USER MOD reduce.3.24.130724 H: found=0, std=0, add=965, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 963 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 29 ASN : amide:sc= -3.42 K(o=-5.9,f=-6.9!) USER MOD Set 1.2: A 73 ASN : amide:sc= -2.46! C(o=-5.9!,f=-8.9!) USER MOD Single : A 1 GLY N :NH3+ -102:sc= 0.0753 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.204 K(o=-0.2,f=-2.2!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot -137:sc= 1.25 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0646) USER MOD Single : A 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 130:sc= -0.387 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -0.813 USER MOD Single : A 51 THR OG1 : rot 122:sc= 1.17 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -1.94 K(o=-1.9,f=-1.1) USER MOD Single : A 67 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.0133) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -12:sc= 0.362 USER MOD Single : A 76 SER OG : rot 37:sc= 0.876 USER MOD Single : A 83 THR OG1 : rot 149:sc= 1.5 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0623 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.428 X(o=-0.43,f=-0.076) USER MOD Single : A 99 ASN : amide:sc= -0.451 X(o=-0.45,f=0.046) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00522) USER MOD Single : A 114 ASN : amide:sc= -1.66 X(o=-1.7,f=-2.1) USER MOD Single : A 116 ASN : amide:sc=-0.00816 X(o=-0.0082,f=0) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.261 1.824 20.968 1.00 0.00 N ATOM 2 CA GLY A 1 -12.434 2.862 20.381 1.00 0.00 C ATOM 3 C GLY A 1 -12.950 3.321 19.032 1.00 0.00 C ATOM 4 O GLY A 1 -13.812 2.674 18.437 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.869 2.239 21.703 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.854 1.394 20.230 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.653 1.095 21.393 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.391 3.714 21.059 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -11.415 2.491 20.270 1.00 0.00 H new ATOM 8 N SER A 2 -12.424 4.442 18.549 1.00 0.00 N ATOM 9 CA SER A 2 -12.842 4.990 17.263 1.00 0.00 C ATOM 10 C SER A 2 -11.633 5.425 16.440 1.00 0.00 C ATOM 11 O SER A 2 -10.564 5.701 16.985 1.00 0.00 O ATOM 12 CB SER A 2 -13.784 6.177 17.473 1.00 0.00 C ATOM 13 OG SER A 2 -15.085 5.739 17.823 1.00 0.00 O ATOM 0 H SER A 2 -11.708 4.988 19.028 1.00 0.00 H new ATOM 0 HA SER A 2 -13.370 4.209 16.717 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.391 6.823 18.258 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.831 6.774 16.562 1.00 0.00 H new ATOM 0 HG SER A 2 -15.668 6.516 17.953 1.00 0.00 H new ATOM 19 N SER A 3 -11.811 5.483 15.124 1.00 0.00 N ATOM 20 CA SER A 3 -10.735 5.880 14.224 1.00 0.00 C ATOM 21 C SER A 3 -10.863 7.351 13.839 1.00 0.00 C ATOM 22 O SER A 3 -9.920 8.127 13.985 1.00 0.00 O ATOM 23 CB SER A 3 -10.746 5.009 12.966 1.00 0.00 C ATOM 24 OG SER A 3 -10.246 3.712 13.240 1.00 0.00 O ATOM 0 H SER A 3 -12.690 5.260 14.658 1.00 0.00 H new ATOM 0 HA SER A 3 -9.788 5.740 14.746 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.762 4.936 12.579 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.142 5.478 12.189 1.00 0.00 H new ATOM 0 HG SER A 3 -10.265 3.174 12.421 1.00 0.00 H new ATOM 30 N GLY A 4 -12.040 7.726 13.347 1.00 0.00 N ATOM 31 CA GLY A 4 -12.272 9.102 12.948 1.00 0.00 C ATOM 32 C GLY A 4 -11.888 9.360 11.505 1.00 0.00 C ATOM 33 O GLY A 4 -10.841 9.946 11.228 1.00 0.00 O ATOM 0 H GLY A 4 -12.836 7.102 13.218 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.325 9.345 13.090 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.701 9.766 13.597 1.00 0.00 H new ATOM 37 N SER A 5 -12.737 8.921 10.581 1.00 0.00 N ATOM 38 CA SER A 5 -12.478 9.102 9.157 1.00 0.00 C ATOM 39 C SER A 5 -11.900 10.487 8.882 1.00 0.00 C ATOM 40 O SER A 5 -10.925 10.629 8.144 1.00 0.00 O ATOM 41 CB SER A 5 -13.766 8.907 8.354 1.00 0.00 C ATOM 42 OG SER A 5 -13.938 7.548 7.989 1.00 0.00 O ATOM 0 H SER A 5 -13.610 8.438 10.793 1.00 0.00 H new ATOM 0 HA SER A 5 -11.748 8.354 8.848 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.620 9.239 8.944 1.00 0.00 H new ATOM 0 HB3 SER A 5 -13.737 9.527 7.458 1.00 0.00 H new ATOM 0 HG SER A 5 -14.769 7.449 7.478 1.00 0.00 H new ATOM 48 N SER A 6 -12.508 11.505 9.483 1.00 0.00 N ATOM 49 CA SER A 6 -12.057 12.880 9.300 1.00 0.00 C ATOM 50 C SER A 6 -11.637 13.495 10.632 1.00 0.00 C ATOM 51 O SER A 6 -12.191 13.169 11.681 1.00 0.00 O ATOM 52 CB SER A 6 -13.163 13.722 8.663 1.00 0.00 C ATOM 53 OG SER A 6 -14.271 13.854 9.537 1.00 0.00 O ATOM 0 H SER A 6 -13.314 11.404 10.100 1.00 0.00 H new ATOM 0 HA SER A 6 -11.193 12.867 8.636 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.774 14.709 8.412 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.485 13.259 7.730 1.00 0.00 H new ATOM 0 HG SER A 6 -14.964 14.398 9.107 1.00 0.00 H new ATOM 59 N GLY A 7 -10.654 14.388 10.581 1.00 0.00 N ATOM 60 CA GLY A 7 -10.175 15.035 11.789 1.00 0.00 C ATOM 61 C GLY A 7 -9.321 16.253 11.495 1.00 0.00 C ATOM 62 O GLY A 7 -8.263 16.435 12.096 1.00 0.00 O ATOM 0 H GLY A 7 -10.180 14.675 9.725 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.027 15.332 12.401 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.595 14.321 12.374 1.00 0.00 H new ATOM 66 N GLN A 8 -9.781 17.086 10.568 1.00 0.00 N ATOM 67 CA GLN A 8 -9.050 18.291 10.194 1.00 0.00 C ATOM 68 C GLN A 8 -7.545 18.059 10.266 1.00 0.00 C ATOM 69 O GLN A 8 -6.810 18.855 10.850 1.00 0.00 O ATOM 70 CB GLN A 8 -9.443 19.455 11.107 1.00 0.00 C ATOM 71 CG GLN A 8 -9.040 19.251 12.559 1.00 0.00 C ATOM 72 CD GLN A 8 -8.757 20.558 13.274 1.00 0.00 C ATOM 73 OE1 GLN A 8 -8.459 21.572 12.644 1.00 0.00 O ATOM 74 NE2 GLN A 8 -8.850 20.539 14.599 1.00 0.00 N ATOM 0 H GLN A 8 -10.656 16.949 10.062 1.00 0.00 H new ATOM 0 HA GLN A 8 -9.312 18.540 9.166 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -8.981 20.370 10.735 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -10.522 19.599 11.055 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -9.835 18.720 13.082 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.153 18.619 12.601 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.100 19.675 15.080 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.671 21.388 15.135 1.00 0.00 H new ATOM 83 N LYS A 9 -7.092 16.962 9.667 1.00 0.00 N ATOM 84 CA LYS A 9 -5.673 16.624 9.662 1.00 0.00 C ATOM 85 C LYS A 9 -5.003 17.110 8.381 1.00 0.00 C ATOM 86 O LYS A 9 -5.656 17.265 7.348 1.00 0.00 O ATOM 87 CB LYS A 9 -5.488 15.112 9.804 1.00 0.00 C ATOM 88 CG LYS A 9 -5.972 14.323 8.600 1.00 0.00 C ATOM 89 CD LYS A 9 -7.397 13.829 8.793 1.00 0.00 C ATOM 90 CE LYS A 9 -7.425 12.439 9.408 1.00 0.00 C ATOM 91 NZ LYS A 9 -7.227 11.375 8.385 1.00 0.00 N ATOM 0 H LYS A 9 -7.687 16.292 9.179 1.00 0.00 H new ATOM 0 HA LYS A 9 -5.203 17.123 10.509 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -4.432 14.898 9.967 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -6.023 14.771 10.690 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -5.920 14.949 7.709 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -5.311 13.473 8.431 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -7.940 14.523 9.434 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.911 13.814 7.832 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -6.647 12.362 10.167 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -8.379 12.284 9.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -7.253 10.442 8.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -7.984 11.432 7.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -6.306 11.507 7.921 1.00 0.00 H new ATOM 105 N ARG A 10 -3.698 17.347 8.454 1.00 0.00 N ATOM 106 CA ARG A 10 -2.940 17.815 7.300 1.00 0.00 C ATOM 107 C ARG A 10 -1.772 16.879 7.000 1.00 0.00 C ATOM 108 O ARG A 10 -0.633 17.152 7.378 1.00 0.00 O ATOM 109 CB ARG A 10 -2.421 19.233 7.545 1.00 0.00 C ATOM 110 CG ARG A 10 -1.865 19.902 6.299 1.00 0.00 C ATOM 111 CD ARG A 10 -1.453 21.340 6.575 1.00 0.00 C ATOM 112 NE ARG A 10 -0.441 21.810 5.632 1.00 0.00 N ATOM 113 CZ ARG A 10 0.322 22.876 5.844 1.00 0.00 C ATOM 114 NH1 ARG A 10 0.189 23.579 6.960 1.00 0.00 N ATOM 115 NH2 ARG A 10 1.221 23.241 4.939 1.00 0.00 N ATOM 0 H ARG A 10 -3.143 17.223 9.301 1.00 0.00 H new ATOM 0 HA ARG A 10 -3.607 17.823 6.438 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.231 19.843 7.944 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -1.642 19.199 8.307 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -1.005 19.339 5.936 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -2.615 19.883 5.509 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -2.329 21.986 6.518 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -1.066 21.418 7.591 1.00 0.00 H new ATOM 0 HE ARG A 10 -0.314 21.291 4.763 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -0.501 23.302 7.658 1.00 0.00 H new ATOM 0 HH12 ARG A 10 0.776 24.397 7.120 1.00 0.00 H new ATOM 0 HH21 ARG A 10 1.327 22.703 4.079 1.00 0.00 H new ATOM 0 HH22 ARG A 10 1.806 24.060 5.103 1.00 0.00 H new ATOM 129 N ALA A 11 -2.065 15.776 6.320 1.00 0.00 N ATOM 130 CA ALA A 11 -1.040 14.801 5.969 1.00 0.00 C ATOM 131 C ALA A 11 -1.511 13.894 4.837 1.00 0.00 C ATOM 132 O ALA A 11 -2.670 13.948 4.426 1.00 0.00 O ATOM 133 CB ALA A 11 -0.659 13.973 7.187 1.00 0.00 C ATOM 0 H ALA A 11 -3.003 15.535 6.001 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.160 15.344 5.623 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.107 13.249 6.910 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -0.273 14.629 7.967 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.538 13.446 7.558 1.00 0.00 H new ATOM 139 N TRP A 12 -0.605 13.061 4.337 1.00 0.00 N ATOM 140 CA TRP A 12 -0.928 12.143 3.251 1.00 0.00 C ATOM 141 C TRP A 12 -0.666 10.698 3.664 1.00 0.00 C ATOM 142 O TRP A 12 -0.181 9.894 2.868 1.00 0.00 O ATOM 143 CB TRP A 12 -0.111 12.486 2.005 1.00 0.00 C ATOM 144 CG TRP A 12 1.266 11.893 2.014 1.00 0.00 C ATOM 145 CD1 TRP A 12 2.084 11.737 3.097 1.00 0.00 C ATOM 146 CD2 TRP A 12 1.984 11.377 0.889 1.00 0.00 C ATOM 147 NE1 TRP A 12 3.268 11.157 2.712 1.00 0.00 N ATOM 148 CE2 TRP A 12 3.232 10.925 1.362 1.00 0.00 C ATOM 149 CE3 TRP A 12 1.695 11.252 -0.473 1.00 0.00 C ATOM 150 CZ2 TRP A 12 4.186 10.359 0.521 1.00 0.00 C ATOM 151 CZ3 TRP A 12 2.644 10.690 -1.306 1.00 0.00 C ATOM 152 CH2 TRP A 12 3.877 10.249 -0.807 1.00 0.00 C ATOM 0 H TRP A 12 0.359 13.003 4.666 1.00 0.00 H new ATOM 0 HA TRP A 12 -1.988 12.250 3.022 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -0.644 12.134 1.122 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -0.031 13.570 1.919 1.00 0.00 H new ATOM 0 HD1 TRP A 12 1.836 12.027 4.107 1.00 0.00 H new ATOM 0 HE1 TRP A 12 4.048 10.935 3.331 1.00 0.00 H new ATOM 0 HE3 TRP A 12 0.747 11.588 -0.867 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 5.137 10.019 0.904 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 2.432 10.589 -2.360 1.00 0.00 H new ATOM 0 HH2 TRP A 12 4.597 9.814 -1.484 1.00 0.00 H new ATOM 163 N ILE A 13 -0.989 10.376 4.912 1.00 0.00 N ATOM 164 CA ILE A 13 -0.789 9.028 5.429 1.00 0.00 C ATOM 165 C ILE A 13 -1.829 8.064 4.867 1.00 0.00 C ATOM 166 O ILE A 13 -2.949 8.461 4.542 1.00 0.00 O ATOM 167 CB ILE A 13 -0.856 8.999 6.967 1.00 0.00 C ATOM 168 CG1 ILE A 13 -0.665 7.570 7.481 1.00 0.00 C ATOM 169 CG2 ILE A 13 -2.182 9.568 7.450 1.00 0.00 C ATOM 170 CD1 ILE A 13 -0.497 7.485 8.981 1.00 0.00 C ATOM 0 H ILE A 13 -1.390 11.030 5.584 1.00 0.00 H new ATOM 0 HA ILE A 13 0.205 8.712 5.111 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.051 9.618 7.363 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -1.524 6.968 7.185 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.210 7.134 7.000 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -2.214 9.541 8.539 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -2.281 10.599 7.110 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -3.002 8.973 7.048 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.366 6.443 9.274 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.379 8.059 9.282 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -1.382 7.891 9.470 1.00 0.00 H new ATOM 182 N THR A 14 -1.452 6.794 4.757 1.00 0.00 N ATOM 183 CA THR A 14 -2.352 5.773 4.235 1.00 0.00 C ATOM 184 C THR A 14 -2.745 4.779 5.323 1.00 0.00 C ATOM 185 O THR A 14 -2.203 4.808 6.428 1.00 0.00 O ATOM 186 CB THR A 14 -1.712 5.006 3.063 1.00 0.00 C ATOM 187 OG1 THR A 14 -0.504 4.370 3.494 1.00 0.00 O ATOM 188 CG2 THR A 14 -1.410 5.944 1.903 1.00 0.00 C ATOM 0 H THR A 14 -0.530 6.448 5.022 1.00 0.00 H new ATOM 0 HA THR A 14 -3.243 6.289 3.878 1.00 0.00 H new ATOM 0 HB THR A 14 -2.420 4.249 2.724 1.00 0.00 H new ATOM 0 HG1 THR A 14 -0.105 3.883 2.743 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.958 5.380 1.087 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.335 6.405 1.557 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.720 6.720 2.233 1.00 0.00 H new ATOM 196 N ALA A 15 -3.689 3.901 5.002 1.00 0.00 N ATOM 197 CA ALA A 15 -4.152 2.897 5.952 1.00 0.00 C ATOM 198 C ALA A 15 -3.328 1.618 5.843 1.00 0.00 C ATOM 199 O ALA A 15 -2.709 1.335 4.818 1.00 0.00 O ATOM 200 CB ALA A 15 -5.627 2.597 5.726 1.00 0.00 C ATOM 0 H ALA A 15 -4.148 3.864 4.092 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.024 3.297 6.958 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.959 1.846 6.442 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.209 3.509 5.861 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.771 2.221 4.713 1.00 0.00 H new ATOM 206 N PRO A 16 -3.319 0.825 6.925 1.00 0.00 N ATOM 207 CA PRO A 16 -2.575 -0.436 6.976 1.00 0.00 C ATOM 208 C PRO A 16 -3.186 -1.506 6.077 1.00 0.00 C ATOM 209 O PRO A 16 -4.282 -2.001 6.340 1.00 0.00 O ATOM 210 CB PRO A 16 -2.679 -0.850 8.446 1.00 0.00 C ATOM 211 CG PRO A 16 -3.924 -0.196 8.937 1.00 0.00 C ATOM 212 CD PRO A 16 -4.035 1.100 8.183 1.00 0.00 C ATOM 0 HA PRO A 16 -1.550 -0.319 6.623 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -2.734 -1.934 8.549 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -1.808 -0.520 9.013 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -4.794 -0.828 8.757 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -3.875 -0.020 10.011 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.075 1.372 8.002 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -3.581 1.925 8.732 1.00 0.00 H new ATOM 220 N VAL A 17 -2.469 -1.860 5.015 1.00 0.00 N ATOM 221 CA VAL A 17 -2.939 -2.873 4.078 1.00 0.00 C ATOM 222 C VAL A 17 -2.974 -4.251 4.730 1.00 0.00 C ATOM 223 O VAL A 17 -1.946 -4.771 5.161 1.00 0.00 O ATOM 224 CB VAL A 17 -2.049 -2.933 2.823 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.527 -4.027 1.881 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.028 -1.584 2.120 1.00 0.00 C ATOM 0 H VAL A 17 -1.560 -1.460 4.782 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.949 -2.588 3.784 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.031 -3.172 3.132 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.886 -4.054 1.000 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.485 -4.990 2.390 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.553 -3.822 1.577 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.394 -1.645 1.235 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.041 -1.313 1.823 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.634 -0.827 2.798 1.00 0.00 H new ATOM 236 N ALA A 18 -4.165 -4.837 4.797 1.00 0.00 N ATOM 237 CA ALA A 18 -4.334 -6.156 5.394 1.00 0.00 C ATOM 238 C ALA A 18 -4.923 -7.142 4.390 1.00 0.00 C ATOM 239 O ALA A 18 -6.141 -7.305 4.305 1.00 0.00 O ATOM 240 CB ALA A 18 -5.218 -6.067 6.629 1.00 0.00 C ATOM 0 H ALA A 18 -5.027 -4.419 4.445 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.351 -6.522 5.690 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.336 -7.059 7.065 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -4.757 -5.402 7.360 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.196 -5.675 6.349 1.00 0.00 H new ATOM 246 N LEU A 19 -4.051 -7.796 3.630 1.00 0.00 N ATOM 247 CA LEU A 19 -4.485 -8.766 2.630 1.00 0.00 C ATOM 248 C LEU A 19 -4.517 -10.174 3.215 1.00 0.00 C ATOM 249 O LEU A 19 -4.071 -10.400 4.341 1.00 0.00 O ATOM 250 CB LEU A 19 -3.555 -8.727 1.416 1.00 0.00 C ATOM 251 CG LEU A 19 -3.265 -7.341 0.838 1.00 0.00 C ATOM 252 CD1 LEU A 19 -2.214 -7.430 -0.258 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.541 -6.707 0.305 1.00 0.00 C ATOM 0 H LEU A 19 -3.040 -7.672 3.687 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.494 -8.500 2.316 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.607 -9.188 1.694 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.991 -9.343 0.629 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.876 -6.709 1.637 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.020 -6.435 -0.658 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.293 -7.841 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.575 -8.078 -1.057 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.315 -5.721 -0.102 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.960 -7.337 -0.480 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.264 -6.608 1.115 1.00 0.00 H new ATOM 265 N ARG A 20 -5.044 -11.118 2.443 1.00 0.00 N ATOM 266 CA ARG A 20 -5.133 -12.505 2.885 1.00 0.00 C ATOM 267 C ARG A 20 -4.158 -13.386 2.108 1.00 0.00 C ATOM 268 O ARG A 20 -3.851 -13.114 0.948 1.00 0.00 O ATOM 269 CB ARG A 20 -6.560 -13.028 2.710 1.00 0.00 C ATOM 270 CG ARG A 20 -6.766 -14.431 3.256 1.00 0.00 C ATOM 271 CD ARG A 20 -8.233 -14.828 3.235 1.00 0.00 C ATOM 272 NE ARG A 20 -8.611 -15.464 1.975 1.00 0.00 N ATOM 273 CZ ARG A 20 -9.863 -15.552 1.543 1.00 0.00 C ATOM 274 NH1 ARG A 20 -10.854 -15.047 2.264 1.00 0.00 N ATOM 275 NH2 ARG A 20 -10.127 -16.146 0.386 1.00 0.00 N ATOM 0 H ARG A 20 -5.416 -10.948 1.508 1.00 0.00 H new ATOM 0 HA ARG A 20 -4.867 -12.542 3.941 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.251 -12.348 3.209 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.814 -13.019 1.650 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.188 -15.141 2.665 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -6.388 -14.484 4.277 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.436 -15.510 4.060 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.850 -13.944 3.394 1.00 0.00 H new ATOM 0 HE ARG A 20 -7.872 -15.862 1.395 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.656 -14.589 3.154 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.815 -15.116 1.929 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.367 -16.536 -0.172 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.089 -16.213 0.055 1.00 0.00 H new ATOM 289 N GLU A 21 -3.676 -14.441 2.758 1.00 0.00 N ATOM 290 CA GLU A 21 -2.736 -15.360 2.128 1.00 0.00 C ATOM 291 C GLU A 21 -3.448 -16.621 1.645 1.00 0.00 C ATOM 292 O GLU A 21 -4.486 -17.005 2.181 1.00 0.00 O ATOM 293 CB GLU A 21 -1.621 -15.735 3.108 1.00 0.00 C ATOM 294 CG GLU A 21 -2.033 -16.787 4.124 1.00 0.00 C ATOM 295 CD GLU A 21 -3.419 -16.542 4.688 1.00 0.00 C ATOM 296 OE1 GLU A 21 -3.637 -15.464 5.279 1.00 0.00 O ATOM 297 OE2 GLU A 21 -4.285 -17.429 4.539 1.00 0.00 O ATOM 0 H GLU A 21 -3.921 -14.680 3.719 1.00 0.00 H new ATOM 0 HA GLU A 21 -2.299 -14.857 1.265 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.762 -16.102 2.546 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.297 -14.839 3.637 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.004 -17.771 3.655 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -1.310 -16.802 4.940 1.00 0.00 H new ATOM 304 N GLY A 22 -2.881 -17.260 0.626 1.00 0.00 N ATOM 305 CA GLY A 22 -3.474 -18.469 0.086 1.00 0.00 C ATOM 306 C GLY A 22 -3.631 -18.415 -1.421 1.00 0.00 C ATOM 307 O GLY A 22 -2.868 -19.043 -2.153 1.00 0.00 O ATOM 0 H GLY A 22 -2.021 -16.962 0.165 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.854 -19.325 0.353 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.450 -18.627 0.544 1.00 0.00 H new ATOM 311 N GLU A 23 -4.625 -17.664 -1.884 1.00 0.00 N ATOM 312 CA GLU A 23 -4.881 -17.533 -3.314 1.00 0.00 C ATOM 313 C GLU A 23 -4.195 -16.292 -3.878 1.00 0.00 C ATOM 314 O GLU A 23 -3.625 -15.493 -3.135 1.00 0.00 O ATOM 315 CB GLU A 23 -6.386 -17.463 -3.581 1.00 0.00 C ATOM 316 CG GLU A 23 -7.148 -18.685 -3.095 1.00 0.00 C ATOM 317 CD GLU A 23 -8.461 -18.883 -3.827 1.00 0.00 C ATOM 318 OE1 GLU A 23 -9.154 -17.877 -4.084 1.00 0.00 O ATOM 319 OE2 GLU A 23 -8.795 -20.044 -4.143 1.00 0.00 O ATOM 0 H GLU A 23 -5.266 -17.137 -1.290 1.00 0.00 H new ATOM 0 HA GLU A 23 -4.471 -18.412 -3.812 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.792 -16.575 -3.095 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.551 -17.344 -4.652 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.527 -19.571 -3.225 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.343 -18.586 -2.027 1.00 0.00 H new ATOM 326 N ASP A 24 -4.255 -16.138 -5.196 1.00 0.00 N ATOM 327 CA ASP A 24 -3.641 -14.995 -5.861 1.00 0.00 C ATOM 328 C ASP A 24 -4.547 -13.770 -5.785 1.00 0.00 C ATOM 329 O ASP A 24 -5.686 -13.798 -6.252 1.00 0.00 O ATOM 330 CB ASP A 24 -3.337 -15.330 -7.322 1.00 0.00 C ATOM 331 CG ASP A 24 -2.487 -14.270 -7.994 1.00 0.00 C ATOM 332 OD1 ASP A 24 -1.826 -13.494 -7.273 1.00 0.00 O ATOM 333 OD2 ASP A 24 -2.482 -14.218 -9.242 1.00 0.00 O ATOM 0 H ASP A 24 -4.723 -16.791 -5.825 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.707 -14.766 -5.347 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.823 -16.290 -7.372 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.273 -15.441 -7.869 1.00 0.00 H new ATOM 338 N LEU A 25 -4.035 -12.697 -5.192 1.00 0.00 N ATOM 339 CA LEU A 25 -4.799 -11.462 -5.053 1.00 0.00 C ATOM 340 C LEU A 25 -4.383 -10.443 -6.109 1.00 0.00 C ATOM 341 O LEU A 25 -4.172 -9.269 -5.804 1.00 0.00 O ATOM 342 CB LEU A 25 -4.604 -10.873 -3.655 1.00 0.00 C ATOM 343 CG LEU A 25 -5.331 -11.591 -2.517 1.00 0.00 C ATOM 344 CD1 LEU A 25 -4.649 -12.911 -2.196 1.00 0.00 C ATOM 345 CD2 LEU A 25 -5.392 -10.705 -1.281 1.00 0.00 C ATOM 0 H LEU A 25 -3.094 -12.657 -4.800 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.853 -11.698 -5.197 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.537 -10.866 -3.431 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.933 -9.834 -3.671 1.00 0.00 H new ATOM 0 HG LEU A 25 -6.351 -11.802 -2.839 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.181 -13.407 -1.384 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.658 -13.550 -3.079 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.618 -12.724 -1.894 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.913 -11.232 -0.481 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.380 -10.462 -0.957 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -5.927 -9.786 -1.518 1.00 0.00 H new ATOM 357 N SER A 26 -4.268 -10.900 -7.352 1.00 0.00 N ATOM 358 CA SER A 26 -3.875 -10.028 -8.453 1.00 0.00 C ATOM 359 C SER A 26 -5.100 -9.408 -9.118 1.00 0.00 C ATOM 360 O SER A 26 -5.113 -9.172 -10.326 1.00 0.00 O ATOM 361 CB SER A 26 -3.061 -10.811 -9.485 1.00 0.00 C ATOM 362 OG SER A 26 -3.744 -11.985 -9.889 1.00 0.00 O ATOM 0 H SER A 26 -4.441 -11.868 -7.622 1.00 0.00 H new ATOM 0 HA SER A 26 -3.259 -9.226 -8.047 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.868 -10.182 -10.354 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.092 -11.077 -9.063 1.00 0.00 H new ATOM 0 HG SER A 26 -3.111 -12.732 -9.936 1.00 0.00 H new ATOM 368 N LYS A 27 -6.130 -9.148 -8.321 1.00 0.00 N ATOM 369 CA LYS A 27 -7.361 -8.554 -8.829 1.00 0.00 C ATOM 370 C LYS A 27 -7.722 -7.295 -8.047 1.00 0.00 C ATOM 371 O LYS A 27 -8.135 -6.289 -8.625 1.00 0.00 O ATOM 372 CB LYS A 27 -8.509 -9.563 -8.749 1.00 0.00 C ATOM 373 CG LYS A 27 -9.870 -8.962 -9.056 1.00 0.00 C ATOM 374 CD LYS A 27 -10.076 -8.783 -10.551 1.00 0.00 C ATOM 375 CE LYS A 27 -11.508 -8.384 -10.873 1.00 0.00 C ATOM 376 NZ LYS A 27 -11.782 -8.433 -12.336 1.00 0.00 N ATOM 0 H LYS A 27 -6.137 -9.339 -7.319 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.198 -8.279 -9.871 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -8.315 -10.377 -9.447 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -8.530 -9.998 -7.750 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -10.652 -9.606 -8.655 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.964 -7.998 -8.557 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.392 -8.021 -10.925 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.831 -9.712 -11.067 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -12.196 -9.050 -10.352 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.697 -7.377 -10.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.768 -8.154 -12.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -11.143 -7.779 -12.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.627 -9.400 -12.686 1.00 0.00 H new ATOM 390 N LYS A 28 -7.562 -7.357 -6.729 1.00 0.00 N ATOM 391 CA LYS A 28 -7.868 -6.222 -5.867 1.00 0.00 C ATOM 392 C LYS A 28 -7.130 -4.970 -6.333 1.00 0.00 C ATOM 393 O LYS A 28 -7.728 -3.905 -6.479 1.00 0.00 O ATOM 394 CB LYS A 28 -7.491 -6.539 -4.418 1.00 0.00 C ATOM 395 CG LYS A 28 -8.451 -7.498 -3.736 1.00 0.00 C ATOM 396 CD LYS A 28 -8.065 -8.946 -3.986 1.00 0.00 C ATOM 397 CE LYS A 28 -8.931 -9.902 -3.181 1.00 0.00 C ATOM 398 NZ LYS A 28 -10.263 -10.110 -3.813 1.00 0.00 N ATOM 0 H LYS A 28 -7.222 -8.182 -6.235 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.940 -6.033 -5.924 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.488 -6.966 -4.397 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.454 -5.610 -3.849 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.461 -7.303 -2.664 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -9.463 -7.322 -4.101 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.163 -9.171 -5.048 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.017 -9.095 -3.724 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.421 -10.861 -3.085 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -9.065 -9.510 -2.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.823 -10.768 -3.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.761 -9.199 -3.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.137 -10.508 -4.765 1.00 0.00 H new ATOM 412 N ASN A 29 -5.829 -5.108 -6.565 1.00 0.00 N ATOM 413 CA ASN A 29 -5.010 -3.989 -7.016 1.00 0.00 C ATOM 414 C ASN A 29 -5.802 -3.077 -7.948 1.00 0.00 C ATOM 415 O ASN A 29 -6.717 -3.508 -8.650 1.00 0.00 O ATOM 416 CB ASN A 29 -3.757 -4.501 -7.728 1.00 0.00 C ATOM 417 CG ASN A 29 -3.073 -5.618 -6.963 1.00 0.00 C ATOM 418 OD1 ASN A 29 -2.507 -5.396 -5.892 1.00 0.00 O ATOM 419 ND2 ASN A 29 -3.122 -6.826 -7.511 1.00 0.00 N ATOM 0 H ASN A 29 -5.319 -5.984 -6.448 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.711 -3.413 -6.140 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.027 -4.858 -8.722 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -3.057 -3.676 -7.865 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -2.679 -7.617 -7.043 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -3.602 -6.964 -8.400 1.00 0.00 H new ATOM 426 N PRO A 30 -5.441 -1.785 -7.959 1.00 0.00 N ATOM 427 CA PRO A 30 -4.354 -1.260 -7.128 1.00 0.00 C ATOM 428 C PRO A 30 -4.709 -1.250 -5.645 1.00 0.00 C ATOM 429 O PRO A 30 -5.841 -0.941 -5.271 1.00 0.00 O ATOM 430 CB PRO A 30 -4.172 0.170 -7.644 1.00 0.00 C ATOM 431 CG PRO A 30 -5.496 0.536 -8.221 1.00 0.00 C ATOM 432 CD PRO A 30 -6.069 -0.737 -8.781 1.00 0.00 C ATOM 0 HA PRO A 30 -3.455 -1.872 -7.200 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.890 0.848 -6.839 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.384 0.222 -8.396 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -6.151 0.957 -7.458 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.387 1.291 -9.000 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.156 -0.759 -8.698 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.827 -0.856 -9.837 1.00 0.00 H new ATOM 440 N ILE A 31 -3.737 -1.590 -4.806 1.00 0.00 N ATOM 441 CA ILE A 31 -3.948 -1.618 -3.364 1.00 0.00 C ATOM 442 C ILE A 31 -3.445 -0.336 -2.709 1.00 0.00 C ATOM 443 O ILE A 31 -3.944 0.075 -1.662 1.00 0.00 O ATOM 444 CB ILE A 31 -3.242 -2.824 -2.716 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.783 -2.893 -3.169 1.00 0.00 C ATOM 446 CG2 ILE A 31 -3.972 -4.113 -3.062 1.00 0.00 C ATOM 447 CD1 ILE A 31 -0.992 -3.992 -2.495 1.00 0.00 C ATOM 0 H ILE A 31 -2.795 -1.850 -5.100 1.00 0.00 H new ATOM 0 HA ILE A 31 -5.023 -1.707 -3.204 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.260 -2.698 -1.633 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.753 -3.044 -4.248 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -1.303 -1.935 -2.968 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.461 -4.956 -2.597 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.997 -4.061 -2.693 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.982 -4.246 -4.144 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.033 -3.981 -2.865 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -0.991 -3.831 -1.417 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.448 -4.957 -2.717 1.00 0.00 H new ATOM 459 N ALA A 32 -2.454 0.291 -3.334 1.00 0.00 N ATOM 460 CA ALA A 32 -1.885 1.529 -2.815 1.00 0.00 C ATOM 461 C ALA A 32 -1.921 2.633 -3.866 1.00 0.00 C ATOM 462 O ALA A 32 -1.558 2.417 -5.022 1.00 0.00 O ATOM 463 CB ALA A 32 -0.459 1.296 -2.340 1.00 0.00 C ATOM 0 H ALA A 32 -2.028 -0.038 -4.201 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.490 1.851 -1.968 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -0.047 2.229 -1.955 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -0.457 0.545 -1.550 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.150 0.947 -3.174 1.00 0.00 H new ATOM 469 N LYS A 33 -2.362 3.818 -3.457 1.00 0.00 N ATOM 470 CA LYS A 33 -2.445 4.958 -4.362 1.00 0.00 C ATOM 471 C LYS A 33 -1.873 6.213 -3.711 1.00 0.00 C ATOM 472 O LYS A 33 -2.474 6.778 -2.797 1.00 0.00 O ATOM 473 CB LYS A 33 -3.899 5.202 -4.776 1.00 0.00 C ATOM 474 CG LYS A 33 -4.524 4.034 -5.517 1.00 0.00 C ATOM 475 CD LYS A 33 -5.192 3.060 -4.561 1.00 0.00 C ATOM 476 CE LYS A 33 -6.557 3.563 -4.116 1.00 0.00 C ATOM 477 NZ LYS A 33 -7.578 3.422 -5.191 1.00 0.00 N ATOM 0 H LYS A 33 -2.668 4.014 -2.504 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.854 4.729 -5.249 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -4.491 5.415 -3.886 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.944 6.089 -5.408 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -5.259 4.406 -6.231 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.757 3.514 -6.091 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.301 2.090 -5.046 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.556 2.911 -3.689 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.879 3.008 -3.235 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.480 4.610 -3.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -8.521 3.631 -4.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -7.365 4.087 -5.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.563 2.449 -5.559 1.00 0.00 H new ATOM 491 N ILE A 34 -0.711 6.645 -4.189 1.00 0.00 N ATOM 492 CA ILE A 34 -0.061 7.835 -3.655 1.00 0.00 C ATOM 493 C ILE A 34 0.036 8.930 -4.711 1.00 0.00 C ATOM 494 O ILE A 34 0.420 8.674 -5.853 1.00 0.00 O ATOM 495 CB ILE A 34 1.352 7.516 -3.131 1.00 0.00 C ATOM 496 CG1 ILE A 34 2.110 6.648 -4.138 1.00 0.00 C ATOM 497 CG2 ILE A 34 1.272 6.822 -1.780 1.00 0.00 C ATOM 498 CD1 ILE A 34 3.610 6.670 -3.946 1.00 0.00 C ATOM 0 H ILE A 34 -0.201 6.189 -4.945 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.677 8.187 -2.827 1.00 0.00 H new ATOM 0 HB ILE A 34 1.896 8.452 -3.005 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.757 5.620 -4.058 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.876 6.988 -5.147 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.278 6.603 -1.423 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.767 7.473 -1.066 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.713 5.892 -1.881 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.082 6.033 -4.694 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.976 7.691 -4.056 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.855 6.302 -2.950 1.00 0.00 H new ATOM 510 N HIS A 35 -0.313 10.152 -4.323 1.00 0.00 N ATOM 511 CA HIS A 35 -0.264 11.288 -5.236 1.00 0.00 C ATOM 512 C HIS A 35 0.403 12.490 -4.573 1.00 0.00 C ATOM 513 O HIS A 35 -0.233 13.225 -3.817 1.00 0.00 O ATOM 514 CB HIS A 35 -1.673 11.662 -5.696 1.00 0.00 C ATOM 515 CG HIS A 35 -2.360 10.575 -6.465 1.00 0.00 C ATOM 516 ND1 HIS A 35 -2.311 10.479 -7.839 1.00 0.00 N ATOM 517 CD2 HIS A 35 -3.113 9.533 -6.043 1.00 0.00 C ATOM 518 CE1 HIS A 35 -3.006 9.425 -8.230 1.00 0.00 C ATOM 519 NE2 HIS A 35 -3.503 8.834 -7.159 1.00 0.00 N ATOM 0 H HIS A 35 -0.633 10.381 -3.382 1.00 0.00 H new ATOM 0 HA HIS A 35 0.328 10.999 -6.104 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -2.276 11.916 -4.824 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -1.618 12.556 -6.317 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.361 9.295 -5.019 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -3.144 9.102 -9.251 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -4.082 7.995 -7.160 1.00 0.00 H new ATOM 528 N SER A 36 1.686 12.682 -4.860 1.00 0.00 N ATOM 529 CA SER A 36 2.440 13.792 -4.288 1.00 0.00 C ATOM 530 C SER A 36 1.659 15.097 -4.406 1.00 0.00 C ATOM 531 O SER A 36 1.007 15.353 -5.419 1.00 0.00 O ATOM 532 CB SER A 36 3.794 13.929 -4.985 1.00 0.00 C ATOM 533 OG SER A 36 4.546 14.996 -4.433 1.00 0.00 O ATOM 0 H SER A 36 2.226 12.084 -5.485 1.00 0.00 H new ATOM 0 HA SER A 36 2.604 13.582 -3.231 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.352 12.998 -4.888 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.642 14.100 -6.051 1.00 0.00 H new ATOM 0 HG SER A 36 5.448 14.681 -4.214 1.00 0.00 H new ATOM 539 N ASP A 37 1.730 15.918 -3.365 1.00 0.00 N ATOM 540 CA ASP A 37 1.032 17.198 -3.351 1.00 0.00 C ATOM 541 C ASP A 37 1.652 18.167 -4.353 1.00 0.00 C ATOM 542 O ASP A 37 0.977 18.658 -5.258 1.00 0.00 O ATOM 543 CB ASP A 37 1.064 17.806 -1.948 1.00 0.00 C ATOM 544 CG ASP A 37 2.463 17.842 -1.365 1.00 0.00 C ATOM 545 OD1 ASP A 37 3.108 16.775 -1.305 1.00 0.00 O ATOM 546 OD2 ASP A 37 2.912 18.938 -0.967 1.00 0.00 O ATOM 0 H ASP A 37 2.264 15.720 -2.519 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.004 17.021 -3.638 1.00 0.00 H new ATOM 0 HB2 ASP A 37 0.663 18.819 -1.985 1.00 0.00 H new ATOM 0 HB3 ASP A 37 0.414 17.229 -1.290 1.00 0.00 H new ATOM 551 N LEU A 38 2.942 18.439 -4.184 1.00 0.00 N ATOM 552 CA LEU A 38 3.654 19.350 -5.073 1.00 0.00 C ATOM 553 C LEU A 38 3.416 18.983 -6.534 1.00 0.00 C ATOM 554 O LEU A 38 3.117 19.845 -7.360 1.00 0.00 O ATOM 555 CB LEU A 38 5.153 19.324 -4.767 1.00 0.00 C ATOM 556 CG LEU A 38 5.615 20.201 -3.603 1.00 0.00 C ATOM 557 CD1 LEU A 38 6.993 19.769 -3.124 1.00 0.00 C ATOM 558 CD2 LEU A 38 5.626 21.667 -4.011 1.00 0.00 C ATOM 0 H LEU A 38 3.515 18.042 -3.440 1.00 0.00 H new ATOM 0 HA LEU A 38 3.271 20.356 -4.904 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.443 18.294 -4.558 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.692 19.631 -5.663 1.00 0.00 H new ATOM 0 HG LEU A 38 4.911 20.079 -2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.306 20.404 -2.295 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.954 18.732 -2.791 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.708 19.861 -3.942 1.00 0.00 H new ATOM 0 HD21 LEU A 38 5.957 22.276 -3.170 1.00 0.00 H new ATOM 0 HD22 LEU A 38 6.307 21.806 -4.850 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.621 21.970 -4.305 1.00 0.00 H new ATOM 570 N ALA A 39 3.548 17.698 -6.845 1.00 0.00 N ATOM 571 CA ALA A 39 3.343 17.216 -8.206 1.00 0.00 C ATOM 572 C ALA A 39 2.125 17.876 -8.844 1.00 0.00 C ATOM 573 O ALA A 39 2.193 18.365 -9.971 1.00 0.00 O ATOM 574 CB ALA A 39 3.189 15.703 -8.212 1.00 0.00 C ATOM 0 H ALA A 39 3.796 16.972 -6.173 1.00 0.00 H new ATOM 0 HA ALA A 39 4.220 17.483 -8.796 1.00 0.00 H new ATOM 0 HB1 ALA A 39 3.037 15.357 -9.234 1.00 0.00 H new ATOM 0 HB2 ALA A 39 4.089 15.244 -7.804 1.00 0.00 H new ATOM 0 HB3 ALA A 39 2.330 15.422 -7.602 1.00 0.00 H new ATOM 580 N GLU A 40 1.013 17.886 -8.115 1.00 0.00 N ATOM 581 CA GLU A 40 -0.220 18.485 -8.612 1.00 0.00 C ATOM 582 C GLU A 40 -0.244 19.986 -8.339 1.00 0.00 C ATOM 583 O GLU A 40 -0.318 20.794 -9.264 1.00 0.00 O ATOM 584 CB GLU A 40 -1.435 17.818 -7.964 1.00 0.00 C ATOM 585 CG GLU A 40 -1.914 16.579 -8.701 1.00 0.00 C ATOM 586 CD GLU A 40 -3.204 16.023 -8.129 1.00 0.00 C ATOM 587 OE1 GLU A 40 -3.136 15.253 -7.149 1.00 0.00 O ATOM 588 OE2 GLU A 40 -4.282 16.359 -8.663 1.00 0.00 O ATOM 0 H GLU A 40 0.941 17.486 -7.179 1.00 0.00 H new ATOM 0 HA GLU A 40 -0.261 18.328 -9.690 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -1.186 17.547 -6.938 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -2.251 18.539 -7.914 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.062 16.821 -9.753 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.141 15.812 -8.656 1.00 0.00 H new ATOM 595 N GLU A 41 -0.181 20.351 -7.062 1.00 0.00 N ATOM 596 CA GLU A 41 -0.197 21.754 -6.668 1.00 0.00 C ATOM 597 C GLU A 41 0.529 22.617 -7.696 1.00 0.00 C ATOM 598 O GLU A 41 -0.042 23.560 -8.244 1.00 0.00 O ATOM 599 CB GLU A 41 0.450 21.928 -5.292 1.00 0.00 C ATOM 600 CG GLU A 41 -0.514 21.721 -4.135 1.00 0.00 C ATOM 601 CD GLU A 41 -1.330 22.961 -3.828 1.00 0.00 C ATOM 602 OE1 GLU A 41 -2.372 23.163 -4.487 1.00 0.00 O ATOM 603 OE2 GLU A 41 -0.928 23.730 -2.930 1.00 0.00 O ATOM 0 H GLU A 41 -0.118 19.695 -6.284 1.00 0.00 H new ATOM 0 HA GLU A 41 -1.236 22.078 -6.617 1.00 0.00 H new ATOM 0 HB2 GLU A 41 1.276 21.223 -5.196 1.00 0.00 H new ATOM 0 HB3 GLU A 41 0.876 22.929 -5.224 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -1.187 20.897 -4.371 1.00 0.00 H new ATOM 0 HG3 GLU A 41 0.047 21.431 -3.247 1.00 0.00 H new ATOM 610 N ARG A 42 1.791 22.287 -7.951 1.00 0.00 N ATOM 611 CA ARG A 42 2.596 23.032 -8.911 1.00 0.00 C ATOM 612 C ARG A 42 2.484 22.420 -10.305 1.00 0.00 C ATOM 613 O ARG A 42 1.988 23.055 -11.234 1.00 0.00 O ATOM 614 CB ARG A 42 4.060 23.058 -8.470 1.00 0.00 C ATOM 615 CG ARG A 42 4.351 24.084 -7.386 1.00 0.00 C ATOM 616 CD ARG A 42 5.775 24.609 -7.484 1.00 0.00 C ATOM 617 NE ARG A 42 6.032 25.257 -8.768 1.00 0.00 N ATOM 618 CZ ARG A 42 7.027 26.113 -8.972 1.00 0.00 C ATOM 619 NH1 ARG A 42 7.854 26.422 -7.983 1.00 0.00 N ATOM 620 NH2 ARG A 42 7.196 26.661 -10.169 1.00 0.00 N ATOM 0 H ARG A 42 2.278 21.509 -7.506 1.00 0.00 H new ATOM 0 HA ARG A 42 2.217 24.053 -8.950 1.00 0.00 H new ATOM 0 HB2 ARG A 42 4.339 22.069 -8.107 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.688 23.268 -9.336 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.649 24.914 -7.471 1.00 0.00 H new ATOM 0 HG3 ARG A 42 4.195 23.634 -6.406 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.956 25.319 -6.677 1.00 0.00 H new ATOM 0 HD3 ARG A 42 6.475 23.785 -7.347 1.00 0.00 H new ATOM 0 HE ARG A 42 5.414 25.040 -9.550 1.00 0.00 H new ATOM 0 HH11 ARG A 42 7.727 26.002 -7.062 1.00 0.00 H new ATOM 0 HH12 ARG A 42 8.617 27.080 -8.143 1.00 0.00 H new ATOM 0 HH21 ARG A 42 6.562 26.425 -10.932 1.00 0.00 H new ATOM 0 HH22 ARG A 42 7.960 27.318 -10.326 1.00 0.00 H new ATOM 634 N GLY A 43 2.951 21.183 -10.441 1.00 0.00 N ATOM 635 CA GLY A 43 2.895 20.506 -11.724 1.00 0.00 C ATOM 636 C GLY A 43 4.206 19.834 -12.082 1.00 0.00 C ATOM 637 O GLY A 43 4.692 19.965 -13.206 1.00 0.00 O ATOM 0 H GLY A 43 3.367 20.637 -9.686 1.00 0.00 H new ATOM 0 HA2 GLY A 43 2.101 19.759 -11.703 1.00 0.00 H new ATOM 0 HA3 GLY A 43 2.635 21.226 -12.500 1.00 0.00 H new ATOM 641 N LEU A 44 4.780 19.114 -11.125 1.00 0.00 N ATOM 642 CA LEU A 44 6.044 18.419 -11.345 1.00 0.00 C ATOM 643 C LEU A 44 5.828 16.912 -11.441 1.00 0.00 C ATOM 644 O LEU A 44 4.840 16.382 -10.932 1.00 0.00 O ATOM 645 CB LEU A 44 7.025 18.734 -10.214 1.00 0.00 C ATOM 646 CG LEU A 44 7.253 20.216 -9.917 1.00 0.00 C ATOM 647 CD1 LEU A 44 7.824 20.399 -8.519 1.00 0.00 C ATOM 648 CD2 LEU A 44 8.178 20.832 -10.957 1.00 0.00 C ATOM 0 H LEU A 44 4.391 18.996 -10.190 1.00 0.00 H new ATOM 0 HA LEU A 44 6.463 18.768 -12.289 1.00 0.00 H new ATOM 0 HB2 LEU A 44 6.666 18.253 -9.304 1.00 0.00 H new ATOM 0 HB3 LEU A 44 7.986 18.281 -10.457 1.00 0.00 H new ATOM 0 HG LEU A 44 6.292 20.728 -9.965 1.00 0.00 H new ATOM 0 HD11 LEU A 44 7.980 21.460 -8.326 1.00 0.00 H new ATOM 0 HD12 LEU A 44 7.126 19.995 -7.785 1.00 0.00 H new ATOM 0 HD13 LEU A 44 8.776 19.873 -8.443 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.329 21.887 -10.730 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.138 20.316 -10.941 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.730 20.734 -11.946 1.00 0.00 H new ATOM 660 N LYS A 45 6.759 16.227 -12.096 1.00 0.00 N ATOM 661 CA LYS A 45 6.673 14.780 -12.256 1.00 0.00 C ATOM 662 C LYS A 45 7.444 14.063 -11.152 1.00 0.00 C ATOM 663 O LYS A 45 8.605 13.693 -11.333 1.00 0.00 O ATOM 664 CB LYS A 45 7.218 14.365 -13.625 1.00 0.00 C ATOM 665 CG LYS A 45 6.564 13.114 -14.186 1.00 0.00 C ATOM 666 CD LYS A 45 6.926 12.903 -15.646 1.00 0.00 C ATOM 667 CE LYS A 45 5.998 13.678 -16.569 1.00 0.00 C ATOM 668 NZ LYS A 45 4.766 12.906 -16.893 1.00 0.00 N ATOM 0 H LYS A 45 7.582 16.650 -12.525 1.00 0.00 H new ATOM 0 HA LYS A 45 5.624 14.494 -12.187 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.075 15.186 -14.328 1.00 0.00 H new ATOM 0 HB3 LYS A 45 8.292 14.198 -13.544 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.876 12.247 -13.604 1.00 0.00 H new ATOM 0 HG3 LYS A 45 5.481 13.192 -14.086 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.956 13.218 -15.816 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.874 11.841 -15.885 1.00 0.00 H new ATOM 0 HE2 LYS A 45 5.722 14.621 -16.098 1.00 0.00 H new ATOM 0 HE3 LYS A 45 6.525 13.924 -17.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 4.160 13.468 -17.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 5.027 12.017 -17.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 4.249 12.693 -16.016 1.00 0.00 H new ATOM 682 N ILE A 46 6.792 13.871 -10.011 1.00 0.00 N ATOM 683 CA ILE A 46 7.416 13.196 -8.879 1.00 0.00 C ATOM 684 C ILE A 46 7.565 11.702 -9.144 1.00 0.00 C ATOM 685 O ILE A 46 6.677 11.069 -9.715 1.00 0.00 O ATOM 686 CB ILE A 46 6.605 13.399 -7.586 1.00 0.00 C ATOM 687 CG1 ILE A 46 6.448 14.890 -7.285 1.00 0.00 C ATOM 688 CG2 ILE A 46 7.277 12.685 -6.422 1.00 0.00 C ATOM 689 CD1 ILE A 46 7.759 15.592 -7.006 1.00 0.00 C ATOM 0 H ILE A 46 5.832 14.173 -9.845 1.00 0.00 H new ATOM 0 HA ILE A 46 8.403 13.640 -8.752 1.00 0.00 H new ATOM 0 HB ILE A 46 5.613 12.970 -7.726 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.959 15.374 -8.131 1.00 0.00 H new ATOM 0 HG13 ILE A 46 5.790 15.011 -6.425 1.00 0.00 H new ATOM 0 HG21 ILE A 46 6.692 12.838 -5.515 1.00 0.00 H new ATOM 0 HG22 ILE A 46 7.341 11.618 -6.637 1.00 0.00 H new ATOM 0 HG23 ILE A 46 8.280 13.087 -6.279 1.00 0.00 H new ATOM 0 HD11 ILE A 46 7.571 16.646 -6.801 1.00 0.00 H new ATOM 0 HD12 ILE A 46 8.240 15.134 -6.142 1.00 0.00 H new ATOM 0 HD13 ILE A 46 8.412 15.502 -7.874 1.00 0.00 H new ATOM 701 N THR A 47 8.695 11.142 -8.724 1.00 0.00 N ATOM 702 CA THR A 47 8.961 9.722 -8.914 1.00 0.00 C ATOM 703 C THR A 47 8.608 8.923 -7.665 1.00 0.00 C ATOM 704 O THR A 47 8.792 9.395 -6.542 1.00 0.00 O ATOM 705 CB THR A 47 10.439 9.470 -9.270 1.00 0.00 C ATOM 706 OG1 THR A 47 10.821 10.286 -10.383 1.00 0.00 O ATOM 707 CG2 THR A 47 10.672 8.004 -9.606 1.00 0.00 C ATOM 0 H THR A 47 9.441 11.651 -8.250 1.00 0.00 H new ATOM 0 HA THR A 47 8.333 9.392 -9.742 1.00 0.00 H new ATOM 0 HB THR A 47 11.048 9.730 -8.404 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.762 10.121 -10.602 1.00 0.00 H new ATOM 0 HG21 THR A 47 11.722 7.850 -9.854 1.00 0.00 H new ATOM 0 HG22 THR A 47 10.408 7.387 -8.747 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.053 7.723 -10.458 1.00 0.00 H new ATOM 715 N TYR A 48 8.101 7.712 -7.866 1.00 0.00 N ATOM 716 CA TYR A 48 7.721 6.849 -6.754 1.00 0.00 C ATOM 717 C TYR A 48 8.699 5.687 -6.607 1.00 0.00 C ATOM 718 O TYR A 48 9.357 5.288 -7.568 1.00 0.00 O ATOM 719 CB TYR A 48 6.303 6.313 -6.960 1.00 0.00 C ATOM 720 CG TYR A 48 5.311 7.372 -7.384 1.00 0.00 C ATOM 721 CD1 TYR A 48 5.183 8.558 -6.670 1.00 0.00 C ATOM 722 CD2 TYR A 48 4.501 7.188 -8.498 1.00 0.00 C ATOM 723 CE1 TYR A 48 4.278 9.528 -7.053 1.00 0.00 C ATOM 724 CE2 TYR A 48 3.594 8.154 -8.889 1.00 0.00 C ATOM 725 CZ TYR A 48 3.486 9.322 -8.163 1.00 0.00 C ATOM 726 OH TYR A 48 2.583 10.286 -8.549 1.00 0.00 O ATOM 0 H TYR A 48 7.944 7.306 -8.788 1.00 0.00 H new ATOM 0 HA TYR A 48 7.750 7.442 -5.840 1.00 0.00 H new ATOM 0 HB2 TYR A 48 6.327 5.527 -7.714 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.959 5.855 -6.033 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.802 8.724 -5.801 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.582 6.274 -9.068 1.00 0.00 H new ATOM 0 HE1 TYR A 48 4.191 10.443 -6.486 1.00 0.00 H new ATOM 0 HE2 TYR A 48 2.973 7.996 -9.758 1.00 0.00 H new ATOM 0 HH TYR A 48 2.105 9.985 -9.350 1.00 0.00 H new ATOM 736 N LYS A 49 8.789 5.148 -5.396 1.00 0.00 N ATOM 737 CA LYS A 49 9.684 4.030 -5.120 1.00 0.00 C ATOM 738 C LYS A 49 9.310 3.344 -3.810 1.00 0.00 C ATOM 739 O LYS A 49 9.212 3.989 -2.766 1.00 0.00 O ATOM 740 CB LYS A 49 11.134 4.515 -5.058 1.00 0.00 C ATOM 741 CG LYS A 49 12.146 3.391 -4.925 1.00 0.00 C ATOM 742 CD LYS A 49 13.554 3.928 -4.729 1.00 0.00 C ATOM 743 CE LYS A 49 14.535 2.813 -4.398 1.00 0.00 C ATOM 744 NZ LYS A 49 15.049 2.144 -5.625 1.00 0.00 N ATOM 0 H LYS A 49 8.253 5.467 -4.589 1.00 0.00 H new ATOM 0 HA LYS A 49 9.583 3.307 -5.930 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.356 5.087 -5.959 1.00 0.00 H new ATOM 0 HB3 LYS A 49 11.245 5.195 -4.213 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.877 2.756 -4.081 1.00 0.00 H new ATOM 0 HG3 LYS A 49 12.115 2.765 -5.817 1.00 0.00 H new ATOM 0 HD2 LYS A 49 13.878 4.442 -5.634 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.555 4.665 -3.926 1.00 0.00 H new ATOM 0 HE2 LYS A 49 15.371 3.221 -3.830 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.046 2.076 -3.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.714 1.391 -5.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 14.254 1.732 -6.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.538 2.841 -6.222 1.00 0.00 H new ATOM 758 N TYR A 50 9.103 2.033 -3.873 1.00 0.00 N ATOM 759 CA TYR A 50 8.738 1.260 -2.692 1.00 0.00 C ATOM 760 C TYR A 50 9.872 0.326 -2.281 1.00 0.00 C ATOM 761 O TYR A 50 9.944 -0.819 -2.730 1.00 0.00 O ATOM 762 CB TYR A 50 7.467 0.452 -2.958 1.00 0.00 C ATOM 763 CG TYR A 50 6.242 1.308 -3.185 1.00 0.00 C ATOM 764 CD1 TYR A 50 5.911 1.758 -4.457 1.00 0.00 C ATOM 765 CD2 TYR A 50 5.415 1.668 -2.127 1.00 0.00 C ATOM 766 CE1 TYR A 50 4.793 2.541 -4.669 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.294 2.449 -2.331 1.00 0.00 C ATOM 768 CZ TYR A 50 3.988 2.883 -3.603 1.00 0.00 C ATOM 769 OH TYR A 50 2.873 3.663 -3.810 1.00 0.00 O ATOM 0 H TYR A 50 9.182 1.484 -4.729 1.00 0.00 H new ATOM 0 HA TYR A 50 8.552 1.958 -1.875 1.00 0.00 H new ATOM 0 HB2 TYR A 50 7.625 -0.181 -3.832 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.285 -0.212 -2.113 1.00 0.00 H new ATOM 0 HD1 TYR A 50 6.539 1.491 -5.294 1.00 0.00 H new ATOM 0 HD2 TYR A 50 5.653 1.331 -1.129 1.00 0.00 H new ATOM 0 HE1 TYR A 50 4.551 2.883 -5.664 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.661 2.718 -1.498 1.00 0.00 H new ATOM 0 HH TYR A 50 2.415 3.812 -2.957 1.00 0.00 H new ATOM 779 N THR A 51 10.759 0.822 -1.423 1.00 0.00 N ATOM 780 CA THR A 51 11.890 0.033 -0.952 1.00 0.00 C ATOM 781 C THR A 51 11.451 -0.988 0.091 1.00 0.00 C ATOM 782 O THR A 51 10.509 -0.753 0.847 1.00 0.00 O ATOM 783 CB THR A 51 12.986 0.930 -0.346 1.00 0.00 C ATOM 784 OG1 THR A 51 13.019 2.190 -1.025 1.00 0.00 O ATOM 785 CG2 THR A 51 14.348 0.260 -0.443 1.00 0.00 C ATOM 0 H THR A 51 10.715 1.767 -1.041 1.00 0.00 H new ATOM 0 HA THR A 51 12.295 -0.489 -1.819 1.00 0.00 H new ATOM 0 HB THR A 51 12.752 1.091 0.706 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.873 2.913 -0.380 1.00 0.00 H new ATOM 0 HG21 THR A 51 15.106 0.912 -0.009 1.00 0.00 H new ATOM 0 HG22 THR A 51 14.328 -0.685 0.100 1.00 0.00 H new ATOM 0 HG23 THR A 51 14.587 0.072 -1.490 1.00 0.00 H new ATOM 793 N GLY A 52 12.142 -2.124 0.128 1.00 0.00 N ATOM 794 CA GLY A 52 11.808 -3.164 1.083 1.00 0.00 C ATOM 795 C GLY A 52 11.832 -4.548 0.465 1.00 0.00 C ATOM 796 O GLY A 52 12.175 -4.708 -0.707 1.00 0.00 O ATOM 0 H GLY A 52 12.927 -2.342 -0.486 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.511 -3.129 1.915 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.817 -2.970 1.495 1.00 0.00 H new ATOM 800 N LYS A 53 11.468 -5.553 1.254 1.00 0.00 N ATOM 801 CA LYS A 53 11.449 -6.932 0.779 1.00 0.00 C ATOM 802 C LYS A 53 10.252 -7.176 -0.134 1.00 0.00 C ATOM 803 O LYS A 53 9.148 -6.702 0.133 1.00 0.00 O ATOM 804 CB LYS A 53 11.407 -7.901 1.963 1.00 0.00 C ATOM 805 CG LYS A 53 11.950 -9.281 1.638 1.00 0.00 C ATOM 806 CD LYS A 53 12.491 -9.973 2.878 1.00 0.00 C ATOM 807 CE LYS A 53 11.403 -10.749 3.604 1.00 0.00 C ATOM 808 NZ LYS A 53 11.928 -11.445 4.811 1.00 0.00 N ATOM 0 H LYS A 53 11.182 -5.439 2.226 1.00 0.00 H new ATOM 0 HA LYS A 53 12.361 -7.106 0.208 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.981 -7.479 2.788 1.00 0.00 H new ATOM 0 HB3 LYS A 53 10.377 -7.997 2.307 1.00 0.00 H new ATOM 0 HG2 LYS A 53 11.161 -9.889 1.196 1.00 0.00 H new ATOM 0 HG3 LYS A 53 12.741 -9.196 0.893 1.00 0.00 H new ATOM 0 HD2 LYS A 53 13.296 -10.651 2.595 1.00 0.00 H new ATOM 0 HD3 LYS A 53 12.921 -9.231 3.551 1.00 0.00 H new ATOM 0 HE2 LYS A 53 10.605 -10.067 3.897 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.964 -11.480 2.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.155 -11.962 5.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.672 -12.115 4.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.324 -10.745 5.471 1.00 0.00 H new ATOM 822 N GLY A 54 10.478 -7.920 -1.213 1.00 0.00 N ATOM 823 CA GLY A 54 9.408 -8.215 -2.148 1.00 0.00 C ATOM 824 C GLY A 54 9.401 -7.275 -3.337 1.00 0.00 C ATOM 825 O GLY A 54 8.909 -7.625 -4.410 1.00 0.00 O ATOM 0 H GLY A 54 11.383 -8.323 -1.456 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.511 -9.241 -2.501 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.450 -8.150 -1.632 1.00 0.00 H new ATOM 829 N ILE A 55 9.948 -6.079 -3.147 1.00 0.00 N ATOM 830 CA ILE A 55 10.003 -5.086 -4.213 1.00 0.00 C ATOM 831 C ILE A 55 11.428 -4.906 -4.723 1.00 0.00 C ATOM 832 O ILE A 55 11.669 -4.873 -5.930 1.00 0.00 O ATOM 833 CB ILE A 55 9.461 -3.724 -3.741 1.00 0.00 C ATOM 834 CG1 ILE A 55 7.945 -3.792 -3.550 1.00 0.00 C ATOM 835 CG2 ILE A 55 9.827 -2.635 -4.739 1.00 0.00 C ATOM 836 CD1 ILE A 55 7.418 -2.793 -2.544 1.00 0.00 C ATOM 0 H ILE A 55 10.359 -5.774 -2.265 1.00 0.00 H new ATOM 0 HA ILE A 55 9.375 -5.456 -5.023 1.00 0.00 H new ATOM 0 HB ILE A 55 9.918 -3.480 -2.782 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.458 -3.620 -4.510 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.672 -4.797 -3.229 1.00 0.00 H new ATOM 0 HG21 ILE A 55 9.437 -1.678 -4.392 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.912 -2.574 -4.829 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.395 -2.872 -5.711 1.00 0.00 H new ATOM 0 HD11 ILE A 55 6.336 -2.898 -2.459 1.00 0.00 H new ATOM 0 HD12 ILE A 55 7.877 -2.978 -1.573 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.660 -1.783 -2.874 1.00 0.00 H new ATOM 848 N THR A 56 12.373 -4.790 -3.795 1.00 0.00 N ATOM 849 CA THR A 56 13.776 -4.614 -4.149 1.00 0.00 C ATOM 850 C THR A 56 14.667 -5.564 -3.358 1.00 0.00 C ATOM 851 O THR A 56 15.638 -6.103 -3.887 1.00 0.00 O ATOM 852 CB THR A 56 14.240 -3.166 -3.901 1.00 0.00 C ATOM 853 OG1 THR A 56 15.626 -3.150 -3.542 1.00 0.00 O ATOM 854 CG2 THR A 56 13.418 -2.515 -2.799 1.00 0.00 C ATOM 0 H THR A 56 12.192 -4.815 -2.792 1.00 0.00 H new ATOM 0 HA THR A 56 13.864 -4.839 -5.212 1.00 0.00 H new ATOM 0 HB THR A 56 14.097 -2.600 -4.821 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.913 -2.226 -3.388 1.00 0.00 H new ATOM 0 HG21 THR A 56 13.764 -1.493 -2.642 1.00 0.00 H new ATOM 0 HG22 THR A 56 12.367 -2.502 -3.088 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.533 -3.083 -1.876 1.00 0.00 H new ATOM 862 N GLU A 57 14.329 -5.764 -2.088 1.00 0.00 N ATOM 863 CA GLU A 57 15.101 -6.650 -1.224 1.00 0.00 C ATOM 864 C GLU A 57 14.666 -8.102 -1.406 1.00 0.00 C ATOM 865 O GLU A 57 13.505 -8.398 -1.690 1.00 0.00 O ATOM 866 CB GLU A 57 14.940 -6.238 0.241 1.00 0.00 C ATOM 867 CG GLU A 57 15.931 -5.177 0.687 1.00 0.00 C ATOM 868 CD GLU A 57 16.038 -5.076 2.196 1.00 0.00 C ATOM 869 OE1 GLU A 57 16.233 -6.122 2.849 1.00 0.00 O ATOM 870 OE2 GLU A 57 15.926 -3.949 2.724 1.00 0.00 O ATOM 0 H GLU A 57 13.527 -5.325 -1.635 1.00 0.00 H new ATOM 0 HA GLU A 57 16.151 -6.565 -1.505 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.927 -5.865 0.396 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.055 -7.119 0.872 1.00 0.00 H new ATOM 0 HG2 GLU A 57 16.913 -5.404 0.271 1.00 0.00 H new ATOM 0 HG3 GLU A 57 15.630 -4.211 0.282 1.00 0.00 H new ATOM 877 N PRO A 58 15.620 -9.030 -1.239 1.00 0.00 N ATOM 878 CA PRO A 58 15.361 -10.466 -1.380 1.00 0.00 C ATOM 879 C PRO A 58 14.495 -11.012 -0.251 1.00 0.00 C ATOM 880 O PRO A 58 14.720 -10.733 0.927 1.00 0.00 O ATOM 881 CB PRO A 58 16.760 -11.085 -1.329 1.00 0.00 C ATOM 882 CG PRO A 58 17.580 -10.105 -0.564 1.00 0.00 C ATOM 883 CD PRO A 58 17.025 -8.749 -0.900 1.00 0.00 C ATOM 0 HA PRO A 58 14.812 -10.694 -2.294 1.00 0.00 H new ATOM 0 HB2 PRO A 58 16.745 -12.058 -0.837 1.00 0.00 H new ATOM 0 HB3 PRO A 58 17.161 -11.240 -2.331 1.00 0.00 H new ATOM 0 HG2 PRO A 58 17.519 -10.297 0.507 1.00 0.00 H new ATOM 0 HG3 PRO A 58 18.632 -10.176 -0.841 1.00 0.00 H new ATOM 0 HD2 PRO A 58 17.105 -8.062 -0.058 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.556 -8.293 -1.735 1.00 0.00 H new ATOM 891 N PRO A 59 13.480 -11.810 -0.615 1.00 0.00 N ATOM 892 CA PRO A 59 13.201 -12.148 -2.014 1.00 0.00 C ATOM 893 C PRO A 59 12.677 -10.955 -2.805 1.00 0.00 C ATOM 894 O PRO A 59 11.886 -10.159 -2.298 1.00 0.00 O ATOM 895 CB PRO A 59 12.128 -13.234 -1.909 1.00 0.00 C ATOM 896 CG PRO A 59 11.459 -12.981 -0.602 1.00 0.00 C ATOM 897 CD PRO A 59 12.525 -12.442 0.311 1.00 0.00 C ATOM 0 HA PRO A 59 14.099 -12.467 -2.543 1.00 0.00 H new ATOM 0 HB2 PRO A 59 11.419 -13.172 -2.735 1.00 0.00 H new ATOM 0 HB3 PRO A 59 12.569 -14.230 -1.942 1.00 0.00 H new ATOM 0 HG2 PRO A 59 10.643 -12.267 -0.713 1.00 0.00 H new ATOM 0 HG3 PRO A 59 11.028 -13.898 -0.200 1.00 0.00 H new ATOM 0 HD2 PRO A 59 12.119 -11.723 1.022 1.00 0.00 H new ATOM 0 HD3 PRO A 59 12.994 -13.235 0.893 1.00 0.00 H new ATOM 905 N PHE A 60 13.122 -10.836 -4.052 1.00 0.00 N ATOM 906 CA PHE A 60 12.697 -9.739 -4.914 1.00 0.00 C ATOM 907 C PHE A 60 11.922 -10.263 -6.119 1.00 0.00 C ATOM 908 O PHE A 60 12.199 -11.349 -6.626 1.00 0.00 O ATOM 909 CB PHE A 60 13.910 -8.934 -5.385 1.00 0.00 C ATOM 910 CG PHE A 60 15.132 -9.774 -5.623 1.00 0.00 C ATOM 911 CD1 PHE A 60 15.294 -10.464 -6.813 1.00 0.00 C ATOM 912 CD2 PHE A 60 16.119 -9.875 -4.655 1.00 0.00 C ATOM 913 CE1 PHE A 60 16.418 -11.238 -7.035 1.00 0.00 C ATOM 914 CE2 PHE A 60 17.245 -10.647 -4.871 1.00 0.00 C ATOM 915 CZ PHE A 60 17.393 -11.331 -6.062 1.00 0.00 C ATOM 0 H PHE A 60 13.777 -11.486 -4.488 1.00 0.00 H new ATOM 0 HA PHE A 60 12.040 -9.089 -4.336 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.653 -8.411 -6.306 1.00 0.00 H new ATOM 0 HB3 PHE A 60 14.142 -8.173 -4.640 1.00 0.00 H new ATOM 0 HD1 PHE A 60 14.533 -10.397 -7.577 1.00 0.00 H new ATOM 0 HD2 PHE A 60 16.007 -9.344 -3.721 1.00 0.00 H new ATOM 0 HE1 PHE A 60 16.533 -11.769 -7.968 1.00 0.00 H new ATOM 0 HE2 PHE A 60 18.008 -10.715 -4.110 1.00 0.00 H new ATOM 0 HZ PHE A 60 18.270 -11.938 -6.232 1.00 0.00 H new ATOM 925 N GLY A 61 10.946 -9.482 -6.572 1.00 0.00 N ATOM 926 CA GLY A 61 10.144 -9.883 -7.713 1.00 0.00 C ATOM 927 C GLY A 61 8.793 -10.437 -7.306 1.00 0.00 C ATOM 928 O GLY A 61 8.346 -11.454 -7.838 1.00 0.00 O ATOM 0 H GLY A 61 10.696 -8.579 -6.169 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.999 -9.026 -8.370 1.00 0.00 H new ATOM 0 HA3 GLY A 61 10.684 -10.636 -8.286 1.00 0.00 H new ATOM 932 N ILE A 62 8.142 -9.769 -6.360 1.00 0.00 N ATOM 933 CA ILE A 62 6.835 -10.201 -5.882 1.00 0.00 C ATOM 934 C ILE A 62 5.756 -9.183 -6.234 1.00 0.00 C ATOM 935 O ILE A 62 4.622 -9.546 -6.547 1.00 0.00 O ATOM 936 CB ILE A 62 6.838 -10.423 -4.358 1.00 0.00 C ATOM 937 CG1 ILE A 62 7.909 -11.445 -3.971 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.466 -10.882 -3.887 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.973 -11.720 -2.486 1.00 0.00 C ATOM 0 H ILE A 62 8.499 -8.926 -5.909 1.00 0.00 H new ATOM 0 HA ILE A 62 6.615 -11.146 -6.378 1.00 0.00 H new ATOM 0 HB ILE A 62 7.071 -9.477 -3.869 1.00 0.00 H new ATOM 0 HG12 ILE A 62 7.715 -12.380 -4.497 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.881 -11.086 -4.308 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.484 -11.035 -2.808 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.724 -10.123 -4.134 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.206 -11.818 -4.382 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.754 -12.453 -2.285 1.00 0.00 H new ATOM 0 HD12 ILE A 62 8.198 -10.796 -1.954 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.013 -12.110 -2.146 1.00 0.00 H new ATOM 951 N PHE A 63 6.118 -7.905 -6.182 1.00 0.00 N ATOM 952 CA PHE A 63 5.181 -6.832 -6.496 1.00 0.00 C ATOM 953 C PHE A 63 5.624 -6.071 -7.742 1.00 0.00 C ATOM 954 O PHE A 63 6.740 -6.252 -8.230 1.00 0.00 O ATOM 955 CB PHE A 63 5.059 -5.870 -5.313 1.00 0.00 C ATOM 956 CG PHE A 63 4.602 -6.533 -4.046 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.252 -6.638 -3.751 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.521 -7.052 -3.149 1.00 0.00 C ATOM 959 CE1 PHE A 63 2.828 -7.247 -2.585 1.00 0.00 C ATOM 960 CE2 PHE A 63 5.104 -7.663 -1.981 1.00 0.00 C ATOM 961 CZ PHE A 63 3.755 -7.761 -1.700 1.00 0.00 C ATOM 0 H PHE A 63 7.053 -7.587 -5.926 1.00 0.00 H new ATOM 0 HA PHE A 63 4.207 -7.280 -6.692 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.026 -5.398 -5.138 1.00 0.00 H new ATOM 0 HB3 PHE A 63 4.358 -5.076 -5.571 1.00 0.00 H new ATOM 0 HD1 PHE A 63 2.523 -6.239 -4.440 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.577 -6.978 -3.365 1.00 0.00 H new ATOM 0 HE1 PHE A 63 1.773 -7.321 -2.366 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.831 -8.063 -1.290 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.426 -8.239 -0.789 1.00 0.00 H new ATOM 971 N VAL A 64 4.742 -5.218 -8.253 1.00 0.00 N ATOM 972 CA VAL A 64 5.041 -4.428 -9.441 1.00 0.00 C ATOM 973 C VAL A 64 4.477 -3.017 -9.319 1.00 0.00 C ATOM 974 O VAL A 64 3.351 -2.824 -8.860 1.00 0.00 O ATOM 975 CB VAL A 64 4.473 -5.088 -10.711 1.00 0.00 C ATOM 976 CG1 VAL A 64 5.065 -6.476 -10.902 1.00 0.00 C ATOM 977 CG2 VAL A 64 2.955 -5.152 -10.645 1.00 0.00 C ATOM 0 H VAL A 64 3.814 -5.056 -7.862 1.00 0.00 H new ATOM 0 HA VAL A 64 6.127 -4.376 -9.522 1.00 0.00 H new ATOM 0 HB VAL A 64 4.751 -4.479 -11.571 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.652 -6.927 -11.804 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.148 -6.400 -10.998 1.00 0.00 H new ATOM 0 HG13 VAL A 64 4.820 -7.098 -10.041 1.00 0.00 H new ATOM 0 HG21 VAL A 64 2.571 -5.621 -11.551 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.653 -5.738 -9.777 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.552 -4.143 -10.560 1.00 0.00 H new ATOM 987 N PHE A 65 5.266 -2.032 -9.735 1.00 0.00 N ATOM 988 CA PHE A 65 4.846 -0.637 -9.672 1.00 0.00 C ATOM 989 C PHE A 65 5.690 0.228 -10.603 1.00 0.00 C ATOM 990 O PHE A 65 6.707 -0.219 -11.131 1.00 0.00 O ATOM 991 CB PHE A 65 4.950 -0.114 -8.238 1.00 0.00 C ATOM 992 CG PHE A 65 6.327 0.360 -7.872 1.00 0.00 C ATOM 993 CD1 PHE A 65 6.702 1.676 -8.089 1.00 0.00 C ATOM 994 CD2 PHE A 65 7.248 -0.510 -7.310 1.00 0.00 C ATOM 995 CE1 PHE A 65 7.968 2.116 -7.753 1.00 0.00 C ATOM 996 CE2 PHE A 65 8.515 -0.076 -6.972 1.00 0.00 C ATOM 997 CZ PHE A 65 8.876 1.239 -7.194 1.00 0.00 C ATOM 0 H PHE A 65 6.200 -2.174 -10.119 1.00 0.00 H new ATOM 0 HA PHE A 65 3.807 -0.582 -9.996 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.245 0.707 -8.107 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.651 -0.904 -7.549 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.996 2.367 -8.526 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.972 -1.539 -7.134 1.00 0.00 H new ATOM 0 HE1 PHE A 65 8.247 3.145 -7.927 1.00 0.00 H new ATOM 0 HE2 PHE A 65 9.223 -0.764 -6.534 1.00 0.00 H new ATOM 0 HZ PHE A 65 9.866 1.580 -6.931 1.00 0.00 H new ATOM 1007 N ASN A 66 5.259 1.470 -10.800 1.00 0.00 N ATOM 1008 CA ASN A 66 5.974 2.398 -11.669 1.00 0.00 C ATOM 1009 C ASN A 66 5.811 3.835 -11.181 1.00 0.00 C ATOM 1010 O ASN A 66 5.023 4.109 -10.275 1.00 0.00 O ATOM 1011 CB ASN A 66 5.469 2.276 -13.107 1.00 0.00 C ATOM 1012 CG ASN A 66 5.075 0.855 -13.463 1.00 0.00 C ATOM 1013 OD1 ASN A 66 5.805 0.153 -14.163 1.00 0.00 O ATOM 1014 ND2 ASN A 66 3.915 0.425 -12.981 1.00 0.00 N ATOM 0 H ASN A 66 4.419 1.857 -10.370 1.00 0.00 H new ATOM 0 HA ASN A 66 7.033 2.141 -11.640 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.611 2.933 -13.245 1.00 0.00 H new ATOM 0 HB3 ASN A 66 6.245 2.617 -13.792 1.00 0.00 H new ATOM 0 HD21 ASN A 66 3.597 -0.522 -13.187 1.00 0.00 H new ATOM 0 HD22 ASN A 66 3.342 1.042 -12.405 1.00 0.00 H new ATOM 1021 N LYS A 67 6.560 4.748 -11.788 1.00 0.00 N ATOM 1022 CA LYS A 67 6.499 6.158 -11.419 1.00 0.00 C ATOM 1023 C LYS A 67 5.609 6.935 -12.384 1.00 0.00 C ATOM 1024 O LYS A 67 5.194 8.057 -12.093 1.00 0.00 O ATOM 1025 CB LYS A 67 7.904 6.764 -11.403 1.00 0.00 C ATOM 1026 CG LYS A 67 8.569 6.793 -12.769 1.00 0.00 C ATOM 1027 CD LYS A 67 9.419 5.555 -13.002 1.00 0.00 C ATOM 1028 CE LYS A 67 10.559 5.836 -13.969 1.00 0.00 C ATOM 1029 NZ LYS A 67 11.665 6.590 -13.318 1.00 0.00 N ATOM 0 H LYS A 67 7.218 4.537 -12.539 1.00 0.00 H new ATOM 0 HA LYS A 67 6.069 6.228 -10.420 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.848 7.781 -11.014 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.529 6.194 -10.716 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.806 6.863 -13.545 1.00 0.00 H new ATOM 0 HG3 LYS A 67 9.191 7.684 -12.853 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.824 5.206 -12.052 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.795 4.753 -13.396 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.943 4.894 -14.361 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.182 6.405 -14.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.153 7.172 -14.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 11.276 7.205 -12.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 12.340 5.921 -12.896 1.00 0.00 H new ATOM 1043 N ASP A 68 5.319 6.331 -13.531 1.00 0.00 N ATOM 1044 CA ASP A 68 4.476 6.965 -14.537 1.00 0.00 C ATOM 1045 C ASP A 68 2.999 6.762 -14.215 1.00 0.00 C ATOM 1046 O ASP A 68 2.197 7.692 -14.313 1.00 0.00 O ATOM 1047 CB ASP A 68 4.790 6.403 -15.924 1.00 0.00 C ATOM 1048 CG ASP A 68 4.076 7.156 -17.030 1.00 0.00 C ATOM 1049 OD1 ASP A 68 3.995 8.400 -16.944 1.00 0.00 O ATOM 1050 OD2 ASP A 68 3.599 6.502 -17.981 1.00 0.00 O ATOM 0 H ASP A 68 5.656 5.403 -13.787 1.00 0.00 H new ATOM 0 HA ASP A 68 4.687 8.034 -14.530 1.00 0.00 H new ATOM 0 HB2 ASP A 68 5.866 6.446 -16.095 1.00 0.00 H new ATOM 0 HB3 ASP A 68 4.503 5.352 -15.960 1.00 0.00 H new ATOM 1055 N THR A 69 2.644 5.540 -13.831 1.00 0.00 N ATOM 1056 CA THR A 69 1.264 5.214 -13.497 1.00 0.00 C ATOM 1057 C THR A 69 1.033 5.279 -11.991 1.00 0.00 C ATOM 1058 O THR A 69 -0.057 5.621 -11.535 1.00 0.00 O ATOM 1059 CB THR A 69 0.879 3.811 -14.004 1.00 0.00 C ATOM 1060 OG1 THR A 69 1.632 2.814 -13.304 1.00 0.00 O ATOM 1061 CG2 THR A 69 1.131 3.688 -15.499 1.00 0.00 C ATOM 0 H THR A 69 3.294 4.759 -13.744 1.00 0.00 H new ATOM 0 HA THR A 69 0.636 5.955 -13.991 1.00 0.00 H new ATOM 0 HB THR A 69 -0.184 3.660 -13.818 1.00 0.00 H new ATOM 0 HG1 THR A 69 1.381 1.925 -13.631 1.00 0.00 H new ATOM 0 HG21 THR A 69 0.852 2.689 -15.834 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.534 4.429 -16.031 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.188 3.858 -15.705 1.00 0.00 H new ATOM 1069 N GLY A 70 2.067 4.948 -11.224 1.00 0.00 N ATOM 1070 CA GLY A 70 1.955 4.976 -9.777 1.00 0.00 C ATOM 1071 C GLY A 70 0.946 3.973 -9.254 1.00 0.00 C ATOM 1072 O GLY A 70 0.154 4.286 -8.366 1.00 0.00 O ATOM 0 H GLY A 70 2.980 4.661 -11.578 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.930 4.769 -9.336 1.00 0.00 H new ATOM 0 HA3 GLY A 70 1.667 5.977 -9.457 1.00 0.00 H new ATOM 1076 N GLU A 71 0.974 2.764 -9.807 1.00 0.00 N ATOM 1077 CA GLU A 71 0.052 1.714 -9.391 1.00 0.00 C ATOM 1078 C GLU A 71 0.807 0.546 -8.761 1.00 0.00 C ATOM 1079 O GLU A 71 1.788 0.053 -9.319 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.767 1.221 -10.586 1.00 0.00 C ATOM 1081 CG GLU A 71 -1.421 -0.131 -10.359 1.00 0.00 C ATOM 1082 CD GLU A 71 -2.705 -0.298 -11.150 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -3.633 0.513 -10.953 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -2.780 -1.241 -11.966 1.00 0.00 O ATOM 0 H GLU A 71 1.624 2.488 -10.543 1.00 0.00 H new ATOM 0 HA GLU A 71 -0.623 2.133 -8.645 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.540 1.955 -10.814 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.118 1.159 -11.460 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.722 -0.920 -10.637 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -1.634 -0.254 -9.297 1.00 0.00 H new ATOM 1091 N LEU A 72 0.342 0.110 -7.596 1.00 0.00 N ATOM 1092 CA LEU A 72 0.972 -1.000 -6.888 1.00 0.00 C ATOM 1093 C LEU A 72 0.138 -2.271 -7.015 1.00 0.00 C ATOM 1094 O LEU A 72 -1.012 -2.316 -6.580 1.00 0.00 O ATOM 1095 CB LEU A 72 1.162 -0.647 -5.412 1.00 0.00 C ATOM 1096 CG LEU A 72 1.904 -1.681 -4.565 1.00 0.00 C ATOM 1097 CD1 LEU A 72 3.365 -1.761 -4.977 1.00 0.00 C ATOM 1098 CD2 LEU A 72 1.783 -1.345 -3.085 1.00 0.00 C ATOM 0 H LEU A 72 -0.469 0.507 -7.121 1.00 0.00 H new ATOM 0 HA LEU A 72 1.947 -1.181 -7.341 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.702 0.298 -5.352 1.00 0.00 H new ATOM 0 HB3 LEU A 72 0.180 -0.481 -4.969 1.00 0.00 H new ATOM 0 HG LEU A 72 1.447 -2.656 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.876 -2.502 -4.363 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.432 -2.050 -6.026 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.836 -0.788 -4.838 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.317 -2.092 -2.498 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.213 -0.361 -2.899 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.732 -1.341 -2.797 1.00 0.00 H new ATOM 1110 N ASN A 73 0.727 -3.301 -7.613 1.00 0.00 N ATOM 1111 CA ASN A 73 0.039 -4.574 -7.796 1.00 0.00 C ATOM 1112 C ASN A 73 0.942 -5.741 -7.409 1.00 0.00 C ATOM 1113 O ASN A 73 2.136 -5.743 -7.710 1.00 0.00 O ATOM 1114 CB ASN A 73 -0.417 -4.727 -9.249 1.00 0.00 C ATOM 1115 CG ASN A 73 -0.587 -6.179 -9.652 1.00 0.00 C ATOM 1116 OD1 ASN A 73 0.351 -6.972 -9.564 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -1.787 -6.533 -10.096 1.00 0.00 N ATOM 0 H ASN A 73 1.679 -3.279 -7.979 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.835 -4.583 -7.145 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -1.362 -4.201 -9.388 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.311 -4.253 -9.907 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.961 -7.497 -10.381 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.535 -5.841 -10.152 1.00 0.00 H new ATOM 1124 N VAL A 74 0.363 -6.734 -6.741 1.00 0.00 N ATOM 1125 CA VAL A 74 1.114 -7.908 -6.314 1.00 0.00 C ATOM 1126 C VAL A 74 0.987 -9.040 -7.327 1.00 0.00 C ATOM 1127 O VAL A 74 -0.119 -9.425 -7.710 1.00 0.00 O ATOM 1128 CB VAL A 74 0.638 -8.410 -4.938 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -0.847 -8.737 -4.973 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.449 -9.621 -4.502 1.00 0.00 C ATOM 0 H VAL A 74 -0.624 -6.748 -6.484 1.00 0.00 H new ATOM 0 HA VAL A 74 2.158 -7.605 -6.240 1.00 0.00 H new ATOM 0 HB VAL A 74 0.794 -7.616 -4.208 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.165 -9.090 -3.992 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.411 -7.842 -5.237 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.031 -9.514 -5.715 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.099 -9.962 -3.528 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.328 -10.422 -5.232 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.502 -9.348 -4.434 1.00 0.00 H new ATOM 1140 N THR A 75 2.126 -9.572 -7.759 1.00 0.00 N ATOM 1141 CA THR A 75 2.143 -10.660 -8.728 1.00 0.00 C ATOM 1142 C THR A 75 2.613 -11.961 -8.087 1.00 0.00 C ATOM 1143 O THR A 75 3.373 -12.721 -8.687 1.00 0.00 O ATOM 1144 CB THR A 75 3.055 -10.332 -9.925 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.401 -10.138 -9.477 1.00 0.00 O ATOM 1146 CG2 THR A 75 2.571 -9.085 -10.649 1.00 0.00 C ATOM 0 H THR A 75 3.050 -9.266 -7.452 1.00 0.00 H new ATOM 0 HA THR A 75 1.120 -10.782 -9.083 1.00 0.00 H new ATOM 0 HB THR A 75 3.021 -11.172 -10.619 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.413 -10.059 -8.500 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.231 -8.874 -11.490 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.557 -9.247 -11.015 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.578 -8.239 -9.961 1.00 0.00 H new ATOM 1154 N SER A 76 2.155 -12.212 -6.864 1.00 0.00 N ATOM 1155 CA SER A 76 2.532 -13.420 -6.140 1.00 0.00 C ATOM 1156 C SER A 76 1.597 -13.659 -4.958 1.00 0.00 C ATOM 1157 O SER A 76 1.036 -12.717 -4.397 1.00 0.00 O ATOM 1158 CB SER A 76 3.977 -13.317 -5.650 1.00 0.00 C ATOM 1159 OG SER A 76 4.881 -13.820 -6.618 1.00 0.00 O ATOM 0 H SER A 76 1.523 -11.595 -6.354 1.00 0.00 H new ATOM 0 HA SER A 76 2.448 -14.265 -6.824 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.216 -12.277 -5.430 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.089 -13.873 -4.719 1.00 0.00 H new ATOM 0 HG SER A 76 4.567 -13.580 -7.515 1.00 0.00 H new ATOM 1165 N ILE A 77 1.436 -14.924 -4.585 1.00 0.00 N ATOM 1166 CA ILE A 77 0.571 -15.286 -3.470 1.00 0.00 C ATOM 1167 C ILE A 77 1.305 -15.153 -2.139 1.00 0.00 C ATOM 1168 O ILE A 77 2.285 -15.854 -1.886 1.00 0.00 O ATOM 1169 CB ILE A 77 0.044 -16.727 -3.610 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.772 -16.871 -4.896 1.00 0.00 C ATOM 1171 CG2 ILE A 77 -0.794 -17.105 -2.399 1.00 0.00 C ATOM 1172 CD1 ILE A 77 -0.891 -18.299 -5.380 1.00 0.00 C ATOM 0 H ILE A 77 1.893 -15.715 -5.039 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.272 -14.596 -3.489 1.00 0.00 H new ATOM 0 HB ILE A 77 0.895 -17.406 -3.664 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.771 -16.468 -4.730 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.311 -16.268 -5.678 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.159 -18.126 -2.513 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.184 -17.036 -1.498 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.641 -16.424 -2.316 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.482 -18.325 -6.295 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.103 -18.700 -5.579 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.380 -18.903 -4.615 1.00 0.00 H new ATOM 1184 N LEU A 78 0.823 -14.250 -1.292 1.00 0.00 N ATOM 1185 CA LEU A 78 1.432 -14.026 0.014 1.00 0.00 C ATOM 1186 C LEU A 78 1.387 -15.294 0.861 1.00 0.00 C ATOM 1187 O LEU A 78 0.468 -16.103 0.737 1.00 0.00 O ATOM 1188 CB LEU A 78 0.716 -12.887 0.743 1.00 0.00 C ATOM 1189 CG LEU A 78 0.491 -11.609 -0.065 1.00 0.00 C ATOM 1190 CD1 LEU A 78 -0.240 -10.570 0.771 1.00 0.00 C ATOM 1191 CD2 LEU A 78 1.817 -11.056 -0.567 1.00 0.00 C ATOM 0 H LEU A 78 0.013 -13.662 -1.486 1.00 0.00 H new ATOM 0 HA LEU A 78 2.475 -13.752 -0.141 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.253 -13.253 1.084 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.292 -12.633 1.633 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.129 -11.852 -0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.391 -9.667 0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.207 -10.967 1.081 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.353 -10.330 1.653 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.638 -10.146 -1.140 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.461 -10.829 0.282 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.302 -11.796 -1.203 1.00 0.00 H new ATOM 1203 N ASP A 79 2.385 -15.459 1.722 1.00 0.00 N ATOM 1204 CA ASP A 79 2.459 -16.627 2.593 1.00 0.00 C ATOM 1205 C ASP A 79 2.938 -16.236 3.987 1.00 0.00 C ATOM 1206 O ASP A 79 3.900 -15.482 4.135 1.00 0.00 O ATOM 1207 CB ASP A 79 3.395 -17.677 1.993 1.00 0.00 C ATOM 1208 CG ASP A 79 3.023 -19.088 2.408 1.00 0.00 C ATOM 1209 OD1 ASP A 79 2.041 -19.245 3.163 1.00 0.00 O ATOM 1210 OD2 ASP A 79 3.715 -20.034 1.978 1.00 0.00 O ATOM 0 H ASP A 79 3.154 -14.799 1.836 1.00 0.00 H new ATOM 0 HA ASP A 79 1.458 -17.050 2.679 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.371 -17.603 0.906 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.418 -17.468 2.304 1.00 0.00 H new ATOM 1215 N ARG A 80 2.261 -16.753 5.007 1.00 0.00 N ATOM 1216 CA ARG A 80 2.616 -16.457 6.389 1.00 0.00 C ATOM 1217 C ARG A 80 3.914 -17.159 6.779 1.00 0.00 C ATOM 1218 O ARG A 80 4.881 -16.514 7.185 1.00 0.00 O ATOM 1219 CB ARG A 80 1.489 -16.885 7.331 1.00 0.00 C ATOM 1220 CG ARG A 80 1.461 -16.111 8.639 1.00 0.00 C ATOM 1221 CD ARG A 80 0.159 -16.334 9.391 1.00 0.00 C ATOM 1222 NE ARG A 80 0.139 -17.621 10.080 1.00 0.00 N ATOM 1223 CZ ARG A 80 -0.619 -17.875 11.142 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -1.414 -16.935 11.632 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -0.582 -19.072 11.714 1.00 0.00 N ATOM 0 H ARG A 80 1.463 -17.379 4.902 1.00 0.00 H new ATOM 0 HA ARG A 80 2.764 -15.381 6.477 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.534 -16.757 6.822 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.594 -17.948 7.550 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.300 -16.419 9.263 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.588 -15.048 8.436 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.017 -15.532 10.116 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.676 -16.284 8.693 1.00 0.00 H new ATOM 0 HE ARG A 80 0.740 -18.366 9.727 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -1.445 -16.014 11.194 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -1.995 -17.132 12.447 1.00 0.00 H new ATOM 0 HH21 ARG A 80 0.028 -19.798 11.339 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -1.164 -19.266 12.529 1.00 0.00 H new ATOM 1239 N GLU A 81 3.926 -18.482 6.655 1.00 0.00 N ATOM 1240 CA GLU A 81 5.104 -19.270 6.996 1.00 0.00 C ATOM 1241 C GLU A 81 6.364 -18.651 6.398 1.00 0.00 C ATOM 1242 O GLU A 81 7.384 -18.522 7.074 1.00 0.00 O ATOM 1243 CB GLU A 81 4.944 -20.709 6.499 1.00 0.00 C ATOM 1244 CG GLU A 81 4.832 -20.822 4.988 1.00 0.00 C ATOM 1245 CD GLU A 81 4.645 -22.253 4.522 1.00 0.00 C ATOM 1246 OE1 GLU A 81 5.661 -22.946 4.310 1.00 0.00 O ATOM 1247 OE2 GLU A 81 3.481 -22.679 4.370 1.00 0.00 O ATOM 0 H GLU A 81 3.134 -19.031 6.321 1.00 0.00 H new ATOM 0 HA GLU A 81 5.203 -19.277 8.081 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.797 -21.298 6.837 1.00 0.00 H new ATOM 0 HB3 GLU A 81 4.055 -21.145 6.954 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.992 -20.219 4.644 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.730 -20.409 4.529 1.00 0.00 H new ATOM 1254 N GLU A 82 6.284 -18.272 5.127 1.00 0.00 N ATOM 1255 CA GLU A 82 7.419 -17.668 4.438 1.00 0.00 C ATOM 1256 C GLU A 82 7.749 -16.300 5.028 1.00 0.00 C ATOM 1257 O GLU A 82 8.800 -16.112 5.641 1.00 0.00 O ATOM 1258 CB GLU A 82 7.123 -17.533 2.943 1.00 0.00 C ATOM 1259 CG GLU A 82 8.345 -17.182 2.110 1.00 0.00 C ATOM 1260 CD GLU A 82 9.560 -18.012 2.478 1.00 0.00 C ATOM 1261 OE1 GLU A 82 10.259 -17.641 3.444 1.00 0.00 O ATOM 1262 OE2 GLU A 82 9.811 -19.030 1.801 1.00 0.00 O ATOM 0 H GLU A 82 5.446 -18.372 4.554 1.00 0.00 H new ATOM 0 HA GLU A 82 8.282 -18.320 4.573 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.702 -18.470 2.578 1.00 0.00 H new ATOM 0 HB3 GLU A 82 6.363 -16.765 2.800 1.00 0.00 H new ATOM 0 HG2 GLU A 82 8.115 -17.329 1.055 1.00 0.00 H new ATOM 0 HG3 GLU A 82 8.578 -16.125 2.241 1.00 0.00 H new ATOM 1269 N THR A 83 6.843 -15.346 4.838 1.00 0.00 N ATOM 1270 CA THR A 83 7.036 -13.995 5.349 1.00 0.00 C ATOM 1271 C THR A 83 5.853 -13.555 6.203 1.00 0.00 C ATOM 1272 O THR A 83 4.698 -13.606 5.779 1.00 0.00 O ATOM 1273 CB THR A 83 7.233 -12.984 4.204 1.00 0.00 C ATOM 1274 OG1 THR A 83 6.235 -13.184 3.197 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.617 -13.126 3.588 1.00 0.00 C ATOM 0 H THR A 83 5.967 -15.485 4.333 1.00 0.00 H new ATOM 0 HA THR A 83 7.936 -14.016 5.964 1.00 0.00 H new ATOM 0 HB THR A 83 7.137 -11.979 4.616 1.00 0.00 H new ATOM 0 HG1 THR A 83 6.024 -12.327 2.771 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.732 -12.402 2.782 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.375 -12.945 4.350 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.737 -14.134 3.190 1.00 0.00 H new ATOM 1283 N PRO A 84 6.143 -13.112 7.435 1.00 0.00 N ATOM 1284 CA PRO A 84 5.115 -12.653 8.374 1.00 0.00 C ATOM 1285 C PRO A 84 4.483 -11.334 7.942 1.00 0.00 C ATOM 1286 O PRO A 84 3.282 -11.125 8.112 1.00 0.00 O ATOM 1287 CB PRO A 84 5.886 -12.473 9.684 1.00 0.00 C ATOM 1288 CG PRO A 84 7.294 -12.226 9.264 1.00 0.00 C ATOM 1289 CD PRO A 84 7.497 -13.024 8.007 1.00 0.00 C ATOM 0 HA PRO A 84 4.285 -13.356 8.445 1.00 0.00 H new ATOM 0 HB2 PRO A 84 5.493 -11.637 10.263 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.810 -13.360 10.313 1.00 0.00 H new ATOM 0 HG2 PRO A 84 7.467 -11.165 9.085 1.00 0.00 H new ATOM 0 HG3 PRO A 84 7.993 -12.537 10.041 1.00 0.00 H new ATOM 0 HD2 PRO A 84 8.190 -12.530 7.325 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.908 -14.011 8.220 1.00 0.00 H new ATOM 1297 N PHE A 85 5.299 -10.447 7.382 1.00 0.00 N ATOM 1298 CA PHE A 85 4.820 -9.148 6.926 1.00 0.00 C ATOM 1299 C PHE A 85 5.793 -8.528 5.928 1.00 0.00 C ATOM 1300 O PHE A 85 6.930 -8.982 5.788 1.00 0.00 O ATOM 1301 CB PHE A 85 4.625 -8.206 8.117 1.00 0.00 C ATOM 1302 CG PHE A 85 5.698 -8.329 9.161 1.00 0.00 C ATOM 1303 CD1 PHE A 85 6.916 -7.689 9.000 1.00 0.00 C ATOM 1304 CD2 PHE A 85 5.488 -9.086 10.302 1.00 0.00 C ATOM 1305 CE1 PHE A 85 7.905 -7.800 9.959 1.00 0.00 C ATOM 1306 CE2 PHE A 85 6.474 -9.200 11.265 1.00 0.00 C ATOM 1307 CZ PHE A 85 7.684 -8.557 11.092 1.00 0.00 C ATOM 0 H PHE A 85 6.296 -10.605 7.233 1.00 0.00 H new ATOM 0 HA PHE A 85 3.862 -9.297 6.428 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.597 -7.178 7.756 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.658 -8.409 8.576 1.00 0.00 H new ATOM 0 HD1 PHE A 85 7.095 -7.096 8.115 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.544 -9.592 10.441 1.00 0.00 H new ATOM 0 HE1 PHE A 85 8.850 -7.295 9.822 1.00 0.00 H new ATOM 0 HE2 PHE A 85 6.298 -9.791 12.151 1.00 0.00 H new ATOM 0 HZ PHE A 85 8.456 -8.646 11.842 1.00 0.00 H new ATOM 1317 N PHE A 86 5.340 -7.489 5.235 1.00 0.00 N ATOM 1318 CA PHE A 86 6.169 -6.808 4.248 1.00 0.00 C ATOM 1319 C PHE A 86 6.304 -5.325 4.582 1.00 0.00 C ATOM 1320 O PHE A 86 5.461 -4.512 4.201 1.00 0.00 O ATOM 1321 CB PHE A 86 5.574 -6.975 2.848 1.00 0.00 C ATOM 1322 CG PHE A 86 5.723 -8.363 2.295 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.962 -8.832 1.889 1.00 0.00 C ATOM 1324 CD2 PHE A 86 4.624 -9.199 2.180 1.00 0.00 C ATOM 1325 CE1 PHE A 86 7.103 -10.110 1.380 1.00 0.00 C ATOM 1326 CE2 PHE A 86 4.759 -10.478 1.673 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.000 -10.933 1.271 1.00 0.00 C ATOM 0 H PHE A 86 4.403 -7.100 5.339 1.00 0.00 H new ATOM 0 HA PHE A 86 7.161 -7.259 4.270 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.516 -6.716 2.879 1.00 0.00 H new ATOM 0 HB3 PHE A 86 6.055 -6.269 2.171 1.00 0.00 H new ATOM 0 HD1 PHE A 86 7.828 -8.192 1.971 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.651 -8.847 2.490 1.00 0.00 H new ATOM 0 HE1 PHE A 86 8.075 -10.464 1.068 1.00 0.00 H new ATOM 0 HE2 PHE A 86 3.895 -11.121 1.591 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.107 -11.931 0.872 1.00 0.00 H new ATOM 1337 N LEU A 87 7.370 -4.980 5.295 1.00 0.00 N ATOM 1338 CA LEU A 87 7.617 -3.596 5.682 1.00 0.00 C ATOM 1339 C LEU A 87 8.143 -2.786 4.501 1.00 0.00 C ATOM 1340 O LEU A 87 9.307 -2.913 4.116 1.00 0.00 O ATOM 1341 CB LEU A 87 8.616 -3.539 6.839 1.00 0.00 C ATOM 1342 CG LEU A 87 8.017 -3.575 8.245 1.00 0.00 C ATOM 1343 CD1 LEU A 87 9.107 -3.787 9.285 1.00 0.00 C ATOM 1344 CD2 LEU A 87 7.247 -2.294 8.530 1.00 0.00 C ATOM 0 H LEU A 87 8.078 -5.640 5.617 1.00 0.00 H new ATOM 0 HA LEU A 87 6.671 -3.161 6.005 1.00 0.00 H new ATOM 0 HB2 LEU A 87 9.306 -4.377 6.738 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.205 -2.627 6.740 1.00 0.00 H new ATOM 0 HG LEU A 87 7.322 -4.413 8.301 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.661 -3.810 10.280 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.614 -4.732 9.093 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.827 -2.971 9.229 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.828 -2.338 9.535 1.00 0.00 H new ATOM 0 HD22 LEU A 87 7.920 -1.440 8.454 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.440 -2.185 7.805 1.00 0.00 H new ATOM 1356 N LEU A 88 7.281 -1.952 3.931 1.00 0.00 N ATOM 1357 CA LEU A 88 7.658 -1.119 2.794 1.00 0.00 C ATOM 1358 C LEU A 88 7.671 0.356 3.181 1.00 0.00 C ATOM 1359 O LEU A 88 7.227 0.729 4.268 1.00 0.00 O ATOM 1360 CB LEU A 88 6.694 -1.344 1.629 1.00 0.00 C ATOM 1361 CG LEU A 88 6.403 -2.802 1.270 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.184 -2.896 0.366 1.00 0.00 C ATOM 1363 CD2 LEU A 88 7.614 -3.438 0.602 1.00 0.00 C ATOM 0 H LEU A 88 6.315 -1.834 4.238 1.00 0.00 H new ATOM 0 HA LEU A 88 8.664 -1.404 2.484 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.750 -0.854 1.865 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.099 -0.848 0.747 1.00 0.00 H new ATOM 0 HG LEU A 88 6.191 -3.347 2.190 1.00 0.00 H new ATOM 0 HD11 LEU A 88 4.992 -3.941 0.121 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.318 -2.479 0.879 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.367 -2.336 -0.551 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.389 -4.475 0.353 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.856 -2.891 -0.309 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.465 -3.404 1.283 1.00 0.00 H new ATOM 1375 N THR A 89 8.182 1.194 2.284 1.00 0.00 N ATOM 1376 CA THR A 89 8.252 2.628 2.530 1.00 0.00 C ATOM 1377 C THR A 89 8.159 3.415 1.228 1.00 0.00 C ATOM 1378 O THR A 89 9.016 3.290 0.353 1.00 0.00 O ATOM 1379 CB THR A 89 9.555 3.011 3.256 1.00 0.00 C ATOM 1380 OG1 THR A 89 9.722 2.200 4.424 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.544 4.480 3.650 1.00 0.00 C ATOM 0 H THR A 89 8.554 0.903 1.380 1.00 0.00 H new ATOM 0 HA THR A 89 7.403 2.881 3.165 1.00 0.00 H new ATOM 0 HB THR A 89 10.388 2.841 2.574 1.00 0.00 H new ATOM 0 HG1 THR A 89 10.554 2.449 4.879 1.00 0.00 H new ATOM 0 HG21 THR A 89 10.475 4.727 4.161 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.447 5.096 2.756 1.00 0.00 H new ATOM 0 HG23 THR A 89 8.703 4.672 4.316 1.00 0.00 H new ATOM 1389 N GLY A 90 7.113 4.227 1.105 1.00 0.00 N ATOM 1390 CA GLY A 90 6.929 5.023 -0.095 1.00 0.00 C ATOM 1391 C GLY A 90 7.883 6.199 -0.163 1.00 0.00 C ATOM 1392 O GLY A 90 7.854 7.081 0.696 1.00 0.00 O ATOM 0 H GLY A 90 6.390 4.348 1.814 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.073 4.391 -0.972 1.00 0.00 H new ATOM 0 HA3 GLY A 90 5.903 5.389 -0.131 1.00 0.00 H new ATOM 1396 N TYR A 91 8.731 6.211 -1.185 1.00 0.00 N ATOM 1397 CA TYR A 91 9.701 7.286 -1.359 1.00 0.00 C ATOM 1398 C TYR A 91 9.377 8.117 -2.597 1.00 0.00 C ATOM 1399 O TYR A 91 9.402 7.614 -3.720 1.00 0.00 O ATOM 1400 CB TYR A 91 11.115 6.711 -1.473 1.00 0.00 C ATOM 1401 CG TYR A 91 11.688 6.248 -0.153 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.979 7.156 0.858 1.00 0.00 C ATOM 1403 CD2 TYR A 91 11.939 4.902 0.084 1.00 0.00 C ATOM 1404 CE1 TYR A 91 12.504 6.738 2.065 1.00 0.00 C ATOM 1405 CE2 TYR A 91 12.462 4.474 1.289 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.743 5.396 2.276 1.00 0.00 C ATOM 1407 OH TYR A 91 13.265 4.974 3.477 1.00 0.00 O ATOM 0 H TYR A 91 8.767 5.489 -1.905 1.00 0.00 H new ATOM 0 HA TYR A 91 9.648 7.934 -0.484 1.00 0.00 H new ATOM 0 HB2 TYR A 91 11.102 5.872 -2.168 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.773 7.468 -1.900 1.00 0.00 H new ATOM 0 HD1 TYR A 91 11.791 8.207 0.697 1.00 0.00 H new ATOM 0 HD2 TYR A 91 11.721 4.178 -0.687 1.00 0.00 H new ATOM 0 HE1 TYR A 91 12.726 7.458 2.839 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.650 3.424 1.457 1.00 0.00 H new ATOM 0 HH TYR A 91 13.372 4.000 3.463 1.00 0.00 H new ATOM 1417 N ALA A 92 9.074 9.393 -2.382 1.00 0.00 N ATOM 1418 CA ALA A 92 8.747 10.296 -3.478 1.00 0.00 C ATOM 1419 C ALA A 92 9.965 11.111 -3.900 1.00 0.00 C ATOM 1420 O ALA A 92 10.182 12.220 -3.411 1.00 0.00 O ATOM 1421 CB ALA A 92 7.605 11.218 -3.080 1.00 0.00 C ATOM 0 H ALA A 92 9.048 9.825 -1.458 1.00 0.00 H new ATOM 0 HA ALA A 92 8.432 9.694 -4.330 1.00 0.00 H new ATOM 0 HB1 ALA A 92 7.372 11.887 -3.908 1.00 0.00 H new ATOM 0 HB2 ALA A 92 6.725 10.623 -2.835 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.898 11.806 -2.210 1.00 0.00 H new ATOM 1427 N LEU A 93 10.758 10.554 -4.808 1.00 0.00 N ATOM 1428 CA LEU A 93 11.956 11.229 -5.296 1.00 0.00 C ATOM 1429 C LEU A 93 11.597 12.309 -6.311 1.00 0.00 C ATOM 1430 O LEU A 93 10.732 12.110 -7.165 1.00 0.00 O ATOM 1431 CB LEU A 93 12.914 10.217 -5.927 1.00 0.00 C ATOM 1432 CG LEU A 93 13.289 9.015 -5.059 1.00 0.00 C ATOM 1433 CD1 LEU A 93 14.161 8.045 -5.840 1.00 0.00 C ATOM 1434 CD2 LEU A 93 13.998 9.473 -3.793 1.00 0.00 C ATOM 0 H LEU A 93 10.593 9.636 -5.222 1.00 0.00 H new ATOM 0 HA LEU A 93 12.447 11.704 -4.447 1.00 0.00 H new ATOM 0 HB2 LEU A 93 12.465 9.848 -6.849 1.00 0.00 H new ATOM 0 HB3 LEU A 93 13.830 10.739 -6.205 1.00 0.00 H new ATOM 0 HG LEU A 93 12.374 8.498 -4.772 1.00 0.00 H new ATOM 0 HD11 LEU A 93 14.418 7.196 -5.207 1.00 0.00 H new ATOM 0 HD12 LEU A 93 13.618 7.692 -6.717 1.00 0.00 H new ATOM 0 HD13 LEU A 93 15.073 8.550 -6.157 1.00 0.00 H new ATOM 0 HD21 LEU A 93 14.258 8.605 -3.187 1.00 0.00 H new ATOM 0 HD22 LEU A 93 14.906 10.014 -4.060 1.00 0.00 H new ATOM 0 HD23 LEU A 93 13.339 10.129 -3.224 1.00 0.00 H new ATOM 1446 N ASP A 94 12.268 13.451 -6.214 1.00 0.00 N ATOM 1447 CA ASP A 94 12.023 14.562 -7.126 1.00 0.00 C ATOM 1448 C ASP A 94 12.803 14.382 -8.425 1.00 0.00 C ATOM 1449 O ASP A 94 13.698 13.542 -8.511 1.00 0.00 O ATOM 1450 CB ASP A 94 12.407 15.887 -6.465 1.00 0.00 C ATOM 1451 CG ASP A 94 11.968 17.088 -7.279 1.00 0.00 C ATOM 1452 OD1 ASP A 94 10.863 17.041 -7.859 1.00 0.00 O ATOM 1453 OD2 ASP A 94 12.729 18.077 -7.335 1.00 0.00 O ATOM 0 H ASP A 94 12.986 13.632 -5.513 1.00 0.00 H new ATOM 0 HA ASP A 94 10.959 14.578 -7.362 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.957 15.939 -5.474 1.00 0.00 H new ATOM 0 HB3 ASP A 94 13.488 15.921 -6.326 1.00 0.00 H new ATOM 1458 N ALA A 95 12.456 15.175 -9.433 1.00 0.00 N ATOM 1459 CA ALA A 95 13.124 15.104 -10.726 1.00 0.00 C ATOM 1460 C ALA A 95 14.618 14.848 -10.559 1.00 0.00 C ATOM 1461 O ALA A 95 15.213 14.073 -11.308 1.00 0.00 O ATOM 1462 CB ALA A 95 12.891 16.386 -11.512 1.00 0.00 C ATOM 0 H ALA A 95 11.716 15.874 -9.379 1.00 0.00 H new ATOM 0 HA ALA A 95 12.699 14.268 -11.281 1.00 0.00 H new ATOM 0 HB1 ALA A 95 13.396 16.319 -12.476 1.00 0.00 H new ATOM 0 HB2 ALA A 95 11.822 16.526 -11.671 1.00 0.00 H new ATOM 0 HB3 ALA A 95 13.288 17.233 -10.953 1.00 0.00 H new ATOM 1468 N ARG A 96 15.219 15.505 -9.572 1.00 0.00 N ATOM 1469 CA ARG A 96 16.645 15.350 -9.308 1.00 0.00 C ATOM 1470 C ARG A 96 16.938 13.985 -8.693 1.00 0.00 C ATOM 1471 O ARG A 96 17.934 13.343 -9.027 1.00 0.00 O ATOM 1472 CB ARG A 96 17.136 16.458 -8.374 1.00 0.00 C ATOM 1473 CG ARG A 96 17.626 17.697 -9.105 1.00 0.00 C ATOM 1474 CD ARG A 96 17.669 18.906 -8.184 1.00 0.00 C ATOM 1475 NE ARG A 96 18.613 18.723 -7.084 1.00 0.00 N ATOM 1476 CZ ARG A 96 19.103 19.724 -6.361 1.00 0.00 C ATOM 1477 NH1 ARG A 96 18.740 20.973 -6.621 1.00 0.00 N ATOM 1478 NH2 ARG A 96 19.957 19.477 -5.376 1.00 0.00 N ATOM 0 H ARG A 96 14.741 16.149 -8.942 1.00 0.00 H new ATOM 0 HA ARG A 96 17.175 15.423 -10.258 1.00 0.00 H new ATOM 0 HB2 ARG A 96 16.326 16.740 -7.701 1.00 0.00 H new ATOM 0 HB3 ARG A 96 17.944 16.068 -7.755 1.00 0.00 H new ATOM 0 HG2 ARG A 96 18.620 17.512 -9.511 1.00 0.00 H new ATOM 0 HG3 ARG A 96 16.970 17.905 -9.950 1.00 0.00 H new ATOM 0 HD2 ARG A 96 17.948 19.789 -8.758 1.00 0.00 H new ATOM 0 HD3 ARG A 96 16.673 19.090 -7.780 1.00 0.00 H new ATOM 0 HE ARG A 96 18.912 17.774 -6.859 1.00 0.00 H new ATOM 0 HH11 ARG A 96 18.083 21.166 -7.377 1.00 0.00 H new ATOM 0 HH12 ARG A 96 19.117 21.740 -6.065 1.00 0.00 H new ATOM 0 HH21 ARG A 96 20.238 18.518 -5.173 1.00 0.00 H new ATOM 0 HH22 ARG A 96 20.333 20.246 -4.822 1.00 0.00 H new ATOM 1492 N GLY A 97 16.064 13.547 -7.792 1.00 0.00 N ATOM 1493 CA GLY A 97 16.248 12.261 -7.144 1.00 0.00 C ATOM 1494 C GLY A 97 16.495 12.392 -5.655 1.00 0.00 C ATOM 1495 O GLY A 97 17.300 11.657 -5.085 1.00 0.00 O ATOM 0 H GLY A 97 15.232 14.059 -7.499 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.364 11.645 -7.310 1.00 0.00 H new ATOM 0 HA3 GLY A 97 17.089 11.743 -7.604 1.00 0.00 H new ATOM 1499 N ASN A 98 15.801 13.333 -5.022 1.00 0.00 N ATOM 1500 CA ASN A 98 15.951 13.559 -3.589 1.00 0.00 C ATOM 1501 C ASN A 98 14.591 13.582 -2.897 1.00 0.00 C ATOM 1502 O ASN A 98 13.718 14.374 -3.248 1.00 0.00 O ATOM 1503 CB ASN A 98 16.688 14.876 -3.334 1.00 0.00 C ATOM 1504 CG ASN A 98 17.786 15.130 -4.349 1.00 0.00 C ATOM 1505 OD1 ASN A 98 18.721 14.339 -4.478 1.00 0.00 O ATOM 1506 ND2 ASN A 98 17.677 16.237 -5.074 1.00 0.00 N ATOM 0 H ASN A 98 15.130 13.951 -5.479 1.00 0.00 H new ATOM 0 HA ASN A 98 16.536 12.737 -3.176 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.974 15.700 -3.361 1.00 0.00 H new ATOM 0 HB3 ASN A 98 17.119 14.860 -2.333 1.00 0.00 H new ATOM 0 HD21 ASN A 98 18.386 16.461 -5.772 1.00 0.00 H new ATOM 0 HD22 ASN A 98 16.884 16.863 -4.933 1.00 0.00 H new ATOM 1513 N ASN A 99 14.421 12.708 -1.910 1.00 0.00 N ATOM 1514 CA ASN A 99 13.168 12.628 -1.168 1.00 0.00 C ATOM 1515 C ASN A 99 12.789 13.988 -0.592 1.00 0.00 C ATOM 1516 O ASN A 99 13.165 14.326 0.530 1.00 0.00 O ATOM 1517 CB ASN A 99 13.284 11.599 -0.042 1.00 0.00 C ATOM 1518 CG ASN A 99 14.661 11.588 0.593 1.00 0.00 C ATOM 1519 OD1 ASN A 99 14.979 12.436 1.427 1.00 0.00 O ATOM 1520 ND2 ASN A 99 15.486 10.625 0.199 1.00 0.00 N ATOM 0 H ASN A 99 15.135 12.046 -1.606 1.00 0.00 H new ATOM 0 HA ASN A 99 12.385 12.315 -1.858 1.00 0.00 H new ATOM 0 HB2 ASN A 99 12.537 11.815 0.722 1.00 0.00 H new ATOM 0 HB3 ASN A 99 13.061 10.607 -0.436 1.00 0.00 H new ATOM 0 HD21 ASN A 99 16.426 10.567 0.590 1.00 0.00 H new ATOM 0 HD22 ASN A 99 15.180 9.943 -0.495 1.00 0.00 H new ATOM 1527 N VAL A 100 12.040 14.766 -1.368 1.00 0.00 N ATOM 1528 CA VAL A 100 11.608 16.089 -0.935 1.00 0.00 C ATOM 1529 C VAL A 100 10.503 15.992 0.110 1.00 0.00 C ATOM 1530 O VAL A 100 10.490 16.742 1.085 1.00 0.00 O ATOM 1531 CB VAL A 100 11.104 16.931 -2.122 1.00 0.00 C ATOM 1532 CG1 VAL A 100 12.242 17.231 -3.086 1.00 0.00 C ATOM 1533 CG2 VAL A 100 9.965 16.219 -2.835 1.00 0.00 C ATOM 0 H VAL A 100 11.720 14.502 -2.300 1.00 0.00 H new ATOM 0 HA VAL A 100 12.478 16.577 -0.495 1.00 0.00 H new ATOM 0 HB VAL A 100 10.726 17.878 -1.738 1.00 0.00 H new ATOM 0 HG11 VAL A 100 11.867 17.827 -3.918 1.00 0.00 H new ATOM 0 HG12 VAL A 100 13.023 17.786 -2.566 1.00 0.00 H new ATOM 0 HG13 VAL A 100 12.653 16.296 -3.466 1.00 0.00 H new ATOM 0 HG21 VAL A 100 9.621 16.828 -3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 100 10.314 15.256 -3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 100 9.142 16.061 -2.138 1.00 0.00 H new ATOM 1543 N GLU A 101 9.577 15.061 -0.100 1.00 0.00 N ATOM 1544 CA GLU A 101 8.467 14.866 0.825 1.00 0.00 C ATOM 1545 C GLU A 101 8.761 13.725 1.795 1.00 0.00 C ATOM 1546 O GLU A 101 9.602 12.867 1.526 1.00 0.00 O ATOM 1547 CB GLU A 101 7.177 14.575 0.054 1.00 0.00 C ATOM 1548 CG GLU A 101 6.454 15.826 -0.417 1.00 0.00 C ATOM 1549 CD GLU A 101 6.237 16.829 0.699 1.00 0.00 C ATOM 1550 OE1 GLU A 101 5.653 16.448 1.735 1.00 0.00 O ATOM 1551 OE2 GLU A 101 6.650 17.996 0.536 1.00 0.00 O ATOM 0 H GLU A 101 9.574 14.431 -0.902 1.00 0.00 H new ATOM 0 HA GLU A 101 8.340 15.784 1.399 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.413 13.954 -0.811 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.507 13.996 0.689 1.00 0.00 H new ATOM 0 HG2 GLU A 101 7.029 16.295 -1.215 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.490 15.546 -0.841 1.00 0.00 H new ATOM 1558 N LYS A 102 8.063 13.723 2.925 1.00 0.00 N ATOM 1559 CA LYS A 102 8.247 12.689 3.937 1.00 0.00 C ATOM 1560 C LYS A 102 7.656 11.362 3.472 1.00 0.00 C ATOM 1561 O LYS A 102 6.526 11.294 2.988 1.00 0.00 O ATOM 1562 CB LYS A 102 7.597 13.115 5.255 1.00 0.00 C ATOM 1563 CG LYS A 102 8.514 13.931 6.150 1.00 0.00 C ATOM 1564 CD LYS A 102 8.123 13.805 7.612 1.00 0.00 C ATOM 1565 CE LYS A 102 7.014 14.780 7.979 1.00 0.00 C ATOM 1566 NZ LYS A 102 6.720 14.762 9.438 1.00 0.00 N ATOM 0 H LYS A 102 7.364 14.426 3.164 1.00 0.00 H new ATOM 0 HA LYS A 102 9.317 12.555 4.094 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.702 13.698 5.037 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.274 12.225 5.795 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.543 13.598 6.018 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.477 14.979 5.852 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.795 12.786 7.815 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.994 13.990 8.240 1.00 0.00 H new ATOM 0 HE2 LYS A 102 7.302 15.787 7.679 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.111 14.528 7.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.959 15.440 9.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.420 13.807 9.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 7.575 15.027 9.968 1.00 0.00 H new ATOM 1580 N PRO A 103 8.435 10.281 3.622 1.00 0.00 N ATOM 1581 CA PRO A 103 8.009 8.936 3.226 1.00 0.00 C ATOM 1582 C PRO A 103 6.907 8.388 4.127 1.00 0.00 C ATOM 1583 O PRO A 103 6.630 8.941 5.192 1.00 0.00 O ATOM 1584 CB PRO A 103 9.284 8.102 3.372 1.00 0.00 C ATOM 1585 CG PRO A 103 10.098 8.829 4.386 1.00 0.00 C ATOM 1586 CD PRO A 103 9.793 10.289 4.192 1.00 0.00 C ATOM 0 HA PRO A 103 7.587 8.922 2.221 1.00 0.00 H new ATOM 0 HB2 PRO A 103 9.058 7.087 3.699 1.00 0.00 H new ATOM 0 HB3 PRO A 103 9.814 8.020 2.423 1.00 0.00 H new ATOM 0 HG2 PRO A 103 9.842 8.508 5.396 1.00 0.00 H new ATOM 0 HG3 PRO A 103 11.161 8.631 4.248 1.00 0.00 H new ATOM 0 HD2 PRO A 103 9.830 10.836 5.134 1.00 0.00 H new ATOM 0 HD3 PRO A 103 10.508 10.763 3.520 1.00 0.00 H new ATOM 1594 N LEU A 104 6.282 7.299 3.694 1.00 0.00 N ATOM 1595 CA LEU A 104 5.211 6.675 4.462 1.00 0.00 C ATOM 1596 C LEU A 104 5.606 5.271 4.907 1.00 0.00 C ATOM 1597 O LEU A 104 6.178 4.503 4.135 1.00 0.00 O ATOM 1598 CB LEU A 104 3.928 6.617 3.631 1.00 0.00 C ATOM 1599 CG LEU A 104 3.436 7.948 3.062 1.00 0.00 C ATOM 1600 CD1 LEU A 104 2.490 7.712 1.894 1.00 0.00 C ATOM 1601 CD2 LEU A 104 2.754 8.772 4.145 1.00 0.00 C ATOM 0 H LEU A 104 6.499 6.830 2.815 1.00 0.00 H new ATOM 0 HA LEU A 104 5.034 7.281 5.351 1.00 0.00 H new ATOM 0 HB2 LEU A 104 4.087 5.927 2.802 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.137 6.195 4.250 1.00 0.00 H new ATOM 0 HG LEU A 104 4.298 8.506 2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.150 8.670 1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.011 7.163 1.109 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.631 7.133 2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.410 9.716 3.722 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.901 8.220 4.540 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.461 8.972 4.950 1.00 0.00 H new ATOM 1613 N GLU A 105 5.294 4.942 6.157 1.00 0.00 N ATOM 1614 CA GLU A 105 5.616 3.629 6.704 1.00 0.00 C ATOM 1615 C GLU A 105 4.476 2.644 6.461 1.00 0.00 C ATOM 1616 O GLU A 105 3.659 2.391 7.348 1.00 0.00 O ATOM 1617 CB GLU A 105 5.904 3.733 8.203 1.00 0.00 C ATOM 1618 CG GLU A 105 6.180 2.393 8.864 1.00 0.00 C ATOM 1619 CD GLU A 105 6.249 2.491 10.376 1.00 0.00 C ATOM 1620 OE1 GLU A 105 5.366 3.145 10.969 1.00 0.00 O ATOM 1621 OE2 GLU A 105 7.187 1.914 10.965 1.00 0.00 O ATOM 0 H GLU A 105 4.819 5.566 6.809 1.00 0.00 H new ATOM 0 HA GLU A 105 6.507 3.260 6.195 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.762 4.387 8.355 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.053 4.204 8.696 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.398 1.687 8.585 1.00 0.00 H new ATOM 0 HG3 GLU A 105 7.121 1.993 8.486 1.00 0.00 H new ATOM 1628 N LEU A 106 4.426 2.092 5.254 1.00 0.00 N ATOM 1629 CA LEU A 106 3.386 1.135 4.892 1.00 0.00 C ATOM 1630 C LEU A 106 3.664 -0.231 5.511 1.00 0.00 C ATOM 1631 O LEU A 106 4.774 -0.755 5.410 1.00 0.00 O ATOM 1632 CB LEU A 106 3.288 1.008 3.371 1.00 0.00 C ATOM 1633 CG LEU A 106 2.282 -0.017 2.846 1.00 0.00 C ATOM 1634 CD1 LEU A 106 0.908 0.616 2.688 1.00 0.00 C ATOM 1635 CD2 LEU A 106 2.757 -0.602 1.524 1.00 0.00 C ATOM 0 H LEU A 106 5.094 2.291 4.509 1.00 0.00 H new ATOM 0 HA LEU A 106 2.437 1.504 5.281 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.029 1.984 2.961 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.274 0.751 2.984 1.00 0.00 H new ATOM 0 HG LEU A 106 2.205 -0.827 3.572 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.205 -0.128 2.313 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.564 0.986 3.654 1.00 0.00 H new ATOM 0 HD13 LEU A 106 0.968 1.445 1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.029 -1.329 1.165 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.864 0.197 0.790 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.719 -1.093 1.668 1.00 0.00 H new ATOM 1647 N ARG A 107 2.649 -0.804 6.150 1.00 0.00 N ATOM 1648 CA ARG A 107 2.784 -2.109 6.784 1.00 0.00 C ATOM 1649 C ARG A 107 1.719 -3.075 6.272 1.00 0.00 C ATOM 1650 O ARG A 107 0.552 -2.986 6.653 1.00 0.00 O ATOM 1651 CB ARG A 107 2.677 -1.975 8.304 1.00 0.00 C ATOM 1652 CG ARG A 107 3.243 -3.165 9.062 1.00 0.00 C ATOM 1653 CD ARG A 107 2.965 -3.059 10.553 1.00 0.00 C ATOM 1654 NE ARG A 107 3.571 -1.867 11.140 1.00 0.00 N ATOM 1655 CZ ARG A 107 3.822 -1.733 12.437 1.00 0.00 C ATOM 1656 NH1 ARG A 107 3.520 -2.713 13.279 1.00 0.00 N ATOM 1657 NH2 ARG A 107 4.376 -0.618 12.896 1.00 0.00 N ATOM 0 H ARG A 107 1.724 -0.384 6.242 1.00 0.00 H new ATOM 0 HA ARG A 107 3.766 -2.509 6.529 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.201 -1.072 8.618 1.00 0.00 H new ATOM 0 HB3 ARG A 107 1.629 -1.847 8.576 1.00 0.00 H new ATOM 0 HG2 ARG A 107 2.807 -4.086 8.674 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.318 -3.226 8.895 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.888 -3.038 10.720 1.00 0.00 H new ATOM 0 HD3 ARG A 107 3.348 -3.946 11.057 1.00 0.00 H new ATOM 0 HE ARG A 107 3.815 -1.095 10.520 1.00 0.00 H new ATOM 0 HH11 ARG A 107 3.094 -3.572 12.930 1.00 0.00 H new ATOM 0 HH12 ARG A 107 3.714 -2.608 14.275 1.00 0.00 H new ATOM 0 HH21 ARG A 107 4.610 0.138 12.252 1.00 0.00 H new ATOM 0 HH22 ARG A 107 4.568 -0.517 13.893 1.00 0.00 H new ATOM 1671 N ILE A 108 2.130 -3.996 5.407 1.00 0.00 N ATOM 1672 CA ILE A 108 1.212 -4.978 4.843 1.00 0.00 C ATOM 1673 C ILE A 108 1.105 -6.207 5.740 1.00 0.00 C ATOM 1674 O ILE A 108 1.812 -7.196 5.545 1.00 0.00 O ATOM 1675 CB ILE A 108 1.655 -5.420 3.436 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.712 -4.216 2.494 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.710 -6.481 2.892 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.527 -4.464 1.244 1.00 0.00 C ATOM 0 H ILE A 108 3.093 -4.083 5.081 1.00 0.00 H new ATOM 0 HA ILE A 108 0.237 -4.496 4.772 1.00 0.00 H new ATOM 0 HB ILE A 108 2.654 -5.852 3.504 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.697 -3.941 2.207 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.133 -3.365 3.030 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.036 -6.783 1.897 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.715 -7.347 3.554 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.300 -6.074 2.835 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.523 -3.568 0.623 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.552 -4.709 1.521 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.094 -5.294 0.686 1.00 0.00 H new ATOM 1690 N LYS A 109 0.213 -6.140 6.722 1.00 0.00 N ATOM 1691 CA LYS A 109 0.008 -7.248 7.648 1.00 0.00 C ATOM 1692 C LYS A 109 -0.517 -8.479 6.916 1.00 0.00 C ATOM 1693 O LYS A 109 -1.630 -8.472 6.389 1.00 0.00 O ATOM 1694 CB LYS A 109 -0.970 -6.842 8.753 1.00 0.00 C ATOM 1695 CG LYS A 109 -0.986 -7.799 9.933 1.00 0.00 C ATOM 1696 CD LYS A 109 -2.301 -7.729 10.690 1.00 0.00 C ATOM 1697 CE LYS A 109 -2.376 -8.791 11.776 1.00 0.00 C ATOM 1698 NZ LYS A 109 -1.416 -8.522 12.882 1.00 0.00 N ATOM 0 H LYS A 109 -0.380 -5.329 6.898 1.00 0.00 H new ATOM 0 HA LYS A 109 0.970 -7.497 8.096 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.710 -5.845 9.108 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.974 -6.779 8.333 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.823 -8.817 9.579 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.164 -7.560 10.607 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.412 -6.741 11.137 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.130 -7.859 9.994 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -3.389 -8.830 12.176 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -2.166 -9.769 11.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -1.522 -9.249 13.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -0.445 -8.543 12.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -1.610 -7.585 13.290 1.00 0.00 H new ATOM 1712 N VAL A 110 0.290 -9.535 6.888 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.095 -10.774 6.223 1.00 0.00 C ATOM 1714 C VAL A 110 -1.018 -11.607 7.105 1.00 0.00 C ATOM 1715 O VAL A 110 -0.592 -12.163 8.118 1.00 0.00 O ATOM 1716 CB VAL A 110 1.138 -11.617 5.850 1.00 0.00 C ATOM 1717 CG1 VAL A 110 0.714 -12.930 5.211 1.00 0.00 C ATOM 1718 CG2 VAL A 110 2.056 -10.835 4.922 1.00 0.00 C ATOM 0 H VAL A 110 1.215 -9.557 7.318 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.623 -10.493 5.312 1.00 0.00 H new ATOM 0 HB VAL A 110 1.689 -11.846 6.762 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.599 -13.512 4.954 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.099 -13.494 5.912 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.139 -12.726 4.308 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.923 -11.446 4.668 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.517 -10.574 4.011 1.00 0.00 H new ATOM 0 HG23 VAL A 110 2.387 -9.924 5.421 1.00 0.00 H new ATOM 1728 N LEU A 111 -2.285 -11.690 6.714 1.00 0.00 N ATOM 1729 CA LEU A 111 -3.270 -12.457 7.469 1.00 0.00 C ATOM 1730 C LEU A 111 -3.016 -13.954 7.332 1.00 0.00 C ATOM 1731 O LEU A 111 -2.029 -14.374 6.728 1.00 0.00 O ATOM 1732 CB LEU A 111 -4.683 -12.122 6.988 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.071 -10.643 7.021 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.204 -10.366 6.045 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.466 -10.227 8.431 1.00 0.00 C ATOM 0 H LEU A 111 -2.654 -11.236 5.879 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.177 -12.186 8.521 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.792 -12.483 5.965 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -5.394 -12.677 7.599 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.206 -10.053 6.718 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.466 -9.309 6.083 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -5.886 -10.625 5.035 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.073 -10.965 6.317 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.739 -9.172 8.436 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.316 -10.823 8.762 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.626 -10.388 9.107 1.00 0.00 H new ATOM 1747 N ASP A 112 -3.914 -14.755 7.895 1.00 0.00 N ATOM 1748 CA ASP A 112 -3.789 -16.207 7.834 1.00 0.00 C ATOM 1749 C ASP A 112 -5.039 -16.835 7.226 1.00 0.00 C ATOM 1750 O ASP A 112 -6.067 -16.173 7.075 1.00 0.00 O ATOM 1751 CB ASP A 112 -3.543 -16.779 9.231 1.00 0.00 C ATOM 1752 CG ASP A 112 -3.384 -18.286 9.220 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -2.337 -18.770 8.740 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -4.307 -18.983 9.692 1.00 0.00 O ATOM 0 H ASP A 112 -4.737 -14.423 8.399 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.937 -16.447 7.197 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -2.647 -16.325 9.653 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.374 -16.509 9.882 1.00 0.00 H new ATOM 1759 N ILE A 113 -4.944 -18.114 6.879 1.00 0.00 N ATOM 1760 CA ILE A 113 -6.067 -18.830 6.288 1.00 0.00 C ATOM 1761 C ILE A 113 -7.251 -18.883 7.248 1.00 0.00 C ATOM 1762 O ILE A 113 -8.397 -18.684 6.847 1.00 0.00 O ATOM 1763 CB ILE A 113 -5.675 -20.267 5.895 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -6.849 -20.971 5.213 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -5.222 -21.046 7.121 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -6.988 -20.630 3.746 1.00 0.00 C ATOM 0 H ILE A 113 -4.101 -18.676 6.997 1.00 0.00 H new ATOM 0 HA ILE A 113 -6.353 -18.282 5.390 1.00 0.00 H new ATOM 0 HB ILE A 113 -4.845 -20.222 5.190 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -6.726 -22.049 5.317 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.771 -20.704 5.729 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -4.948 -22.059 6.827 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.359 -20.552 7.568 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -6.034 -21.085 7.847 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -7.841 -21.165 3.327 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -7.143 -19.557 3.635 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.081 -20.922 3.217 1.00 0.00 H new ATOM 1778 N ASN A 114 -6.965 -19.152 8.518 1.00 0.00 N ATOM 1779 CA ASN A 114 -8.007 -19.229 9.535 1.00 0.00 C ATOM 1780 C ASN A 114 -8.173 -17.890 10.247 1.00 0.00 C ATOM 1781 O ASN A 114 -8.387 -17.842 11.459 1.00 0.00 O ATOM 1782 CB ASN A 114 -7.674 -20.322 10.553 1.00 0.00 C ATOM 1783 CG ASN A 114 -7.303 -21.635 9.891 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -6.156 -22.077 9.963 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -8.274 -22.265 9.241 1.00 0.00 N ATOM 0 H ASN A 114 -6.021 -19.320 8.867 1.00 0.00 H new ATOM 0 HA ASN A 114 -8.946 -19.476 9.040 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -6.848 -19.989 11.182 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -8.531 -20.478 11.208 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -8.084 -23.152 8.775 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -9.210 -21.862 9.207 1.00 0.00 H new ATOM 1792 N ASP A 115 -8.074 -16.806 9.486 1.00 0.00 N ATOM 1793 CA ASP A 115 -8.215 -15.465 10.043 1.00 0.00 C ATOM 1794 C ASP A 115 -9.685 -15.111 10.241 1.00 0.00 C ATOM 1795 O ASP A 115 -10.507 -15.306 9.346 1.00 0.00 O ATOM 1796 CB ASP A 115 -7.548 -14.437 9.127 1.00 0.00 C ATOM 1797 CG ASP A 115 -8.138 -13.050 9.289 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -9.227 -12.799 8.732 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -7.511 -12.215 9.974 1.00 0.00 O ATOM 0 H ASP A 115 -7.897 -16.829 8.482 1.00 0.00 H new ATOM 0 HA ASP A 115 -7.722 -15.448 11.015 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -6.480 -14.402 9.342 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -7.654 -14.755 8.090 1.00 0.00 H new ATOM 1804 N ASN A 116 -10.010 -14.591 11.420 1.00 0.00 N ATOM 1805 CA ASN A 116 -11.382 -14.211 11.736 1.00 0.00 C ATOM 1806 C ASN A 116 -11.437 -12.797 12.308 1.00 0.00 C ATOM 1807 O ASN A 116 -12.275 -12.493 13.156 1.00 0.00 O ATOM 1808 CB ASN A 116 -11.991 -15.200 12.732 1.00 0.00 C ATOM 1809 CG ASN A 116 -13.492 -15.337 12.566 1.00 0.00 C ATOM 1810 OD1 ASN A 116 -13.968 -16.110 11.734 1.00 0.00 O ATOM 1811 ND2 ASN A 116 -14.246 -14.586 13.360 1.00 0.00 N ATOM 0 H ASN A 116 -9.342 -14.423 12.172 1.00 0.00 H new ATOM 0 HA ASN A 116 -11.960 -14.233 10.812 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -11.523 -16.176 12.603 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -11.769 -14.872 13.747 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -15.263 -14.636 13.295 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -13.809 -13.959 14.035 1.00 0.00 H new ATOM 1818 N GLU A 117 -10.539 -11.938 11.836 1.00 0.00 N ATOM 1819 CA GLU A 117 -10.486 -10.557 12.301 1.00 0.00 C ATOM 1820 C GLU A 117 -11.159 -9.621 11.302 1.00 0.00 C ATOM 1821 O GLU A 117 -10.685 -9.421 10.183 1.00 0.00 O ATOM 1822 CB GLU A 117 -9.034 -10.126 12.523 1.00 0.00 C ATOM 1823 CG GLU A 117 -8.410 -10.715 13.777 1.00 0.00 C ATOM 1824 CD GLU A 117 -8.683 -9.880 15.012 1.00 0.00 C ATOM 1825 OE1 GLU A 117 -9.752 -9.238 15.071 1.00 0.00 O ATOM 1826 OE2 GLU A 117 -7.826 -9.868 15.921 1.00 0.00 O ATOM 0 H GLU A 117 -9.839 -12.174 11.133 1.00 0.00 H new ATOM 0 HA GLU A 117 -11.024 -10.498 13.247 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -8.440 -10.421 11.658 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -8.992 -9.038 12.582 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -8.796 -11.722 13.932 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -7.333 -10.805 13.635 1.00 0.00 H new ATOM 1833 N PRO A 118 -12.291 -9.032 11.714 1.00 0.00 N ATOM 1834 CA PRO A 118 -13.055 -8.107 10.872 1.00 0.00 C ATOM 1835 C PRO A 118 -12.328 -6.783 10.659 1.00 0.00 C ATOM 1836 O PRO A 118 -11.291 -6.527 11.270 1.00 0.00 O ATOM 1837 CB PRO A 118 -14.345 -7.887 11.665 1.00 0.00 C ATOM 1838 CG PRO A 118 -13.969 -8.154 13.081 1.00 0.00 C ATOM 1839 CD PRO A 118 -12.914 -9.223 13.035 1.00 0.00 C ATOM 0 HA PRO A 118 -13.218 -8.507 9.871 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -14.718 -6.871 11.539 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -15.135 -8.560 11.331 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -13.590 -7.252 13.561 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -14.833 -8.483 13.659 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -12.190 -9.107 13.841 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -13.346 -10.219 13.135 1.00 0.00 H new ATOM 1847 N VAL A 119 -12.880 -5.944 9.788 1.00 0.00 N ATOM 1848 CA VAL A 119 -12.285 -4.645 9.496 1.00 0.00 C ATOM 1849 C VAL A 119 -12.856 -3.562 10.404 1.00 0.00 C ATOM 1850 O VAL A 119 -14.019 -3.622 10.804 1.00 0.00 O ATOM 1851 CB VAL A 119 -12.513 -4.241 8.027 1.00 0.00 C ATOM 1852 CG1 VAL A 119 -13.939 -3.751 7.823 1.00 0.00 C ATOM 1853 CG2 VAL A 119 -11.511 -3.177 7.605 1.00 0.00 C ATOM 0 H VAL A 119 -13.738 -6.141 9.273 1.00 0.00 H new ATOM 0 HA VAL A 119 -11.214 -4.739 9.677 1.00 0.00 H new ATOM 0 HB VAL A 119 -12.362 -5.120 7.400 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -14.081 -3.470 6.779 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -14.638 -4.546 8.083 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -14.121 -2.885 8.460 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -11.687 -2.904 6.565 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -11.628 -2.296 8.236 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -10.499 -3.568 7.711 1.00 0.00 H new ATOM 1863 N PHE A 120 -12.031 -2.572 10.726 1.00 0.00 N ATOM 1864 CA PHE A 120 -12.453 -1.474 11.588 1.00 0.00 C ATOM 1865 C PHE A 120 -13.317 -1.986 12.737 1.00 0.00 C ATOM 1866 O PHE A 120 -14.390 -1.448 13.011 1.00 0.00 O ATOM 1867 CB PHE A 120 -13.227 -0.431 10.779 1.00 0.00 C ATOM 1868 CG PHE A 120 -12.679 -0.216 9.398 1.00 0.00 C ATOM 1869 CD1 PHE A 120 -11.358 0.156 9.212 1.00 0.00 C ATOM 1870 CD2 PHE A 120 -13.486 -0.386 8.284 1.00 0.00 C ATOM 1871 CE1 PHE A 120 -10.850 0.354 7.942 1.00 0.00 C ATOM 1872 CE2 PHE A 120 -12.984 -0.190 7.011 1.00 0.00 C ATOM 1873 CZ PHE A 120 -11.664 0.181 6.840 1.00 0.00 C ATOM 0 H PHE A 120 -11.066 -2.507 10.403 1.00 0.00 H new ATOM 0 HA PHE A 120 -11.560 -1.010 12.007 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -14.269 -0.742 10.703 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -13.215 0.517 11.317 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -10.717 0.293 10.070 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -14.519 -0.675 8.412 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -9.818 0.644 7.812 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -13.623 -0.327 6.151 1.00 0.00 H new ATOM 0 HZ PHE A 120 -11.270 0.335 5.846 1.00 0.00 H new ATOM 1883 N THR A 121 -12.841 -3.032 13.407 1.00 0.00 N ATOM 1884 CA THR A 121 -13.569 -3.619 14.525 1.00 0.00 C ATOM 1885 C THR A 121 -14.133 -2.539 15.441 1.00 0.00 C ATOM 1886 O THR A 121 -13.515 -1.493 15.635 1.00 0.00 O ATOM 1887 CB THR A 121 -12.669 -4.558 15.350 1.00 0.00 C ATOM 1888 OG1 THR A 121 -11.660 -3.800 16.027 1.00 0.00 O ATOM 1889 CG2 THR A 121 -12.013 -5.601 14.457 1.00 0.00 C ATOM 0 H THR A 121 -11.955 -3.489 13.194 1.00 0.00 H new ATOM 0 HA THR A 121 -14.390 -4.196 14.100 1.00 0.00 H new ATOM 0 HB THR A 121 -13.292 -5.070 16.084 1.00 0.00 H new ATOM 0 HG1 THR A 121 -11.093 -4.404 16.551 1.00 0.00 H new ATOM 0 HG21 THR A 121 -11.382 -6.253 15.062 1.00 0.00 H new ATOM 0 HG22 THR A 121 -12.783 -6.195 13.965 1.00 0.00 H new ATOM 0 HG23 THR A 121 -11.403 -5.103 13.703 1.00 0.00 H new ATOM 1897 N GLN A 122 -15.309 -2.801 16.003 1.00 0.00 N ATOM 1898 CA GLN A 122 -15.956 -1.851 16.899 1.00 0.00 C ATOM 1899 C GLN A 122 -16.765 -2.576 17.970 1.00 0.00 C ATOM 1900 O GLN A 122 -17.717 -3.292 17.663 1.00 0.00 O ATOM 1901 CB GLN A 122 -16.864 -0.908 16.108 1.00 0.00 C ATOM 1902 CG GLN A 122 -16.120 0.243 15.450 1.00 0.00 C ATOM 1903 CD GLN A 122 -16.909 0.879 14.322 1.00 0.00 C ATOM 1904 OE1 GLN A 122 -18.122 0.691 14.215 1.00 0.00 O ATOM 1905 NE2 GLN A 122 -16.225 1.637 13.474 1.00 0.00 N ATOM 0 H GLN A 122 -15.833 -3.663 15.853 1.00 0.00 H new ATOM 0 HA GLN A 122 -15.178 -1.267 17.391 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -17.386 -1.479 15.340 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -17.624 -0.504 16.776 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -15.892 1.000 16.201 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -15.167 -0.119 15.063 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -15.221 1.765 13.600 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -16.703 2.091 12.696 1.00 0.00 H new ATOM 1914 N ASP A 123 -16.379 -2.385 19.226 1.00 0.00 N ATOM 1915 CA ASP A 123 -17.069 -3.020 20.343 1.00 0.00 C ATOM 1916 C ASP A 123 -16.619 -2.420 21.672 1.00 0.00 C ATOM 1917 O ASP A 123 -15.424 -2.242 21.911 1.00 0.00 O ATOM 1918 CB ASP A 123 -16.812 -4.528 20.338 1.00 0.00 C ATOM 1919 CG ASP A 123 -15.348 -4.866 20.132 1.00 0.00 C ATOM 1920 OD1 ASP A 123 -14.812 -4.549 19.050 1.00 0.00 O ATOM 1921 OD2 ASP A 123 -14.739 -5.446 21.055 1.00 0.00 O ATOM 0 H ASP A 123 -15.592 -1.796 19.497 1.00 0.00 H new ATOM 0 HA ASP A 123 -18.138 -2.840 20.227 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -17.151 -4.954 21.282 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -17.403 -4.992 19.548 1.00 0.00 H new TER 1926 ASP A 123