USER MOD reduce.3.24.130724 H: found=0, std=0, add=920, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 918 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 116 TYR OH : rot 180:sc= 0.00775 USER MOD Set 1.2: A 117 GLN : amide:sc= -0.218 K(o=-0.21,f=-2.2) USER MOD Set 2.1: A 110 GLN : amide:sc= -1.46 K(o=-2,f=-5.3!) USER MOD Set 2.2: A 113 GLN : amide:sc= -0.531 K(o=-2,f=-5!) USER MOD Set 3.1: A 46 THR OG1 : rot 41:sc= -1! USER MOD Set 3.2: A 47 HIS : no HD1:sc= -3.61! C(o=-5.9!,f=-19!) USER MOD Set 3.3: A 50 GLN : amide:sc= -1.29 K(o=-5.9,f=-7.8) USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 CYS SG : rot 148:sc= 1.13 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.125 USER MOD Single : A 18 GLN : amide:sc= -0.279 K(o=-0.28,f=-1.3) USER MOD Single : A 20 CYS SG : rot 180:sc= -3.21! USER MOD Single : A 21 GLN : amide:sc= -7.19! C(o=-7.2!,f=-10!) USER MOD Single : A 25 SER OG : rot 27:sc= 0.531! USER MOD Single : A 29 TYR OH : rot 70:sc= -1.46 USER MOD Single : A 30 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.0031) USER MOD Single : A 32 GLN : amide:sc= -0.0638 X(o=-0.064,f=-0.083) USER MOD Single : A 34 CYS SG : rot 100:sc= -2.17 USER MOD Single : A 36 SER OG : rot 168:sc= 0.475 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= -2.3! USER MOD Single : A 45 GLN : amide:sc= -3.16! C(o=-3.2!,f=-9.2!) USER MOD Single : A 53 CYS SG : rot 45:sc= -1.18! USER MOD Single : A 60 ASN : amide:sc= -0.0535 K(o=-0.054,f=-2.5!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.14 X(o=-0.14,f=-0.14) USER MOD Single : A 69 GLN : amide:sc= -0.152 K(o=-0.15,f=-1.4!) USER MOD Single : A 71 CYS SG : rot 32:sc= -3.89! USER MOD Single : A 99 TYR OH : rot -2:sc= 0.121 USER MOD Single : A 100 HIS : +bothHN:sc= -14.4! C(o=-14!,f=-18!) USER MOD Single : A 101 SER OG : rot 180:sc= -0.642 USER MOD Single : A 105 HIS :FLIP no HD1:sc= -0.148 F(o=-1.7,f=-0.15) USER MOD Single : A 109 HIS : no HD1:sc= -2.81! C(o=-2.8!,f=-2.3!) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.0336 USER MOD Single : A 134 MET CE :methyl -102:sc= 0 (180deg=-0.0561) USER MOD ----------------------------------------------------------------- ATOM 50 N GLN A 4 3.579 5.279 15.362 1.00 0.00 N ATOM 51 CA GLN A 4 4.271 4.408 14.370 1.00 0.00 C ATOM 52 C GLN A 4 3.365 4.163 13.164 1.00 0.00 C ATOM 53 O GLN A 4 2.154 4.186 13.272 1.00 0.00 O ATOM 54 CB GLN A 4 4.560 3.100 15.107 1.00 0.00 C ATOM 55 CG GLN A 4 5.455 3.381 16.317 1.00 0.00 C ATOM 56 CD GLN A 4 6.138 2.084 16.758 1.00 0.00 C ATOM 57 OE1 GLN A 4 5.489 1.174 17.232 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.432 1.961 16.616 1.00 0.00 N ATOM 0 HA GLN A 4 5.187 4.863 13.992 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.627 2.639 15.431 1.00 0.00 H new ATOM 0 HB3 GLN A 4 5.049 2.393 14.437 1.00 0.00 H new ATOM 0 HG2 GLN A 4 6.204 4.131 16.063 1.00 0.00 H new ATOM 0 HG3 GLN A 4 4.861 3.788 17.135 1.00 0.00 H new ATOM 0 HE21 GLN A 4 7.976 2.726 16.218 1.00 0.00 H new ATOM 0 HE22 GLN A 4 7.897 1.100 16.904 1.00 0.00 H new ATOM 67 N ILE A 5 3.938 3.932 12.015 1.00 0.00 N ATOM 68 CA ILE A 5 3.108 3.686 10.800 1.00 0.00 C ATOM 69 C ILE A 5 3.180 2.214 10.397 1.00 0.00 C ATOM 70 O ILE A 5 4.249 1.642 10.310 1.00 0.00 O ATOM 71 CB ILE A 5 3.735 4.541 9.697 1.00 0.00 C ATOM 72 CG1 ILE A 5 3.689 6.023 10.079 1.00 0.00 C ATOM 73 CG2 ILE A 5 2.961 4.323 8.395 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.616 6.810 9.150 1.00 0.00 C ATOM 0 H ILE A 5 4.946 3.903 11.864 1.00 0.00 H new ATOM 0 HA ILE A 5 2.061 3.934 10.976 1.00 0.00 H new ATOM 0 HB ILE A 5 4.776 4.247 9.565 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.669 6.400 10.000 1.00 0.00 H new ATOM 0 HG13 ILE A 5 3.997 6.153 11.116 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.402 4.929 7.604 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.009 3.271 8.115 1.00 0.00 H new ATOM 0 HG23 ILE A 5 1.920 4.614 8.537 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.588 7.866 9.417 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.635 6.437 9.252 1.00 0.00 H new ATOM 0 HD13 ILE A 5 4.286 6.688 8.118 1.00 0.00 H new ATOM 86 N ALA A 6 2.068 1.594 10.124 1.00 0.00 N ATOM 87 CA ALA A 6 2.119 0.174 9.703 1.00 0.00 C ATOM 88 C ALA A 6 2.251 0.116 8.188 1.00 0.00 C ATOM 89 O ALA A 6 1.340 0.460 7.462 1.00 0.00 O ATOM 90 CB ALA A 6 0.803 -0.442 10.158 1.00 0.00 C ATOM 0 H ALA A 6 1.136 2.006 10.174 1.00 0.00 H new ATOM 0 HA ALA A 6 2.965 -0.363 10.133 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.777 -1.495 9.876 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.715 -0.354 11.241 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.027 0.081 9.683 1.00 0.00 H new ATOM 96 N ILE A 7 3.383 -0.297 7.705 1.00 0.00 N ATOM 97 CA ILE A 7 3.569 -0.357 6.232 1.00 0.00 C ATOM 98 C ILE A 7 3.863 -1.787 5.791 1.00 0.00 C ATOM 99 O ILE A 7 4.863 -2.371 6.157 1.00 0.00 O ATOM 100 CB ILE A 7 4.759 0.559 5.945 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.449 1.960 6.477 1.00 0.00 C ATOM 102 CG2 ILE A 7 5.001 0.627 4.437 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.498 2.951 5.970 1.00 0.00 C ATOM 0 H ILE A 7 4.185 -0.595 8.261 1.00 0.00 H new ATOM 0 HA ILE A 7 2.677 -0.043 5.690 1.00 0.00 H new ATOM 0 HB ILE A 7 5.651 0.168 6.434 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.456 2.270 6.153 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.440 1.951 7.567 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.850 1.280 4.234 1.00 0.00 H new ATOM 0 HG22 ILE A 7 5.213 -0.372 4.057 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.113 1.022 3.943 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.272 3.947 6.352 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.485 2.645 6.316 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.485 2.969 4.880 1.00 0.00 H new ATOM 115 N CYS A 8 2.997 -2.351 4.996 1.00 0.00 N ATOM 116 CA CYS A 8 3.222 -3.741 4.520 1.00 0.00 C ATOM 117 C CYS A 8 3.708 -3.714 3.079 1.00 0.00 C ATOM 118 O CYS A 8 3.119 -3.077 2.228 1.00 0.00 O ATOM 119 CB CYS A 8 1.862 -4.428 4.621 1.00 0.00 C ATOM 120 SG CYS A 8 2.080 -6.220 4.495 1.00 0.00 S ATOM 0 H CYS A 8 2.143 -1.908 4.656 1.00 0.00 H new ATOM 0 HA CYS A 8 3.976 -4.266 5.106 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.384 -4.175 5.567 1.00 0.00 H new ATOM 0 HB3 CYS A 8 1.204 -4.074 3.827 1.00 0.00 H new ATOM 0 HG CYS A 8 1.177 -6.819 5.213 1.00 0.00 H new ATOM 126 N ILE A 9 4.786 -4.385 2.797 1.00 0.00 N ATOM 127 CA ILE A 9 5.310 -4.377 1.406 1.00 0.00 C ATOM 128 C ILE A 9 5.277 -5.765 0.795 1.00 0.00 C ATOM 129 O ILE A 9 5.539 -6.755 1.450 1.00 0.00 O ATOM 130 CB ILE A 9 6.760 -3.939 1.533 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.436 -4.006 0.160 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.474 -4.887 2.485 1.00 0.00 C ATOM 133 CD1 ILE A 9 8.861 -3.462 0.264 1.00 0.00 C ATOM 0 H ILE A 9 5.325 -4.936 3.465 1.00 0.00 H new ATOM 0 HA ILE A 9 4.712 -3.725 0.770 1.00 0.00 H new ATOM 0 HB ILE A 9 6.806 -2.918 1.912 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.454 -5.035 -0.198 1.00 0.00 H new ATOM 0 HG13 ILE A 9 6.866 -3.426 -0.566 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.516 -4.585 2.586 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.991 -4.854 3.461 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.427 -5.902 2.091 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.341 -3.510 -0.713 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.831 -2.427 0.603 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.428 -4.061 0.977 1.00 0.00 H new ATOM 145 N TRP A 10 5.014 -5.842 -0.472 1.00 0.00 N ATOM 146 CA TRP A 10 5.033 -7.166 -1.134 1.00 0.00 C ATOM 147 C TRP A 10 6.144 -7.186 -2.174 1.00 0.00 C ATOM 148 O TRP A 10 6.035 -6.585 -3.224 1.00 0.00 O ATOM 149 CB TRP A 10 3.690 -7.362 -1.820 1.00 0.00 C ATOM 150 CG TRP A 10 3.776 -8.617 -2.633 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.724 -9.577 -2.478 1.00 0.00 C ATOM 152 CD2 TRP A 10 2.921 -9.066 -3.718 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.510 -10.576 -3.405 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.407 -10.312 -4.189 1.00 0.00 C ATOM 155 CE3 TRP A 10 1.786 -8.522 -4.335 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.785 -10.990 -5.233 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.158 -9.203 -5.386 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.656 -10.434 -5.835 1.00 0.00 C ATOM 0 H TRP A 10 4.788 -5.051 -1.075 1.00 0.00 H new ATOM 0 HA TRP A 10 5.208 -7.960 -0.408 1.00 0.00 H new ATOM 0 HB2 TRP A 10 2.891 -7.437 -1.083 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.457 -6.508 -2.457 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.518 -9.561 -1.746 1.00 0.00 H new ATOM 0 HE1 TRP A 10 5.095 -11.406 -3.499 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.394 -7.574 -3.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 3.173 -11.938 -5.574 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.283 -8.776 -5.854 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.166 -10.952 -6.646 1.00 0.00 H new ATOM 169 N VAL A 11 7.212 -7.858 -1.891 1.00 0.00 N ATOM 170 CA VAL A 11 8.332 -7.903 -2.859 1.00 0.00 C ATOM 171 C VAL A 11 9.120 -9.199 -2.666 1.00 0.00 C ATOM 172 O VAL A 11 9.413 -9.596 -1.556 1.00 0.00 O ATOM 173 CB VAL A 11 9.164 -6.677 -2.504 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.446 -6.689 -1.005 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.478 -6.693 -3.284 1.00 0.00 C ATOM 0 H VAL A 11 7.361 -8.381 -1.028 1.00 0.00 H new ATOM 0 HA VAL A 11 8.018 -7.890 -3.903 1.00 0.00 H new ATOM 0 HB VAL A 11 8.616 -5.772 -2.767 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.041 -5.815 -0.740 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.504 -6.666 -0.457 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.995 -7.594 -0.745 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.066 -5.813 -3.024 1.00 0.00 H new ATOM 0 HG22 VAL A 11 11.040 -7.592 -3.032 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.267 -6.685 -4.353 1.00 0.00 H new ATOM 185 N GLU A 12 9.438 -9.876 -3.732 1.00 0.00 N ATOM 186 CA GLU A 12 10.179 -11.162 -3.603 1.00 0.00 C ATOM 187 C GLU A 12 11.697 -10.939 -3.603 1.00 0.00 C ATOM 188 O GLU A 12 12.451 -11.786 -3.164 1.00 0.00 O ATOM 189 CB GLU A 12 9.738 -11.972 -4.818 1.00 0.00 C ATOM 190 CG GLU A 12 8.375 -12.607 -4.537 1.00 0.00 C ATOM 191 CD GLU A 12 7.905 -13.379 -5.771 1.00 0.00 C ATOM 192 OE1 GLU A 12 7.931 -12.805 -6.848 1.00 0.00 O ATOM 193 OE2 GLU A 12 7.530 -14.529 -5.620 1.00 0.00 O ATOM 0 H GLU A 12 9.217 -9.595 -4.688 1.00 0.00 H new ATOM 0 HA GLU A 12 9.963 -11.670 -2.663 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.678 -11.328 -5.696 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.473 -12.746 -5.040 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.445 -13.278 -3.681 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.649 -11.836 -4.280 1.00 0.00 H new ATOM 200 N SER A 13 12.157 -9.812 -4.071 1.00 0.00 N ATOM 201 CA SER A 13 13.628 -9.559 -4.067 1.00 0.00 C ATOM 202 C SER A 13 14.026 -8.914 -2.738 1.00 0.00 C ATOM 203 O SER A 13 13.450 -7.930 -2.323 1.00 0.00 O ATOM 204 CB SER A 13 13.875 -8.593 -5.224 1.00 0.00 C ATOM 205 OG SER A 13 15.184 -8.804 -5.740 1.00 0.00 O ATOM 0 H SER A 13 11.584 -9.060 -4.454 1.00 0.00 H new ATOM 0 HA SER A 13 14.211 -10.473 -4.179 1.00 0.00 H new ATOM 0 HB2 SER A 13 13.133 -8.748 -6.007 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.768 -7.563 -4.883 1.00 0.00 H new ATOM 0 HG SER A 13 15.346 -8.187 -6.484 1.00 0.00 H new ATOM 211 N THR A 14 14.998 -9.462 -2.057 1.00 0.00 N ATOM 212 CA THR A 14 15.409 -8.870 -0.751 1.00 0.00 C ATOM 213 C THR A 14 15.899 -7.435 -0.949 1.00 0.00 C ATOM 214 O THR A 14 15.499 -6.531 -0.242 1.00 0.00 O ATOM 215 CB THR A 14 16.547 -9.757 -0.242 1.00 0.00 C ATOM 216 OG1 THR A 14 16.339 -11.093 -0.681 1.00 0.00 O ATOM 217 CG2 THR A 14 16.573 -9.721 1.287 1.00 0.00 C ATOM 0 H THR A 14 15.522 -10.288 -2.346 1.00 0.00 H new ATOM 0 HA THR A 14 14.580 -8.830 -0.044 1.00 0.00 H new ATOM 0 HB THR A 14 17.497 -9.391 -0.632 1.00 0.00 H new ATOM 0 HG1 THR A 14 17.069 -11.661 -0.357 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.383 -10.352 1.652 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.731 -8.697 1.624 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.623 -10.088 1.676 1.00 0.00 H new ATOM 225 N ALA A 15 16.763 -7.217 -1.905 1.00 0.00 N ATOM 226 CA ALA A 15 17.276 -5.836 -2.139 1.00 0.00 C ATOM 227 C ALA A 15 16.106 -4.854 -2.233 1.00 0.00 C ATOM 228 O ALA A 15 16.086 -3.841 -1.565 1.00 0.00 O ATOM 229 CB ALA A 15 18.037 -5.906 -3.463 1.00 0.00 C ATOM 0 H ALA A 15 17.134 -7.932 -2.531 1.00 0.00 H new ATOM 0 HA ALA A 15 17.918 -5.489 -1.329 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.444 -4.923 -3.701 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.852 -6.625 -3.377 1.00 0.00 H new ATOM 0 HB3 ALA A 15 17.359 -6.220 -4.256 1.00 0.00 H new ATOM 235 N ILE A 16 15.120 -5.149 -3.039 1.00 0.00 N ATOM 236 CA ILE A 16 13.951 -4.227 -3.133 1.00 0.00 C ATOM 237 C ILE A 16 13.271 -4.163 -1.770 1.00 0.00 C ATOM 238 O ILE A 16 13.025 -3.101 -1.234 1.00 0.00 O ATOM 239 CB ILE A 16 13.025 -4.859 -4.167 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.698 -4.830 -5.540 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.715 -4.072 -4.222 1.00 0.00 C ATOM 242 CD1 ILE A 16 13.010 -5.835 -6.466 1.00 0.00 C ATOM 0 H ILE A 16 15.073 -5.979 -3.630 1.00 0.00 H new ATOM 0 HA ILE A 16 14.227 -3.212 -3.419 1.00 0.00 H new ATOM 0 HB ILE A 16 12.817 -5.892 -3.888 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.639 -3.828 -5.965 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.756 -5.073 -5.444 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.051 -4.522 -4.960 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.236 -4.093 -3.243 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.922 -3.039 -4.502 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.489 -5.815 -7.445 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.092 -6.836 -6.042 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.958 -5.571 -6.572 1.00 0.00 H new ATOM 254 N LEU A 17 12.990 -5.300 -1.194 1.00 0.00 N ATOM 255 CA LEU A 17 12.354 -5.314 0.147 1.00 0.00 C ATOM 256 C LEU A 17 13.221 -4.507 1.106 1.00 0.00 C ATOM 257 O LEU A 17 12.733 -3.710 1.882 1.00 0.00 O ATOM 258 CB LEU A 17 12.309 -6.796 0.539 1.00 0.00 C ATOM 259 CG LEU A 17 12.243 -6.960 2.063 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.647 -6.819 2.643 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.335 -5.893 2.676 1.00 0.00 C ATOM 0 H LEU A 17 13.175 -6.219 -1.597 1.00 0.00 H new ATOM 0 HA LEU A 17 11.357 -4.874 0.166 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.441 -7.271 0.081 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.192 -7.305 0.153 1.00 0.00 H new ATOM 0 HG LEU A 17 11.837 -7.945 2.296 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.607 -6.935 3.726 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.294 -7.587 2.220 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.045 -5.834 2.398 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.299 -6.023 3.758 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.728 -4.903 2.443 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.330 -5.991 2.265 1.00 0.00 H new ATOM 273 N GLN A 18 14.510 -4.689 1.038 1.00 0.00 N ATOM 274 CA GLN A 18 15.413 -3.912 1.923 1.00 0.00 C ATOM 275 C GLN A 18 15.432 -2.455 1.465 1.00 0.00 C ATOM 276 O GLN A 18 15.297 -1.542 2.254 1.00 0.00 O ATOM 277 CB GLN A 18 16.797 -4.542 1.745 1.00 0.00 C ATOM 278 CG GLN A 18 16.818 -5.947 2.348 1.00 0.00 C ATOM 279 CD GLN A 18 18.225 -6.530 2.228 1.00 0.00 C ATOM 280 OE1 GLN A 18 18.968 -6.177 1.333 1.00 0.00 O ATOM 281 NE2 GLN A 18 18.623 -7.417 3.099 1.00 0.00 N ATOM 0 H GLN A 18 14.974 -5.342 0.407 1.00 0.00 H new ATOM 0 HA GLN A 18 15.096 -3.931 2.966 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.050 -4.589 0.686 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.552 -3.920 2.226 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.516 -5.910 3.395 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.102 -6.587 1.832 1.00 0.00 H new ATOM 0 HE21 GLN A 18 17.998 -7.712 3.849 1.00 0.00 H new ATOM 0 HE22 GLN A 18 19.559 -7.816 3.030 1.00 0.00 H new ATOM 290 N ASP A 19 15.593 -2.234 0.190 1.00 0.00 N ATOM 291 CA ASP A 19 15.618 -0.837 -0.324 1.00 0.00 C ATOM 292 C ASP A 19 14.293 -0.137 -0.024 1.00 0.00 C ATOM 293 O ASP A 19 14.268 1.001 0.403 1.00 0.00 O ATOM 294 CB ASP A 19 15.829 -0.972 -1.833 1.00 0.00 C ATOM 295 CG ASP A 19 17.251 -1.463 -2.107 1.00 0.00 C ATOM 296 OD1 ASP A 19 17.822 -2.088 -1.227 1.00 0.00 O ATOM 297 OD2 ASP A 19 17.748 -1.205 -3.191 1.00 0.00 O ATOM 0 H ASP A 19 15.708 -2.960 -0.517 1.00 0.00 H new ATOM 0 HA ASP A 19 16.401 -0.240 0.143 1.00 0.00 H new ATOM 0 HB2 ASP A 19 15.105 -1.671 -2.251 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.664 -0.012 -2.321 1.00 0.00 H new ATOM 302 N CYS A 20 13.189 -0.803 -0.233 1.00 0.00 N ATOM 303 CA CYS A 20 11.878 -0.158 0.059 1.00 0.00 C ATOM 304 C CYS A 20 11.751 0.090 1.561 1.00 0.00 C ATOM 305 O CYS A 20 11.307 1.135 1.993 1.00 0.00 O ATOM 306 CB CYS A 20 10.818 -1.156 -0.403 1.00 0.00 C ATOM 307 SG CYS A 20 10.665 -1.082 -2.205 1.00 0.00 S ATOM 0 H CYS A 20 13.138 -1.757 -0.590 1.00 0.00 H new ATOM 0 HA CYS A 20 11.771 0.803 -0.445 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.092 -2.164 -0.092 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.860 -0.927 0.064 1.00 0.00 H new ATOM 0 HG CYS A 20 9.765 -1.933 -2.599 1.00 0.00 H new ATOM 313 N GLN A 21 12.150 -0.862 2.362 1.00 0.00 N ATOM 314 CA GLN A 21 12.061 -0.670 3.832 1.00 0.00 C ATOM 315 C GLN A 21 13.173 0.267 4.296 1.00 0.00 C ATOM 316 O GLN A 21 12.974 1.116 5.143 1.00 0.00 O ATOM 317 CB GLN A 21 12.252 -2.060 4.430 1.00 0.00 C ATOM 318 CG GLN A 21 11.030 -2.925 4.124 1.00 0.00 C ATOM 319 CD GLN A 21 11.008 -4.124 5.073 1.00 0.00 C ATOM 320 OE1 GLN A 21 9.980 -4.738 5.269 1.00 0.00 O ATOM 321 NE2 GLN A 21 12.110 -4.487 5.672 1.00 0.00 N ATOM 0 H GLN A 21 12.531 -1.759 2.061 1.00 0.00 H new ATOM 0 HA GLN A 21 11.113 -0.227 4.137 1.00 0.00 H new ATOM 0 HB2 GLN A 21 13.149 -2.523 4.019 1.00 0.00 H new ATOM 0 HB3 GLN A 21 12.396 -1.986 5.508 1.00 0.00 H new ATOM 0 HG2 GLN A 21 10.118 -2.339 4.239 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.062 -3.266 3.089 1.00 0.00 H new ATOM 0 HE21 GLN A 21 12.974 -3.971 5.507 1.00 0.00 H new ATOM 0 HE22 GLN A 21 12.107 -5.287 6.305 1.00 0.00 H new ATOM 330 N ARG A 22 14.345 0.125 3.739 1.00 0.00 N ATOM 331 CA ARG A 22 15.468 1.011 4.142 1.00 0.00 C ATOM 332 C ARG A 22 14.990 2.453 4.157 1.00 0.00 C ATOM 333 O ARG A 22 15.097 3.145 5.150 1.00 0.00 O ATOM 334 CB ARG A 22 16.528 0.812 3.065 1.00 0.00 C ATOM 335 CG ARG A 22 17.377 -0.408 3.416 1.00 0.00 C ATOM 336 CD ARG A 22 18.189 -0.831 2.193 1.00 0.00 C ATOM 337 NE ARG A 22 19.553 -1.102 2.722 1.00 0.00 N ATOM 338 CZ ARG A 22 19.747 -2.091 3.555 1.00 0.00 C ATOM 339 NH1 ARG A 22 18.753 -2.856 3.915 1.00 0.00 N ATOM 340 NH2 ARG A 22 20.940 -2.317 4.031 1.00 0.00 N ATOM 0 H ARG A 22 14.571 -0.566 3.023 1.00 0.00 H new ATOM 0 HA ARG A 22 15.853 0.783 5.136 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.055 0.673 2.093 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.158 1.699 2.989 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.044 -0.174 4.246 1.00 0.00 H new ATOM 0 HG3 ARG A 22 16.737 -1.228 3.743 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.763 -1.717 1.722 1.00 0.00 H new ATOM 0 HD3 ARG A 22 18.206 -0.045 1.438 1.00 0.00 H new ATOM 0 HE ARG A 22 20.337 -0.516 2.435 1.00 0.00 H new ATOM 0 HH11 ARG A 22 17.818 -2.684 3.546 1.00 0.00 H new ATOM 0 HH12 ARG A 22 18.911 -3.626 4.565 1.00 0.00 H new ATOM 0 HH21 ARG A 22 21.721 -1.722 3.753 1.00 0.00 H new ATOM 0 HH22 ARG A 22 21.092 -3.088 4.681 1.00 0.00 H new ATOM 354 N ALA A 23 14.438 2.905 3.071 1.00 0.00 N ATOM 355 CA ALA A 23 13.928 4.295 3.041 1.00 0.00 C ATOM 356 C ALA A 23 12.879 4.446 4.147 1.00 0.00 C ATOM 357 O ALA A 23 12.933 5.359 4.947 1.00 0.00 O ATOM 358 CB ALA A 23 13.315 4.456 1.650 1.00 0.00 C ATOM 0 H ALA A 23 14.319 2.374 2.208 1.00 0.00 H new ATOM 0 HA ALA A 23 14.692 5.053 3.214 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.912 5.463 1.544 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.082 4.291 0.893 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.514 3.729 1.519 1.00 0.00 H new ATOM 364 N LEU A 24 11.939 3.536 4.215 1.00 0.00 N ATOM 365 CA LEU A 24 10.906 3.602 5.286 1.00 0.00 C ATOM 366 C LEU A 24 11.471 3.035 6.591 1.00 0.00 C ATOM 367 O LEU A 24 10.997 2.043 7.108 1.00 0.00 O ATOM 368 CB LEU A 24 9.767 2.735 4.761 1.00 0.00 C ATOM 369 CG LEU A 24 9.335 3.282 3.406 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.082 2.563 2.925 1.00 0.00 C ATOM 371 CD2 LEU A 24 9.045 4.769 3.547 1.00 0.00 C ATOM 0 H LEU A 24 11.845 2.750 3.572 1.00 0.00 H new ATOM 0 HA LEU A 24 10.580 4.619 5.504 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.091 1.699 4.666 1.00 0.00 H new ATOM 0 HB3 LEU A 24 8.930 2.745 5.459 1.00 0.00 H new ATOM 0 HG LEU A 24 10.132 3.123 2.679 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.783 2.962 1.956 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.288 1.497 2.830 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.277 2.714 3.644 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.735 5.172 2.583 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.248 4.917 4.276 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.944 5.285 3.883 1.00 0.00 H new ATOM 383 N SER A 25 12.489 3.659 7.121 1.00 0.00 N ATOM 384 CA SER A 25 13.098 3.162 8.388 1.00 0.00 C ATOM 385 C SER A 25 12.786 4.120 9.540 1.00 0.00 C ATOM 386 O SER A 25 13.258 3.947 10.646 1.00 0.00 O ATOM 387 CB SER A 25 14.602 3.130 8.114 1.00 0.00 C ATOM 388 OG SER A 25 15.294 3.711 9.214 1.00 0.00 O ATOM 0 H SER A 25 12.926 4.494 6.730 1.00 0.00 H new ATOM 0 HA SER A 25 12.711 2.184 8.676 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.934 2.103 7.963 1.00 0.00 H new ATOM 0 HB3 SER A 25 14.828 3.676 7.198 1.00 0.00 H new ATOM 0 HG SER A 25 14.758 3.610 10.028 1.00 0.00 H new ATOM 394 N ALA A 26 12.000 5.132 9.291 1.00 0.00 N ATOM 395 CA ALA A 26 11.673 6.099 10.377 1.00 0.00 C ATOM 396 C ALA A 26 11.336 5.348 11.666 1.00 0.00 C ATOM 397 O ALA A 26 10.678 4.328 11.653 1.00 0.00 O ATOM 398 CB ALA A 26 10.457 6.877 9.872 1.00 0.00 C ATOM 0 H ALA A 26 11.572 5.330 8.387 1.00 0.00 H new ATOM 0 HA ALA A 26 12.508 6.761 10.604 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.157 7.610 10.621 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.712 7.389 8.944 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.633 6.187 9.690 1.00 0.00 H new ATOM 404 N ASP A 27 11.793 5.846 12.780 1.00 0.00 N ATOM 405 CA ASP A 27 11.514 5.164 14.075 1.00 0.00 C ATOM 406 C ASP A 27 10.027 4.817 14.195 1.00 0.00 C ATOM 407 O ASP A 27 9.646 3.951 14.956 1.00 0.00 O ATOM 408 CB ASP A 27 11.911 6.183 15.144 1.00 0.00 C ATOM 409 CG ASP A 27 12.169 5.468 16.471 1.00 0.00 C ATOM 410 OD1 ASP A 27 11.977 4.265 16.523 1.00 0.00 O ATOM 411 OD2 ASP A 27 12.556 6.139 17.414 1.00 0.00 O ATOM 0 H ASP A 27 12.349 6.698 12.850 1.00 0.00 H new ATOM 0 HA ASP A 27 12.061 4.226 14.171 1.00 0.00 H new ATOM 0 HB2 ASP A 27 12.805 6.722 14.831 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.119 6.922 15.267 1.00 0.00 H new ATOM 416 N ARG A 28 9.184 5.487 13.461 1.00 0.00 N ATOM 417 CA ARG A 28 7.725 5.192 13.555 1.00 0.00 C ATOM 418 C ARG A 28 7.253 4.388 12.336 1.00 0.00 C ATOM 419 O ARG A 28 6.220 4.667 11.762 1.00 0.00 O ATOM 420 CB ARG A 28 7.055 6.568 13.608 1.00 0.00 C ATOM 421 CG ARG A 28 7.183 7.267 12.258 1.00 0.00 C ATOM 422 CD ARG A 28 7.497 8.741 12.502 1.00 0.00 C ATOM 423 NE ARG A 28 8.073 9.235 11.220 1.00 0.00 N ATOM 424 CZ ARG A 28 7.294 9.675 10.264 1.00 0.00 C ATOM 425 NH1 ARG A 28 5.994 9.656 10.401 1.00 0.00 N ATOM 426 NH2 ARG A 28 7.819 10.128 9.158 1.00 0.00 N ATOM 0 H ARG A 28 9.439 6.223 12.803 1.00 0.00 H new ATOM 0 HA ARG A 28 7.478 4.586 14.426 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.003 6.459 13.871 1.00 0.00 H new ATOM 0 HB3 ARG A 28 7.517 7.176 14.386 1.00 0.00 H new ATOM 0 HG2 ARG A 28 7.973 6.805 11.666 1.00 0.00 H new ATOM 0 HG3 ARG A 28 6.258 7.166 11.690 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.598 9.296 12.770 1.00 0.00 H new ATOM 0 HD3 ARG A 28 8.203 8.863 13.324 1.00 0.00 H new ATOM 0 HE ARG A 28 9.084 9.230 11.086 1.00 0.00 H new ATOM 0 HH11 ARG A 28 5.577 9.296 11.259 1.00 0.00 H new ATOM 0 HH12 ARG A 28 5.397 10.001 9.650 1.00 0.00 H new ATOM 0 HH21 ARG A 28 8.832 10.138 9.041 1.00 0.00 H new ATOM 0 HH22 ARG A 28 7.216 10.472 8.411 1.00 0.00 H new ATOM 440 N TYR A 29 8.000 3.391 11.936 1.00 0.00 N ATOM 441 CA TYR A 29 7.590 2.572 10.762 1.00 0.00 C ATOM 442 C TYR A 29 7.508 1.091 11.131 1.00 0.00 C ATOM 443 O TYR A 29 8.449 0.511 11.636 1.00 0.00 O ATOM 444 CB TYR A 29 8.696 2.777 9.733 1.00 0.00 C ATOM 445 CG TYR A 29 8.304 3.880 8.789 1.00 0.00 C ATOM 446 CD1 TYR A 29 8.234 5.196 9.249 1.00 0.00 C ATOM 447 CD2 TYR A 29 8.014 3.587 7.454 1.00 0.00 C ATOM 448 CE1 TYR A 29 7.872 6.223 8.377 1.00 0.00 C ATOM 449 CE2 TYR A 29 7.650 4.612 6.580 1.00 0.00 C ATOM 450 CZ TYR A 29 7.578 5.933 7.040 1.00 0.00 C ATOM 451 OH TYR A 29 7.219 6.947 6.177 1.00 0.00 O ATOM 0 H TYR A 29 8.877 3.110 12.374 1.00 0.00 H new ATOM 0 HA TYR A 29 6.607 2.867 10.394 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.631 3.027 10.234 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.868 1.854 9.179 1.00 0.00 H new ATOM 0 HD1 TYR A 29 8.460 5.419 10.281 1.00 0.00 H new ATOM 0 HD2 TYR A 29 8.071 2.569 7.099 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.819 7.241 8.734 1.00 0.00 H new ATOM 0 HE2 TYR A 29 7.424 4.387 5.548 1.00 0.00 H new ATOM 0 HH TYR A 29 7.997 7.515 5.999 1.00 0.00 H new ATOM 461 N GLN A 30 6.402 0.467 10.846 1.00 0.00 N ATOM 462 CA GLN A 30 6.279 -0.992 11.145 1.00 0.00 C ATOM 463 C GLN A 30 6.316 -1.758 9.825 1.00 0.00 C ATOM 464 O GLN A 30 5.300 -2.050 9.230 1.00 0.00 O ATOM 465 CB GLN A 30 4.932 -1.183 11.842 1.00 0.00 C ATOM 466 CG GLN A 30 4.936 -2.524 12.581 1.00 0.00 C ATOM 467 CD GLN A 30 4.587 -2.306 14.055 1.00 0.00 C ATOM 468 OE1 GLN A 30 5.247 -2.830 14.931 1.00 0.00 O ATOM 469 NE2 GLN A 30 3.565 -1.558 14.367 1.00 0.00 N ATOM 0 H GLN A 30 5.580 0.897 10.422 1.00 0.00 H new ATOM 0 HA GLN A 30 7.087 -1.357 11.780 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.752 -0.368 12.543 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.124 -1.159 11.111 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.216 -3.203 12.124 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.916 -2.994 12.496 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.011 -1.118 13.632 1.00 0.00 H new ATOM 0 HE22 GLN A 30 3.319 -1.413 15.346 1.00 0.00 H new ATOM 478 N LEU A 31 7.490 -2.049 9.348 1.00 0.00 N ATOM 479 CA LEU A 31 7.621 -2.754 8.049 1.00 0.00 C ATOM 480 C LEU A 31 7.137 -4.204 8.136 1.00 0.00 C ATOM 481 O LEU A 31 7.457 -4.929 9.057 1.00 0.00 O ATOM 482 CB LEU A 31 9.119 -2.715 7.751 1.00 0.00 C ATOM 483 CG LEU A 31 9.507 -1.340 7.205 1.00 0.00 C ATOM 484 CD1 LEU A 31 8.895 -1.158 5.821 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.990 -0.241 8.137 1.00 0.00 C ATOM 0 H LEU A 31 8.373 -1.826 9.808 1.00 0.00 H new ATOM 0 HA LEU A 31 7.015 -2.285 7.274 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.684 -2.928 8.658 1.00 0.00 H new ATOM 0 HB3 LEU A 31 9.375 -3.489 7.027 1.00 0.00 H new ATOM 0 HG LEU A 31 10.593 -1.272 7.142 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.169 -0.179 5.428 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.268 -1.935 5.153 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.810 -1.230 5.891 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.271 0.735 7.740 1.00 0.00 H new ATOM 0 HD22 LEU A 31 7.904 -0.305 8.208 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.426 -0.369 9.128 1.00 0.00 H new ATOM 497 N GLN A 32 6.396 -4.633 7.154 1.00 0.00 N ATOM 498 CA GLN A 32 5.909 -6.041 7.123 1.00 0.00 C ATOM 499 C GLN A 32 6.258 -6.635 5.755 1.00 0.00 C ATOM 500 O GLN A 32 5.945 -6.065 4.728 1.00 0.00 O ATOM 501 CB GLN A 32 4.394 -5.956 7.323 1.00 0.00 C ATOM 502 CG GLN A 32 3.787 -7.353 7.208 1.00 0.00 C ATOM 503 CD GLN A 32 4.184 -8.184 8.428 1.00 0.00 C ATOM 504 OE1 GLN A 32 3.681 -7.972 9.515 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.078 -9.124 8.295 1.00 0.00 N ATOM 0 H GLN A 32 6.103 -4.062 6.362 1.00 0.00 H new ATOM 0 HA GLN A 32 6.358 -6.673 7.889 1.00 0.00 H new ATOM 0 HB2 GLN A 32 4.169 -5.529 8.300 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.954 -5.294 6.577 1.00 0.00 H new ATOM 0 HG2 GLN A 32 2.701 -7.285 7.139 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.134 -7.838 6.296 1.00 0.00 H new ATOM 0 HE21 GLN A 32 5.500 -9.302 7.383 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.356 -9.682 9.103 1.00 0.00 H new ATOM 514 N VAL A 33 6.935 -7.748 5.725 1.00 0.00 N ATOM 515 CA VAL A 33 7.333 -8.328 4.410 1.00 0.00 C ATOM 516 C VAL A 33 6.476 -9.537 4.029 1.00 0.00 C ATOM 517 O VAL A 33 6.258 -10.438 4.816 1.00 0.00 O ATOM 518 CB VAL A 33 8.785 -8.761 4.598 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.397 -9.078 3.233 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.573 -7.633 5.267 1.00 0.00 C ATOM 0 H VAL A 33 7.229 -8.278 6.545 1.00 0.00 H new ATOM 0 HA VAL A 33 7.201 -7.602 3.608 1.00 0.00 H new ATOM 0 HB VAL A 33 8.824 -9.649 5.229 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.434 -9.388 3.362 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.834 -9.883 2.760 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.360 -8.190 2.602 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.609 -7.943 5.401 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.539 -6.743 4.639 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.133 -7.408 6.239 1.00 0.00 H new ATOM 530 N CYS A 34 6.020 -9.569 2.807 1.00 0.00 N ATOM 531 CA CYS A 34 5.208 -10.724 2.328 1.00 0.00 C ATOM 532 C CYS A 34 5.885 -11.323 1.091 1.00 0.00 C ATOM 533 O CYS A 34 6.017 -10.673 0.073 1.00 0.00 O ATOM 534 CB CYS A 34 3.843 -10.140 1.967 1.00 0.00 C ATOM 535 SG CYS A 34 2.781 -10.156 3.432 1.00 0.00 S ATOM 0 H CYS A 34 6.177 -8.838 2.113 1.00 0.00 H new ATOM 0 HA CYS A 34 5.112 -11.514 3.073 1.00 0.00 H new ATOM 0 HB2 CYS A 34 3.957 -9.121 1.597 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.386 -10.721 1.166 1.00 0.00 H new ATOM 0 HG CYS A 34 2.763 -8.972 3.968 1.00 0.00 H new ATOM 541 N GLU A 35 6.329 -12.547 1.174 1.00 0.00 N ATOM 542 CA GLU A 35 7.015 -13.176 0.006 1.00 0.00 C ATOM 543 C GLU A 35 6.041 -13.397 -1.153 1.00 0.00 C ATOM 544 O GLU A 35 6.437 -13.443 -2.301 1.00 0.00 O ATOM 545 CB GLU A 35 7.538 -14.515 0.524 1.00 0.00 C ATOM 546 CG GLU A 35 8.651 -14.268 1.541 1.00 0.00 C ATOM 547 CD GLU A 35 9.156 -15.606 2.080 1.00 0.00 C ATOM 548 OE1 GLU A 35 8.333 -16.391 2.523 1.00 0.00 O ATOM 549 OE2 GLU A 35 10.355 -15.823 2.041 1.00 0.00 O ATOM 0 H GLU A 35 6.247 -13.140 2.000 1.00 0.00 H new ATOM 0 HA GLU A 35 7.813 -12.541 -0.379 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.728 -15.080 0.985 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.914 -15.116 -0.304 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.469 -13.720 1.074 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.280 -13.651 2.359 1.00 0.00 H new ATOM 556 N SER A 36 4.776 -13.554 -0.874 1.00 0.00 N ATOM 557 CA SER A 36 3.804 -13.793 -1.982 1.00 0.00 C ATOM 558 C SER A 36 2.780 -12.657 -2.068 1.00 0.00 C ATOM 559 O SER A 36 2.915 -11.635 -1.427 1.00 0.00 O ATOM 560 CB SER A 36 3.120 -15.109 -1.619 1.00 0.00 C ATOM 561 OG SER A 36 1.873 -14.835 -0.999 1.00 0.00 O ATOM 0 H SER A 36 4.375 -13.528 0.063 1.00 0.00 H new ATOM 0 HA SER A 36 4.294 -13.835 -2.955 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.969 -15.713 -2.514 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.754 -15.688 -0.947 1.00 0.00 H new ATOM 0 HG SER A 36 1.349 -15.661 -0.940 1.00 0.00 H new ATOM 567 N GLY A 37 1.745 -12.841 -2.843 1.00 0.00 N ATOM 568 CA GLY A 37 0.702 -11.790 -2.958 1.00 0.00 C ATOM 569 C GLY A 37 -0.482 -12.246 -2.129 1.00 0.00 C ATOM 570 O GLY A 37 -1.232 -11.459 -1.592 1.00 0.00 O ATOM 0 H GLY A 37 1.580 -13.678 -3.402 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.078 -10.832 -2.598 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.412 -11.647 -3.999 1.00 0.00 H new ATOM 574 N GLU A 38 -0.619 -13.535 -2.001 1.00 0.00 N ATOM 575 CA GLU A 38 -1.713 -14.100 -1.184 1.00 0.00 C ATOM 576 C GLU A 38 -1.394 -13.822 0.275 1.00 0.00 C ATOM 577 O GLU A 38 -2.251 -13.495 1.073 1.00 0.00 O ATOM 578 CB GLU A 38 -1.666 -15.599 -1.478 1.00 0.00 C ATOM 579 CG GLU A 38 -2.572 -15.928 -2.667 1.00 0.00 C ATOM 580 CD GLU A 38 -4.034 -15.726 -2.265 1.00 0.00 C ATOM 581 OE1 GLU A 38 -4.526 -16.516 -1.476 1.00 0.00 O ATOM 582 OE2 GLU A 38 -4.637 -14.786 -2.755 1.00 0.00 O ATOM 0 H GLU A 38 -0.008 -14.226 -2.436 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.697 -13.683 -1.400 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.642 -15.903 -1.695 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.986 -16.160 -0.600 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.325 -15.288 -3.514 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -2.411 -16.957 -2.987 1.00 0.00 H new ATOM 589 N MET A 39 -0.140 -13.935 0.613 1.00 0.00 N ATOM 590 CA MET A 39 0.293 -13.665 2.004 1.00 0.00 C ATOM 591 C MET A 39 -0.049 -12.218 2.369 1.00 0.00 C ATOM 592 O MET A 39 -0.449 -11.921 3.477 1.00 0.00 O ATOM 593 CB MET A 39 1.807 -13.896 1.985 1.00 0.00 C ATOM 594 CG MET A 39 2.091 -15.400 1.942 1.00 0.00 C ATOM 595 SD MET A 39 3.858 -15.675 1.660 1.00 0.00 S ATOM 596 CE MET A 39 3.824 -17.482 1.755 1.00 0.00 C ATOM 0 H MET A 39 0.608 -14.206 -0.025 1.00 0.00 H new ATOM 0 HA MET A 39 -0.197 -14.299 2.743 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.250 -13.406 1.118 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.265 -13.453 2.870 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.785 -15.865 2.879 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.508 -15.868 1.149 1.00 0.00 H new ATOM 0 HE1 MET A 39 4.830 -17.873 1.606 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.457 -17.788 2.735 1.00 0.00 H new ATOM 0 HE3 MET A 39 3.164 -17.875 0.982 1.00 0.00 H new ATOM 606 N LEU A 40 0.085 -11.319 1.429 1.00 0.00 N ATOM 607 CA LEU A 40 -0.253 -9.891 1.700 1.00 0.00 C ATOM 608 C LEU A 40 -1.742 -9.777 2.019 1.00 0.00 C ATOM 609 O LEU A 40 -2.148 -9.045 2.898 1.00 0.00 O ATOM 610 CB LEU A 40 0.060 -9.161 0.391 1.00 0.00 C ATOM 611 CG LEU A 40 0.381 -7.685 0.660 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.594 -7.103 1.687 1.00 0.00 C ATOM 613 CD2 LEU A 40 1.809 -7.567 1.195 1.00 0.00 C ATOM 0 H LEU A 40 0.415 -11.513 0.483 1.00 0.00 H new ATOM 0 HA LEU A 40 0.301 -9.478 2.543 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.905 -9.638 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.791 -9.236 -0.286 1.00 0.00 H new ATOM 0 HG LEU A 40 0.284 -7.128 -0.272 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.352 -6.055 1.866 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.612 -7.180 1.306 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.513 -7.659 2.621 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.040 -6.519 1.387 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.898 -8.134 2.122 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.508 -7.963 0.458 1.00 0.00 H new ATOM 625 N LEU A 41 -2.556 -10.497 1.297 1.00 0.00 N ATOM 626 CA LEU A 41 -4.024 -10.435 1.540 1.00 0.00 C ATOM 627 C LEU A 41 -4.330 -10.842 2.982 1.00 0.00 C ATOM 628 O LEU A 41 -5.156 -10.246 3.644 1.00 0.00 O ATOM 629 CB LEU A 41 -4.627 -11.450 0.567 1.00 0.00 C ATOM 630 CG LEU A 41 -4.242 -11.089 -0.869 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.788 -12.150 -1.826 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.831 -9.723 -1.229 1.00 0.00 C ATOM 0 H LEU A 41 -2.267 -11.126 0.548 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.428 -9.433 1.392 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -4.271 -12.452 0.807 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.712 -11.464 0.669 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.156 -11.048 -0.954 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.514 -11.893 -2.849 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.366 -13.122 -1.571 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.874 -12.192 -1.741 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.556 -9.467 -2.252 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.917 -9.761 -1.144 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.440 -8.967 -0.548 1.00 0.00 H new ATOM 644 N GLU A 42 -3.671 -11.856 3.469 1.00 0.00 N ATOM 645 CA GLU A 42 -3.923 -12.306 4.866 1.00 0.00 C ATOM 646 C GLU A 42 -3.568 -11.190 5.851 1.00 0.00 C ATOM 647 O GLU A 42 -4.300 -10.913 6.780 1.00 0.00 O ATOM 648 CB GLU A 42 -3.006 -13.514 5.058 1.00 0.00 C ATOM 649 CG GLU A 42 -3.460 -14.315 6.279 1.00 0.00 C ATOM 650 CD GLU A 42 -2.793 -15.692 6.261 1.00 0.00 C ATOM 651 OE1 GLU A 42 -2.726 -16.282 5.196 1.00 0.00 O ATOM 652 OE2 GLU A 42 -2.362 -16.134 7.313 1.00 0.00 O ATOM 0 H GLU A 42 -2.969 -12.393 2.960 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.969 -12.558 5.042 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.027 -14.144 4.169 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.976 -13.184 5.190 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.198 -13.784 7.194 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.545 -14.424 6.273 1.00 0.00 H new ATOM 659 N TYR A 43 -2.450 -10.545 5.654 1.00 0.00 N ATOM 660 CA TYR A 43 -2.055 -9.446 6.581 1.00 0.00 C ATOM 661 C TYR A 43 -3.026 -8.274 6.456 1.00 0.00 C ATOM 662 O TYR A 43 -3.361 -7.627 7.431 1.00 0.00 O ATOM 663 CB TYR A 43 -0.652 -9.027 6.134 1.00 0.00 C ATOM 664 CG TYR A 43 -0.282 -7.718 6.791 1.00 0.00 C ATOM 665 CD1 TYR A 43 -0.658 -6.506 6.198 1.00 0.00 C ATOM 666 CD2 TYR A 43 0.438 -7.717 7.990 1.00 0.00 C ATOM 667 CE1 TYR A 43 -0.313 -5.292 6.806 1.00 0.00 C ATOM 668 CE2 TYR A 43 0.783 -6.504 8.597 1.00 0.00 C ATOM 669 CZ TYR A 43 0.408 -5.291 8.007 1.00 0.00 C ATOM 670 OH TYR A 43 0.753 -4.098 8.609 1.00 0.00 O ATOM 0 H TYR A 43 -1.795 -10.731 4.894 1.00 0.00 H new ATOM 0 HA TYR A 43 -2.071 -9.764 7.623 1.00 0.00 H new ATOM 0 HB2 TYR A 43 0.071 -9.797 6.402 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.621 -8.923 5.049 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.214 -6.507 5.272 1.00 0.00 H new ATOM 0 HD2 TYR A 43 0.728 -8.652 8.447 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.603 -4.357 6.349 1.00 0.00 H new ATOM 0 HE2 TYR A 43 1.340 -6.504 9.522 1.00 0.00 H new ATOM 0 HH TYR A 43 1.250 -4.280 9.434 1.00 0.00 H new ATOM 680 N ALA A 44 -3.473 -7.987 5.266 1.00 0.00 N ATOM 681 CA ALA A 44 -4.415 -6.848 5.081 1.00 0.00 C ATOM 682 C ALA A 44 -5.866 -7.316 5.234 1.00 0.00 C ATOM 683 O ALA A 44 -6.762 -6.521 5.419 1.00 0.00 O ATOM 684 CB ALA A 44 -4.157 -6.350 3.657 1.00 0.00 C ATOM 0 H ALA A 44 -3.227 -8.491 4.414 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.261 -6.065 5.824 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.814 -5.508 3.441 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.118 -6.032 3.565 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.354 -7.155 2.949 1.00 0.00 H new ATOM 690 N GLN A 45 -6.108 -8.595 5.160 1.00 0.00 N ATOM 691 CA GLN A 45 -7.508 -9.100 5.302 1.00 0.00 C ATOM 692 C GLN A 45 -7.980 -8.992 6.745 1.00 0.00 C ATOM 693 O GLN A 45 -9.114 -9.299 7.059 1.00 0.00 O ATOM 694 CB GLN A 45 -7.443 -10.571 4.909 1.00 0.00 C ATOM 695 CG GLN A 45 -7.692 -10.711 3.415 1.00 0.00 C ATOM 696 CD GLN A 45 -7.254 -12.103 2.950 1.00 0.00 C ATOM 697 OE1 GLN A 45 -6.517 -12.780 3.635 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.679 -12.562 1.805 1.00 0.00 N ATOM 0 H GLN A 45 -5.400 -9.314 5.008 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.200 -8.525 4.687 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.467 -10.984 5.166 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.187 -11.140 5.467 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.749 -10.559 3.196 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.141 -9.944 2.871 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.299 -11.995 1.227 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.391 -13.488 1.488 1.00 0.00 H new ATOM 707 N THR A 46 -7.119 -8.603 7.635 1.00 0.00 N ATOM 708 CA THR A 46 -7.530 -8.530 9.061 1.00 0.00 C ATOM 709 C THR A 46 -6.986 -7.260 9.713 1.00 0.00 C ATOM 710 O THR A 46 -7.146 -7.036 10.896 1.00 0.00 O ATOM 711 CB THR A 46 -6.899 -9.783 9.669 1.00 0.00 C ATOM 712 OG1 THR A 46 -5.489 -9.620 9.723 1.00 0.00 O ATOM 713 CG2 THR A 46 -7.231 -10.991 8.788 1.00 0.00 C ATOM 0 H THR A 46 -6.155 -8.334 7.441 1.00 0.00 H new ATOM 0 HA THR A 46 -8.610 -8.491 9.201 1.00 0.00 H new ATOM 0 HB THR A 46 -7.290 -9.939 10.674 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.276 -8.707 10.009 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.784 -11.888 9.217 1.00 0.00 H new ATOM 0 HG22 THR A 46 -8.313 -11.115 8.734 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.833 -10.831 7.786 1.00 0.00 H new ATOM 721 N HIS A 47 -6.343 -6.429 8.946 1.00 0.00 N ATOM 722 CA HIS A 47 -5.782 -5.175 9.508 1.00 0.00 C ATOM 723 C HIS A 47 -5.984 -4.020 8.518 1.00 0.00 C ATOM 724 O HIS A 47 -5.273 -3.038 8.559 1.00 0.00 O ATOM 725 CB HIS A 47 -4.287 -5.472 9.686 1.00 0.00 C ATOM 726 CG HIS A 47 -4.078 -6.408 10.847 1.00 0.00 C ATOM 727 ND1 HIS A 47 -4.440 -7.743 10.793 1.00 0.00 N ATOM 728 CD2 HIS A 47 -3.520 -6.220 12.089 1.00 0.00 C ATOM 729 CE1 HIS A 47 -4.100 -8.305 11.968 1.00 0.00 C ATOM 730 NE2 HIS A 47 -3.536 -7.421 12.795 1.00 0.00 N ATOM 0 H HIS A 47 -6.181 -6.566 7.948 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.260 -4.881 10.442 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.886 -5.916 8.775 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.742 -4.543 9.855 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.129 -5.284 12.461 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.263 -9.344 12.212 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -3.191 -7.589 13.740 1.00 0.00 H new ATOM 738 N ARG A 48 -6.938 -4.138 7.617 1.00 0.00 N ATOM 739 CA ARG A 48 -7.148 -3.037 6.609 1.00 0.00 C ATOM 740 C ARG A 48 -7.014 -1.691 7.297 1.00 0.00 C ATOM 741 O ARG A 48 -6.198 -0.866 6.940 1.00 0.00 O ATOM 742 CB ARG A 48 -8.587 -3.149 6.077 1.00 0.00 C ATOM 743 CG ARG A 48 -9.082 -4.590 6.098 1.00 0.00 C ATOM 744 CD ARG A 48 -10.348 -4.696 5.245 1.00 0.00 C ATOM 745 NE ARG A 48 -11.476 -4.617 6.214 1.00 0.00 N ATOM 746 CZ ARG A 48 -12.698 -4.861 5.822 1.00 0.00 C ATOM 747 NH1 ARG A 48 -12.944 -5.149 4.573 1.00 0.00 N ATOM 748 NH2 ARG A 48 -13.680 -4.808 6.678 1.00 0.00 N ATOM 0 H ARG A 48 -7.571 -4.934 7.535 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.416 -3.124 5.806 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.248 -2.528 6.681 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.630 -2.764 5.058 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.312 -5.258 5.713 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.291 -4.901 7.122 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.399 -3.889 4.514 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.371 -5.633 4.688 1.00 0.00 H new ATOM 0 HE ARG A 48 -11.294 -4.372 7.187 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.180 -5.184 3.898 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.900 -5.339 4.272 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -13.494 -4.576 7.654 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -14.634 -4.998 6.372 1.00 0.00 H new ATOM 762 N ASP A 49 -7.812 -1.477 8.292 1.00 0.00 N ATOM 763 CA ASP A 49 -7.747 -0.187 9.033 1.00 0.00 C ATOM 764 C ASP A 49 -6.424 -0.111 9.794 1.00 0.00 C ATOM 765 O ASP A 49 -5.863 0.948 9.996 1.00 0.00 O ATOM 766 CB ASP A 49 -8.923 -0.226 10.012 1.00 0.00 C ATOM 767 CG ASP A 49 -10.168 -0.781 9.312 1.00 0.00 C ATOM 768 OD1 ASP A 49 -10.213 -1.982 9.092 1.00 0.00 O ATOM 769 OD2 ASP A 49 -11.054 0.001 9.012 1.00 0.00 O ATOM 0 H ASP A 49 -8.511 -2.138 8.630 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.802 0.680 8.374 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -8.671 -0.847 10.871 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -9.125 0.776 10.391 1.00 0.00 H new ATOM 774 N GLN A 50 -5.935 -1.238 10.224 1.00 0.00 N ATOM 775 CA GLN A 50 -4.658 -1.269 10.985 1.00 0.00 C ATOM 776 C GLN A 50 -3.451 -1.020 10.066 1.00 0.00 C ATOM 777 O GLN A 50 -2.360 -0.761 10.533 1.00 0.00 O ATOM 778 CB GLN A 50 -4.604 -2.674 11.584 1.00 0.00 C ATOM 779 CG GLN A 50 -5.698 -2.818 12.643 1.00 0.00 C ATOM 780 CD GLN A 50 -5.577 -4.185 13.318 1.00 0.00 C ATOM 781 OE1 GLN A 50 -4.633 -4.436 14.043 1.00 0.00 O ATOM 782 NE2 GLN A 50 -6.492 -5.089 13.104 1.00 0.00 N ATOM 0 H GLN A 50 -6.370 -2.149 10.079 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.617 -0.489 11.745 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.740 -3.420 10.801 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.626 -2.854 12.029 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -5.607 -2.025 13.385 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -6.681 -2.713 12.183 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -7.284 -4.879 12.496 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.416 -6.006 13.544 1.00 0.00 H new ATOM 791 N ILE A 51 -3.626 -1.089 8.769 1.00 0.00 N ATOM 792 CA ILE A 51 -2.467 -0.844 7.851 1.00 0.00 C ATOM 793 C ILE A 51 -2.400 0.643 7.483 1.00 0.00 C ATOM 794 O ILE A 51 -3.397 1.254 7.158 1.00 0.00 O ATOM 795 CB ILE A 51 -2.732 -1.702 6.606 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.826 -3.197 6.975 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.590 -1.510 5.607 1.00 0.00 C ATOM 798 CD1 ILE A 51 -1.998 -3.504 8.228 1.00 0.00 C ATOM 0 H ILE A 51 -4.511 -1.302 8.309 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.515 -1.105 8.314 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.679 -1.388 6.168 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.868 -3.469 7.147 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.472 -3.804 6.142 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.775 -2.118 4.722 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.530 -0.460 5.320 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.650 -1.815 6.066 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.080 -4.564 8.468 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.953 -3.254 8.044 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.371 -2.913 9.064 1.00 0.00 H new ATOM 810 N ASP A 52 -1.237 1.238 7.545 1.00 0.00 N ATOM 811 CA ASP A 52 -1.126 2.687 7.217 1.00 0.00 C ATOM 812 C ASP A 52 -0.687 2.899 5.766 1.00 0.00 C ATOM 813 O ASP A 52 -1.198 3.760 5.086 1.00 0.00 O ATOM 814 CB ASP A 52 -0.072 3.224 8.181 1.00 0.00 C ATOM 815 CG ASP A 52 -0.675 3.334 9.584 1.00 0.00 C ATOM 816 OD1 ASP A 52 -1.277 2.369 10.026 1.00 0.00 O ATOM 817 OD2 ASP A 52 -0.528 4.382 10.191 1.00 0.00 O ATOM 0 H ASP A 52 -0.363 0.783 7.808 1.00 0.00 H new ATOM 0 HA ASP A 52 -2.083 3.198 7.319 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.794 2.562 8.196 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.279 4.200 7.846 1.00 0.00 H new ATOM 822 N CYS A 53 0.259 2.134 5.285 1.00 0.00 N ATOM 823 CA CYS A 53 0.721 2.318 3.872 1.00 0.00 C ATOM 824 C CYS A 53 1.140 0.977 3.258 1.00 0.00 C ATOM 825 O CYS A 53 1.792 0.173 3.889 1.00 0.00 O ATOM 826 CB CYS A 53 1.921 3.259 3.974 1.00 0.00 C ATOM 827 SG CYS A 53 2.502 3.672 2.312 1.00 0.00 S ATOM 0 H CYS A 53 0.731 1.393 5.804 1.00 0.00 H new ATOM 0 HA CYS A 53 -0.066 2.718 3.233 1.00 0.00 H new ATOM 0 HB2 CYS A 53 1.641 4.166 4.510 1.00 0.00 H new ATOM 0 HB3 CYS A 53 2.721 2.786 4.544 1.00 0.00 H new ATOM 0 HG CYS A 53 1.485 3.960 1.556 1.00 0.00 H new ATOM 833 N LEU A 54 0.763 0.724 2.033 1.00 0.00 N ATOM 834 CA LEU A 54 1.139 -0.580 1.398 1.00 0.00 C ATOM 835 C LEU A 54 2.161 -0.388 0.269 1.00 0.00 C ATOM 836 O LEU A 54 2.000 0.456 -0.586 1.00 0.00 O ATOM 837 CB LEU A 54 -0.173 -1.117 0.829 1.00 0.00 C ATOM 838 CG LEU A 54 0.105 -2.334 -0.057 1.00 0.00 C ATOM 839 CD1 LEU A 54 0.693 -3.470 0.782 1.00 0.00 C ATOM 840 CD2 LEU A 54 -1.201 -2.803 -0.700 1.00 0.00 C ATOM 0 H LEU A 54 0.216 1.355 1.447 1.00 0.00 H new ATOM 0 HA LEU A 54 1.605 -1.255 2.116 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.846 -1.393 1.641 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.673 -0.341 0.250 1.00 0.00 H new ATOM 0 HG LEU A 54 0.819 -2.055 -0.832 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.887 -4.331 0.143 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.626 -3.140 1.239 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.015 -3.750 1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.005 -3.670 -1.331 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.913 -3.075 0.079 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.617 -1.999 -1.307 1.00 0.00 H new ATOM 852 N ILE A 55 3.201 -1.184 0.233 1.00 0.00 N ATOM 853 CA ILE A 55 4.188 -1.041 -0.873 1.00 0.00 C ATOM 854 C ILE A 55 3.947 -2.146 -1.898 1.00 0.00 C ATOM 855 O ILE A 55 3.685 -3.280 -1.547 1.00 0.00 O ATOM 856 CB ILE A 55 5.561 -1.211 -0.236 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.708 -0.266 0.950 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.647 -0.896 -1.270 1.00 0.00 C ATOM 859 CD1 ILE A 55 6.936 -0.685 1.745 1.00 0.00 C ATOM 0 H ILE A 55 3.405 -1.916 0.913 1.00 0.00 H new ATOM 0 HA ILE A 55 4.105 -0.079 -1.378 1.00 0.00 H new ATOM 0 HB ILE A 55 5.667 -2.240 0.109 1.00 0.00 H new ATOM 0 HG12 ILE A 55 5.812 0.763 0.605 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.818 -0.304 1.578 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.630 -1.018 -0.814 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.553 -1.577 -2.116 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.532 0.131 -1.617 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.060 -0.020 2.600 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.810 -1.709 2.097 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.819 -0.626 1.109 1.00 0.00 H new ATOM 871 N LEU A 56 4.019 -1.834 -3.159 1.00 0.00 N ATOM 872 CA LEU A 56 3.776 -2.887 -4.183 1.00 0.00 C ATOM 873 C LEU A 56 4.808 -2.818 -5.306 1.00 0.00 C ATOM 874 O LEU A 56 5.389 -1.785 -5.574 1.00 0.00 O ATOM 875 CB LEU A 56 2.385 -2.593 -4.730 1.00 0.00 C ATOM 876 CG LEU A 56 1.339 -2.985 -3.692 1.00 0.00 C ATOM 877 CD1 LEU A 56 -0.057 -2.756 -4.269 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.512 -4.463 -3.326 1.00 0.00 C ATOM 0 H LEU A 56 4.233 -0.906 -3.524 1.00 0.00 H new ATOM 0 HA LEU A 56 3.854 -3.886 -3.753 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.294 -1.534 -4.972 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.221 -3.147 -5.654 1.00 0.00 H new ATOM 0 HG LEU A 56 1.464 -2.376 -2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.807 -3.035 -3.529 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.176 -1.704 -4.527 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.185 -3.365 -5.164 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.765 -4.744 -2.584 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.386 -5.076 -4.218 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.509 -4.622 -2.915 1.00 0.00 H new ATOM 890 N VAL A 57 5.020 -3.916 -5.974 1.00 0.00 N ATOM 891 CA VAL A 57 5.991 -3.939 -7.104 1.00 0.00 C ATOM 892 C VAL A 57 5.284 -4.472 -8.352 1.00 0.00 C ATOM 893 O VAL A 57 4.909 -5.626 -8.418 1.00 0.00 O ATOM 894 CB VAL A 57 7.100 -4.888 -6.656 1.00 0.00 C ATOM 895 CG1 VAL A 57 8.176 -4.963 -7.741 1.00 0.00 C ATOM 896 CG2 VAL A 57 7.718 -4.365 -5.357 1.00 0.00 C ATOM 0 H VAL A 57 4.559 -4.806 -5.785 1.00 0.00 H new ATOM 0 HA VAL A 57 6.391 -2.955 -7.348 1.00 0.00 H new ATOM 0 HB VAL A 57 6.686 -5.882 -6.489 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.968 -5.640 -7.422 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.734 -5.332 -8.667 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.593 -3.970 -7.909 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.510 -5.040 -5.034 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.134 -3.372 -5.526 1.00 0.00 H new ATOM 0 HG23 VAL A 57 6.950 -4.310 -4.585 1.00 0.00 H new ATOM 906 N ALA A 58 5.079 -3.640 -9.331 1.00 0.00 N ATOM 907 CA ALA A 58 4.368 -4.099 -10.561 1.00 0.00 C ATOM 908 C ALA A 58 5.175 -5.168 -11.299 1.00 0.00 C ATOM 909 O ALA A 58 4.626 -5.998 -11.996 1.00 0.00 O ATOM 910 CB ALA A 58 4.212 -2.850 -11.420 1.00 0.00 C ATOM 0 H ALA A 58 5.371 -2.663 -9.336 1.00 0.00 H new ATOM 0 HA ALA A 58 3.407 -4.555 -10.324 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.696 -3.107 -12.345 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.632 -2.105 -10.876 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.196 -2.444 -11.654 1.00 0.00 H new ATOM 916 N ALA A 59 6.468 -5.155 -11.158 1.00 0.00 N ATOM 917 CA ALA A 59 7.304 -6.170 -11.860 1.00 0.00 C ATOM 918 C ALA A 59 6.773 -7.585 -11.603 1.00 0.00 C ATOM 919 O ALA A 59 7.083 -8.509 -12.329 1.00 0.00 O ATOM 920 CB ALA A 59 8.706 -6.009 -11.271 1.00 0.00 C ATOM 0 H ALA A 59 6.985 -4.486 -10.587 1.00 0.00 H new ATOM 0 HA ALA A 59 7.294 -6.026 -12.940 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.382 -6.725 -11.739 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.065 -4.997 -11.457 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.672 -6.191 -10.197 1.00 0.00 H new ATOM 926 N ASN A 60 5.977 -7.773 -10.585 1.00 0.00 N ATOM 927 CA ASN A 60 5.447 -9.141 -10.314 1.00 0.00 C ATOM 928 C ASN A 60 4.448 -9.549 -11.401 1.00 0.00 C ATOM 929 O ASN A 60 3.961 -8.719 -12.142 1.00 0.00 O ATOM 930 CB ASN A 60 4.779 -9.047 -8.943 1.00 0.00 C ATOM 931 CG ASN A 60 5.837 -9.259 -7.856 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.996 -9.470 -8.155 1.00 0.00 O ATOM 933 ND2 ASN A 60 5.490 -9.206 -6.600 1.00 0.00 N ATOM 0 H ASN A 60 5.673 -7.048 -9.936 1.00 0.00 H new ATOM 0 HA ASN A 60 6.229 -9.900 -10.320 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.305 -8.073 -8.822 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.993 -9.797 -8.855 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.191 -9.341 -5.871 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.518 -9.029 -6.346 1.00 0.00 H new ATOM 940 N PRO A 61 4.204 -10.829 -11.473 1.00 0.00 N ATOM 941 CA PRO A 61 3.283 -11.380 -12.498 1.00 0.00 C ATOM 942 C PRO A 61 1.816 -11.033 -12.202 1.00 0.00 C ATOM 943 O PRO A 61 1.269 -10.096 -12.750 1.00 0.00 O ATOM 944 CB PRO A 61 3.518 -12.888 -12.412 1.00 0.00 C ATOM 945 CG PRO A 61 4.033 -13.127 -11.028 1.00 0.00 C ATOM 946 CD PRO A 61 4.763 -11.876 -10.611 1.00 0.00 C ATOM 0 HA PRO A 61 3.474 -10.969 -13.489 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.596 -13.441 -12.590 1.00 0.00 H new ATOM 0 HB3 PRO A 61 4.237 -13.218 -13.162 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.213 -13.342 -10.343 1.00 0.00 H new ATOM 0 HG3 PRO A 61 4.700 -13.989 -11.008 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.600 -11.653 -9.557 1.00 0.00 H new ATOM 0 HD3 PRO A 61 5.839 -11.977 -10.753 1.00 0.00 H new ATOM 954 N SER A 62 1.169 -11.795 -11.364 1.00 0.00 N ATOM 955 CA SER A 62 -0.269 -11.527 -11.063 1.00 0.00 C ATOM 956 C SER A 62 -0.414 -10.503 -9.934 1.00 0.00 C ATOM 957 O SER A 62 -1.450 -10.395 -9.310 1.00 0.00 O ATOM 958 CB SER A 62 -0.837 -12.881 -10.637 1.00 0.00 C ATOM 959 OG SER A 62 -0.297 -13.900 -11.466 1.00 0.00 O ATOM 0 H SER A 62 1.573 -12.593 -10.873 1.00 0.00 H new ATOM 0 HA SER A 62 -0.793 -11.109 -11.922 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.593 -13.078 -9.593 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.924 -12.872 -10.714 1.00 0.00 H new ATOM 0 HG SER A 62 -0.658 -14.769 -11.194 1.00 0.00 H new ATOM 965 N PHE A 63 0.611 -9.747 -9.671 1.00 0.00 N ATOM 966 CA PHE A 63 0.534 -8.730 -8.583 1.00 0.00 C ATOM 967 C PHE A 63 -0.768 -7.921 -8.675 1.00 0.00 C ATOM 968 O PHE A 63 -1.453 -7.722 -7.692 1.00 0.00 O ATOM 969 CB PHE A 63 1.767 -7.842 -8.812 1.00 0.00 C ATOM 970 CG PHE A 63 1.494 -6.413 -8.390 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.212 -6.112 -7.054 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.521 -5.391 -9.345 1.00 0.00 C ATOM 973 CE1 PHE A 63 0.958 -4.788 -6.675 1.00 0.00 C ATOM 974 CE2 PHE A 63 1.270 -4.069 -8.967 1.00 0.00 C ATOM 975 CZ PHE A 63 0.988 -3.766 -7.631 1.00 0.00 C ATOM 0 H PHE A 63 1.504 -9.787 -10.163 1.00 0.00 H new ATOM 0 HA PHE A 63 0.527 -9.178 -7.589 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.613 -8.236 -8.248 1.00 0.00 H new ATOM 0 HB3 PHE A 63 2.047 -7.867 -9.865 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.190 -6.900 -6.315 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.736 -5.624 -10.377 1.00 0.00 H new ATOM 0 HE1 PHE A 63 0.739 -4.555 -5.643 1.00 0.00 H new ATOM 0 HE2 PHE A 63 1.294 -3.282 -9.706 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.794 -2.745 -7.337 1.00 0.00 H new ATOM 985 N ARG A 64 -1.109 -7.455 -9.841 1.00 0.00 N ATOM 986 CA ARG A 64 -2.360 -6.654 -9.984 1.00 0.00 C ATOM 987 C ARG A 64 -3.547 -7.420 -9.400 1.00 0.00 C ATOM 988 O ARG A 64 -4.357 -6.874 -8.677 1.00 0.00 O ATOM 989 CB ARG A 64 -2.537 -6.458 -11.490 1.00 0.00 C ATOM 990 CG ARG A 64 -1.865 -5.151 -11.919 1.00 0.00 C ATOM 991 CD ARG A 64 -0.354 -5.359 -12.085 1.00 0.00 C ATOM 992 NE ARG A 64 -0.129 -5.394 -13.562 1.00 0.00 N ATOM 993 CZ ARG A 64 -0.054 -6.534 -14.212 1.00 0.00 C ATOM 994 NH1 ARG A 64 -0.215 -7.673 -13.592 1.00 0.00 N ATOM 995 NH2 ARG A 64 0.182 -6.533 -15.498 1.00 0.00 N ATOM 0 H ARG A 64 -0.579 -7.592 -10.702 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.304 -5.703 -9.454 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -2.100 -7.298 -12.030 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.597 -6.434 -11.742 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.296 -4.803 -12.858 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.053 -4.376 -11.176 1.00 0.00 H new ATOM 0 HD2 ARG A 64 0.209 -4.551 -11.619 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -0.029 -6.287 -11.614 1.00 0.00 H new ATOM 0 HE ARG A 64 -0.032 -4.518 -14.075 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -0.402 -7.686 -12.589 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -0.154 -8.549 -14.111 1.00 0.00 H new ATOM 0 HH21 ARG A 64 0.307 -5.650 -15.993 1.00 0.00 H new ATOM 0 HH22 ARG A 64 0.241 -7.415 -16.006 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.648 -8.685 -9.698 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.777 -9.489 -9.154 1.00 0.00 C ATOM 1011 C ALA A 65 -4.767 -9.421 -7.625 1.00 0.00 C ATOM 1012 O ALA A 65 -5.794 -9.330 -6.984 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.513 -10.914 -9.635 1.00 0.00 C ATOM 0 H ALA A 65 -2.998 -9.197 -10.295 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.750 -9.127 -9.485 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.304 -11.572 -9.275 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.494 -10.933 -10.725 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.553 -11.256 -9.249 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.611 -9.455 -7.037 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.533 -9.378 -5.555 1.00 0.00 C ATOM 1021 C VAL A 66 -4.004 -7.999 -5.087 1.00 0.00 C ATOM 1022 O VAL A 66 -4.700 -7.871 -4.095 1.00 0.00 O ATOM 1023 CB VAL A 66 -2.057 -9.591 -5.241 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.780 -9.285 -3.770 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.681 -11.045 -5.536 1.00 0.00 C ATOM 0 H VAL A 66 -2.714 -9.533 -7.517 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.163 -10.112 -5.053 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.462 -8.921 -5.861 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.722 -9.441 -3.559 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.043 -8.249 -3.558 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.377 -9.947 -3.142 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.626 -11.200 -5.312 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -2.285 -11.710 -4.918 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.865 -11.262 -6.588 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.640 -6.962 -5.795 1.00 0.00 N ATOM 1036 CA VAL A 67 -4.078 -5.598 -5.387 1.00 0.00 C ATOM 1037 C VAL A 67 -5.598 -5.474 -5.527 1.00 0.00 C ATOM 1038 O VAL A 67 -6.265 -4.973 -4.644 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.376 -4.633 -6.338 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.595 -3.199 -5.850 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.878 -4.937 -6.365 1.00 0.00 C ATOM 0 H VAL A 67 -3.061 -7.002 -6.634 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.827 -5.385 -4.348 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.785 -4.748 -7.342 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.096 -2.505 -6.526 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.663 -2.981 -5.829 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.183 -3.089 -4.847 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.379 -4.247 -7.045 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.465 -4.822 -5.363 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.720 -5.960 -6.707 1.00 0.00 H new ATOM 1051 N GLN A 68 -6.162 -5.931 -6.620 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.640 -5.824 -6.761 1.00 0.00 C ATOM 1053 C GLN A 68 -8.300 -6.571 -5.602 1.00 0.00 C ATOM 1054 O GLN A 68 -9.364 -6.206 -5.144 1.00 0.00 O ATOM 1055 CB GLN A 68 -7.993 -6.458 -8.110 1.00 0.00 C ATOM 1056 CG GLN A 68 -7.585 -7.928 -8.118 1.00 0.00 C ATOM 1057 CD GLN A 68 -8.431 -8.692 -9.138 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -8.246 -8.545 -10.329 1.00 0.00 O ATOM 1059 NE2 GLN A 68 -9.355 -9.512 -8.714 1.00 0.00 N ATOM 0 H GLN A 68 -5.671 -6.364 -7.403 1.00 0.00 H new ATOM 0 HA GLN A 68 -7.990 -4.792 -6.732 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -9.064 -6.368 -8.294 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -7.485 -5.927 -8.915 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -6.528 -8.021 -8.366 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -7.719 -8.358 -7.125 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.508 -9.634 -7.713 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.923 -10.031 -9.384 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.667 -7.600 -5.097 1.00 0.00 N ATOM 1069 CA GLN A 69 -8.269 -8.323 -3.947 1.00 0.00 C ATOM 1070 C GLN A 69 -8.364 -7.364 -2.761 1.00 0.00 C ATOM 1071 O GLN A 69 -9.408 -7.212 -2.156 1.00 0.00 O ATOM 1072 CB GLN A 69 -7.328 -9.482 -3.628 1.00 0.00 C ATOM 1073 CG GLN A 69 -8.003 -10.391 -2.598 1.00 0.00 C ATOM 1074 CD GLN A 69 -9.110 -11.203 -3.270 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -9.000 -11.567 -4.424 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -10.181 -11.506 -2.589 1.00 0.00 N ATOM 0 H GLN A 69 -6.773 -7.963 -5.428 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.270 -8.693 -4.167 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -7.098 -10.043 -4.534 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.383 -9.105 -3.238 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -7.267 -11.061 -2.153 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -8.419 -9.792 -1.788 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -10.273 -11.200 -1.620 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -10.926 -12.049 -3.025 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.287 -6.684 -2.441 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.346 -5.709 -1.315 1.00 0.00 C ATOM 1087 C LEU A 70 -8.529 -4.778 -1.570 1.00 0.00 C ATOM 1088 O LEU A 70 -9.368 -4.558 -0.719 1.00 0.00 O ATOM 1089 CB LEU A 70 -6.025 -4.927 -1.378 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.952 -5.626 -0.538 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.706 -5.847 -1.391 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.572 -4.743 0.652 1.00 0.00 C ATOM 0 H LEU A 70 -6.383 -6.763 -2.907 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.472 -6.179 -0.340 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.691 -4.847 -2.413 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.178 -3.912 -1.013 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.343 -6.580 -0.184 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.941 -6.344 -0.795 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.959 -6.469 -2.250 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.328 -4.886 -1.738 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.808 -5.244 1.247 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.183 -3.791 0.289 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.453 -4.564 1.268 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.602 -4.253 -2.765 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.728 -3.350 -3.137 1.00 0.00 C ATOM 1106 C CYS A 71 -11.058 -4.102 -3.061 1.00 0.00 C ATOM 1107 O CYS A 71 -12.060 -3.578 -2.617 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.440 -2.967 -4.590 1.00 0.00 C ATOM 1109 SG CYS A 71 -7.936 -1.966 -4.670 1.00 0.00 S ATOM 0 H CYS A 71 -7.921 -4.414 -3.507 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.804 -2.488 -2.475 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.323 -3.865 -5.197 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.281 -2.410 -5.003 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.122 -2.330 -3.724 1.00 0.00 H new ATOM 1115 N PHE A 72 -11.068 -5.327 -3.509 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.324 -6.126 -3.490 1.00 0.00 C ATOM 1117 C PHE A 72 -12.844 -6.277 -2.061 1.00 0.00 C ATOM 1118 O PHE A 72 -14.009 -6.064 -1.788 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.924 -7.487 -4.061 1.00 0.00 C ATOM 1120 CG PHE A 72 -13.132 -8.389 -4.095 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.575 -9.013 -2.923 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -13.813 -8.593 -5.298 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.701 -9.845 -2.957 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -14.940 -9.424 -5.333 1.00 0.00 C ATOM 1125 CZ PHE A 72 -15.384 -10.050 -4.162 1.00 0.00 C ATOM 0 H PHE A 72 -10.255 -5.811 -3.890 1.00 0.00 H new ATOM 0 HA PHE A 72 -13.122 -5.654 -4.063 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.517 -7.367 -5.065 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -11.139 -7.934 -3.450 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -13.049 -8.853 -1.993 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -13.470 -8.110 -6.201 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -15.043 -10.329 -2.054 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -15.466 -9.582 -6.263 1.00 0.00 H new ATOM 0 HZ PHE A 72 -16.253 -10.691 -4.188 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.991 -6.643 -1.151 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.433 -6.808 0.261 1.00 0.00 C ATOM 1137 C GLU A 73 -12.714 -5.442 0.882 1.00 0.00 C ATOM 1138 O GLU A 73 -13.461 -5.320 1.832 1.00 0.00 O ATOM 1139 CB GLU A 73 -11.261 -7.492 0.959 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.887 -8.751 0.179 1.00 0.00 C ATOM 1141 CD GLU A 73 -10.175 -9.736 1.107 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -10.863 -10.495 1.772 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -8.956 -9.715 1.137 1.00 0.00 O ATOM 0 H GLU A 73 -11.004 -6.836 -1.322 1.00 0.00 H new ATOM 0 HA GLU A 73 -13.351 -7.389 0.349 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.408 -6.815 1.014 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.530 -7.749 1.983 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.782 -9.212 -0.239 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -10.240 -8.493 -0.659 1.00 0.00 H new ATOM 1150 N GLY A 74 -12.118 -4.412 0.350 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.346 -3.053 0.905 1.00 0.00 C ATOM 1152 C GLY A 74 -11.050 -2.541 1.531 1.00 0.00 C ATOM 1153 O GLY A 74 -11.035 -1.528 2.202 1.00 0.00 O ATOM 0 H GLY A 74 -11.482 -4.455 -0.446 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.675 -2.376 0.117 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.139 -3.081 1.653 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.958 -3.225 1.318 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.676 -2.752 1.909 1.00 0.00 C ATOM 1159 C VAL A 75 -8.069 -1.662 1.028 1.00 0.00 C ATOM 1160 O VAL A 75 -7.358 -1.938 0.080 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.749 -3.971 1.949 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.628 -3.716 2.959 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.531 -5.219 2.369 1.00 0.00 C ATOM 0 H VAL A 75 -9.899 -4.081 0.767 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.824 -2.332 2.904 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.330 -4.132 0.956 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.965 -4.580 2.992 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.061 -2.835 2.659 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -7.059 -3.551 3.947 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.860 -6.078 2.393 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.958 -5.064 3.360 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.332 -5.404 1.653 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.334 -0.425 1.337 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.761 0.680 0.524 1.00 0.00 C ATOM 1175 C VAL A 76 -6.786 1.486 1.382 1.00 0.00 C ATOM 1176 O VAL A 76 -7.146 2.046 2.398 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.959 1.529 0.100 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.529 2.485 -1.013 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -10.071 0.613 -0.420 1.00 0.00 C ATOM 0 H VAL A 76 -8.922 -0.132 2.117 1.00 0.00 H new ATOM 0 HA VAL A 76 -7.206 0.325 -0.344 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.325 2.100 0.953 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.380 3.093 -1.319 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.732 3.133 -0.648 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -8.168 1.911 -1.866 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.927 1.216 -0.723 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.705 0.046 -1.276 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.374 -0.076 0.369 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.548 1.534 0.986 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.538 2.285 1.782 1.00 0.00 C ATOM 1191 C VAL A 77 -3.628 3.090 0.855 1.00 0.00 C ATOM 1192 O VAL A 77 -3.614 2.870 -0.340 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.727 1.197 2.485 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.563 0.564 3.594 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.338 0.121 1.467 1.00 0.00 C ATOM 0 H VAL A 77 -5.189 1.085 0.143 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.995 2.989 2.477 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.830 1.638 2.918 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.980 -0.211 4.092 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.845 1.328 4.319 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.462 0.122 3.165 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.759 -0.658 1.964 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.239 -0.316 1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.738 0.569 0.675 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.866 3.973 1.443 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.908 4.783 0.658 1.00 0.00 C ATOM 1207 C PRO A 78 -0.818 3.846 0.163 1.00 0.00 C ATOM 1208 O PRO A 78 0.153 3.583 0.844 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.369 5.789 1.666 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.572 5.140 2.991 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.813 4.293 2.872 1.00 0.00 C ATOM 0 HA PRO A 78 -2.332 5.287 -0.210 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.315 6.004 1.487 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.903 6.737 1.603 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.710 4.529 3.259 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.688 5.888 3.775 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.746 3.393 3.484 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.702 4.834 3.197 1.00 0.00 H new ATOM 1219 N ALA A 79 -1.007 3.291 -0.990 1.00 0.00 N ATOM 1220 CA ALA A 79 -0.028 2.310 -1.508 1.00 0.00 C ATOM 1221 C ALA A 79 0.916 2.919 -2.545 1.00 0.00 C ATOM 1222 O ALA A 79 0.501 3.579 -3.477 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.902 1.237 -2.149 1.00 0.00 C ATOM 0 H ALA A 79 -1.803 3.475 -1.601 1.00 0.00 H new ATOM 0 HA ALA A 79 0.623 1.933 -0.719 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.269 0.455 -2.568 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.561 0.806 -1.395 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.502 1.682 -2.943 1.00 0.00 H new ATOM 1229 N ILE A 80 2.188 2.664 -2.395 1.00 0.00 N ATOM 1230 CA ILE A 80 3.187 3.179 -3.375 1.00 0.00 C ATOM 1231 C ILE A 80 3.581 2.032 -4.313 1.00 0.00 C ATOM 1232 O ILE A 80 3.814 0.923 -3.876 1.00 0.00 O ATOM 1233 CB ILE A 80 4.380 3.635 -2.530 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.884 4.555 -1.407 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.369 4.399 -3.413 1.00 0.00 C ATOM 1236 CD1 ILE A 80 4.953 4.667 -0.314 1.00 0.00 C ATOM 0 H ILE A 80 2.581 2.116 -1.629 1.00 0.00 H new ATOM 0 HA ILE A 80 2.811 3.997 -3.989 1.00 0.00 H new ATOM 0 HB ILE A 80 4.875 2.765 -2.099 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.657 5.543 -1.808 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.959 4.162 -0.985 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.218 4.724 -2.812 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.719 3.748 -4.214 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.875 5.270 -3.843 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.594 5.322 0.480 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.159 3.678 0.096 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.867 5.081 -0.740 1.00 0.00 H new ATOM 1248 N VAL A 81 3.625 2.272 -5.599 1.00 0.00 N ATOM 1249 CA VAL A 81 3.966 1.164 -6.545 1.00 0.00 C ATOM 1250 C VAL A 81 5.354 1.364 -7.168 1.00 0.00 C ATOM 1251 O VAL A 81 5.831 2.471 -7.320 1.00 0.00 O ATOM 1252 CB VAL A 81 2.876 1.217 -7.616 1.00 0.00 C ATOM 1253 CG1 VAL A 81 3.126 0.117 -8.649 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.503 1.005 -6.960 1.00 0.00 C ATOM 0 H VAL A 81 3.442 3.177 -6.032 1.00 0.00 H new ATOM 0 HA VAL A 81 4.005 0.199 -6.040 1.00 0.00 H new ATOM 0 HB VAL A 81 2.895 2.189 -8.109 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.350 0.153 -9.414 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.100 0.269 -9.113 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.106 -0.855 -8.157 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.725 1.043 -7.723 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.481 0.033 -6.467 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.327 1.789 -6.223 1.00 0.00 H new ATOM 1264 N VAL A 82 6.004 0.285 -7.522 1.00 0.00 N ATOM 1265 CA VAL A 82 7.366 0.387 -8.130 1.00 0.00 C ATOM 1266 C VAL A 82 7.398 -0.271 -9.515 1.00 0.00 C ATOM 1267 O VAL A 82 6.596 -1.128 -9.827 1.00 0.00 O ATOM 1268 CB VAL A 82 8.280 -0.387 -7.180 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.741 -0.026 -7.465 1.00 0.00 C ATOM 1270 CG2 VAL A 82 7.943 -0.033 -5.732 1.00 0.00 C ATOM 0 H VAL A 82 5.649 -0.665 -7.416 1.00 0.00 H new ATOM 0 HA VAL A 82 7.669 1.426 -8.259 1.00 0.00 H new ATOM 0 HB VAL A 82 8.131 -1.456 -7.334 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.391 -0.579 -6.787 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.986 -0.286 -8.495 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.887 1.044 -7.316 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.598 -0.588 -5.060 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.085 1.036 -5.576 1.00 0.00 H new ATOM 0 HG23 VAL A 82 6.905 -0.295 -5.526 1.00 0.00 H new ATOM 1280 N GLY A 83 8.338 0.110 -10.339 1.00 0.00 N ATOM 1281 CA GLY A 83 8.446 -0.506 -11.693 1.00 0.00 C ATOM 1282 C GLY A 83 7.289 -0.044 -12.583 1.00 0.00 C ATOM 1283 O GLY A 83 6.528 -0.844 -13.088 1.00 0.00 O ATOM 0 H GLY A 83 9.037 0.823 -10.132 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.397 -0.231 -12.150 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.436 -1.593 -11.607 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.268 -0.332 -11.051 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.641 -1.407 -10.246 1.00 0.00 C ATOM 1494 C LEU A 98 -3.336 -1.447 -8.902 1.00 0.00 C ATOM 1495 O LEU A 98 -3.467 -2.477 -8.280 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.183 -0.981 -10.073 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.502 -0.880 -11.437 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.867 -0.210 -11.281 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.314 -2.283 -12.009 1.00 0.00 C ATOM 0 HA LEU A 98 -2.713 -2.392 -10.707 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.135 -0.020 -9.561 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.657 -1.702 -9.447 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.121 -0.286 -12.109 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.351 -0.139 -12.255 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.738 0.790 -10.867 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.488 -0.803 -10.610 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.172 -2.217 -12.983 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.307 -2.871 -11.333 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.286 -2.764 -12.120 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.789 -0.310 -8.467 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.493 -0.226 -7.164 1.00 0.00 C ATOM 1513 C TYR A 99 -5.601 0.830 -7.254 1.00 0.00 C ATOM 1514 O TYR A 99 -6.409 0.807 -8.162 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.403 0.182 -6.169 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.773 -0.254 -4.772 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.107 -0.515 -4.437 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.771 -0.390 -3.804 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.438 -0.913 -3.133 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.102 -0.788 -2.505 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.435 -1.050 -2.170 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.758 -1.442 -0.887 1.00 0.00 O ATOM 0 H TYR A 99 -3.700 0.576 -8.965 1.00 0.00 H new ATOM 0 HA TYR A 99 -4.974 -1.158 -6.866 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.453 -0.267 -6.457 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.265 1.263 -6.195 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.881 -0.410 -5.182 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.742 -0.187 -4.061 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.467 -1.113 -2.874 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.328 -0.893 -1.759 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.729 -1.551 -0.813 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.643 1.769 -6.345 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.703 2.822 -6.429 1.00 0.00 C ATOM 1534 C HIS A 100 -6.136 4.082 -7.089 1.00 0.00 C ATOM 1535 O HIS A 100 -5.057 4.070 -7.648 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.166 3.120 -4.992 1.00 0.00 C ATOM 1537 CG HIS A 100 -6.033 2.969 -4.010 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -5.818 1.779 -3.305 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.052 3.838 -3.587 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -4.748 1.965 -2.507 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.269 3.186 -2.656 1.00 0.00 N ATOM 0 H HIS A 100 -5.000 1.854 -5.558 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.544 2.484 -7.034 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -7.564 4.133 -4.939 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.977 2.444 -4.721 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -6.371 0.925 -3.381 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -4.918 4.855 -3.926 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.340 1.220 -1.840 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.463 3.578 -2.169 1.00 0.00 H new ATOM 1549 N SER A 101 -6.864 5.162 -7.049 1.00 0.00 N ATOM 1550 CA SER A 101 -6.377 6.417 -7.693 1.00 0.00 C ATOM 1551 C SER A 101 -5.533 7.239 -6.714 1.00 0.00 C ATOM 1552 O SER A 101 -5.167 8.363 -6.994 1.00 0.00 O ATOM 1553 CB SER A 101 -7.646 7.182 -8.061 1.00 0.00 C ATOM 1554 OG SER A 101 -8.041 7.985 -6.957 1.00 0.00 O ATOM 0 H SER A 101 -7.776 5.232 -6.598 1.00 0.00 H new ATOM 0 HA SER A 101 -5.745 6.212 -8.557 1.00 0.00 H new ATOM 0 HB2 SER A 101 -7.468 7.807 -8.936 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.442 6.485 -8.323 1.00 0.00 H new ATOM 0 HG SER A 101 -8.855 8.480 -7.187 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.232 6.698 -5.567 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.424 7.466 -4.574 1.00 0.00 C ATOM 1562 C ALA A 102 -3.042 6.834 -4.371 1.00 0.00 C ATOM 1563 O ALA A 102 -2.136 7.468 -3.871 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.234 7.410 -3.281 1.00 0.00 C ATOM 0 H ALA A 102 -5.508 5.761 -5.273 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.243 8.488 -4.907 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.706 7.954 -2.497 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.211 7.865 -3.444 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.364 6.371 -2.978 1.00 0.00 H new ATOM 1570 N GLU A 103 -2.861 5.598 -4.748 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.526 4.968 -4.561 1.00 0.00 C ATOM 1572 C GLU A 103 -0.446 5.839 -5.204 1.00 0.00 C ATOM 1573 O GLU A 103 -0.684 6.514 -6.184 1.00 0.00 O ATOM 1574 CB GLU A 103 -1.614 3.624 -5.275 1.00 0.00 C ATOM 1575 CG GLU A 103 -2.060 3.848 -6.722 1.00 0.00 C ATOM 1576 CD GLU A 103 -1.745 2.604 -7.557 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.109 1.707 -7.029 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -2.144 2.573 -8.709 1.00 0.00 O ATOM 0 H GLU A 103 -3.572 5.003 -5.173 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.268 4.852 -3.508 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -0.646 3.124 -5.254 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.321 2.972 -4.761 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -3.129 4.059 -6.755 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -1.551 4.717 -7.139 1.00 0.00 H new ATOM 1585 N LEU A 104 0.740 5.829 -4.667 1.00 0.00 N ATOM 1586 CA LEU A 104 1.824 6.658 -5.263 1.00 0.00 C ATOM 1587 C LEU A 104 2.736 5.791 -6.128 1.00 0.00 C ATOM 1588 O LEU A 104 2.811 4.590 -5.960 1.00 0.00 O ATOM 1589 CB LEU A 104 2.602 7.213 -4.072 1.00 0.00 C ATOM 1590 CG LEU A 104 2.150 8.645 -3.784 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.742 8.624 -3.187 1.00 0.00 C ATOM 1592 CD2 LEU A 104 3.119 9.293 -2.790 1.00 0.00 C ATOM 0 H LEU A 104 1.006 5.286 -3.845 1.00 0.00 H new ATOM 0 HA LEU A 104 1.430 7.449 -5.901 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.439 6.587 -3.195 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.671 7.194 -4.283 1.00 0.00 H new ATOM 0 HG LEU A 104 2.142 9.219 -4.710 1.00 0.00 H new ATOM 0 HD11 LEU A 104 0.419 9.644 -2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.054 8.161 -3.894 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.749 8.052 -2.259 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.799 10.314 -2.583 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.126 8.720 -1.863 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.122 9.307 -3.216 1.00 0.00 H new ATOM 1604 N HIS A 105 3.438 6.393 -7.045 1.00 0.00 N ATOM 1605 CA HIS A 105 4.357 5.605 -7.909 1.00 0.00 C ATOM 1606 C HIS A 105 5.803 5.932 -7.547 1.00 0.00 C ATOM 1607 O HIS A 105 6.141 7.060 -7.247 1.00 0.00 O ATOM 1608 CB HIS A 105 4.056 6.040 -9.341 1.00 0.00 C ATOM 1609 CG HIS A 105 2.670 5.603 -9.724 1.00 0.00 C ATOM 1610 ND1 HIS A 105 1.661 5.015 -9.005 1.00 0.00 N flip ATOM 1611 CD2 HIS A 105 2.177 5.760 -11.010 1.00 0.00 C flip ATOM 1612 CE1 HIS A 105 0.557 4.809 -9.827 1.00 0.00 C flip ATOM 1613 NE2 HIS A 105 0.922 5.275 -11.025 1.00 0.00 N flip ATOM 0 H HIS A 105 3.415 7.395 -7.233 1.00 0.00 H new ATOM 0 HA HIS A 105 4.219 4.531 -7.784 1.00 0.00 H new ATOM 0 HB2 HIS A 105 4.143 7.123 -9.428 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.786 5.606 -10.024 1.00 0.00 H new ATOM 0 HD2 HIS A 105 2.704 6.193 -11.847 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -0.390 4.368 -9.555 1.00 0.00 H new ATOM 0 HE2 HIS A 105 0.322 5.264 -11.850 1.00 0.00 H new ATOM 1621 N LEU A 106 6.658 4.955 -7.565 1.00 0.00 N ATOM 1622 CA LEU A 106 8.080 5.208 -7.214 1.00 0.00 C ATOM 1623 C LEU A 106 9.000 4.617 -8.283 1.00 0.00 C ATOM 1624 O LEU A 106 8.700 3.603 -8.881 1.00 0.00 O ATOM 1625 CB LEU A 106 8.277 4.501 -5.873 1.00 0.00 C ATOM 1626 CG LEU A 106 9.748 4.569 -5.459 1.00 0.00 C ATOM 1627 CD1 LEU A 106 10.158 6.027 -5.227 1.00 0.00 C ATOM 1628 CD2 LEU A 106 9.941 3.774 -4.165 1.00 0.00 C ATOM 0 H LEU A 106 6.435 3.990 -7.808 1.00 0.00 H new ATOM 0 HA LEU A 106 8.316 6.270 -7.154 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.654 4.969 -5.111 1.00 0.00 H new ATOM 0 HB3 LEU A 106 7.960 3.461 -5.950 1.00 0.00 H new ATOM 0 HG LEU A 106 10.367 4.146 -6.250 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.207 6.068 -4.932 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.017 6.595 -6.146 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.542 6.457 -4.437 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.988 3.818 -3.864 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.319 4.202 -3.379 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.654 2.735 -4.330 1.00 0.00 H new ATOM 1640 N GLY A 107 10.116 5.241 -8.533 1.00 0.00 N ATOM 1641 CA GLY A 107 11.042 4.708 -9.567 1.00 0.00 C ATOM 1642 C GLY A 107 11.821 3.528 -8.990 1.00 0.00 C ATOM 1643 O GLY A 107 12.149 3.501 -7.820 1.00 0.00 O ATOM 0 H GLY A 107 10.426 6.094 -8.067 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.480 4.392 -10.446 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.730 5.488 -9.892 1.00 0.00 H new ATOM 1647 N ILE A 108 12.127 2.552 -9.799 1.00 0.00 N ATOM 1648 CA ILE A 108 12.888 1.384 -9.301 1.00 0.00 C ATOM 1649 C ILE A 108 14.230 1.844 -8.737 1.00 0.00 C ATOM 1650 O ILE A 108 14.668 1.393 -7.697 1.00 0.00 O ATOM 1651 CB ILE A 108 13.100 0.535 -10.546 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.753 0.045 -11.084 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.967 -0.654 -10.190 1.00 0.00 C ATOM 1654 CD1 ILE A 108 11.911 -0.361 -12.551 1.00 0.00 C ATOM 0 H ILE A 108 11.879 2.518 -10.788 1.00 0.00 H new ATOM 0 HA ILE A 108 12.376 0.844 -8.504 1.00 0.00 H new ATOM 0 HB ILE A 108 13.589 1.134 -11.314 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.400 -0.803 -10.496 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.004 0.831 -10.991 1.00 0.00 H new ATOM 0 HG21 ILE A 108 14.124 -1.268 -11.077 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.929 -0.304 -9.816 1.00 0.00 H new ATOM 0 HG23 ILE A 108 13.473 -1.247 -9.421 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.953 -0.710 -12.937 1.00 0.00 H new ATOM 0 HD12 ILE A 108 12.245 0.498 -13.132 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.648 -1.161 -12.630 1.00 0.00 H new ATOM 1666 N HIS A 109 14.881 2.746 -9.413 1.00 0.00 N ATOM 1667 CA HIS A 109 16.190 3.248 -8.914 1.00 0.00 C ATOM 1668 C HIS A 109 15.959 4.430 -7.968 1.00 0.00 C ATOM 1669 O HIS A 109 16.887 5.069 -7.513 1.00 0.00 O ATOM 1670 CB HIS A 109 16.950 3.684 -10.171 1.00 0.00 C ATOM 1671 CG HIS A 109 16.429 5.012 -10.651 1.00 0.00 C ATOM 1672 ND1 HIS A 109 17.222 6.148 -10.682 1.00 0.00 N ATOM 1673 CD2 HIS A 109 15.199 5.402 -11.123 1.00 0.00 C ATOM 1674 CE1 HIS A 109 16.470 7.156 -11.159 1.00 0.00 C ATOM 1675 NE2 HIS A 109 15.227 6.757 -11.443 1.00 0.00 N ATOM 0 H HIS A 109 14.563 3.158 -10.290 1.00 0.00 H new ATOM 0 HA HIS A 109 16.747 2.498 -8.353 1.00 0.00 H new ATOM 0 HB2 HIS A 109 18.016 3.759 -9.954 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.836 2.934 -10.954 1.00 0.00 H new ATOM 0 HD2 HIS A 109 14.340 4.756 -11.230 1.00 0.00 H new ATOM 0 HE1 HIS A 109 16.828 8.166 -11.296 1.00 0.00 H new ATOM 0 HE2 HIS A 109 14.464 7.323 -11.814 1.00 0.00 H new ATOM 1683 N GLN A 110 14.721 4.721 -7.666 1.00 0.00 N ATOM 1684 CA GLN A 110 14.419 5.857 -6.746 1.00 0.00 C ATOM 1685 C GLN A 110 14.047 5.327 -5.359 1.00 0.00 C ATOM 1686 O GLN A 110 13.287 5.942 -4.637 1.00 0.00 O ATOM 1687 CB GLN A 110 13.224 6.578 -7.372 1.00 0.00 C ATOM 1688 CG GLN A 110 13.656 7.281 -8.660 1.00 0.00 C ATOM 1689 CD GLN A 110 12.495 8.124 -9.192 1.00 0.00 C ATOM 1690 OE1 GLN A 110 11.682 7.646 -9.958 1.00 0.00 O ATOM 1691 NE2 GLN A 110 12.382 9.367 -8.813 1.00 0.00 N ATOM 0 H GLN A 110 13.905 4.220 -8.017 1.00 0.00 H new ATOM 0 HA GLN A 110 15.275 6.520 -6.622 1.00 0.00 H new ATOM 0 HB2 GLN A 110 12.429 5.864 -7.586 1.00 0.00 H new ATOM 0 HB3 GLN A 110 12.818 7.305 -6.669 1.00 0.00 H new ATOM 0 HG2 GLN A 110 14.522 7.914 -8.469 1.00 0.00 H new ATOM 0 HG3 GLN A 110 13.957 6.545 -9.406 1.00 0.00 H new ATOM 0 HE21 GLN A 110 13.065 9.768 -8.170 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.611 9.938 -9.160 1.00 0.00 H new ATOM 1700 N LEU A 111 14.563 4.187 -4.985 1.00 0.00 N ATOM 1701 CA LEU A 111 14.223 3.617 -3.647 1.00 0.00 C ATOM 1702 C LEU A 111 14.786 4.493 -2.535 1.00 0.00 C ATOM 1703 O LEU A 111 15.630 4.091 -1.759 1.00 0.00 O ATOM 1704 CB LEU A 111 14.864 2.223 -3.632 1.00 0.00 C ATOM 1705 CG LEU A 111 13.957 1.196 -4.330 1.00 0.00 C ATOM 1706 CD1 LEU A 111 13.063 0.526 -3.294 1.00 0.00 C ATOM 1707 CD2 LEU A 111 13.080 1.876 -5.383 1.00 0.00 C ATOM 0 H LEU A 111 15.204 3.626 -5.546 1.00 0.00 H new ATOM 0 HA LEU A 111 13.147 3.566 -3.481 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.832 2.258 -4.131 1.00 0.00 H new ATOM 0 HB3 LEU A 111 15.047 1.913 -2.603 1.00 0.00 H new ATOM 0 HG LEU A 111 14.586 0.454 -4.822 1.00 0.00 H new ATOM 0 HD11 LEU A 111 12.419 -0.203 -3.786 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.681 0.021 -2.552 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.448 1.280 -2.802 1.00 0.00 H new ATOM 0 HD21 LEU A 111 12.446 1.131 -5.865 1.00 0.00 H new ATOM 0 HD22 LEU A 111 12.455 2.630 -4.904 1.00 0.00 H new ATOM 0 HD23 LEU A 111 13.713 2.352 -6.132 1.00 0.00 H new ATOM 1719 N GLU A 112 14.305 5.689 -2.463 1.00 0.00 N ATOM 1720 CA GLU A 112 14.767 6.640 -1.412 1.00 0.00 C ATOM 1721 C GLU A 112 13.648 7.634 -1.073 1.00 0.00 C ATOM 1722 O GLU A 112 13.730 8.370 -0.112 1.00 0.00 O ATOM 1723 CB GLU A 112 15.954 7.375 -2.036 1.00 0.00 C ATOM 1724 CG GLU A 112 16.989 6.363 -2.528 1.00 0.00 C ATOM 1725 CD GLU A 112 18.222 7.104 -3.048 1.00 0.00 C ATOM 1726 OE1 GLU A 112 18.058 8.193 -3.573 1.00 0.00 O ATOM 1727 OE2 GLU A 112 19.311 6.570 -2.910 1.00 0.00 O ATOM 0 H GLU A 112 13.598 6.063 -3.096 1.00 0.00 H new ATOM 0 HA GLU A 112 15.040 6.132 -0.487 1.00 0.00 H new ATOM 0 HB2 GLU A 112 15.614 7.994 -2.866 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.405 8.044 -1.303 1.00 0.00 H new ATOM 0 HG2 GLU A 112 17.271 5.692 -1.717 1.00 0.00 H new ATOM 0 HG3 GLU A 112 16.562 5.746 -3.319 1.00 0.00 H new ATOM 1734 N GLN A 113 12.605 7.663 -1.862 1.00 0.00 N ATOM 1735 CA GLN A 113 11.485 8.612 -1.598 1.00 0.00 C ATOM 1736 C GLN A 113 10.340 7.891 -0.891 1.00 0.00 C ATOM 1737 O GLN A 113 9.361 8.488 -0.511 1.00 0.00 O ATOM 1738 CB GLN A 113 11.061 9.089 -2.988 1.00 0.00 C ATOM 1739 CG GLN A 113 12.115 10.060 -3.523 1.00 0.00 C ATOM 1740 CD GLN A 113 12.430 9.733 -4.983 1.00 0.00 C ATOM 1741 OE1 GLN A 113 11.611 9.939 -5.857 1.00 0.00 O ATOM 1742 NE2 GLN A 113 13.596 9.229 -5.286 1.00 0.00 N ATOM 0 H GLN A 113 12.481 7.067 -2.681 1.00 0.00 H new ATOM 0 HA GLN A 113 11.772 9.440 -0.950 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.955 8.239 -3.662 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.089 9.579 -2.938 1.00 0.00 H new ATOM 0 HG2 GLN A 113 11.753 11.085 -3.441 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.022 9.993 -2.922 1.00 0.00 H new ATOM 0 HE21 GLN A 113 14.283 9.056 -4.552 1.00 0.00 H new ATOM 0 HE22 GLN A 113 13.820 9.008 -6.256 1.00 0.00 H new ATOM 1751 N LEU A 114 10.458 6.609 -0.714 1.00 0.00 N ATOM 1752 CA LEU A 114 9.374 5.844 -0.037 1.00 0.00 C ATOM 1753 C LEU A 114 8.847 6.573 1.210 1.00 0.00 C ATOM 1754 O LEU A 114 7.655 6.689 1.375 1.00 0.00 O ATOM 1755 CB LEU A 114 10.006 4.504 0.330 1.00 0.00 C ATOM 1756 CG LEU A 114 9.982 3.585 -0.895 1.00 0.00 C ATOM 1757 CD1 LEU A 114 11.404 3.383 -1.420 1.00 0.00 C ATOM 1758 CD2 LEU A 114 9.390 2.230 -0.502 1.00 0.00 C ATOM 0 H LEU A 114 11.261 6.053 -1.009 1.00 0.00 H new ATOM 0 HA LEU A 114 8.506 5.725 -0.685 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.031 4.652 0.669 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.461 4.045 1.155 1.00 0.00 H new ATOM 0 HG LEU A 114 9.372 4.041 -1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 114 11.381 2.728 -2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 114 11.828 4.347 -1.701 1.00 0.00 H new ATOM 0 HD13 LEU A 114 12.018 2.930 -0.642 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.372 1.574 -1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 114 10.001 1.779 0.279 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.374 2.370 -0.132 1.00 0.00 H new ATOM 1770 N PRO A 115 9.729 7.042 2.058 1.00 0.00 N ATOM 1771 CA PRO A 115 9.275 7.750 3.285 1.00 0.00 C ATOM 1772 C PRO A 115 8.590 9.055 2.898 1.00 0.00 C ATOM 1773 O PRO A 115 7.437 9.276 3.211 1.00 0.00 O ATOM 1774 CB PRO A 115 10.564 7.994 4.064 1.00 0.00 C ATOM 1775 CG PRO A 115 11.637 7.967 3.026 1.00 0.00 C ATOM 1776 CD PRO A 115 11.191 6.980 1.978 1.00 0.00 C ATOM 0 HA PRO A 115 8.549 7.190 3.874 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.539 8.952 4.584 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.723 7.225 4.820 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.782 8.956 2.591 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.591 7.667 3.461 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.552 7.255 0.987 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.563 5.977 2.186 1.00 0.00 H new ATOM 1784 N TYR A 116 9.274 9.912 2.196 1.00 0.00 N ATOM 1785 CA TYR A 116 8.635 11.179 1.767 1.00 0.00 C ATOM 1786 C TYR A 116 7.410 10.823 0.913 1.00 0.00 C ATOM 1787 O TYR A 116 6.410 11.513 0.916 1.00 0.00 O ATOM 1788 CB TYR A 116 9.741 11.907 0.978 1.00 0.00 C ATOM 1789 CG TYR A 116 9.282 12.245 -0.422 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.256 13.174 -0.613 1.00 0.00 C ATOM 1791 CD2 TYR A 116 9.887 11.629 -1.521 1.00 0.00 C ATOM 1792 CE1 TYR A 116 7.833 13.488 -1.909 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.465 11.942 -2.818 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.437 12.872 -3.012 1.00 0.00 C ATOM 1795 OH TYR A 116 8.019 13.185 -4.290 1.00 0.00 O ATOM 0 H TYR A 116 10.243 9.789 1.903 1.00 0.00 H new ATOM 0 HA TYR A 116 8.272 11.815 2.574 1.00 0.00 H new ATOM 0 HB2 TYR A 116 10.023 12.820 1.501 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.631 11.279 0.930 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.790 13.649 0.238 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.680 10.912 -1.369 1.00 0.00 H new ATOM 0 HE1 TYR A 116 7.040 14.206 -2.059 1.00 0.00 H new ATOM 0 HE2 TYR A 116 9.932 11.467 -3.668 1.00 0.00 H new ATOM 0 HH TYR A 116 8.541 12.670 -4.940 1.00 0.00 H new ATOM 1805 N GLN A 117 7.486 9.724 0.214 1.00 0.00 N ATOM 1806 CA GLN A 117 6.339 9.270 -0.616 1.00 0.00 C ATOM 1807 C GLN A 117 5.251 8.736 0.307 1.00 0.00 C ATOM 1808 O GLN A 117 4.084 9.034 0.155 1.00 0.00 O ATOM 1809 CB GLN A 117 6.902 8.147 -1.486 1.00 0.00 C ATOM 1810 CG GLN A 117 7.706 8.751 -2.637 1.00 0.00 C ATOM 1811 CD GLN A 117 6.763 9.062 -3.800 1.00 0.00 C ATOM 1812 OE1 GLN A 117 5.967 8.231 -4.188 1.00 0.00 O ATOM 1813 NE2 GLN A 117 6.817 10.231 -4.375 1.00 0.00 N ATOM 0 H GLN A 117 8.304 9.116 0.184 1.00 0.00 H new ATOM 0 HA GLN A 117 5.905 10.065 -1.222 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.537 7.493 -0.889 1.00 0.00 H new ATOM 0 HB3 GLN A 117 6.090 7.534 -1.877 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.209 9.660 -2.307 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.482 8.056 -2.958 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.485 10.929 -4.049 1.00 0.00 H new ATOM 0 HE22 GLN A 117 6.191 10.447 -5.150 1.00 0.00 H new ATOM 1822 N VAL A 118 5.640 7.961 1.280 1.00 0.00 N ATOM 1823 CA VAL A 118 4.646 7.415 2.240 1.00 0.00 C ATOM 1824 C VAL A 118 3.862 8.581 2.844 1.00 0.00 C ATOM 1825 O VAL A 118 2.649 8.575 2.860 1.00 0.00 O ATOM 1826 CB VAL A 118 5.478 6.676 3.301 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.755 6.691 4.652 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.681 5.223 2.865 1.00 0.00 C ATOM 0 H VAL A 118 6.606 7.682 1.451 1.00 0.00 H new ATOM 0 HA VAL A 118 3.921 6.740 1.784 1.00 0.00 H new ATOM 0 HB VAL A 118 6.440 7.178 3.403 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.357 6.164 5.393 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.605 7.722 4.973 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.788 6.198 4.553 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.271 4.697 3.616 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.712 4.736 2.759 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.206 5.200 1.910 1.00 0.00 H new ATOM 1838 N ASP A 119 4.537 9.600 3.313 1.00 0.00 N ATOM 1839 CA ASP A 119 3.794 10.763 3.875 1.00 0.00 C ATOM 1840 C ASP A 119 2.962 11.390 2.759 1.00 0.00 C ATOM 1841 O ASP A 119 1.824 11.769 2.951 1.00 0.00 O ATOM 1842 CB ASP A 119 4.864 11.737 4.366 1.00 0.00 C ATOM 1843 CG ASP A 119 5.385 11.283 5.731 1.00 0.00 C ATOM 1844 OD1 ASP A 119 5.449 10.084 5.949 1.00 0.00 O ATOM 1845 OD2 ASP A 119 5.711 12.140 6.535 1.00 0.00 O ATOM 0 H ASP A 119 5.554 9.675 3.331 1.00 0.00 H new ATOM 0 HA ASP A 119 3.120 10.487 4.686 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.684 11.783 3.650 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.449 12.742 4.440 1.00 0.00 H new ATOM 1850 N ALA A 120 3.522 11.474 1.582 1.00 0.00 N ATOM 1851 CA ALA A 120 2.768 12.048 0.436 1.00 0.00 C ATOM 1852 C ALA A 120 1.628 11.100 0.071 1.00 0.00 C ATOM 1853 O ALA A 120 0.607 11.507 -0.444 1.00 0.00 O ATOM 1854 CB ALA A 120 3.779 12.139 -0.707 1.00 0.00 C ATOM 0 H ALA A 120 4.471 11.169 1.367 1.00 0.00 H new ATOM 0 HA ALA A 120 2.334 13.023 0.658 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.294 12.555 -1.590 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.607 12.783 -0.410 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.159 11.144 -0.937 1.00 0.00 H new ATOM 1860 N ALA A 121 1.797 9.833 0.341 1.00 0.00 N ATOM 1861 CA ALA A 121 0.724 8.854 0.020 1.00 0.00 C ATOM 1862 C ALA A 121 -0.365 8.886 1.097 1.00 0.00 C ATOM 1863 O ALA A 121 -1.541 8.793 0.806 1.00 0.00 O ATOM 1864 CB ALA A 121 1.428 7.494 -0.002 1.00 0.00 C ATOM 0 H ALA A 121 2.633 9.436 0.770 1.00 0.00 H new ATOM 0 HA ALA A 121 0.232 9.073 -0.927 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.704 6.713 -0.233 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.209 7.501 -0.763 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.873 7.299 0.974 1.00 0.00 H new ATOM 1870 N LEU A 122 0.014 9.020 2.342 1.00 0.00 N ATOM 1871 CA LEU A 122 -1.007 9.058 3.429 1.00 0.00 C ATOM 1872 C LEU A 122 -1.937 10.253 3.228 1.00 0.00 C ATOM 1873 O LEU A 122 -3.144 10.120 3.213 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.207 9.212 4.724 1.00 0.00 C ATOM 1875 CG LEU A 122 0.724 8.013 4.902 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.881 8.403 5.824 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.050 6.852 5.529 1.00 0.00 C ATOM 0 H LEU A 122 0.982 9.104 2.651 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.631 8.164 3.443 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.374 10.134 4.696 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.885 9.287 5.574 1.00 0.00 H new ATOM 0 HG LEU A 122 1.113 7.709 3.930 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.547 7.550 5.953 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.434 9.232 5.383 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.487 8.706 6.794 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.615 5.998 5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.438 7.156 6.501 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -0.879 6.574 4.878 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.385 11.421 3.058 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.241 12.620 2.843 1.00 0.00 C ATOM 1891 C ALA A 123 -3.008 12.467 1.532 1.00 0.00 C ATOM 1892 O ALA A 123 -4.188 12.746 1.453 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.275 13.801 2.770 1.00 0.00 C ATOM 0 H ALA A 123 -0.380 11.597 3.059 1.00 0.00 H new ATOM 0 HA ALA A 123 -2.975 12.758 3.637 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.837 14.722 2.612 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.716 13.872 3.703 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.581 13.653 1.942 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.349 12.011 0.503 1.00 0.00 N ATOM 1900 CA GLU A 124 -3.045 11.825 -0.797 1.00 0.00 C ATOM 1901 C GLU A 124 -4.160 10.789 -0.636 1.00 0.00 C ATOM 1902 O GLU A 124 -5.232 10.924 -1.192 1.00 0.00 O ATOM 1903 CB GLU A 124 -1.972 11.315 -1.759 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.457 11.488 -3.197 1.00 0.00 C ATOM 1905 CD GLU A 124 -2.832 12.952 -3.429 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -2.360 13.790 -2.677 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -3.588 13.213 -4.350 1.00 0.00 O ATOM 0 H GLU A 124 -1.360 11.760 0.508 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.504 12.744 -1.161 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.042 11.864 -1.608 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.758 10.265 -1.559 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -1.677 11.185 -3.895 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.318 10.846 -3.383 1.00 0.00 H new ATOM 1914 N PHE A 125 -3.914 9.753 0.123 1.00 0.00 N ATOM 1915 CA PHE A 125 -4.961 8.712 0.315 1.00 0.00 C ATOM 1916 C PHE A 125 -6.044 9.205 1.281 1.00 0.00 C ATOM 1917 O PHE A 125 -7.223 9.048 1.031 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.226 7.503 0.895 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.236 6.524 1.432 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -5.718 6.670 2.736 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.696 5.478 0.626 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -6.662 5.769 3.236 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.639 4.575 1.126 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.124 4.721 2.432 1.00 0.00 C ATOM 0 H PHE A 125 -3.037 9.585 0.615 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.467 8.468 -0.619 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.615 7.030 0.126 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -3.550 7.819 1.689 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -5.361 7.479 3.357 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -5.323 5.368 -0.382 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -7.035 5.882 4.243 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.993 3.765 0.506 1.00 0.00 H new ATOM 0 HZ PHE A 125 -7.854 4.025 2.818 1.00 0.00 H new ATOM 1934 N LEU A 126 -5.665 9.804 2.380 1.00 0.00 N ATOM 1935 CA LEU A 126 -6.697 10.296 3.336 1.00 0.00 C ATOM 1936 C LEU A 126 -7.595 11.312 2.635 1.00 0.00 C ATOM 1937 O LEU A 126 -8.804 11.281 2.757 1.00 0.00 O ATOM 1938 CB LEU A 126 -5.913 10.962 4.466 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.131 9.903 5.245 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -4.218 10.589 6.262 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.111 8.986 5.980 1.00 0.00 C ATOM 0 H LEU A 126 -4.697 9.972 2.654 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.337 9.497 3.710 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.229 11.706 4.058 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.595 11.489 5.134 1.00 0.00 H new ATOM 0 HG LEU A 126 -4.528 9.314 4.554 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.661 9.835 6.817 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -3.521 11.245 5.741 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.821 11.177 6.954 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -5.555 8.231 6.536 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -6.713 9.576 6.672 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -6.764 8.497 5.257 1.00 0.00 H new ATOM 1953 N ARG A 127 -7.008 12.201 1.887 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.819 13.215 1.153 1.00 0.00 C ATOM 1955 C ARG A 127 -8.772 12.519 0.185 1.00 0.00 C ATOM 1956 O ARG A 127 -9.912 12.910 0.024 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.796 14.053 0.386 1.00 0.00 C ATOM 1958 CG ARG A 127 -7.525 15.085 -0.475 1.00 0.00 C ATOM 1959 CD ARG A 127 -8.184 16.132 0.422 1.00 0.00 C ATOM 1960 NE ARG A 127 -8.998 16.967 -0.508 1.00 0.00 N ATOM 1961 CZ ARG A 127 -9.704 17.966 -0.048 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -9.680 18.257 1.224 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -10.433 18.680 -0.868 1.00 0.00 N ATOM 0 H ARG A 127 -6.000 12.271 1.750 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.429 13.824 1.820 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -6.125 14.554 1.083 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.180 13.409 -0.242 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -6.823 15.566 -1.156 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -8.279 14.593 -1.090 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -8.808 15.665 1.184 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -7.439 16.732 0.944 1.00 0.00 H new ATOM 0 HE ARG A 127 -9.004 16.758 -1.506 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -9.109 17.704 1.863 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -10.232 19.037 1.579 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -10.449 18.456 -1.863 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -10.985 19.460 -0.512 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.315 11.484 -0.462 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.191 10.762 -1.425 1.00 0.00 C ATOM 1979 C LEU A 128 -10.007 9.684 -0.706 1.00 0.00 C ATOM 1980 O LEU A 128 -10.808 8.999 -1.311 1.00 0.00 O ATOM 1981 CB LEU A 128 -8.234 10.131 -2.432 1.00 0.00 C ATOM 1982 CG LEU A 128 -8.277 10.927 -3.736 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -7.519 12.243 -3.556 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -7.628 10.110 -4.856 1.00 0.00 C ATOM 0 H LEU A 128 -7.372 11.107 -0.365 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.909 11.427 -1.905 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.220 10.122 -2.031 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.514 9.094 -2.616 1.00 0.00 H new ATOM 0 HG LEU A 128 -9.314 11.139 -3.998 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.550 12.811 -4.486 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -7.984 12.825 -2.760 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -6.482 12.033 -3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -7.659 10.678 -5.786 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.591 9.896 -4.596 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.171 9.174 -4.985 1.00 0.00 H new ATOM 1996 N ALA A 129 -9.817 9.528 0.576 1.00 0.00 N ATOM 1997 CA ALA A 129 -10.594 8.493 1.314 1.00 0.00 C ATOM 1998 C ALA A 129 -12.049 8.956 1.489 1.00 0.00 C ATOM 1999 O ALA A 129 -12.290 10.085 1.869 1.00 0.00 O ATOM 2000 CB ALA A 129 -9.911 8.371 2.674 1.00 0.00 C ATOM 0 H ALA A 129 -9.162 10.069 1.141 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.617 7.541 0.784 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.429 7.624 3.276 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.873 8.068 2.534 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -9.942 9.334 3.184 1.00 0.00 H new ATOM 2006 N PRO A 130 -12.977 8.076 1.211 1.00 0.00 N ATOM 2007 CA PRO A 130 -12.642 6.708 0.749 1.00 0.00 C ATOM 2008 C PRO A 130 -12.174 6.751 -0.707 1.00 0.00 C ATOM 2009 O PRO A 130 -12.827 7.319 -1.560 1.00 0.00 O ATOM 2010 CB PRO A 130 -13.958 5.951 0.875 1.00 0.00 C ATOM 2011 CG PRO A 130 -15.017 7.000 0.782 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.426 8.284 1.300 1.00 0.00 C ATOM 0 HA PRO A 130 -11.839 6.243 1.320 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.065 5.211 0.082 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.016 5.415 1.822 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.350 7.119 -0.249 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -15.891 6.716 1.368 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -14.743 9.138 0.702 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -14.738 8.480 2.326 1.00 0.00 H new ATOM 2020 N VAL A 131 -11.050 6.163 -1.000 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.552 6.179 -2.403 1.00 0.00 C ATOM 2022 C VAL A 131 -11.423 5.286 -3.284 1.00 0.00 C ATOM 2023 O VAL A 131 -12.118 4.408 -2.808 1.00 0.00 O ATOM 2024 CB VAL A 131 -9.132 5.623 -2.336 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.410 5.905 -3.654 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -8.375 6.290 -1.186 1.00 0.00 C ATOM 0 H VAL A 131 -10.455 5.673 -0.332 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.579 7.181 -2.831 1.00 0.00 H new ATOM 0 HB VAL A 131 -9.172 4.547 -2.168 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.396 5.508 -3.606 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.948 5.428 -4.473 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.370 6.981 -3.824 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.361 5.892 -1.139 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -8.335 7.366 -1.352 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -8.888 6.087 -0.246 1.00 0.00 H new ATOM 2036 N GLU A 132 -11.382 5.500 -4.566 1.00 0.00 N ATOM 2037 CA GLU A 132 -12.196 4.661 -5.489 1.00 0.00 C ATOM 2038 C GLU A 132 -11.395 3.423 -5.882 1.00 0.00 C ATOM 2039 O GLU A 132 -10.366 3.513 -6.523 1.00 0.00 O ATOM 2040 CB GLU A 132 -12.465 5.547 -6.705 1.00 0.00 C ATOM 2041 CG GLU A 132 -13.405 4.819 -7.662 1.00 0.00 C ATOM 2042 CD GLU A 132 -13.536 5.623 -8.956 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -13.530 6.840 -8.875 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -13.639 5.009 -10.004 1.00 0.00 O ATOM 0 H GLU A 132 -10.819 6.221 -5.018 1.00 0.00 H new ATOM 0 HA GLU A 132 -13.127 4.316 -5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.908 6.492 -6.390 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.529 5.787 -7.209 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.021 3.822 -7.878 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.384 4.691 -7.200 1.00 0.00 H new ATOM 2051 N THR A 133 -11.848 2.268 -5.492 1.00 0.00 N ATOM 2052 CA THR A 133 -11.095 1.033 -5.832 1.00 0.00 C ATOM 2053 C THR A 133 -11.934 0.118 -6.727 1.00 0.00 C ATOM 2054 O THR A 133 -12.249 -0.997 -6.363 1.00 0.00 O ATOM 2055 CB THR A 133 -10.827 0.363 -4.486 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.885 0.667 -3.586 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.500 0.869 -3.916 1.00 0.00 C ATOM 0 H THR A 133 -12.703 2.125 -4.955 1.00 0.00 H new ATOM 0 HA THR A 133 -10.177 1.247 -6.380 1.00 0.00 H new ATOM 0 HB THR A 133 -10.769 -0.717 -4.622 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.714 0.236 -2.723 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.310 0.390 -2.955 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.692 0.629 -4.607 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.551 1.949 -3.779 1.00 0.00 H new ATOM 2065 N MET A 134 -12.298 0.573 -7.895 1.00 0.00 N ATOM 2066 CA MET A 134 -13.112 -0.288 -8.801 1.00 0.00 C ATOM 2067 C MET A 134 -12.350 -1.580 -9.111 1.00 0.00 C ATOM 2068 O MET A 134 -12.935 -2.611 -9.381 1.00 0.00 O ATOM 2069 CB MET A 134 -13.321 0.544 -10.070 1.00 0.00 C ATOM 2070 CG MET A 134 -14.209 1.750 -9.750 1.00 0.00 C ATOM 2071 SD MET A 134 -15.908 1.194 -9.465 1.00 0.00 S ATOM 2072 CE MET A 134 -16.425 1.135 -11.197 1.00 0.00 C ATOM 0 H MET A 134 -12.069 1.498 -8.260 1.00 0.00 H new ATOM 0 HA MET A 134 -14.064 -0.579 -8.357 1.00 0.00 H new ATOM 0 HB2 MET A 134 -12.360 0.880 -10.460 1.00 0.00 H new ATOM 0 HB3 MET A 134 -13.784 -0.066 -10.846 1.00 0.00 H new ATOM 0 HG2 MET A 134 -13.832 2.268 -8.868 1.00 0.00 H new ATOM 0 HG3 MET A 134 -14.182 2.463 -10.574 1.00 0.00 H new ATOM 0 HE1 MET A 134 -17.027 2.014 -11.427 1.00 0.00 H new ATOM 0 HE2 MET A 134 -15.544 1.119 -11.839 1.00 0.00 H new ATOM 0 HE3 MET A 134 -17.016 0.236 -11.370 1.00 0.00 H new ATOM 2082 N ALA A 135 -11.045 -1.531 -9.068 1.00 0.00 N ATOM 2083 CA ALA A 135 -10.238 -2.753 -9.351 1.00 0.00 C ATOM 2084 C ALA A 135 -10.696 -3.402 -10.657 1.00 0.00 C ATOM 2085 O ALA A 135 -11.058 -4.566 -10.622 1.00 0.00 O ATOM 2086 CB ALA A 135 -10.500 -3.686 -8.167 1.00 0.00 C ATOM 2087 OXT ALA A 135 -10.675 -2.726 -11.672 1.00 0.00 O ATOM 0 H ALA A 135 -10.502 -0.696 -8.849 1.00 0.00 H new ATOM 0 HA ALA A 135 -9.178 -2.528 -9.465 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -9.939 -4.611 -8.302 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -10.183 -3.200 -7.244 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -11.565 -3.912 -8.111 1.00 0.00 H new