6.314 -2.295 1.00 0.00 H new ATOM 0 HG22 THR A 49 -15.859 -5.306 -1.839 1.00 0.00 H new ATOM 0 HG23 THR A 49 -15.731 -7.081 -1.783 1.00 0.00 H new ATOM 780 N PHE A 50 -13.858 -4.760 -0.120 1.00 0.00 N ATOM 781 CA PHE A 50 -13.141 -3.470 -0.336 1.00 0.00 C ATOM 782 C PHE A 50 -12.559 -3.385 -1.747 1.00 0.00 C ATOM 783 O PHE A 50 -12.215 -4.372 -2.367 1.00 0.00 O ATOM 784 CB PHE A 50 -11.997 -3.334 0.673 1.00 0.00 C ATOM 785 CG PHE A 50 -12.557 -3.413 2.065 1.00 0.00 C ATOM 786 CD1 PHE A 50 -12.774 -4.656 2.649 1.00 0.00 C ATOM 787 CD2 PHE A 50 -12.885 -2.245 2.759 1.00 0.00 C ATOM 788 CE1 PHE A 50 -13.322 -4.741 3.924 1.00 0.00 C ATOM 789 CE2 PHE A 50 -13.431 -2.327 4.044 1.00 0.00 C ATOM 790 CZ PHE A 50 -13.653 -3.580 4.625 1.00 0.00 C ATOM 0 H PHE A 50 -13.413 -5.583 -0.526 1.00 0.00 H new ATOM 0 HA PHE A 50 -13.864 -2.665 -0.203 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.263 -4.124 0.518 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -11.480 -2.386 0.529 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -12.517 -5.557 2.112 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -12.717 -1.280 2.304 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -13.492 -5.708 4.373 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -13.680 -1.426 4.586 1.00 0.00 H new ATOM 0 HZ PHE A 50 -14.080 -3.649 5.615 1.00 0.00 H new ATOM 800 N TYR A 51 -12.414 -2.183 -2.219 1.00 0.00 N ATOM 801 CA TYR A 51 -11.818 -1.928 -3.554 1.00 0.00 C ATOM 802 C TYR A 51 -10.758 -0.851 -3.301 1.00 0.00 C ATOM 803 O TYR A 51 -10.941 0.004 -2.453 1.00 0.00 O ATOM 804 CB TYR A 51 -12.940 -1.477 -4.528 1.00 0.00 C ATOM 805 CG TYR A 51 -12.451 -0.531 -5.610 1.00 0.00 C ATOM 806 CD1 TYR A 51 -12.149 0.794 -5.294 1.00 0.00 C ATOM 807 CD2 TYR A 51 -12.343 -0.973 -6.928 1.00 0.00 C ATOM 808 CE1 TYR A 51 -11.739 1.678 -6.282 1.00 0.00 C ATOM 809 CE2 TYR A 51 -11.921 -0.086 -7.929 1.00 0.00 C ATOM 810 CZ TYR A 51 -11.620 1.242 -7.604 1.00 0.00 C ATOM 811 OH TYR A 51 -11.216 2.120 -8.589 1.00 0.00 O ATOM 0 H TYR A 51 -12.693 -1.340 -1.718 1.00 0.00 H new ATOM 0 HA TYR A 51 -11.359 -2.801 -4.019 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -13.380 -2.357 -4.996 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -13.731 -0.989 -3.959 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -12.235 1.134 -4.273 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -12.584 -1.996 -7.177 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -11.512 2.703 -6.029 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -11.828 -0.427 -8.950 1.00 0.00 H new ATOM 0 HH TYR A 51 -11.260 3.038 -8.248 1.00 0.00 H new ATOM 821 N ILE A 52 -9.648 -0.900 -3.981 1.00 0.00 N ATOM 822 CA ILE A 52 -8.581 0.116 -3.713 1.00 0.00 C ATOM 823 C ILE A 52 -7.872 0.484 -5.012 1.00 0.00 C ATOM 824 O ILE A 52 -7.081 -0.281 -5.518 1.00 0.00 O ATOM 825 CB ILE A 52 -7.552 -0.465 -2.722 1.00 0.00 C ATOM 826 CG1 ILE A 52 -8.281 -1.249 -1.609 1.00 0.00 C ATOM 827 CG2 ILE A 52 -6.728 0.677 -2.106 1.00 0.00 C ATOM 828 CD1 ILE A 52 -7.273 -1.780 -0.582 1.00 0.00 C ATOM 0 H ILE A 52 -9.430 -1.588 -4.702 1.00 0.00 H new ATOM 0 HA ILE A 52 -9.041 1.008 -3.288 1.00 0.00 H new ATOM 0 HB ILE A 52 -6.884 -1.143 -3.253 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.007 -0.603 -1.115 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.838 -2.079 -2.045 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.001 0.265 -1.406 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -6.205 1.216 -2.896 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -7.392 1.361 -1.578 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -7.802 -2.330 0.196 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.564 -2.443 -1.077 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -6.736 -0.944 -0.134 1.00 0.00 H new ATOM 840 N LYS A 53 -8.147 1.647 -5.559 1.00 0.00 N ATOM 841 CA LYS A 53 -7.478 2.040 -6.839 1.00 0.00 C ATOM 842 C LYS A 53 -6.601 3.278 -6.646 1.00 0.00 C ATOM 843 O LYS A 53 -7.084 4.379 -6.476 1.00 0.00 O ATOM 844 CB LYS A 53 -8.536 2.314 -7.910 1.00 0.00 C ATOM 845 CG LYS A 53 -7.856 2.570 -9.260 1.00 0.00 C ATOM 846 CD LYS A 53 -8.608 3.672 -10.014 1.00 0.00 C ATOM 847 CE LYS A 53 -9.751 3.060 -10.834 1.00 0.00 C ATOM 848 NZ LYS A 53 -9.545 3.370 -12.278 1.00 0.00 N ATOM 0 H LYS A 53 -8.799 2.333 -5.178 1.00 0.00 H new ATOM 0 HA LYS A 53 -6.838 1.217 -7.158 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -9.214 1.464 -7.990 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -9.138 3.177 -7.627 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -6.818 2.864 -9.106 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -7.843 1.655 -9.851 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -9.006 4.401 -9.308 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -7.923 4.207 -10.672 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -9.784 1.981 -10.683 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -10.708 3.458 -10.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -10.319 2.956 -12.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -9.534 4.401 -12.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -8.638 2.969 -12.593 1.00 0.00 H new ATOM 983 N GLU A 62 -5.330 -1.647 -9.056 1.00 0.00 N ATOM 984 CA GLU A 62 -6.288 -1.614 -7.914 1.00 0.00 C ATOM 985 C GLU A 62 -6.676 -3.035 -7.489 1.00 0.00 C ATOM 986 O GLU A 62 -6.779 -3.931 -8.305 1.00 0.00 O ATOM 987 CB GLU A 62 -7.537 -0.799 -8.313 1.00 0.00 C ATOM 988 CG GLU A 62 -8.394 -1.536 -9.345 1.00 0.00 C ATOM 989 CD GLU A 62 -7.682 -1.548 -10.699 1.00 0.00 C ATOM 990 OE1 GLU A 62 -7.563 -0.489 -11.293 1.00 0.00 O ATOM 991 OE2 GLU A 62 -7.266 -2.616 -11.118 1.00 0.00 O ATOM 0 HA GLU A 62 -5.809 -1.133 -7.061 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.135 -0.593 -7.425 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.228 0.164 -8.719 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.580 -2.557 -9.013 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.365 -1.049 -9.439 1.00 0.00 H new ATOM 998 N ILE A 63 -6.903 -3.236 -6.212 1.00 0.00 N ATOM 999 CA ILE A 63 -7.298 -4.589 -5.726 1.00 0.00 C ATOM 1000 C ILE A 63 -8.789 -4.610 -5.428 1.00 0.00 C ATOM 1001 O ILE A 63 -9.246 -4.058 -4.444 1.00 0.00 O ATOM 1002 CB ILE A 63 -6.522 -4.984 -4.458 1.00 0.00 C ATOM 1003 CG1 ILE A 63 -6.428 -3.801 -3.481 1.00 0.00 C ATOM 1004 CG2 ILE A 63 -5.122 -5.438 -4.853 1.00 0.00 C ATOM 1005 CD1 ILE A 63 -5.693 -4.231 -2.205 1.00 0.00 C ATOM 0 H ILE A 63 -6.831 -2.520 -5.489 1.00 0.00 H new ATOM 0 HA ILE A 63 -7.060 -5.308 -6.510 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.052 -5.796 -3.959 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.901 -2.971 -3.952 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -7.427 -3.444 -3.232 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -4.565 -5.720 -3.959 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -5.193 -6.296 -5.522 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -4.605 -4.624 -5.361 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.631 -3.386 -1.519 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -6.237 -5.046 -1.729 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.688 -4.566 -2.460 1.00 0.00 H new ATOM 1017 N ASN A 64 -9.545 -5.277 -6.256 1.00 0.00 N ATOM 1018 CA ASN A 64 -11.003 -5.390 -6.011 1.00 0.00 C ATOM 1019 C ASN A 64 -11.183 -6.716 -5.304 1.00 0.00 C ATOM 1020 O ASN A 64 -11.411 -7.742 -5.918 1.00 0.00 O ATOM 1021 CB ASN A 64 -11.787 -5.386 -7.331 1.00 0.00 C ATOM 1022 CG ASN A 64 -11.261 -4.290 -8.266 1.00 0.00 C ATOM 1023 OD1 ASN A 64 -10.746 -3.200 -7.765 1.00 0.00 O flip ATOM 1024 ND2 ASN A 64 -11.319 -4.430 -9.472 1.00 0.00 N flip ATOM 0 H ASN A 64 -9.210 -5.750 -7.095 1.00 0.00 H new ATOM 0 HA ASN A 64 -11.375 -4.551 -5.424 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -11.699 -6.358 -7.816 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -12.846 -5.224 -7.131 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -11.721 -5.280 -9.868 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -10.966 -3.698 -10.088 1.00 0.00 H new ATOM 1031 N PHE A 65 -10.991 -6.704 -4.024 1.00 0.00 N ATOM 1032 CA PHE A 65 -11.044 -7.970 -3.248 1.00 0.00 C ATOM 1033 C PHE A 65 -12.042 -7.887 -2.083 1.00 0.00 C ATOM 1034 O PHE A 65 -12.859 -6.998 -1.997 1.00 0.00 O ATOM 1035 CB PHE A 65 -9.623 -8.211 -2.694 1.00 0.00 C ATOM 1036 CG PHE A 65 -9.306 -7.172 -1.620 1.00 0.00 C ATOM 1037 CD1 PHE A 65 -8.886 -5.886 -1.982 1.00 0.00 C ATOM 1038 CD2 PHE A 65 -9.487 -7.485 -0.266 1.00 0.00 C ATOM 1039 CE1 PHE A 65 -8.644 -4.922 -1.005 1.00 0.00 C ATOM 1040 CE2 PHE A 65 -9.254 -6.515 0.715 1.00 0.00 C ATOM 1041 CZ PHE A 65 -8.832 -5.232 0.347 1.00 0.00 C ATOM 0 H PHE A 65 -10.798 -5.867 -3.474 1.00 0.00 H new ATOM 0 HA PHE A 65 -11.376 -8.783 -3.893 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -9.551 -9.215 -2.275 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -8.892 -8.149 -3.501 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -8.749 -5.640 -3.025 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -9.807 -8.476 0.020 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.311 -3.935 -1.291 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.400 -6.756 1.758 1.00 0.00 H new ATOM 0 HZ PHE A 65 -8.652 -4.483 1.104 1.00 0.00 H new ATOM 1051 N LYS A 66 -11.913 -8.813 -1.174 1.00 0.00 N ATOM 1052 CA LYS A 66 -12.748 -8.856 0.044 1.00 0.00 C ATOM 1053 C LYS A 66 -11.793 -9.264 1.160 1.00 0.00 C ATOM 1054 O LYS A 66 -11.097 -10.253 1.040 1.00 0.00 O ATOM 1055 CB LYS A 66 -13.848 -9.901 -0.115 1.00 0.00 C ATOM 1056 CG LYS A 66 -15.169 -9.210 -0.461 1.00 0.00 C ATOM 1057 CD LYS A 66 -16.128 -10.224 -1.090 1.00 0.00 C ATOM 1058 CE LYS A 66 -16.968 -9.535 -2.167 1.00 0.00 C ATOM 1059 NZ LYS A 66 -17.517 -10.558 -3.102 1.00 0.00 N ATOM 0 H LYS A 66 -11.232 -9.570 -1.236 1.00 0.00 H new ATOM 0 HA LYS A 66 -13.234 -7.902 0.247 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -13.580 -10.609 -0.900 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -13.956 -10.473 0.807 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -15.614 -8.782 0.437 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -14.990 -8.386 -1.152 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -15.566 -11.050 -1.526 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -16.777 -10.649 -0.325 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -17.782 -8.975 -1.706 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -16.358 -8.817 -2.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -18.088 -10.089 -3.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -16.734 -11.073 -3.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -18.113 -11.227 -2.574 1.00 0.00 H new ATOM 1073 N VAL A 67 -11.698 -8.490 2.208 1.00 0.00 N ATOM 1074 CA VAL A 67 -10.728 -8.798 3.311 1.00 0.00 C ATOM 1075 C VAL A 67 -10.728 -10.289 3.703 1.00 0.00 C ATOM 1076 O VAL A 67 -9.755 -10.774 4.251 1.00 0.00 O ATOM 1077 CB VAL A 67 -11.053 -7.919 4.520 1.00 0.00 C ATOM 1078 CG1 VAL A 67 -10.205 -8.341 5.725 1.00 0.00 C ATOM 1079 CG2 VAL A 67 -10.716 -6.478 4.164 1.00 0.00 C ATOM 0 H VAL A 67 -12.255 -7.648 2.353 1.00 0.00 H new ATOM 0 HA VAL A 67 -9.724 -8.579 2.949 1.00 0.00 H new ATOM 0 HB VAL A 67 -12.108 -8.022 4.774 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -10.446 -7.708 6.579 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -10.417 -9.381 5.973 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.148 -8.235 5.481 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -10.940 -5.832 5.013 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -9.656 -6.402 3.920 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -11.310 -6.167 3.304 1.00 0.00 H new ATOM 1089 N GLY A 68 -11.779 -11.017 3.431 1.00 0.00 N ATOM 1090 CA GLY A 68 -11.790 -12.463 3.794 1.00 0.00 C ATOM 1091 C GLY A 68 -11.129 -13.298 2.687 1.00 0.00 C ATOM 1092 O GLY A 68 -11.598 -14.376 2.368 1.00 0.00 O ATOM 0 H GLY A 68 -12.625 -10.675 2.976 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -11.261 -12.612 4.736 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -12.816 -12.798 3.948 1.00 0.00 H new ATOM 1096 N GLU A 69 -10.045 -12.827 2.100 1.00 0.00 N ATOM 1097 CA GLU A 69 -9.383 -13.633 1.023 1.00 0.00 C ATOM 1098 C GLU A 69 -8.014 -13.047 0.626 1.00 0.00 C ATOM 1099 O GLU A 69 -7.601 -11.990 1.080 1.00 0.00 O ATOM 1100 CB GLU A 69 -10.292 -13.682 -0.211 1.00 0.00 C ATOM 1101 CG GLU A 69 -10.553 -12.263 -0.728 1.00 0.00 C ATOM 1102 CD GLU A 69 -10.524 -12.259 -2.259 1.00 0.00 C ATOM 1103 OE1 GLU A 69 -11.292 -13.002 -2.848 1.00 0.00 O ATOM 1104 OE2 GLU A 69 -9.736 -11.512 -2.815 1.00 0.00 O ATOM 0 H GLU A 69 -9.600 -11.935 2.318 1.00 0.00 H new ATOM 0 HA GLU A 69 -9.217 -14.637 1.413 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.826 -14.282 -0.992 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -11.236 -14.165 0.042 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -11.520 -11.908 -0.372 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.799 -11.579 -0.338 1.00 0.00 H new ATOM 1111 N GLU A 70 -7.314 -13.760 -0.223 1.00 0.00 N ATOM 1112 CA GLU A 70 -5.962 -13.313 -0.690 1.00 0.00 C ATOM 1113 C GLU A 70 -5.991 -12.922 -2.166 1.00 0.00 C ATOM 1114 O GLU A 70 -6.977 -13.084 -2.858 1.00 0.00 O ATOM 1115 CB GLU A 70 -4.922 -14.452 -0.563 1.00 0.00 C ATOM 1116 CG GLU A 70 -5.552 -15.822 -0.804 1.00 0.00 C ATOM 1117 CD GLU A 70 -6.146 -15.890 -2.213 1.00 0.00 C ATOM 1118 OE1 GLU A 70 -5.385 -15.782 -3.161 1.00 0.00 O ATOM 1119 OE2 GLU A 70 -7.350 -16.049 -2.321 1.00 0.00 O ATOM 0 H GLU A 70 -7.627 -14.647 -0.619 1.00 0.00 H new ATOM 0 HA GLU A 70 -5.690 -12.463 -0.064 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.117 -14.291 -1.280 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.475 -14.427 0.431 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -4.801 -16.602 -0.680 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -6.330 -16.008 -0.064 1.00 0.00 H new ATOM 1126 N PHE A 71 -4.864 -12.474 -2.652 1.00 0.00 N ATOM 1127 CA PHE A 71 -4.720 -12.131 -4.093 1.00 0.00 C ATOM 1128 C PHE A 71 -3.516 -12.914 -4.598 1.00 0.00 C ATOM 1129 O PHE A 71 -2.879 -13.630 -3.848 1.00 0.00 O ATOM 1130 CB PHE A 71 -4.431 -10.632 -4.338 1.00 0.00 C ATOM 1131 CG PHE A 71 -5.058 -9.719 -3.305 1.00 0.00 C ATOM 1132 CD1 PHE A 71 -6.324 -9.982 -2.776 1.00 0.00 C ATOM 1133 CD2 PHE A 71 -4.360 -8.572 -2.904 1.00 0.00 C ATOM 1134 CE1 PHE A 71 -6.884 -9.100 -1.842 1.00 0.00 C ATOM 1135 CE2 PHE A 71 -4.926 -7.691 -1.983 1.00 0.00 C ATOM 1136 CZ PHE A 71 -6.183 -7.954 -1.451 1.00 0.00 C ATOM 0 H PHE A 71 -4.021 -12.329 -2.097 1.00 0.00 H new ATOM 0 HA PHE A 71 -5.655 -12.369 -4.600 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.352 -10.474 -4.344 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -4.799 -10.356 -5.326 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -6.869 -10.862 -3.086 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -3.380 -8.369 -3.310 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -7.858 -9.305 -1.423 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.388 -6.804 -1.683 1.00 0.00 H new ATOM 0 HZ PHE A 71 -6.619 -7.273 -0.735 1.00 0.00 H new ATOM 1146 N GLU A 72 -3.179 -12.759 -5.842 1.00 0.00 N ATOM 1147 CA GLU A 72 -1.986 -13.467 -6.381 1.00 0.00 C ATOM 1148 C GLU A 72 -1.213 -12.517 -7.274 1.00 0.00 C ATOM 1149 O GLU A 72 -1.763 -11.592 -7.843 1.00 0.00 O ATOM 1150 CB GLU A 72 -2.391 -14.686 -7.197 1.00 0.00 C ATOM 1151 CG GLU A 72 -3.374 -15.534 -6.399 1.00 0.00 C ATOM 1152 CD GLU A 72 -4.034 -16.561 -7.321 1.00 0.00 C ATOM 1153 OE1 GLU A 72 -4.383 -16.193 -8.431 1.00 0.00 O ATOM 1154 OE2 GLU A 72 -4.181 -17.697 -6.902 1.00 0.00 O ATOM 0 H GLU A 72 -3.677 -12.173 -6.512 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.373 -13.798 -5.543 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.846 -14.372 -8.137 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -1.510 -15.275 -7.451 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -2.855 -16.041 -5.586 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.133 -14.897 -5.945 1.00 0.00 H new ATOM 1161 N GLU A 73 0.057 -12.744 -7.398 1.00 0.00 N ATOM 1162 CA GLU A 73 0.891 -11.855 -8.261 1.00 0.00 C ATOM 1163 C GLU A 73 2.314 -12.395 -8.369 1.00 0.00 C ATOM 1164 O GLU A 73 2.629 -13.456 -7.873 1.00 0.00 O ATOM 1165 CB GLU A 73 0.922 -10.448 -7.656 1.00 0.00 C ATOM 1166 CG GLU A 73 0.913 -9.404 -8.776 1.00 0.00 C ATOM 1167 CD GLU A 73 0.078 -8.196 -8.346 1.00 0.00 C ATOM 1168 OE1 GLU A 73 0.573 -7.410 -7.556 1.00 0.00 O ATOM 1169 OE2 GLU A 73 -1.043 -8.079 -8.814 1.00 0.00 O ATOM 0 H GLU A 73 0.561 -13.505 -6.942 1.00 0.00 H new ATOM 0 HA GLU A 73 0.454 -11.821 -9.259 1.00 0.00 H new ATOM 0 HB2 GLU A 73 0.061 -10.303 -7.004 1.00 0.00 H new ATOM 0 HB3 GLU A 73 1.813 -10.326 -7.040 1.00 0.00 H new ATOM 0 HG2 GLU A 73 1.932 -9.092 -9.004 1.00 0.00 H new ATOM 0 HG3 GLU A 73 0.501 -9.837 -9.687 1.00 0.00 H new ATOM 1280 N CYS A 81 4.662 -14.485 -5.841 1.00 0.00 N ATOM 1281 CA CYS A 81 4.233 -13.934 -4.520 1.00 0.00 C ATOM 1282 C CYS A 81 2.744 -13.600 -4.527 1.00 0.00 C ATOM 1283 O CYS A 81 2.215 -13.045 -5.469 1.00 0.00 O ATOM 1284 CB CYS A 81 5.034 -12.661 -4.202 1.00 0.00 C ATOM 1285 SG CYS A 81 4.782 -11.420 -5.498 1.00 0.00 S ATOM 0 HA CYS A 81 4.420 -14.691 -3.759 1.00 0.00 H new ATOM 0 HB2 CYS A 81 4.723 -12.259 -3.238 1.00 0.00 H new ATOM 0 HB3 CYS A 81 6.094 -12.901 -4.120 1.00 0.00 H new ATOM 0 HG CYS A 81 3.598 -11.566 -6.015 1.00 0.00 H new ATOM 1291 N LYS A 82 2.086 -13.918 -3.454 1.00 0.00 N ATOM 1292 CA LYS A 82 0.640 -13.619 -3.325 1.00 0.00 C ATOM 1293 C LYS A 82 0.458 -12.636 -2.175 1.00 0.00 C ATOM 1294 O LYS A 82 1.414 -12.114 -1.633 1.00 0.00 O ATOM 1295 CB LYS A 82 -0.124 -14.905 -3.028 1.00 0.00 C ATOM 1296 CG LYS A 82 0.444 -15.581 -1.766 1.00 0.00 C ATOM 1297 CD LYS A 82 -0.246 -16.937 -1.518 1.00 0.00 C ATOM 1298 CE LYS A 82 -1.762 -16.821 -1.721 1.00 0.00 C ATOM 1299 NZ LYS A 82 -2.467 -17.762 -0.806 1.00 0.00 N ATOM 0 H LYS A 82 2.498 -14.382 -2.645 1.00 0.00 H new ATOM 0 HA LYS A 82 0.259 -13.189 -4.251 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.182 -14.684 -2.886 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -0.051 -15.584 -3.877 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.518 -15.729 -1.879 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.300 -14.931 -0.903 1.00 0.00 H new ATOM 0 HD2 LYS A 82 0.160 -17.687 -2.197 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -0.035 -17.278 -0.504 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.087 -15.799 -1.527 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.018 -17.046 -2.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.334 -18.108 -1.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -1.845 -18.567 -0.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.715 -17.269 0.075 1.00 0.00 H new ATOM 1313 N SER A 83 -0.759 -12.377 -1.813 1.00 0.00 N ATOM 1314 CA SER A 83 -1.027 -11.417 -0.704 1.00 0.00 C ATOM 1315 C SER A 83 -2.235 -11.861 0.097 1.00 0.00 C ATOM 1316 O SER A 83 -2.842 -12.859 -0.199 1.00 0.00 O ATOM 1317 CB SER A 83 -1.328 -10.055 -1.312 1.00 0.00 C ATOM 1318 OG SER A 83 -2.298 -10.227 -2.344 1.00 0.00 O ATOM 0 H SER A 83 -1.590 -12.789 -2.237 1.00 0.00 H new ATOM 0 HA SER A 83 -0.158 -11.373 -0.048 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.703 -9.373 -0.549 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.418 -9.611 -1.717 1.00 0.00 H new ATOM 0 HG SER A 83 -3.035 -9.596 -2.208 1.00 0.00 H new ATOM 1324 N LEU A 84 -2.597 -11.102 1.097 1.00 0.00 N ATOM 1325 CA LEU A 84 -3.803 -11.462 1.909 1.00 0.00 C ATOM 1326 C LEU A 84 -4.151 -10.328 2.858 1.00 0.00 C ATOM 1327 O LEU A 84 -3.359 -9.947 3.694 1.00 0.00 O ATOM 1328 CB LEU A 84 -3.553 -12.742 2.703 1.00 0.00 C ATOM 1329 CG LEU A 84 -4.825 -13.591 2.684 1.00 0.00 C ATOM 1330 CD1 LEU A 84 -4.456 -15.064 2.829 1.00 0.00 C ATOM 1331 CD2 LEU A 84 -5.748 -13.174 3.824 1.00 0.00 C ATOM 0 H LEU A 84 -2.114 -10.252 1.388 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.638 -11.630 1.229 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.722 -13.298 2.270 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.275 -12.501 3.729 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.344 -13.439 1.737 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.362 -15.669 2.816 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.810 -15.360 2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.932 -15.217 3.772 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.651 -13.784 3.803 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -5.237 -13.316 4.776 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -6.017 -12.124 3.709 1.00 0.00 H new ATOM 1343 N VAL A 85 -5.337 -9.786 2.725 1.00 0.00 N ATOM 1344 CA VAL A 85 -5.749 -8.654 3.605 1.00 0.00 C ATOM 1345 C VAL A 85 -6.535 -9.170 4.820 1.00 0.00 C ATOM 1346 O VAL A 85 -7.308 -10.104 4.734 1.00 0.00 O ATOM 1347 CB VAL A 85 -6.603 -7.670 2.781 1.00 0.00 C ATOM 1348 CG1 VAL A 85 -7.271 -6.621 3.688 1.00 0.00 C ATOM 1349 CG2 VAL A 85 -5.704 -6.955 1.771 1.00 0.00 C ATOM 0 H VAL A 85 -6.037 -10.081 2.044 1.00 0.00 H new ATOM 0 HA VAL A 85 -4.863 -8.142 3.979 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.384 -8.233 2.270 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -7.867 -5.941 3.080 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.916 -7.122 4.410 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.504 -6.057 4.218 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -6.300 -6.257 1.184 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -4.924 -6.409 2.301 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -5.247 -7.689 1.108 1.00 0.00 H new ATOM 1359 N LYS A 86 -6.337 -8.534 5.946 1.00 0.00 N ATOM 1360 CA LYS A 86 -7.051 -8.922 7.190 1.00 0.00 C ATOM 1361 C LYS A 86 -7.295 -7.664 8.029 1.00 0.00 C ATOM 1362 O LYS A 86 -7.258 -6.557 7.528 1.00 0.00 O ATOM 1363 CB LYS A 86 -6.195 -9.923 7.972 1.00 0.00 C ATOM 1364 CG LYS A 86 -7.072 -11.043 8.550 1.00 0.00 C ATOM 1365 CD LYS A 86 -7.797 -11.792 7.421 1.00 0.00 C ATOM 1366 CE LYS A 86 -9.292 -11.441 7.431 1.00 0.00 C ATOM 1367 NZ LYS A 86 -10.083 -12.656 7.775 1.00 0.00 N ATOM 0 H LYS A 86 -5.697 -7.747 6.053 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.007 -9.388 6.950 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -5.434 -10.349 7.318 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.671 -9.410 8.779 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.456 -11.739 9.120 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.801 -10.622 9.243 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -7.360 -11.527 6.458 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.667 -12.867 7.545 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -9.486 -10.650 8.155 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -9.594 -11.061 6.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -11.096 -12.420 7.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -9.905 -13.398 7.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.801 -12.999 8.715 1.00 0.00 H new ATOM 1381 N TRP A 87 -7.566 -7.833 9.292 1.00 0.00 N ATOM 1382 CA TRP A 87 -7.840 -6.662 10.178 1.00 0.00 C ATOM 1383 C TRP A 87 -6.917 -6.646 11.388 1.00 0.00 C ATOM 1384 O TRP A 87 -6.089 -7.513 11.586 1.00 0.00 O ATOM 1385 CB TRP A 87 -9.260 -6.766 10.692 1.00 0.00 C ATOM 1386 CG TRP A 87 -10.173 -6.673 9.548 1.00 0.00 C ATOM 1387 CD1 TRP A 87 -10.740 -7.721 8.938 1.00 0.00 C ATOM 1388 CD2 TRP A 87 -10.612 -5.486 8.847 1.00 0.00 C ATOM 1389 NE1 TRP A 87 -11.542 -7.254 7.927 1.00 0.00 N ATOM 1390 CE2 TRP A 87 -11.490 -5.880 7.824 1.00 0.00 C ATOM 1391 CE3 TRP A 87 -10.344 -4.116 9.007 1.00 0.00 C ATOM 1392 CZ2 TRP A 87 -12.087 -4.955 6.983 1.00 0.00 C ATOM 1393 CZ3 TRP A 87 -10.940 -3.175 8.156 1.00 0.00 C ATOM 1394 CH2 TRP A 87 -11.814 -3.596 7.146 1.00 0.00 C ATOM 0 H TRP A 87 -7.610 -8.741 9.756 1.00 0.00 H new ATOM 0 HA TRP A 87 -7.680 -5.755 9.595 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -9.405 -7.710 11.218 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -9.464 -5.969 11.406 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -10.591 -8.759 9.198 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -12.108 -7.851 7.324 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -9.676 -3.787 9.789 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -12.760 -5.284 6.205 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -10.725 -2.124 8.279 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -12.276 -2.870 6.494 1.00 0.00 H new ATOM 1405 N GLU A 88 -7.097 -5.653 12.207 1.00 0.00 N ATOM 1406 CA GLU A 88 -6.298 -5.513 13.448 1.00 0.00 C ATOM 1407 C GLU A 88 -7.284 -5.209 14.582 1.00 0.00 C ATOM 1408 O GLU A 88 -7.342 -5.898 15.583 1.00 0.00 O ATOM 1409 CB GLU A 88 -5.285 -4.362 13.239 1.00 0.00 C ATOM 1410 CG GLU A 88 -4.995 -3.589 14.541 1.00 0.00 C ATOM 1411 CD GLU A 88 -4.433 -4.548 15.592 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -3.624 -5.386 15.228 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -4.821 -4.428 16.742 1.00 0.00 O ATOM 0 H GLU A 88 -7.784 -4.913 12.062 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.737 -6.414 13.695 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.353 -4.769 12.846 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.673 -3.672 12.489 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.283 -2.786 14.349 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.908 -3.123 14.910 1.00 0.00 H new ATOM 1420 N SER A 89 -8.048 -4.169 14.412 1.00 0.00 N ATOM 1421 CA SER A 89 -9.040 -3.770 15.445 1.00 0.00 C ATOM 1422 C SER A 89 -10.442 -3.753 14.834 1.00 0.00 C ATOM 1423 O SER A 89 -11.368 -4.349 15.345 1.00 0.00 O ATOM 1424 CB SER A 89 -8.696 -2.363 15.932 1.00 0.00 C ATOM 1425 OG SER A 89 -8.489 -1.517 14.801 1.00 0.00 O ATOM 0 H SER A 89 -8.026 -3.569 13.587 1.00 0.00 H new ATOM 0 HA SER A 89 -9.014 -4.478 16.273 1.00 0.00 H new ATOM 0 HB2 SER A 89 -9.502 -1.972 16.552 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.800 -2.388 16.552 1.00 0.00 H new ATOM 0 HG SER A 89 -8.269 -0.612 15.105 1.00 0.00 H new ATOM 1431 N GLU A 90 -10.584 -3.053 13.744 1.00 0.00 N ATOM 1432 CA GLU A 90 -11.900 -2.927 13.037 1.00 0.00 C ATOM 1433 C GLU A 90 -11.749 -1.822 11.992 1.00 0.00 C ATOM 1434 O GLU A 90 -12.267 -1.903 10.895 1.00 0.00 O ATOM 1435 CB GLU A 90 -13.021 -2.542 14.015 1.00 0.00 C ATOM 1436 CG GLU A 90 -12.602 -1.315 14.829 1.00 0.00 C ATOM 1437 CD GLU A 90 -13.212 -1.399 16.230 1.00 0.00 C ATOM 1438 OE1 GLU A 90 -14.424 -1.503 16.322 1.00 0.00 O ATOM 1439 OE2 GLU A 90 -12.456 -1.359 17.187 1.00 0.00 O ATOM 0 H GLU A 90 -9.821 -2.545 13.296 1.00 0.00 H new ATOM 0 HA GLU A 90 -12.165 -3.881 12.582 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -13.938 -2.329 13.466 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -13.236 -3.376 14.683 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -11.515 -1.264 14.896 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.934 -0.404 14.330 1.00 0.00 H new ATOM 1446 N ASN A 91 -10.994 -0.811 12.328 1.00 0.00 N ATOM 1447 CA ASN A 91 -10.728 0.304 11.375 1.00 0.00 C ATOM 1448 C ASN A 91 -9.264 0.228 10.930 1.00 0.00 C ATOM 1449 O ASN A 91 -8.803 1.059 10.174 1.00 0.00 O ATOM 1450 CB ASN A 91 -10.975 1.646 12.049 1.00 0.00 C ATOM 1451 CG ASN A 91 -12.435 1.760 12.493 1.00 0.00 C ATOM 1452 OD1 ASN A 91 -13.168 0.791 12.490 1.00 0.00 O ATOM 1453 ND2 ASN A 91 -12.890 2.924 12.869 1.00 0.00 N ATOM 0 H ASN A 91 -10.543 -0.710 13.237 1.00 0.00 H new ATOM 0 HA ASN A 91 -11.394 0.213 10.517 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -10.317 1.754 12.911 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -10.733 2.456 11.360 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.862 3.021 13.161 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -12.273 3.736 12.871 1.00 0.00 H new ATOM 1460 N LYS A 92 -8.534 -0.772 11.381 1.00 0.00 N ATOM 1461 CA LYS A 92 -7.134 -0.929 10.956 1.00 0.00 C ATOM 1462 C LYS A 92 -7.057 -2.287 10.267 1.00 0.00 C ATOM 1463 O LYS A 92 -7.703 -3.227 10.687 1.00 0.00 O ATOM 1464 CB LYS A 92 -6.212 -0.895 12.175 1.00 0.00 C ATOM 1465 CG LYS A 92 -4.782 -0.626 11.716 1.00 0.00 C ATOM 1466 CD LYS A 92 -4.045 -1.949 11.499 1.00 0.00 C ATOM 1467 CE LYS A 92 -2.676 -1.676 10.874 1.00 0.00 C ATOM 1468 NZ LYS A 92 -1.760 -1.121 11.910 1.00 0.00 N ATOM 0 H LYS A 92 -8.868 -1.484 12.031 1.00 0.00 H new ATOM 0 HA LYS A 92 -6.820 -0.127 10.288 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -6.536 -0.119 12.869 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.262 -1.843 12.710 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.791 -0.049 10.791 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -4.259 -0.027 12.461 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -3.925 -2.470 12.449 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -4.629 -2.600 10.849 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -2.262 -2.596 10.462 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -2.775 -0.973 10.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.796 -1.062 11.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.082 -0.171 12.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.762 -1.742 12.744 1.00 0.00 H new ATOM 1482 N MET A 93 -6.303 -2.402 9.215 1.00 0.00 N ATOM 1483 CA MET A 93 -6.216 -3.706 8.502 1.00 0.00 C ATOM 1484 C MET A 93 -4.822 -3.889 7.934 1.00 0.00 C ATOM 1485 O MET A 93 -4.046 -2.959 7.827 1.00 0.00 O ATOM 1486 CB MET A 93 -7.246 -3.822 7.356 1.00 0.00 C ATOM 1487 CG MET A 93 -7.697 -2.446 6.842 1.00 0.00 C ATOM 1488 SD MET A 93 -7.908 -2.499 5.042 1.00 0.00 S ATOM 1489 CE MET A 93 -9.043 -3.907 4.991 1.00 0.00 C ATOM 0 H MET A 93 -5.742 -1.650 8.816 1.00 0.00 H new ATOM 0 HA MET A 93 -6.438 -4.485 9.232 1.00 0.00 H new ATOM 0 HB2 MET A 93 -6.811 -4.390 6.534 1.00 0.00 H new ATOM 0 HB3 MET A 93 -8.115 -4.381 7.705 1.00 0.00 H new ATOM 0 HG2 MET A 93 -8.634 -2.159 7.319 1.00 0.00 H new ATOM 0 HG3 MET A 93 -6.959 -1.689 7.108 1.00 0.00 H new ATOM 0 HE1 MET A 93 -9.381 -4.065 3.967 1.00 0.00 H new ATOM 0 HE2 MET A 93 -8.530 -4.801 5.346 1.00 0.00 H new ATOM 0 HE3 MET A 93 -9.903 -3.704 5.630 1.00 0.00 H new ATOM 1499 N VAL A 94 -4.507 -5.097 7.586 1.00 0.00 N ATOM 1500 CA VAL A 94 -3.163 -5.403 7.031 1.00 0.00 C ATOM 1501 C VAL A 94 -3.295 -6.063 5.667 1.00 0.00 C ATOM 1502 O VAL A 94 -4.375 -6.248 5.143 1.00 0.00 O ATOM 1503 CB VAL A 94 -2.437 -6.375 7.964 1.00 0.00 C ATOM 1504 CG1 VAL A 94 -1.956 -5.634 9.206 1.00 0.00 C ATOM 1505 CG2 VAL A 94 -3.397 -7.491 8.373 1.00 0.00 C ATOM 0 H VAL A 94 -5.131 -5.900 7.663 1.00 0.00 H new ATOM 0 HA VAL A 94 -2.605 -4.471 6.938 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.577 -6.802 7.447 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -1.440 -6.330 9.868 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -1.273 -4.837 8.912 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.811 -5.204 9.727 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -2.885 -8.186 9.038 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -4.256 -7.061 8.889 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -3.737 -8.023 7.484 1.00 0.00 H new ATOM 1515 N CYS A 95 -2.185 -6.435 5.111 1.00 0.00 N ATOM 1516 CA CYS A 95 -2.174 -7.119 3.797 1.00 0.00 C ATOM 1517 C CYS A 95 -0.814 -7.776 3.648 1.00 0.00 C ATOM 1518 O CYS A 95 0.032 -7.314 2.911 1.00 0.00 O ATOM 1519 CB CYS A 95 -2.393 -6.116 2.674 1.00 0.00 C ATOM 1520 SG CYS A 95 -2.553 -7.000 1.103 1.00 0.00 S ATOM 0 H CYS A 95 -1.263 -6.290 5.522 1.00 0.00 H new ATOM 0 HA CYS A 95 -2.974 -7.858 3.743 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -3.290 -5.528 2.866 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -1.558 -5.417 2.627 1.00 0.00 H new ATOM 0 HG CYS A 95 -2.516 -6.149 0.121 1.00 0.00 H new ATOM 1526 N GLU A 96 -0.585 -8.831 4.381 1.00 0.00 N ATOM 1527 CA GLU A 96 0.744 -9.495 4.328 1.00 0.00 C ATOM 1528 C GLU A 96 0.995 -10.104 2.952 1.00 0.00 C ATOM 1529 O GLU A 96 0.383 -11.083 2.570 1.00 0.00 O ATOM 1530 CB GLU A 96 0.831 -10.590 5.386 1.00 0.00 C ATOM 1531 CG GLU A 96 2.276 -11.085 5.459 1.00 0.00 C ATOM 1532 CD GLU A 96 2.350 -12.333 6.341 1.00 0.00 C ATOM 1533 OE1 GLU A 96 2.258 -12.187 7.549 1.00 0.00 O ATOM 1534 OE2 GLU A 96 2.498 -13.414 5.794 1.00 0.00 O ATOM 0 H GLU A 96 -1.261 -9.260 5.013 1.00 0.00 H new ATOM 0 HA GLU A 96 1.503 -8.738 4.523 1.00 0.00 H new ATOM 0 HB2 GLU A 96 0.514 -10.205 6.355 1.00 0.00 H new ATOM 0 HB3 GLU A 96 0.162 -11.413 5.135 1.00 0.00 H new ATOM 0 HG2 GLU A 96 2.643 -11.313 4.458 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.918 -10.303 5.864 1.00 0.00 H new ATOM 1541 N GLN A 97 1.918 -9.539 2.222 1.00 0.00 N ATOM 1542 CA GLN A 97 2.257 -10.073 0.885 1.00 0.00 C ATOM 1543 C GLN A 97 3.540 -10.901 1.009 1.00 0.00 C ATOM 1544 O GLN A 97 4.541 -10.422 1.509 1.00 0.00 O ATOM 1545 CB GLN A 97 2.488 -8.905 -0.070 1.00 0.00 C ATOM 1546 CG GLN A 97 1.212 -8.068 -0.179 1.00 0.00 C ATOM 1547 CD GLN A 97 1.039 -7.565 -1.616 1.00 0.00 C ATOM 1548 OE1 GLN A 97 1.968 -7.588 -2.401 1.00 0.00 O ATOM 1549 NE2 GLN A 97 -0.121 -7.105 -1.997 1.00 0.00 N ATOM 0 H GLN A 97 2.455 -8.719 2.505 1.00 0.00 H new ATOM 0 HA GLN A 97 1.449 -10.696 0.503 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.311 -8.286 0.289 1.00 0.00 H new ATOM 0 HB3 GLN A 97 2.775 -9.278 -1.053 1.00 0.00 H new ATOM 0 HG2 GLN A 97 0.349 -8.666 0.113 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.261 -7.223 0.508 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -0.902 -7.084 -1.341 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -0.247 -6.766 -2.951 1.00 0.00 H new ATOM 1558 N LYS A 98 3.522 -12.140 0.580 1.00 0.00 N ATOM 1559 CA LYS A 98 4.756 -12.984 0.701 1.00 0.00 C ATOM 1560 C LYS A 98 5.114 -13.602 -0.654 1.00 0.00 C ATOM 1561 O LYS A 98 4.302 -13.648 -1.554 1.00 0.00 O ATOM 1562 CB LYS A 98 4.511 -14.100 1.720 1.00 0.00 C ATOM 1563 CG LYS A 98 3.263 -14.893 1.324 1.00 0.00 C ATOM 1564 CD LYS A 98 2.933 -15.906 2.422 1.00 0.00 C ATOM 1565 CE LYS A 98 3.844 -17.127 2.282 1.00 0.00 C ATOM 1566 NZ LYS A 98 3.223 -18.292 2.974 1.00 0.00 N ATOM 0 H LYS A 98 2.717 -12.601 0.156 1.00 0.00 H new ATOM 0 HA LYS A 98 5.583 -12.355 1.032 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.376 -14.762 1.764 1.00 0.00 H new ATOM 0 HB3 LYS A 98 4.383 -13.675 2.716 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.422 -14.216 1.174 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.431 -15.408 0.378 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.066 -15.451 3.403 1.00 0.00 H new ATOM 0 HD3 LYS A 98 1.888 -16.209 2.350 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.001 -17.358 1.228 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.823 -16.915 2.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 3.842 -19.122 2.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.095 -18.069 3.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.299 -18.498 2.545 1.00 0.00 H new ATOM 1580 N LEU A 99 6.326 -14.090 -0.797 1.00 0.00 N ATOM 1581 CA LEU A 99 6.731 -14.723 -2.097 1.00 0.00 C ATOM 1582 C LEU A 99 6.668 -16.244 -1.970 1.00 0.00 C ATOM 1583 O LEU A 99 7.460 -16.962 -2.550 1.00 0.00 O ATOM 1584 CB LEU A 99 8.141 -14.292 -2.559 1.00 0.00 C ATOM 1585 CG LEU A 99 9.044 -13.959 -1.376 1.00 0.00 C ATOM 1586 CD1 LEU A 99 10.497 -14.283 -1.734 1.00 0.00 C ATOM 1587 CD2 LEU A 99 8.924 -12.467 -1.056 1.00 0.00 C ATOM 0 H LEU A 99 7.048 -14.078 -0.076 1.00 0.00 H new ATOM 0 HA LEU A 99 6.029 -14.378 -2.856 1.00 0.00 H new ATOM 0 HB2 LEU A 99 8.592 -15.091 -3.147 1.00 0.00 H new ATOM 0 HB3 LEU A 99 8.060 -13.423 -3.212 1.00 0.00 H new ATOM 0 HG LEU A 99 8.743 -14.548 -0.510 1.00 0.00 H new ATOM 0 HD11 LEU A 99 11.142 -14.045 -0.888 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.586 -15.343 -1.971 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.799 -13.692 -2.598 1.00 0.00 H new ATOM 0 HD21 LEU A 99 9.568 -12.223 -0.211 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.229 -11.883 -1.924 1.00 0.00 H new ATOM 0 HD23 LEU A 99 7.890 -12.231 -0.805 1.00 0.00 H new ATOM 1599 N LEU A 100 5.707 -16.736 -1.228 1.00 0.00 N ATOM 1600 CA LEU A 100 5.546 -18.214 -1.064 1.00 0.00 C ATOM 1601 C LEU A 100 6.827 -18.854 -0.517 1.00 0.00 C ATOM 1602 O LEU A 100 7.037 -20.045 -0.653 1.00 0.00 O ATOM 1603 CB LEU A 100 5.229 -18.827 -2.420 1.00 0.00 C ATOM 1604 CG LEU A 100 3.921 -18.238 -2.950 1.00 0.00 C ATOM 1605 CD1 LEU A 100 3.693 -18.703 -4.389 1.00 0.00 C ATOM 1606 CD2 LEU A 100 2.758 -18.708 -2.073 1.00 0.00 C ATOM 0 H LEU A 100 5.022 -16.172 -0.725 1.00 0.00 H new ATOM 0 HA LEU A 100 4.738 -18.398 -0.356 1.00 0.00 H new ATOM 0 HB2 LEU A 100 6.040 -18.628 -3.120 1.00 0.00 H new ATOM 0 HB3 LEU A 100 5.143 -19.910 -2.331 1.00 0.00 H new ATOM 0 HG LEU A 100 3.980 -17.150 -2.927 1.00 0.00 H new ATOM 0 HD11 LEU A 100 2.760 -18.282 -4.764 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.520 -18.368 -5.015 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.636 -19.791 -4.415 1.00 0.00 H new ATOM 0 HD21 LEU A 100 1.825 -18.289 -2.450 1.00 0.00 H new ATOM 0 HD22 LEU A 100 2.702 -19.796 -2.096 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.917 -18.374 -1.048 1.00 0.00 H new ATOM 1618 N LYS A 101 7.678 -18.080 0.097 1.00 0.00 N ATOM 1619 CA LYS A 101 8.945 -18.639 0.655 1.00 0.00 C ATOM 1620 C LYS A 101 9.712 -17.532 1.376 1.00 0.00 C ATOM 1621 O LYS A 101 10.021 -17.637 2.547 1.00 0.00 O ATOM 1622 CB LYS A 101 9.802 -19.200 -0.482 1.00 0.00 C ATOM 1623 CG LYS A 101 10.551 -20.443 0.004 1.00 0.00 C ATOM 1624 CD LYS A 101 9.561 -21.593 0.199 1.00 0.00 C ATOM 1625 CE LYS A 101 10.325 -22.916 0.280 1.00 0.00 C ATOM 1626 NZ LYS A 101 10.522 -23.459 -1.094 1.00 0.00 N ATOM 0 H LYS A 101 7.551 -17.078 0.238 1.00 0.00 H new ATOM 0 HA LYS A 101 8.712 -19.438 1.359 1.00 0.00 H new ATOM 0 HB2 LYS A 101 9.172 -19.453 -1.335 1.00 0.00 H new ATOM 0 HB3 LYS A 101 10.511 -18.446 -0.822 1.00 0.00 H new ATOM 0 HG2 LYS A 101 11.315 -20.726 -0.720 1.00 0.00 H new ATOM 0 HG3 LYS A 101 11.064 -20.228 0.941 1.00 0.00 H new ATOM 0 HD2 LYS A 101 8.983 -21.438 1.110 1.00 0.00 H new ATOM 0 HD3 LYS A 101 8.852 -21.620 -0.628 1.00 0.00 H new ATOM 0 HE2 LYS A 101 11.290 -22.763 0.764 1.00 0.00 H new ATOM 0 HE3 LYS A 101 9.773 -23.631 0.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 11.041 -24.358 -1.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 9.596 -23.620 -1.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 11.066 -22.778 -1.662 1.00 0.00 H new ATOM 1640 N GLY A 102 10.013 -16.472 0.678 1.00 0.00 N ATOM 1641 CA GLY A 102 10.756 -15.340 1.303 1.00 0.00 C ATOM 1642 C GLY A 102 12.254 -15.639 1.303 1.00 0.00 C ATOM 1643 O GLY A 102 12.679 -16.746 1.574 1.00 0.00 O ATOM 0 H GLY A 102 9.775 -16.340 -0.305 1.00 0.00 H new ATOM 0 HA2 GLY A 102 10.560 -14.418 0.755 1.00 0.00 H new ATOM 0 HA3 GLY A 102 10.407 -15.184 2.324 1.00 0.00 H new ATOM 1647 N GLU A 103 13.052 -14.647 1.016 1.00 0.00 N ATOM 1648 CA GLU A 103 14.530 -14.838 1.008 1.00 0.00 C ATOM 1649 C GLU A 103 15.140 -13.956 2.097 1.00 0.00 C ATOM 1650 O GLU A 103 16.036 -14.361 2.813 1.00 0.00 O ATOM 1651 CB GLU A 103 15.105 -14.456 -0.361 1.00 0.00 C ATOM 1652 CG GLU A 103 14.613 -13.064 -0.768 1.00 0.00 C ATOM 1653 CD GLU A 103 15.177 -12.707 -2.144 1.00 0.00 C ATOM 1654 OE1 GLU A 103 16.319 -13.049 -2.402 1.00 0.00 O ATOM 1655 OE2 GLU A 103 14.457 -12.098 -2.918 1.00 0.00 O ATOM 0 H GLU A 103 12.740 -13.704 0.785 1.00 0.00 H new ATOM 0 HA GLU A 103 14.769 -15.884 1.200 1.00 0.00 H new ATOM 0 HB2 GLU A 103 16.194 -14.469 -0.323 1.00 0.00 H new ATOM 0 HB3 GLU A 103 14.804 -15.190 -1.108 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.523 -13.045 -0.793 1.00 0.00 H new ATOM 0 HG3 GLU A 103 14.928 -12.325 -0.031 1.00 0.00 H new ATOM 1662 N GLY A 104 14.640 -12.758 2.233 1.00 0.00 N ATOM 1663 CA GLY A 104 15.149 -11.832 3.278 1.00 0.00 C ATOM 1664 C GLY A 104 13.970 -10.986 3.787 1.00 0.00 C ATOM 1665 O GLY A 104 13.319 -11.370 4.739 1.00 0.00 O ATOM 0 H GLY A 104 13.890 -12.379 1.655 1.00 0.00 H new ATOM 0 HA2 GLY A 104 15.596 -12.394 4.098 1.00 0.00 H new ATOM 0 HA3 GLY A 104 15.929 -11.190 2.869 1.00 0.00 H new ATOM 1669 N PRO A 105 13.706 -9.863 3.140 1.00 0.00 N ATOM 1670 CA PRO A 105 12.590 -8.988 3.531 1.00 0.00 C ATOM 1671 C PRO A 105 11.275 -9.502 2.928 1.00 0.00 C ATOM 1672 O PRO A 105 11.172 -10.655 2.550 1.00 0.00 O ATOM 1673 CB PRO A 105 12.976 -7.632 2.945 1.00 0.00 C ATOM 1674 CG PRO A 105 13.968 -7.910 1.790 1.00 0.00 C ATOM 1675 CD PRO A 105 14.483 -9.351 1.984 1.00 0.00 C ATOM 0 HA PRO A 105 12.430 -8.945 4.608 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.095 -7.104 2.579 1.00 0.00 H new ATOM 0 HB3 PRO A 105 13.435 -6.999 3.705 1.00 0.00 H new ATOM 0 HG2 PRO A 105 13.476 -7.802 0.823 1.00 0.00 H new ATOM 0 HG3 PRO A 105 14.793 -7.198 1.809 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.317 -9.957 1.093 1.00 0.00 H new ATOM 0 HD3 PRO A 105 15.554 -9.367 2.185 1.00 0.00 H new ATOM 1683 N LYS A 106 10.266 -8.665 2.849 1.00 0.00 N ATOM 1684 CA LYS A 106 8.960 -9.114 2.290 1.00 0.00 C ATOM 1685 C LYS A 106 8.068 -7.906 1.992 1.00 0.00 C ATOM 1686 O LYS A 106 8.377 -6.787 2.355 1.00 0.00 O ATOM 1687 CB LYS A 106 8.277 -9.997 3.325 1.00 0.00 C ATOM 1688 CG LYS A 106 7.629 -11.202 2.639 1.00 0.00 C ATOM 1689 CD LYS A 106 7.589 -12.384 3.610 1.00 0.00 C ATOM 1690 CE LYS A 106 8.977 -13.021 3.698 1.00 0.00 C ATOM 1691 NZ LYS A 106 8.965 -14.095 4.732 1.00 0.00 N ATOM 0 H LYS A 106 10.296 -7.691 3.149 1.00 0.00 H new ATOM 0 HA LYS A 106 9.127 -9.664 1.364 1.00 0.00 H new ATOM 0 HB2 LYS A 106 9.004 -10.336 4.063 1.00 0.00 H new ATOM 0 HB3 LYS A 106 7.521 -9.424 3.862 1.00 0.00 H new ATOM 0 HG2 LYS A 106 6.619 -10.950 2.315 1.00 0.00 H new ATOM 0 HG3 LYS A 106 8.192 -11.471 1.745 1.00 0.00 H new ATOM 0 HD2 LYS A 106 7.269 -12.047 4.596 1.00 0.00 H new ATOM 0 HD3 LYS A 106 6.860 -13.121 3.273 1.00 0.00 H new ATOM 0 HE2 LYS A 106 9.261 -13.436 2.731 1.00 0.00 H new ATOM 0 HE3 LYS A 106 9.721 -12.265 3.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 9.908 -14.529 4.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 8.712 -13.686 5.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 8.267 -14.820 4.471 1.00 0.00 H new ATOM 1705 N THR A 107 6.956 -8.136 1.342 1.00 0.00 N ATOM 1706 CA THR A 107 6.025 -7.024 1.017 1.00 0.00 C ATOM 1707 C THR A 107 4.790 -7.123 1.913 1.00 0.00 C ATOM 1708 O THR A 107 4.530 -8.147 2.512 1.00 0.00 O ATOM 1709 CB THR A 107 5.602 -7.149 -0.452 1.00 0.00 C ATOM 1710 OG1 THR A 107 5.512 -8.521 -0.810 1.00 0.00 O ATOM 1711 CG2 THR A 107 6.628 -6.469 -1.351 1.00 0.00 C ATOM 0 H THR A 107 6.654 -9.056 1.022 1.00 0.00 H new ATOM 0 HA THR A 107 6.515 -6.064 1.181 1.00 0.00 H new ATOM 0 HB THR A 107 4.632 -6.669 -0.579 1.00 0.00 H new ATOM 0 HG1 THR A 107 5.240 -8.597 -1.748 1.00 0.00 H new ATOM 0 HG21 THR A 107 6.319 -6.563 -2.392 1.00 0.00 H new ATOM 0 HG22 THR A 107 6.700 -5.414 -1.088 1.00 0.00 H new ATOM 0 HG23 THR A 107 7.600 -6.943 -1.217 1.00 0.00 H new ATOM 1719 N SER A 108 4.031 -6.060 2.010 1.00 0.00 N ATOM 1720 CA SER A 108 2.802 -6.066 2.866 1.00 0.00 C ATOM 1721 C SER A 108 2.248 -4.642 2.940 1.00 0.00 C ATOM 1722 O SER A 108 2.903 -3.702 2.533 1.00 0.00 O ATOM 1723 CB SER A 108 3.150 -6.531 4.285 1.00 0.00 C ATOM 1724 OG SER A 108 4.451 -6.067 4.625 1.00 0.00 O ATOM 0 H SER A 108 4.211 -5.179 1.528 1.00 0.00 H new ATOM 0 HA SER A 108 2.066 -6.744 2.434 1.00 0.00 H new ATOM 0 HB2 SER A 108 2.417 -6.148 4.996 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.112 -7.619 4.343 1.00 0.00 H new ATOM 0 HG SER A 108 4.677 -6.361 5.532 1.00 0.00 H new ATOM 1730 N TRP A 109 1.072 -4.464 3.495 1.00 0.00 N ATOM 1731 CA TRP A 109 0.523 -3.081 3.640 1.00 0.00 C ATOM 1732 C TRP A 109 -0.594 -3.071 4.651 1.00 0.00 C ATOM 1733 O TRP A 109 -1.376 -3.998 4.745 1.00 0.00 O ATOM 1734 CB TRP A 109 0.054 -2.468 2.301 1.00 0.00 C ATOM 1735 CG TRP A 109 -1.157 -3.106 1.683 1.00 0.00 C ATOM 1736 CD1 TRP A 109 -1.139 -3.720 0.481 1.00 0.00 C ATOM 1737 CD2 TRP A 109 -2.559 -3.134 2.134 1.00 0.00 C ATOM 1738 NE1 TRP A 109 -2.417 -4.134 0.159 1.00 0.00 N ATOM 1739 CE2 TRP A 109 -3.328 -3.804 1.142 1.00 0.00 C ATOM 1740 CE3 TRP A 109 -3.241 -2.668 3.287 1.00 0.00 C ATOM 1741 CZ2 TRP A 109 -4.705 -3.996 1.285 1.00 0.00 C ATOM 1742 CZ3 TRP A 109 -4.621 -2.868 3.424 1.00 0.00 C ATOM 1743 CH2 TRP A 109 -5.347 -3.528 2.427 1.00 0.00 C ATOM 0 H TRP A 109 0.475 -5.210 3.850 1.00 0.00 H new ATOM 0 HA TRP A 109 1.340 -2.452 3.993 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -0.156 -1.410 2.460 1.00 0.00 H new ATOM 0 HB3 TRP A 109 0.876 -2.526 1.588 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -0.262 -3.865 -0.133 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -2.658 -4.625 -0.702 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -2.693 -2.156 4.064 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.266 -4.504 0.515 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -5.129 -2.509 4.307 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -6.411 -3.675 2.544 1.00 0.00 H new ATOM 1754 N THR A 110 -0.665 -2.020 5.427 1.00 0.00 N ATOM 1755 CA THR A 110 -1.734 -1.932 6.456 1.00 0.00 C ATOM 1756 C THR A 110 -2.448 -0.589 6.364 1.00 0.00 C ATOM 1757 O THR A 110 -1.894 0.450 6.650 1.00 0.00 O ATOM 1758 CB THR A 110 -1.136 -2.098 7.849 1.00 0.00 C ATOM 1759 OG1 THR A 110 -0.411 -0.927 8.198 1.00 0.00 O ATOM 1760 CG2 THR A 110 -0.204 -3.309 7.874 1.00 0.00 C ATOM 0 H THR A 110 -0.029 -1.223 5.390 1.00 0.00 H new ATOM 0 HA THR A 110 -2.454 -2.731 6.276 1.00 0.00 H new ATOM 0 HB THR A 110 -1.940 -2.253 8.568 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.948 -0.135 7.988 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.220 -3.422 8.872 1.00 0.00 H new ATOM 0 HG22 THR A 110 -0.766 -4.206 7.615 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.600 -3.164 7.153 1.00 0.00 H new ATOM 1768 N ARG A 111 -3.689 -0.626 5.984 1.00 0.00 N ATOM 1769 CA ARG A 111 -4.495 0.629 5.873 1.00 0.00 C ATOM 1770 C ARG A 111 -5.145 0.900 7.224 1.00 0.00 C ATOM 1771 O ARG A 111 -5.811 0.051 7.759 1.00 0.00 O ATOM 1772 CB ARG A 111 -5.579 0.437 4.804 1.00 0.00 C ATOM 1773 CG ARG A 111 -4.969 0.594 3.410 1.00 0.00 C ATOM 1774 CD ARG A 111 -6.060 0.438 2.347 1.00 0.00 C ATOM 1775 NE ARG A 111 -5.838 1.430 1.258 1.00 0.00 N ATOM 1776 CZ ARG A 111 -6.124 2.688 1.454 1.00 0.00 C ATOM 1777 NH1 ARG A 111 -7.265 3.021 1.992 1.00 0.00 N ATOM 1778 NH2 ARG A 111 -5.269 3.613 1.112 1.00 0.00 N ATOM 0 H ARG A 111 -4.191 -1.480 5.741 1.00 0.00 H new ATOM 0 HA ARG A 111 -3.860 1.469 5.591 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -6.030 -0.550 4.904 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.376 1.167 4.946 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -4.496 1.572 3.318 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -4.190 -0.153 3.257 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -6.045 -0.573 1.941 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -7.043 0.587 2.795 1.00 0.00 H new ATOM 0 HE ARG A 111 -5.463 1.126 0.360 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.933 2.298 2.259 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -7.489 4.004 2.145 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -4.377 3.353 0.691 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -5.493 4.596 1.265 1.00 0.00 H new ATOM 1792 N GLU A 112 -4.959 2.065 7.791 1.00 0.00 N ATOM 1793 CA GLU A 112 -5.581 2.336 9.122 1.00 0.00 C ATOM 1794 C GLU A 112 -6.351 3.647 9.085 1.00 0.00 C ATOM 1795 O GLU A 112 -6.021 4.551 8.352 1.00 0.00 O ATOM 1796 CB GLU A 112 -4.496 2.404 10.199 1.00 0.00 C ATOM 1797 CG GLU A 112 -5.152 2.487 11.579 1.00 0.00 C ATOM 1798 CD GLU A 112 -4.072 2.473 12.664 1.00 0.00 C ATOM 1799 OE1 GLU A 112 -3.053 1.835 12.453 1.00 0.00 O ATOM 1800 OE2 GLU A 112 -4.283 3.100 13.689 1.00 0.00 O ATOM 0 H GLU A 112 -4.412 2.830 7.397 1.00 0.00 H new ATOM 0 HA GLU A 112 -6.272 1.527 9.358 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -3.856 1.524 10.141 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -3.859 3.273 10.034 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.747 3.397 11.656 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -5.834 1.648 11.720 1.00 0.00 H new ATOM 1807 N LEU A 113 -7.384 3.739 9.873 1.00 0.00 N ATOM 1808 CA LEU A 113 -8.216 4.972 9.914 1.00 0.00 C ATOM 1809 C LEU A 113 -7.958 5.697 11.239 1.00 0.00 C ATOM 1810 O LEU A 113 -7.395 5.130 12.157 1.00 0.00 O ATOM 1811 CB LEU A 113 -9.688 4.548 9.834 1.00 0.00 C ATOM 1812 CG LEU A 113 -10.152 4.344 8.382 1.00 0.00 C ATOM 1813 CD1 LEU A 113 -10.396 5.693 7.726 1.00 0.00 C ATOM 1814 CD2 LEU A 113 -9.117 3.559 7.576 1.00 0.00 C ATOM 0 H LEU A 113 -7.692 2.998 10.502 1.00 0.00 H new ATOM 0 HA LEU A 113 -7.971 5.638 9.087 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -9.829 3.623 10.393 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -10.310 5.306 10.310 1.00 0.00 H new ATOM 0 HG LEU A 113 -11.079 3.770 8.399 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -10.725 5.543 6.698 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -11.166 6.232 8.278 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -9.473 6.272 7.731 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -9.473 3.431 6.554 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -8.174 4.105 7.566 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.965 2.581 8.033 1.00 0.00 H new ATOM 1873 N GLU A 118 -8.430 10.510 8.538 1.00 0.00 N ATOM 1874 CA GLU A 118 -6.943 10.455 8.606 1.00 0.00 C ATOM 1875 C GLU A 118 -6.512 9.009 8.356 1.00 0.00 C ATOM 1876 O GLU A 118 -6.105 8.299 9.257 1.00 0.00 O ATOM 1877 CB GLU A 118 -6.467 10.918 9.986 1.00 0.00 C ATOM 1878 CG GLU A 118 -5.183 11.738 9.838 1.00 0.00 C ATOM 1879 CD GLU A 118 -5.103 12.769 10.964 1.00 0.00 C ATOM 1880 OE1 GLU A 118 -5.794 13.771 10.874 1.00 0.00 O ATOM 1881 OE2 GLU A 118 -4.351 12.541 11.898 1.00 0.00 O ATOM 0 HA GLU A 118 -6.503 11.112 7.856 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -7.240 11.518 10.466 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -6.288 10.056 10.628 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.314 11.081 9.870 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -5.169 12.239 8.870 1.00 0.00 H new ATOM 1888 N LEU A 119 -6.635 8.566 7.135 1.00 0.00 N ATOM 1889 CA LEU A 119 -6.281 7.161 6.794 1.00 0.00 C ATOM 1890 C LEU A 119 -4.769 7.014 6.580 1.00 0.00 C ATOM 1891 O LEU A 119 -4.249 7.377 5.547 1.00 0.00 O ATOM 1892 CB LEU A 119 -7.018 6.779 5.508 1.00 0.00 C ATOM 1893 CG LEU A 119 -7.029 5.258 5.336 1.00 0.00 C ATOM 1894 CD1 LEU A 119 -8.384 4.810 4.781 1.00 0.00 C ATOM 1895 CD2 LEU A 119 -5.928 4.850 4.361 1.00 0.00 C ATOM 0 H LEU A 119 -6.970 9.125 6.350 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.572 6.506 7.615 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.040 7.156 5.541 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.533 7.246 4.650 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.859 4.786 6.304 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -8.387 3.727 4.660 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.175 5.100 5.473 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.556 5.283 3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -5.934 3.767 4.237 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -6.102 5.326 3.396 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -4.961 5.165 4.752 1.00 0.00 H new ATOM 1907 N ILE A 120 -4.063 6.461 7.536 1.00 0.00 N ATOM 1908 CA ILE A 120 -2.588 6.271 7.356 1.00 0.00 C ATOM 1909 C ILE A 120 -2.355 4.890 6.745 1.00 0.00 C ATOM 1910 O ILE A 120 -2.595 3.878 7.366 1.00 0.00 O ATOM 1911 CB ILE A 120 -1.870 6.412 8.703 1.00 0.00 C ATOM 1912 CG1 ILE A 120 -2.337 5.324 9.674 1.00 0.00 C ATOM 1913 CG2 ILE A 120 -2.202 7.781 9.287 1.00 0.00 C ATOM 1914 CD1 ILE A 120 -1.297 4.202 9.721 1.00 0.00 C ATOM 0 H ILE A 120 -4.439 6.135 8.426 1.00 0.00 H new ATOM 0 HA ILE A 120 -2.183 7.033 6.690 1.00 0.00 H new ATOM 0 HB ILE A 120 -0.795 6.309 8.553 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -2.478 5.746 10.669 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -3.301 4.928 9.356 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -1.699 7.899 10.247 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -1.865 8.560 8.603 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -3.279 7.864 9.429 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -1.629 3.427 10.412 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -1.178 3.774 8.726 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -0.342 4.605 10.059 1.00 0.00 H new ATOM 1926 N LEU A 121 -1.934 4.850 5.512 1.00 0.00 N ATOM 1927 CA LEU A 121 -1.741 3.547 4.824 1.00 0.00 C ATOM 1928 C LEU A 121 -0.246 3.269 4.577 1.00 0.00 C ATOM 1929 O LEU A 121 0.432 3.978 3.858 1.00 0.00 O ATOM 1930 CB LEU A 121 -2.551 3.599 3.505 1.00 0.00 C ATOM 1931 CG LEU A 121 -2.245 2.426 2.551 1.00 0.00 C ATOM 1932 CD1 LEU A 121 -0.989 2.741 1.743 1.00 0.00 C ATOM 1933 CD2 LEU A 121 -2.033 1.122 3.320 1.00 0.00 C ATOM 0 H LEU A 121 -1.714 5.671 4.949 1.00 0.00 H new ATOM 0 HA LEU A 121 -2.099 2.724 5.443 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -3.615 3.598 3.741 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -2.339 4.538 2.994 1.00 0.00 H new ATOM 0 HG LEU A 121 -3.100 2.299 1.887 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -0.773 1.912 1.069 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -1.148 3.649 1.162 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.148 2.887 2.420 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -1.820 0.316 2.618 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.194 1.237 4.007 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -2.934 0.882 3.885 1.00 0.00 H new ATOM 1945 N THR A 122 0.248 2.213 5.177 1.00 0.00 N ATOM 1946 CA THR A 122 1.676 1.806 5.017 1.00 0.00 C ATOM 1947 C THR A 122 1.754 0.685 3.982 1.00 0.00 C ATOM 1948 O THR A 122 0.795 -0.010 3.749 1.00 0.00 O ATOM 1949 CB THR A 122 2.181 1.246 6.339 1.00 0.00 C ATOM 1950 OG1 THR A 122 1.942 2.181 7.381 1.00 0.00 O ATOM 1951 CG2 THR A 122 3.674 0.946 6.240 1.00 0.00 C ATOM 0 H THR A 122 -0.295 1.602 5.786 1.00 0.00 H new ATOM 0 HA THR A 122 2.270 2.666 4.708 1.00 0.00 H new ATOM 0 HB THR A 122 1.648 0.322 6.562 1.00 0.00 H new ATOM 0 HG1 THR A 122 2.267 1.815 8.230 1.00 0.00 H new ATOM 0 HG21 THR A 122 4.028 0.546 7.190 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.847 0.214 5.451 1.00 0.00 H new ATOM 0 HG23 THR A 122 4.215 1.864 6.009 1.00 0.00 H new ATOM 1959 N MET A 123 2.892 0.477 3.392 1.00 0.00 N ATOM 1960 CA MET A 123 3.021 -0.633 2.400 1.00 0.00 C ATOM 1961 C MET A 123 4.488 -1.012 2.255 1.00 0.00 C ATOM 1962 O MET A 123 5.216 -0.434 1.471 1.00 0.00 O ATOM 1963 CB MET A 123 2.456 -0.202 1.048 1.00 0.00 C ATOM 1964 CG MET A 123 2.452 -1.401 0.089 1.00 0.00 C ATOM 1965 SD MET A 123 3.769 -1.221 -1.144 1.00 0.00 S ATOM 1966 CE MET A 123 3.930 -2.974 -1.562 1.00 0.00 C ATOM 0 H MET A 123 3.740 1.022 3.549 1.00 0.00 H new ATOM 0 HA MET A 123 2.456 -1.496 2.752 1.00 0.00 H new ATOM 0 HB2 MET A 123 1.443 0.182 1.171 1.00 0.00 H new ATOM 0 HB3 MET A 123 3.056 0.608 0.633 1.00 0.00 H new ATOM 0 HG2 MET A 123 2.593 -2.325 0.650 1.00 0.00 H new ATOM 0 HG3 MET A 123 1.485 -1.474 -0.409 1.00 0.00 H new ATOM 0 HE1 MET A 123 4.861 -3.134 -2.106 1.00 0.00 H new ATOM 0 HE2 MET A 123 3.938 -3.567 -0.647 1.00 0.00 H new ATOM 0 HE3 MET A 123 3.089 -3.278 -2.185 1.00 0.00 H new ATOM 1976 N THR A 124 4.925 -1.974 3.021 1.00 0.00 N ATOM 1977 CA THR A 124 6.357 -2.391 2.958 1.00 0.00 C ATOM 1978 C THR A 124 6.639 -3.128 1.666 1.00 0.00 C ATOM 1979 O THR A 124 5.742 -3.497 0.931 1.00 0.00 O ATOM 1980 CB THR A 124 6.747 -3.291 4.154 1.00 0.00 C ATOM 1981 OG1 THR A 124 6.551 -4.664 3.831 1.00 0.00 O ATOM 1982 CG2 THR A 124 5.925 -2.955 5.401 1.00 0.00 C ATOM 0 H THR A 124 4.353 -2.490 3.689 1.00 0.00 H new ATOM 0 HA THR A 124 6.957 -1.482 3.002 1.00 0.00 H new ATOM 0 HB THR A 124 7.800 -3.106 4.365 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.662 -4.947 4.132 1.00 0.00 H new ATOM 0 HG21 THR A 124 6.226 -3.607 6.221 1.00 0.00 H new ATOM 0 HG22 THR A 124 6.097 -1.916 5.681 1.00 0.00 H new ATOM 0 HG23 THR A 124 4.866 -3.103 5.189 1.00 0.00 H new ATOM 1990 N ALA A 125 7.898 -3.347 1.396 1.00 0.00 N ATOM 1991 CA ALA A 125 8.268 -4.070 0.149 1.00 0.00 C ATOM 1992 C ALA A 125 9.772 -4.326 0.062 1.00 0.00 C ATOM 1993 O ALA A 125 10.544 -3.454 -0.279 1.00 0.00 O ATOM 1994 CB ALA A 125 7.833 -3.253 -1.063 1.00 0.00 C ATOM 0 H ALA A 125 8.681 -3.058 1.982 1.00 0.00 H new ATOM 0 HA ALA A 125 7.760 -5.034 0.165 1.00 0.00 H new ATOM 0 HB1 ALA A 125 8.104 -3.783 -1.976 1.00 0.00 H new ATOM 0 HB2 ALA A 125 6.753 -3.108 -1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 125 8.330 -2.283 -1.045 1.00 0.00 H new ATOM 2000 N ASP A 126 10.195 -5.535 0.326 1.00 0.00 N ATOM 2001 CA ASP A 126 11.652 -5.857 0.232 1.00 0.00 C ATOM 2002 C ASP A 126 12.419 -5.062 1.294 1.00 0.00 C ATOM 2003 O ASP A 126 13.553 -4.678 1.088 1.00 0.00 O ATOM 2004 CB ASP A 126 12.175 -5.494 -1.165 1.00 0.00 C ATOM 2005 CG ASP A 126 12.740 -6.740 -1.854 1.00 0.00 C ATOM 2006 OD1 ASP A 126 11.982 -7.673 -2.063 1.00 0.00 O ATOM 2007 OD2 ASP A 126 13.921 -6.739 -2.161 1.00 0.00 O ATOM 0 H ASP A 126 9.596 -6.313 0.602 1.00 0.00 H new ATOM 0 HA ASP A 126 11.799 -6.924 0.401 1.00 0.00 H new ATOM 0 HB2 ASP A 126 11.370 -5.071 -1.765 1.00 0.00 H new ATOM 0 HB3 ASP A 126 12.949 -4.730 -1.085 1.00 0.00 H new ATOM 2012 N ASP A 127 11.783 -4.832 2.423 1.00 0.00 N ATOM 2013 CA ASP A 127 12.390 -4.079 3.584 1.00 0.00 C ATOM 2014 C ASP A 127 12.047 -2.592 3.509 1.00 0.00 C ATOM 2015 O ASP A 127 12.301 -1.856 4.446 1.00 0.00 O ATOM 2016 CB ASP A 127 13.915 -4.246 3.655 1.00 0.00 C ATOM 2017 CG ASP A 127 14.384 -4.077 5.102 1.00 0.00 C ATOM 2018 OD1 ASP A 127 14.224 -5.012 5.869 1.00 0.00 O ATOM 2019 OD2 ASP A 127 14.894 -3.015 5.418 1.00 0.00 O ATOM 0 H ASP A 127 10.829 -5.147 2.597 1.00 0.00 H new ATOM 0 HA ASP A 127 11.960 -4.509 4.489 1.00 0.00 H new ATOM 0 HB2 ASP A 127 14.201 -5.230 3.282 1.00 0.00 H new ATOM 0 HB3 ASP A 127 14.402 -3.509 3.016 1.00 0.00 H new ATOM 2024 N VAL A 128 11.457 -2.135 2.429 1.00 0.00 N ATOM 2025 CA VAL A 128 11.094 -0.704 2.344 1.00 0.00 C ATOM 2026 C VAL A 128 9.759 -0.513 3.058 1.00 0.00 C ATOM 2027 O VAL A 128 9.134 -1.467 3.472 1.00 0.00 O ATOM 2028 CB VAL A 128 10.969 -0.288 0.866 1.00 0.00 C ATOM 2029 CG1 VAL A 128 12.225 -0.705 0.096 1.00 0.00 C ATOM 2030 CG2 VAL A 128 9.750 -0.950 0.224 1.00 0.00 C ATOM 0 H VAL A 128 11.216 -2.696 1.612 1.00 0.00 H new ATOM 0 HA VAL A 128 11.860 -0.086 2.812 1.00 0.00 H new ATOM 0 HB VAL A 128 10.854 0.795 0.825 1.00 0.00 H new ATOM 0 HG11 VAL A 128 12.128 -0.407 -0.948 1.00 0.00 H new ATOM 0 HG12 VAL A 128 13.097 -0.219 0.532 1.00 0.00 H new ATOM 0 HG13 VAL A 128 12.345 -1.787 0.155 1.00 0.00 H new ATOM 0 HG21 VAL A 128 9.678 -0.645 -0.820 1.00 0.00 H new ATOM 0 HG22 VAL A 128 9.853 -2.034 0.279 1.00 0.00 H new ATOM 0 HG23 VAL A 128 8.848 -0.644 0.755 1.00 0.00 H new ATOM 2040 N VAL A 129 9.317 0.701 3.179 1.00 0.00 N ATOM 2041 CA VAL A 129 8.009 0.958 3.830 1.00 0.00 C ATOM 2042 C VAL A 129 7.460 2.299 3.345 1.00 0.00 C ATOM 2043 O VAL A 129 8.029 3.349 3.575 1.00 0.00 O ATOM 2044 CB VAL A 129 8.168 0.880 5.370 1.00 0.00 C ATOM 2045 CG1 VAL A 129 7.341 1.961 6.102 1.00 0.00 C ATOM 2046 CG2 VAL A 129 7.704 -0.510 5.838 1.00 0.00 C ATOM 0 H VAL A 129 9.809 1.533 2.853 1.00 0.00 H new ATOM 0 HA VAL A 129 7.281 0.196 3.554 1.00 0.00 H new ATOM 0 HB VAL A 129 9.217 1.052 5.611 1.00 0.00 H new ATOM 0 HG11 VAL A 129 7.486 1.864 7.178 1.00 0.00 H new ATOM 0 HG12 VAL A 129 7.668 2.950 5.779 1.00 0.00 H new ATOM 0 HG13 VAL A 129 6.285 1.833 5.866 1.00 0.00 H new ATOM 0 HG21 VAL A 129 7.809 -0.583 6.920 1.00 0.00 H new ATOM 0 HG22 VAL A 129 6.659 -0.656 5.564 1.00 0.00 H new ATOM 0 HG23 VAL A 129 8.315 -1.277 5.362 1.00 0.00 H new ATOM 2056 N CYS A 130 6.341 2.245 2.685 1.00 0.00 N ATOM 2057 CA CYS A 130 5.699 3.487 2.175 1.00 0.00 C ATOM 2058 C CYS A 130 4.622 3.917 3.167 1.00 0.00 C ATOM 2059 O CYS A 130 3.477 3.521 3.060 1.00 0.00 O ATOM 2060 CB CYS A 130 5.061 3.213 0.811 1.00 0.00 C ATOM 2061 SG CYS A 130 4.507 4.774 0.081 1.00 0.00 S ATOM 0 H CYS A 130 5.837 1.384 2.474 1.00 0.00 H new ATOM 0 HA CYS A 130 6.444 4.275 2.066 1.00 0.00 H new ATOM 0 HB2 CYS A 130 5.780 2.726 0.152 1.00 0.00 H new ATOM 0 HB3 CYS A 130 4.218 2.531 0.922 1.00 0.00 H new ATOM 0 HG CYS A 130 3.967 4.543 -1.079 1.00 0.00 H new ATOM 2067 N THR A 131 4.988 4.712 4.140 1.00 0.00 N ATOM 2068 CA THR A 131 3.996 5.165 5.157 1.00 0.00 C ATOM 2069 C THR A 131 3.602 6.614 4.885 1.00 0.00 C ATOM 2070 O THR A 131 4.397 7.522 5.038 1.00 0.00 O ATOM 2071 CB THR A 131 4.616 5.068 6.552 1.00 0.00 C ATOM 2072 OG1 THR A 131 5.405 3.890 6.640 1.00 0.00 O ATOM 2073 CG2 THR A 131 3.505 5.023 7.602 1.00 0.00 C ATOM 0 H THR A 131 5.935 5.067 4.273 1.00 0.00 H new ATOM 0 HA THR A 131 3.111 4.531 5.101 1.00 0.00 H new ATOM 0 HB THR A 131 5.247 5.939 6.731 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.803 3.829 7.533 1.00 0.00 H new ATOM 0 HG21 THR A 131 3.947 4.954 8.596 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.903 5.929 7.534 1.00 0.00 H new ATOM 0 HG23 THR A 131 2.872 4.153 7.425 1.00 0.00 H new ATOM 2081 N ARG A 132 2.376 6.833 4.494 1.00 0.00 N ATOM 2082 CA ARG A 132 1.910 8.226 4.220 1.00 0.00 C ATOM 2083 C ARG A 132 0.493 8.387 4.757 1.00 0.00 C ATOM 2084 O ARG A 132 -0.341 7.513 4.605 1.00 0.00 O ATOM 2085 CB ARG A 132 1.928 8.535 2.710 1.00 0.00 C ATOM 2086 CG ARG A 132 1.627 7.281 1.884 1.00 0.00 C ATOM 2087 CD ARG A 132 1.371 7.685 0.433 1.00 0.00 C ATOM 2088 NE ARG A 132 1.399 6.474 -0.434 1.00 0.00 N ATOM 2089 CZ ARG A 132 1.747 6.577 -1.688 1.00 0.00 C ATOM 2090 NH1 ARG A 132 2.955 6.961 -2.000 1.00 0.00 N ATOM 2091 NH2 ARG A 132 0.888 6.297 -2.629 1.00 0.00 N ATOM 0 H ARG A 132 1.674 6.107 4.352 1.00 0.00 H new ATOM 0 HA ARG A 132 2.586 8.924 4.715 1.00 0.00 H new ATOM 0 HB2 ARG A 132 1.192 9.307 2.485 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.903 8.933 2.429 1.00 0.00 H new ATOM 0 HG2 ARG A 132 2.465 6.586 1.938 1.00 0.00 H new ATOM 0 HG3 ARG A 132 0.757 6.764 2.289 1.00 0.00 H new ATOM 0 HD2 ARG A 132 0.405 8.183 0.348 1.00 0.00 H new ATOM 0 HD3 ARG A 132 2.127 8.398 0.104 1.00 0.00 H new ATOM 0 HE ARG A 132 1.146 5.564 -0.048 1.00 0.00 H new ATOM 0 HH11 ARG A 132 3.626 7.180 -1.264 1.00 0.00 H new ATOM 0 HH12 ARG A 132 3.227 7.042 -2.980 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -0.056 5.997 -2.385 1.00 0.00 H new ATOM 0 HH22 ARG A 132 1.160 6.378 -3.609 1.00 0.00 H new ATOM 2105 N VAL A 133 0.216 9.499 5.387 1.00 0.00 N ATOM 2106 CA VAL A 133 -1.146 9.724 5.941 1.00 0.00 C ATOM 2107 C VAL A 133 -2.065 10.188 4.818 1.00 0.00 C ATOM 2108 O VAL A 133 -1.629 10.744 3.836 1.00 0.00 O ATOM 2109 CB VAL A 133 -1.078 10.790 7.049 1.00 0.00 C ATOM 2110 CG1 VAL A 133 -2.490 11.184 7.496 1.00 0.00 C ATOM 2111 CG2 VAL A 133 -0.309 10.224 8.244 1.00 0.00 C ATOM 0 H VAL A 133 0.877 10.260 5.540 1.00 0.00 H new ATOM 0 HA VAL A 133 -1.536 8.799 6.367 1.00 0.00 H new ATOM 0 HB VAL A 133 -0.570 11.674 6.662 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -2.426 11.939 8.280 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -3.041 11.589 6.647 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -3.009 10.305 7.880 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -0.258 10.975 9.032 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.821 9.338 8.620 1.00 0.00 H new ATOM 0 HG23 VAL A 133 0.700 9.955 7.933 1.00 0.00 H new ATOM 2121 N TYR A 134 -3.337 9.968 4.977 1.00 0.00 N ATOM 2122 CA TYR A 134 -4.309 10.402 3.946 1.00 0.00 C ATOM 2123 C TYR A 134 -5.460 11.123 4.628 1.00 0.00 C ATOM 2124 O TYR A 134 -5.577 11.126 5.837 1.00 0.00 O ATOM 2125 CB TYR A 134 -4.911 9.201 3.238 1.00 0.00 C ATOM 2126 CG TYR A 134 -3.911 8.552 2.329 1.00 0.00 C ATOM 2127 CD1 TYR A 134 -2.864 7.806 2.867 1.00 0.00 C ATOM 2128 CD2 TYR A 134 -4.050 8.674 0.944 1.00 0.00 C ATOM 2129 CE1 TYR A 134 -1.950 7.180 2.023 1.00 0.00 C ATOM 2130 CE2 TYR A 134 -3.134 8.052 0.095 1.00 0.00 C ATOM 2131 CZ TYR A 134 -2.081 7.302 0.633 1.00 0.00 C ATOM 2132 OH TYR A 134 -1.177 6.680 -0.204 1.00 0.00 O ATOM 0 H TYR A 134 -3.747 9.501 5.786 1.00 0.00 H new ATOM 0 HA TYR A 134 -3.787 11.041 3.234 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -5.260 8.478 3.975 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -5.782 9.514 2.662 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -2.761 7.713 3.938 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -4.866 9.249 0.531 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -1.140 6.600 2.440 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -3.237 8.149 -0.976 1.00 0.00 H new ATOM 0 HH TYR A 134 -1.413 6.866 -1.137 1.00 0.00 H new ATOM 2142 N VAL A 135 -6.337 11.681 3.850 1.00 0.00 N ATOM 2143 CA VAL A 135 -7.529 12.351 4.413 1.00 0.00 C ATOM 2144 C VAL A 135 -8.676 12.089 3.458 1.00 0.00 C ATOM 2145 O VAL A 135 -8.452 11.749 2.318 1.00 0.00 O ATOM 2146 CB VAL A 135 -7.296 13.836 4.540 1.00 0.00 C ATOM 2147 CG1 VAL A 135 -8.518 14.469 5.186 1.00 0.00 C ATOM 2148 CG2 VAL A 135 -6.074 14.068 5.417 1.00 0.00 C ATOM 0 H VAL A 135 -6.275 11.700 2.832 1.00 0.00 H new ATOM 0 HA VAL A 135 -7.748 11.966 5.409 1.00 0.00 H new ATOM 0 HB VAL A 135 -7.130 14.281 3.559 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -8.362 15.543 5.284 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -9.395 14.284 4.565 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -8.674 14.034 6.173 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -5.895 15.139 5.516 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -6.246 13.636 6.403 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -5.204 13.596 4.961 1.00 0.00 H new ATOM 2158 N ARG A 136 -9.890 12.222 3.891 1.00 0.00 N ATOM 2159 CA ARG A 136 -11.007 11.941 2.948 1.00 0.00 C ATOM 2160 C ARG A 136 -11.305 13.185 2.121 1.00 0.00 C ATOM 2161 O ARG A 136 -11.700 14.213 2.635 1.00 0.00 O ATOM 2162 CB ARG A 136 -12.275 11.488 3.676 1.00 0.00 C ATOM 2163 CG ARG A 136 -12.525 10.001 3.404 1.00 0.00 C ATOM 2164 CD ARG A 136 -13.465 9.432 4.468 1.00 0.00 C ATOM 2165 NE ARG A 136 -12.874 9.642 5.819 1.00 0.00 N ATOM 2166 CZ ARG A 136 -13.652 9.734 6.863 1.00 0.00 C ATOM 2167 NH1 ARG A 136 -14.650 10.575 6.861 1.00 0.00 N ATOM 2168 NH2 ARG A 136 -13.432 8.984 7.908 1.00 0.00 N ATOM 0 H ARG A 136 -10.159 12.506 4.833 1.00 0.00 H new ATOM 0 HA ARG A 136 -10.692 11.125 2.297 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -12.171 11.659 4.748 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -13.128 12.077 3.340 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -12.961 9.871 2.413 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -11.581 9.457 3.411 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -14.438 9.919 4.406 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -13.628 8.369 4.293 1.00 0.00 H new ATOM 0 HE ARG A 136 -11.862 9.714 5.928 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -14.822 11.160 6.044 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -15.258 10.647 7.677 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -12.652 8.326 7.909 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -14.040 9.056 8.724 1.00 0.00 H new ATOM 2182 N GLU A 137 -11.114 13.079 0.836 1.00 0.00 N ATOM 2183 CA GLU A 137 -11.374 14.224 -0.096 1.00 0.00 C ATOM 2184 C GLU A 137 -12.722 14.893 0.215 1.00 0.00 C ATOM 2185 O GLU A 137 -13.742 14.282 -0.058 1.00 0.00 O ATOM 2186 CB GLU A 137 -11.409 13.698 -1.531 1.00 0.00 C ATOM 2187 CG GLU A 137 -11.346 14.874 -2.512 1.00 0.00 C ATOM 2188 CD GLU A 137 -12.741 15.151 -3.080 1.00 0.00 C ATOM 2189 OE1 GLU A 137 -13.431 14.196 -3.396 1.00 0.00 O ATOM 2190 OE2 GLU A 137 -13.095 16.313 -3.188 1.00 0.00 O ATOM 2191 OXT GLU A 137 -12.708 16.004 0.720 1.00 0.00 O ATOM 0 H GLU A 137 -10.781 12.230 0.378 1.00 0.00 H new ATOM 0 HA GLU A 137 -10.579 14.959 0.029 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -10.570 13.023 -1.702 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -12.320 13.122 -1.696 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -10.967 15.762 -2.006 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -10.652 14.647 -3.321 1.00 0.00 H new