USER MOD reduce.3.24.130724 H: found=0, std=0, add=1042, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1035 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 GLN : amide:sc= -4.61! C(o=-12!,f=-13!) USER MOD Set 1.2: A 56 THR OG1 : rot -84:sc= -0.56 USER MOD Set 1.3: A 107 MET CE :methyl 149:sc= -6.56! (180deg=-8.71!) USER MOD Single : A 1 SER N :NH3+ 147:sc= 0.00663 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 ASN : amide:sc= -0.0695 X(o=-0.07,f=-0.43) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -3.71! C(o=-3.7!,f=-2!) USER MOD Single : A 16 GLN : amide:sc= -0.0142 K(o=-0.014,f=-0.86) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 90:sc= 0.524 USER MOD Single : A 21 TYR OH : rot 180:sc= -0.0111 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -42:sc= 0.985 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 31 HIS : no HD1:sc= -0.414 X(o=-0.41,f=-0.86!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl -98:sc= -0.0436 (180deg=-1.88!) USER MOD Single : A 42 GLN : amide:sc= -0.0243 X(o=-0.024,f=-0.51) USER MOD Single : A 45 SER OG : rot -116:sc= 1.25 USER MOD Single : A 47 HIS : no HE2:sc= 0.00625 X(o=0.0062,f=-0.19) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -134:sc= -0.272 (180deg=-1.14!) USER MOD Single : A 58 HIS : no HE2:sc= -1.25 K(o=-1.2,f=-2.3) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc= -0.438 X(o=-0.44,f=-0.86) USER MOD Single : A 62 THR OG1 : rot 110:sc= -0.28 USER MOD Single : A 64 SER OG : rot -106:sc= -0.0724 USER MOD Single : A 70 ASN : amide:sc= -5.46! C(o=-5.5!,f=-13!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HD1:sc= -0.345 X(o=-0.35,f=-0.011) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= -1.1 USER MOD Single : A 89 ASN : amide:sc= -2.06 K(o=-2.1,f=-1.3) USER MOD Single : A 96 THR OG1 : rot -31:sc= 1.05 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0.0793 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 MET CE :methyl 170:sc= -3.36 (180deg=-3.83!) USER MOD Single : A 110 SER OG : rot -130:sc= -0.269 USER MOD Single : A 114 ASN : amide:sc= -0.997 K(o=-1,f=-2.8!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 150:sc= -1.15 USER MOD Single : A 134 THR OG1 : rot -66:sc= 0.273 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -4.609 -18.483 11.753 1.00 0.00 N ATOM 2 CA SER A 1 -4.030 -17.589 10.716 1.00 0.00 C ATOM 3 C SER A 1 -4.915 -17.540 9.474 1.00 0.00 C ATOM 4 O SER A 1 -5.478 -18.553 9.061 1.00 0.00 O ATOM 5 CB SER A 1 -2.637 -18.105 10.350 1.00 0.00 C ATOM 6 OG SER A 1 -2.002 -17.244 9.420 1.00 0.00 O ATOM 0 H1 SER A 1 -3.841 -18.942 12.284 1.00 0.00 H new ATOM 0 H2 SER A 1 -5.195 -17.924 12.405 1.00 0.00 H new ATOM 0 H3 SER A 1 -5.196 -19.210 11.296 1.00 0.00 H new ATOM 0 HA SER A 1 -3.964 -16.576 11.113 1.00 0.00 H new ATOM 0 HB2 SER A 1 -2.028 -18.186 11.250 1.00 0.00 H new ATOM 0 HB3 SER A 1 -2.716 -19.107 9.928 1.00 0.00 H new ATOM 0 HG SER A 1 -1.113 -17.595 9.204 1.00 0.00 H new ATOM 14 N GLY A 2 -5.032 -16.354 8.885 1.00 0.00 N ATOM 15 CA GLY A 2 -5.849 -16.192 7.697 1.00 0.00 C ATOM 16 C GLY A 2 -5.208 -16.803 6.465 1.00 0.00 C ATOM 17 O GLY A 2 -3.983 -16.878 6.367 1.00 0.00 O ATOM 0 H GLY A 2 -4.575 -15.502 9.210 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -6.822 -16.654 7.863 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -6.025 -15.131 7.523 1.00 0.00 H new ATOM 21 N PHE A 3 -6.038 -17.241 5.524 1.00 0.00 N ATOM 22 CA PHE A 3 -5.546 -17.849 4.293 1.00 0.00 C ATOM 23 C PHE A 3 -4.874 -16.808 3.404 1.00 0.00 C ATOM 24 O PHE A 3 -5.013 -15.605 3.623 1.00 0.00 O ATOM 25 CB PHE A 3 -6.695 -18.519 3.536 1.00 0.00 C ATOM 26 CG PHE A 3 -6.424 -19.952 3.181 1.00 0.00 C ATOM 27 CD1 PHE A 3 -6.683 -20.965 4.090 1.00 0.00 C ATOM 28 CD2 PHE A 3 -5.911 -20.288 1.938 1.00 0.00 C ATOM 29 CE1 PHE A 3 -6.435 -22.286 3.766 1.00 0.00 C ATOM 30 CE2 PHE A 3 -5.661 -21.606 1.609 1.00 0.00 C ATOM 31 CZ PHE A 3 -5.924 -22.607 2.525 1.00 0.00 C ATOM 0 H PHE A 3 -7.054 -17.186 5.590 1.00 0.00 H new ATOM 0 HA PHE A 3 -4.807 -18.604 4.560 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -7.598 -18.468 4.144 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -6.894 -17.958 2.623 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -7.083 -20.720 5.063 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -5.704 -19.510 1.218 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -6.641 -23.066 4.484 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -5.260 -21.854 0.637 1.00 0.00 H new ATOM 0 HZ PHE A 3 -5.730 -23.638 2.270 1.00 0.00 H new ATOM 41 N VAL A 4 -4.144 -17.281 2.397 1.00 0.00 N ATOM 42 CA VAL A 4 -3.449 -16.392 1.473 1.00 0.00 C ATOM 43 C VAL A 4 -4.405 -15.830 0.427 1.00 0.00 C ATOM 44 O VAL A 4 -5.622 -15.990 0.536 1.00 0.00 O ATOM 45 CB VAL A 4 -2.292 -17.117 0.759 1.00 0.00 C ATOM 46 CG1 VAL A 4 -1.162 -17.410 1.734 1.00 0.00 C ATOM 47 CG2 VAL A 4 -2.787 -18.398 0.105 1.00 0.00 C ATOM 0 H VAL A 4 -4.019 -18.274 2.201 1.00 0.00 H new ATOM 0 HA VAL A 4 -3.043 -15.573 2.067 1.00 0.00 H new ATOM 0 HB VAL A 4 -1.906 -16.463 -0.023 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -0.354 -17.922 1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -0.789 -16.474 2.150 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -1.532 -18.044 2.540 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -1.956 -18.896 -0.394 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -3.202 -19.059 0.866 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -3.559 -18.158 -0.627 1.00 0.00 H new ATOM 57 N CYS A 5 -3.847 -15.171 -0.585 1.00 0.00 N ATOM 58 CA CYS A 5 -4.646 -14.583 -1.656 1.00 0.00 C ATOM 59 C CYS A 5 -5.648 -13.575 -1.100 1.00 0.00 C ATOM 60 O CYS A 5 -6.661 -13.277 -1.735 1.00 0.00 O ATOM 61 CB CYS A 5 -5.380 -15.676 -2.435 1.00 0.00 C ATOM 62 SG CYS A 5 -5.938 -15.163 -4.091 1.00 0.00 S ATOM 0 H CYS A 5 -2.842 -15.031 -0.686 1.00 0.00 H new ATOM 0 HA CYS A 5 -3.970 -14.059 -2.332 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -4.722 -16.539 -2.536 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -6.245 -16.001 -1.857 1.00 0.00 H new ATOM 67 N ASN A 6 -5.359 -13.052 0.087 1.00 0.00 N ATOM 68 CA ASN A 6 -6.232 -12.076 0.729 1.00 0.00 C ATOM 69 C ASN A 6 -5.547 -11.443 1.936 1.00 0.00 C ATOM 70 O ASN A 6 -5.696 -11.913 3.065 1.00 0.00 O ATOM 71 CB ASN A 6 -7.542 -12.740 1.162 1.00 0.00 C ATOM 72 CG ASN A 6 -8.730 -12.255 0.356 1.00 0.00 C ATOM 73 OD1 ASN A 6 -8.850 -11.066 0.058 1.00 0.00 O ATOM 74 ND2 ASN A 6 -9.618 -13.175 -0.003 1.00 0.00 N ATOM 0 H ASN A 6 -4.525 -13.288 0.625 1.00 0.00 H new ATOM 0 HA ASN A 6 -6.451 -11.291 0.005 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -7.451 -13.821 1.055 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -7.717 -12.538 2.219 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -10.438 -12.907 -0.547 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -9.480 -14.149 0.265 1.00 0.00 H new ATOM 81 N THR A 7 -4.796 -10.374 1.692 1.00 0.00 N ATOM 82 CA THR A 7 -4.088 -9.677 2.759 1.00 0.00 C ATOM 83 C THR A 7 -4.913 -8.508 3.287 1.00 0.00 C ATOM 84 O THR A 7 -4.919 -8.231 4.485 1.00 0.00 O ATOM 85 CB THR A 7 -2.731 -9.175 2.258 1.00 0.00 C ATOM 86 OG1 THR A 7 -1.990 -8.597 3.317 1.00 0.00 O ATOM 87 CG2 THR A 7 -2.840 -8.141 1.156 1.00 0.00 C ATOM 0 H THR A 7 -4.662 -9.972 0.764 1.00 0.00 H new ATOM 0 HA THR A 7 -3.927 -10.382 3.575 1.00 0.00 H new ATOM 0 HB THR A 7 -2.229 -10.055 1.857 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.126 -8.283 2.978 1.00 0.00 H new ATOM 0 HG21 THR A 7 -1.841 -7.830 0.849 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.364 -8.572 0.303 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.393 -7.276 1.522 1.00 0.00 H new ATOM 95 N CYS A 8 -5.605 -7.826 2.379 1.00 0.00 N ATOM 96 CA CYS A 8 -6.434 -6.682 2.741 1.00 0.00 C ATOM 97 C CYS A 8 -7.721 -7.134 3.437 1.00 0.00 C ATOM 98 O CYS A 8 -8.604 -7.716 2.807 1.00 0.00 O ATOM 99 CB CYS A 8 -6.764 -5.865 1.490 1.00 0.00 C ATOM 100 SG CYS A 8 -5.601 -6.130 0.108 1.00 0.00 S ATOM 0 H CYS A 8 -5.607 -8.047 1.383 1.00 0.00 H new ATOM 0 HA CYS A 8 -5.877 -6.058 3.440 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -7.771 -6.117 1.158 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -6.770 -4.806 1.750 1.00 0.00 H new ATOM 105 N PRO A 9 -7.837 -6.883 4.757 1.00 0.00 N ATOM 106 CA PRO A 9 -8.999 -7.271 5.543 1.00 0.00 C ATOM 107 C PRO A 9 -10.059 -6.174 5.637 1.00 0.00 C ATOM 108 O PRO A 9 -11.098 -6.246 4.979 1.00 0.00 O ATOM 109 CB PRO A 9 -8.387 -7.547 6.915 1.00 0.00 C ATOM 110 CG PRO A 9 -7.175 -6.666 7.001 1.00 0.00 C ATOM 111 CD PRO A 9 -6.835 -6.213 5.597 1.00 0.00 C ATOM 0 HA PRO A 9 -9.530 -8.115 5.102 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -9.094 -7.320 7.713 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -8.116 -8.598 7.019 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -7.371 -5.807 7.643 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -6.338 -7.208 7.441 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -6.894 -5.129 5.502 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.822 -6.503 5.318 1.00 0.00 H new ATOM 119 N GLU A 10 -9.795 -5.164 6.463 1.00 0.00 N ATOM 120 CA GLU A 10 -10.732 -4.060 6.647 1.00 0.00 C ATOM 121 C GLU A 10 -10.279 -2.830 5.870 1.00 0.00 C ATOM 122 O GLU A 10 -10.688 -2.625 4.727 1.00 0.00 O ATOM 123 CB GLU A 10 -10.874 -3.726 8.134 1.00 0.00 C ATOM 124 CG GLU A 10 -11.883 -2.625 8.418 1.00 0.00 C ATOM 125 CD GLU A 10 -12.894 -3.021 9.476 1.00 0.00 C ATOM 126 OE1 GLU A 10 -12.544 -2.984 10.675 1.00 0.00 O ATOM 127 OE2 GLU A 10 -14.036 -3.366 9.107 1.00 0.00 O ATOM 0 H GLU A 10 -8.940 -5.088 7.015 1.00 0.00 H new ATOM 0 HA GLU A 10 -11.704 -4.369 6.262 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.170 -4.626 8.673 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -9.902 -3.426 8.525 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.355 -1.728 8.742 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.407 -2.371 7.497 1.00 0.00 H new ATOM 134 N LYS A 11 -9.426 -2.019 6.492 1.00 0.00 N ATOM 135 CA LYS A 11 -8.912 -0.817 5.848 1.00 0.00 C ATOM 136 C LYS A 11 -8.347 -1.165 4.478 1.00 0.00 C ATOM 137 O LYS A 11 -8.923 -0.809 3.452 1.00 0.00 O ATOM 138 CB LYS A 11 -7.831 -0.172 6.716 1.00 0.00 C ATOM 139 CG LYS A 11 -8.278 0.096 8.144 1.00 0.00 C ATOM 140 CD LYS A 11 -7.183 -0.242 9.142 1.00 0.00 C ATOM 141 CE LYS A 11 -7.762 -0.617 10.498 1.00 0.00 C ATOM 142 NZ LYS A 11 -6.942 -1.653 11.185 1.00 0.00 N ATOM 0 H LYS A 11 -9.078 -2.173 7.438 1.00 0.00 H new ATOM 0 HA LYS A 11 -9.729 -0.106 5.725 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.956 -0.821 6.734 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.522 0.768 6.258 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.556 1.145 8.249 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -9.168 -0.494 8.365 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -6.583 -1.068 8.760 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.515 0.612 9.254 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -7.823 0.272 11.125 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -8.779 -0.986 10.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.370 -1.881 12.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -6.905 -2.511 10.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.978 -1.292 11.332 1.00 0.00 H new ATOM 155 N TRP A 12 -7.223 -1.876 4.481 1.00 0.00 N ATOM 156 CA TRP A 12 -6.568 -2.305 3.246 1.00 0.00 C ATOM 157 C TRP A 12 -7.613 -2.767 2.229 1.00 0.00 C ATOM 158 O TRP A 12 -8.551 -3.484 2.579 1.00 0.00 O ATOM 159 CB TRP A 12 -5.571 -3.444 3.521 1.00 0.00 C ATOM 160 CG TRP A 12 -4.777 -3.304 4.796 1.00 0.00 C ATOM 161 CD1 TRP A 12 -4.711 -2.217 5.625 1.00 0.00 C ATOM 162 CD2 TRP A 12 -3.927 -4.298 5.381 1.00 0.00 C ATOM 163 NE1 TRP A 12 -3.882 -2.480 6.688 1.00 0.00 N ATOM 164 CE2 TRP A 12 -3.386 -3.749 6.561 1.00 0.00 C ATOM 165 CE3 TRP A 12 -3.570 -5.601 5.023 1.00 0.00 C ATOM 166 CZ2 TRP A 12 -2.512 -4.458 7.381 1.00 0.00 C ATOM 167 CZ3 TRP A 12 -2.702 -6.304 5.838 1.00 0.00 C ATOM 168 CH2 TRP A 12 -2.182 -5.731 7.005 1.00 0.00 C ATOM 0 H TRP A 12 -6.743 -2.170 5.331 1.00 0.00 H new ATOM 0 HA TRP A 12 -6.020 -1.455 2.839 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -6.119 -4.386 3.554 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -4.876 -3.508 2.684 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -5.235 -1.286 5.466 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -3.670 -1.834 7.449 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -3.966 -6.051 4.125 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -2.109 -4.019 8.282 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -2.420 -7.312 5.570 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -1.506 -6.306 7.621 1.00 0.00 H new ATOM 179 N ILE A 13 -7.464 -2.338 0.977 1.00 0.00 N ATOM 180 CA ILE A 13 -8.422 -2.698 -0.069 1.00 0.00 C ATOM 181 C ILE A 13 -7.743 -3.223 -1.335 1.00 0.00 C ATOM 182 O ILE A 13 -6.877 -2.566 -1.904 1.00 0.00 O ATOM 183 CB ILE A 13 -9.307 -1.494 -0.449 1.00 0.00 C ATOM 184 CG1 ILE A 13 -9.082 -0.330 0.532 1.00 0.00 C ATOM 185 CG2 ILE A 13 -10.767 -1.915 -0.480 1.00 0.00 C ATOM 186 CD1 ILE A 13 -10.352 0.367 0.985 1.00 0.00 C ATOM 0 H ILE A 13 -6.696 -1.745 0.663 1.00 0.00 H new ATOM 0 HA ILE A 13 -9.034 -3.496 0.351 1.00 0.00 H new ATOM 0 HB ILE A 13 -9.030 -1.147 -1.444 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -8.557 -0.708 1.410 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -8.428 0.404 0.061 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -11.387 -1.060 -0.749 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.902 -2.707 -1.217 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -11.061 -2.281 0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -10.099 1.173 1.674 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -10.870 0.779 0.119 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -11.001 -0.350 1.488 1.00 0.00 H new ATOM 198 N ASN A 14 -8.163 -4.407 -1.780 1.00 0.00 N ATOM 199 CA ASN A 14 -7.610 -5.023 -2.986 1.00 0.00 C ATOM 200 C ASN A 14 -8.587 -4.909 -4.155 1.00 0.00 C ATOM 201 O ASN A 14 -9.801 -4.850 -3.956 1.00 0.00 O ATOM 202 CB ASN A 14 -7.271 -6.493 -2.730 1.00 0.00 C ATOM 203 CG ASN A 14 -6.913 -7.235 -4.003 1.00 0.00 C ATOM 204 OD1 ASN A 14 -7.690 -8.053 -4.497 1.00 0.00 O ATOM 205 ND2 ASN A 14 -5.732 -6.955 -4.541 1.00 0.00 N ATOM 0 H ASN A 14 -8.887 -4.960 -1.322 1.00 0.00 H new ATOM 0 HA ASN A 14 -6.696 -4.489 -3.246 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -6.437 -6.554 -2.031 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.122 -6.982 -2.255 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -5.437 -7.425 -5.397 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.119 -6.270 -4.098 1.00 0.00 H new ATOM 212 N PHE A 15 -8.050 -4.875 -5.373 1.00 0.00 N ATOM 213 CA PHE A 15 -8.877 -4.765 -6.571 1.00 0.00 C ATOM 214 C PHE A 15 -8.514 -5.851 -7.583 1.00 0.00 C ATOM 215 O PHE A 15 -8.440 -7.030 -7.234 1.00 0.00 O ATOM 216 CB PHE A 15 -8.717 -3.376 -7.196 1.00 0.00 C ATOM 217 CG PHE A 15 -8.611 -2.269 -6.187 1.00 0.00 C ATOM 218 CD1 PHE A 15 -9.749 -1.641 -5.706 1.00 0.00 C ATOM 219 CD2 PHE A 15 -7.374 -1.859 -5.719 1.00 0.00 C ATOM 220 CE1 PHE A 15 -9.654 -0.623 -4.777 1.00 0.00 C ATOM 221 CE2 PHE A 15 -7.272 -0.841 -4.790 1.00 0.00 C ATOM 222 CZ PHE A 15 -8.413 -0.223 -4.319 1.00 0.00 C ATOM 0 H PHE A 15 -7.048 -4.922 -5.555 1.00 0.00 H new ATOM 0 HA PHE A 15 -9.919 -4.904 -6.284 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.826 -3.370 -7.824 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -9.568 -3.181 -7.849 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -10.721 -1.951 -6.061 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -6.479 -2.340 -6.084 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -10.548 -0.141 -4.409 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -6.301 -0.529 -4.433 1.00 0.00 H new ATOM 0 HZ PHE A 15 -8.336 0.573 -3.593 1.00 0.00 H new ATOM 232 N GLN A 16 -8.292 -5.451 -8.837 1.00 0.00 N ATOM 233 CA GLN A 16 -7.938 -6.395 -9.892 1.00 0.00 C ATOM 234 C GLN A 16 -6.801 -7.309 -9.447 1.00 0.00 C ATOM 235 O GLN A 16 -6.879 -8.528 -9.593 1.00 0.00 O ATOM 236 CB GLN A 16 -7.536 -5.645 -11.163 1.00 0.00 C ATOM 237 CG GLN A 16 -8.599 -4.679 -11.661 1.00 0.00 C ATOM 238 CD GLN A 16 -9.733 -5.381 -12.381 1.00 0.00 C ATOM 239 OE1 GLN A 16 -9.516 -6.349 -13.109 1.00 0.00 O ATOM 240 NE2 GLN A 16 -10.952 -4.895 -12.181 1.00 0.00 N ATOM 0 H GLN A 16 -8.352 -4.480 -9.144 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.813 -7.010 -10.102 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -6.615 -5.093 -10.973 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -7.318 -6.369 -11.948 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -9.001 -4.120 -10.816 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -8.140 -3.954 -12.333 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -11.086 -4.090 -11.569 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -11.755 -5.326 -12.639 1.00 0.00 H new ATOM 249 N ARG A 17 -5.748 -6.711 -8.898 1.00 0.00 N ATOM 250 CA ARG A 17 -4.599 -7.475 -8.426 1.00 0.00 C ATOM 251 C ARG A 17 -3.712 -6.631 -7.519 1.00 0.00 C ATOM 252 O ARG A 17 -2.689 -7.101 -7.024 1.00 0.00 O ATOM 253 CB ARG A 17 -3.787 -8.007 -9.609 1.00 0.00 C ATOM 254 CG ARG A 17 -3.541 -6.970 -10.693 1.00 0.00 C ATOM 255 CD ARG A 17 -2.082 -6.546 -10.739 1.00 0.00 C ATOM 256 NE ARG A 17 -1.896 -5.306 -11.487 1.00 0.00 N ATOM 257 CZ ARG A 17 -1.788 -5.251 -12.811 1.00 0.00 C ATOM 258 NH1 ARG A 17 -1.851 -6.364 -13.531 1.00 0.00 N ATOM 259 NH2 ARG A 17 -1.619 -4.084 -13.417 1.00 0.00 N ATOM 0 H ARG A 17 -5.667 -5.702 -8.769 1.00 0.00 H new ATOM 0 HA ARG A 17 -4.974 -8.319 -7.847 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -2.828 -8.374 -9.245 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -4.310 -8.859 -10.044 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -3.833 -7.378 -11.661 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -4.169 -6.097 -10.512 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -1.710 -6.416 -9.723 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -1.489 -7.338 -11.196 1.00 0.00 H new ATOM 0 HE ARG A 17 -1.846 -4.432 -10.964 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -1.983 -7.264 -13.069 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -1.768 -6.320 -14.547 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -1.572 -3.226 -12.867 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -1.536 -4.044 -14.433 1.00 0.00 H new ATOM 273 N LYS A 18 -4.118 -5.387 -7.298 1.00 0.00 N ATOM 274 CA LYS A 18 -3.375 -4.482 -6.444 1.00 0.00 C ATOM 275 C LYS A 18 -4.193 -4.159 -5.206 1.00 0.00 C ATOM 276 O LYS A 18 -5.416 -4.277 -5.212 1.00 0.00 O ATOM 277 CB LYS A 18 -3.039 -3.198 -7.197 1.00 0.00 C ATOM 278 CG LYS A 18 -4.206 -2.233 -7.290 1.00 0.00 C ATOM 279 CD LYS A 18 -4.175 -1.443 -8.588 1.00 0.00 C ATOM 280 CE LYS A 18 -4.309 0.049 -8.332 1.00 0.00 C ATOM 281 NZ LYS A 18 -3.706 0.856 -9.429 1.00 0.00 N ATOM 0 H LYS A 18 -4.963 -4.984 -7.703 1.00 0.00 H new ATOM 0 HA LYS A 18 -2.444 -4.963 -6.144 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.205 -2.702 -6.701 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -2.706 -3.452 -8.203 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -5.143 -2.786 -7.222 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -4.179 -1.546 -6.444 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -3.241 -1.641 -9.114 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.984 -1.776 -9.238 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.363 0.307 -8.229 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.825 0.300 -7.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.818 1.868 -9.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.694 0.629 -9.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -4.184 0.635 -10.326 1.00 0.00 H new ATOM 294 N CYS A 19 -3.518 -3.754 -4.150 1.00 0.00 N ATOM 295 CA CYS A 19 -4.193 -3.420 -2.908 1.00 0.00 C ATOM 296 C CYS A 19 -3.739 -2.066 -2.389 1.00 0.00 C ATOM 297 O CYS A 19 -2.699 -1.542 -2.789 1.00 0.00 O ATOM 298 CB CYS A 19 -3.942 -4.503 -1.854 1.00 0.00 C ATOM 299 SG CYS A 19 -4.884 -4.276 -0.306 1.00 0.00 S ATOM 0 H CYS A 19 -2.504 -3.648 -4.124 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.263 -3.367 -3.109 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -4.194 -5.474 -2.280 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -2.878 -4.525 -1.618 1.00 0.00 H new ATOM 304 N TYR A 20 -4.527 -1.521 -1.483 1.00 0.00 N ATOM 305 CA TYR A 20 -4.242 -0.242 -0.866 1.00 0.00 C ATOM 306 C TYR A 20 -4.233 -0.418 0.635 1.00 0.00 C ATOM 307 O TYR A 20 -4.861 -1.327 1.173 1.00 0.00 O ATOM 308 CB TYR A 20 -5.279 0.818 -1.265 1.00 0.00 C ATOM 309 CG TYR A 20 -4.974 1.526 -2.568 1.00 0.00 C ATOM 310 CD1 TYR A 20 -4.479 0.833 -3.666 1.00 0.00 C ATOM 311 CD2 TYR A 20 -5.185 2.895 -2.699 1.00 0.00 C ATOM 312 CE1 TYR A 20 -4.202 1.480 -4.855 1.00 0.00 C ATOM 313 CE2 TYR A 20 -4.910 3.548 -3.885 1.00 0.00 C ATOM 314 CZ TYR A 20 -4.418 2.838 -4.959 1.00 0.00 C ATOM 315 OH TYR A 20 -4.144 3.485 -6.142 1.00 0.00 O ATOM 0 H TYR A 20 -5.388 -1.957 -1.153 1.00 0.00 H new ATOM 0 HA TYR A 20 -3.268 0.106 -1.211 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.257 0.342 -1.343 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -5.348 1.560 -0.469 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -4.308 -0.231 -3.589 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.570 3.456 -1.860 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -3.818 0.925 -5.698 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.080 4.611 -3.970 1.00 0.00 H new ATOM 0 HH TYR A 20 -4.943 3.480 -6.710 1.00 0.00 H new ATOM 325 N TYR A 21 -3.508 0.445 1.294 1.00 0.00 N ATOM 326 CA TYR A 21 -3.384 0.405 2.735 1.00 0.00 C ATOM 327 C TYR A 21 -3.960 1.665 3.332 1.00 0.00 C ATOM 328 O TYR A 21 -3.476 2.745 3.055 1.00 0.00 O ATOM 329 CB TYR A 21 -1.914 0.295 3.144 1.00 0.00 C ATOM 330 CG TYR A 21 -1.372 -1.113 3.161 1.00 0.00 C ATOM 331 CD1 TYR A 21 -1.476 -1.895 4.299 1.00 0.00 C ATOM 332 CD2 TYR A 21 -0.746 -1.654 2.045 1.00 0.00 C ATOM 333 CE1 TYR A 21 -0.974 -3.177 4.331 1.00 0.00 C ATOM 334 CE2 TYR A 21 -0.241 -2.940 2.064 1.00 0.00 C ATOM 335 CZ TYR A 21 -0.357 -3.699 3.211 1.00 0.00 C ATOM 336 OH TYR A 21 0.146 -4.979 3.239 1.00 0.00 O ATOM 0 H TYR A 21 -2.984 1.199 0.850 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.927 -0.466 3.102 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.314 0.893 2.459 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -1.793 0.729 4.136 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -1.959 -1.492 5.177 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -0.653 -1.060 1.148 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -1.062 -3.772 5.228 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.241 -3.348 1.188 1.00 0.00 H new ATOM 0 HH TYR A 21 0.547 -5.192 2.370 1.00 0.00 H new ATOM 346 N PHE A 22 -4.975 1.528 4.157 1.00 0.00 N ATOM 347 CA PHE A 22 -5.574 2.679 4.800 1.00 0.00 C ATOM 348 C PHE A 22 -5.606 2.431 6.300 1.00 0.00 C ATOM 349 O PHE A 22 -6.656 2.514 6.937 1.00 0.00 O ATOM 350 CB PHE A 22 -6.991 2.928 4.272 1.00 0.00 C ATOM 351 CG PHE A 22 -7.069 3.210 2.792 1.00 0.00 C ATOM 352 CD1 PHE A 22 -6.086 3.947 2.153 1.00 0.00 C ATOM 353 CD2 PHE A 22 -8.137 2.741 2.041 1.00 0.00 C ATOM 354 CE1 PHE A 22 -6.164 4.209 0.797 1.00 0.00 C ATOM 355 CE2 PHE A 22 -8.219 2.998 0.684 1.00 0.00 C ATOM 356 CZ PHE A 22 -7.231 3.734 0.061 1.00 0.00 C ATOM 0 H PHE A 22 -5.403 0.634 4.398 1.00 0.00 H new ATOM 0 HA PHE A 22 -4.981 3.566 4.579 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -7.606 2.056 4.495 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -7.423 3.770 4.812 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.247 4.322 2.721 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -8.915 2.167 2.522 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -5.389 4.786 0.314 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -9.055 2.623 0.113 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.293 3.937 -0.998 1.00 0.00 H new ATOM 366 N GLY A 23 -4.442 2.100 6.851 1.00 0.00 N ATOM 367 CA GLY A 23 -4.347 1.808 8.265 1.00 0.00 C ATOM 368 C GLY A 23 -4.122 3.053 9.104 1.00 0.00 C ATOM 369 O GLY A 23 -4.024 4.158 8.569 1.00 0.00 O ATOM 0 H GLY A 23 -3.562 2.029 6.340 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -5.262 1.314 8.593 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -3.529 1.108 8.434 1.00 0.00 H new ATOM 373 N LYS A 24 -4.047 2.880 10.421 1.00 0.00 N ATOM 374 CA LYS A 24 -3.840 4.004 11.330 1.00 0.00 C ATOM 375 C LYS A 24 -2.522 3.870 12.087 1.00 0.00 C ATOM 376 O LYS A 24 -2.157 2.781 12.530 1.00 0.00 O ATOM 377 CB LYS A 24 -5.002 4.104 12.320 1.00 0.00 C ATOM 378 CG LYS A 24 -5.332 2.787 13.003 1.00 0.00 C ATOM 379 CD LYS A 24 -5.166 2.884 14.511 1.00 0.00 C ATOM 380 CE LYS A 24 -6.511 2.950 15.215 1.00 0.00 C ATOM 381 NZ LYS A 24 -6.388 2.667 16.672 1.00 0.00 N ATOM 0 H LYS A 24 -4.126 1.974 10.882 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.797 4.914 10.732 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.759 4.847 13.080 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.887 4.463 11.794 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -6.357 2.500 12.767 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.683 2.002 12.614 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.606 2.021 14.873 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.581 3.770 14.758 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.948 3.939 15.072 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.194 2.232 14.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.327 2.722 17.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.995 1.714 16.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.756 3.368 17.110 1.00 0.00 H new ATOM 394 N GLY A 25 -1.813 4.988 12.230 1.00 0.00 N ATOM 395 CA GLY A 25 -0.542 4.980 12.935 1.00 0.00 C ATOM 396 C GLY A 25 0.366 6.119 12.509 1.00 0.00 C ATOM 397 O GLY A 25 -0.001 6.927 11.656 1.00 0.00 O ATOM 0 H GLY A 25 -2.096 5.899 11.870 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.725 5.047 14.007 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.037 4.031 12.756 1.00 0.00 H new ATOM 401 N THR A 26 1.555 6.179 13.107 1.00 0.00 N ATOM 402 CA THR A 26 2.532 7.222 12.793 1.00 0.00 C ATOM 403 C THR A 26 1.932 8.615 12.972 1.00 0.00 C ATOM 404 O THR A 26 0.839 8.764 13.520 1.00 0.00 O ATOM 405 CB THR A 26 3.057 7.053 11.366 1.00 0.00 C ATOM 406 OG1 THR A 26 2.158 7.615 10.428 1.00 0.00 O ATOM 407 CG2 THR A 26 3.281 5.607 10.977 1.00 0.00 C ATOM 0 H THR A 26 1.867 5.514 13.815 1.00 0.00 H new ATOM 0 HA THR A 26 3.364 7.119 13.490 1.00 0.00 H new ATOM 0 HB THR A 26 4.016 7.570 11.351 1.00 0.00 H new ATOM 0 HG1 THR A 26 1.239 7.387 10.679 1.00 0.00 H new ATOM 0 HG21 THR A 26 3.653 5.559 9.954 1.00 0.00 H new ATOM 0 HG22 THR A 26 4.011 5.158 11.650 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.340 5.061 11.047 1.00 0.00 H new ATOM 415 N LYS A 27 2.655 9.635 12.512 1.00 0.00 N ATOM 416 CA LYS A 27 2.188 11.013 12.631 1.00 0.00 C ATOM 417 C LYS A 27 2.918 11.940 11.659 1.00 0.00 C ATOM 418 O LYS A 27 2.877 13.161 11.811 1.00 0.00 O ATOM 419 CB LYS A 27 2.377 11.513 14.065 1.00 0.00 C ATOM 420 CG LYS A 27 3.801 11.372 14.576 1.00 0.00 C ATOM 421 CD LYS A 27 3.830 10.886 16.015 1.00 0.00 C ATOM 422 CE LYS A 27 5.209 11.055 16.632 1.00 0.00 C ATOM 423 NZ LYS A 27 5.338 12.349 17.358 1.00 0.00 N ATOM 0 H LYS A 27 3.562 9.533 12.056 1.00 0.00 H new ATOM 0 HA LYS A 27 1.128 11.025 12.378 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.083 12.561 14.117 1.00 0.00 H new ATOM 0 HB3 LYS A 27 1.707 10.961 14.724 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.348 10.673 13.944 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.311 12.333 14.505 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.097 11.440 16.602 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.540 9.836 16.051 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.402 10.232 17.320 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.966 11.001 15.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 6.292 12.426 17.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.179 13.136 16.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.633 12.391 18.121 1.00 0.00 H new ATOM 436 N GLN A 28 3.582 11.359 10.662 1.00 0.00 N ATOM 437 CA GLN A 28 4.314 12.148 9.672 1.00 0.00 C ATOM 438 C GLN A 28 4.282 11.483 8.299 1.00 0.00 C ATOM 439 O GLN A 28 3.985 10.294 8.179 1.00 0.00 O ATOM 440 CB GLN A 28 5.766 12.346 10.114 1.00 0.00 C ATOM 441 CG GLN A 28 5.913 13.178 11.378 1.00 0.00 C ATOM 442 CD GLN A 28 7.359 13.334 11.809 1.00 0.00 C ATOM 443 OE1 GLN A 28 8.266 12.762 11.203 1.00 0.00 O ATOM 444 NE2 GLN A 28 7.581 14.113 12.861 1.00 0.00 N ATOM 0 H GLN A 28 3.629 10.350 10.518 1.00 0.00 H new ATOM 0 HA GLN A 28 3.824 13.119 9.596 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.223 11.370 10.277 1.00 0.00 H new ATOM 0 HB3 GLN A 28 6.320 12.826 9.307 1.00 0.00 H new ATOM 0 HG2 GLN A 28 5.479 14.164 11.212 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.346 12.712 12.184 1.00 0.00 H new ATOM 0 HE21 GLN A 28 6.799 14.568 13.333 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.533 14.257 13.197 1.00 0.00 H new ATOM 453 N TRP A 29 4.595 12.260 7.264 1.00 0.00 N ATOM 454 CA TRP A 29 4.610 11.753 5.896 1.00 0.00 C ATOM 455 C TRP A 29 5.714 10.723 5.712 1.00 0.00 C ATOM 456 O TRP A 29 5.482 9.635 5.184 1.00 0.00 O ATOM 457 CB TRP A 29 4.805 12.895 4.902 1.00 0.00 C ATOM 458 CG TRP A 29 4.802 12.432 3.481 1.00 0.00 C ATOM 459 CD1 TRP A 29 3.721 12.333 2.655 1.00 0.00 C ATOM 460 CD2 TRP A 29 5.932 11.993 2.720 1.00 0.00 C ATOM 461 NE1 TRP A 29 4.110 11.857 1.428 1.00 0.00 N ATOM 462 CE2 TRP A 29 5.462 11.642 1.442 1.00 0.00 C ATOM 463 CE3 TRP A 29 7.297 11.864 2.996 1.00 0.00 C ATOM 464 CZ2 TRP A 29 6.305 11.168 0.442 1.00 0.00 C ATOM 465 CZ3 TRP A 29 8.136 11.394 2.001 1.00 0.00 C ATOM 466 CH2 TRP A 29 7.637 11.051 0.737 1.00 0.00 C ATOM 0 H TRP A 29 4.842 13.246 7.349 1.00 0.00 H new ATOM 0 HA TRP A 29 3.648 11.276 5.707 1.00 0.00 H new ATOM 0 HB2 TRP A 29 4.013 13.631 5.041 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.749 13.398 5.114 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.708 12.591 2.927 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.492 11.690 0.634 1.00 0.00 H new ATOM 0 HE3 TRP A 29 7.689 12.126 3.968 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 5.922 10.902 -0.532 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 9.192 11.290 2.202 1.00 0.00 H new ATOM 0 HH2 TRP A 29 8.317 10.687 -0.019 1.00 0.00 H new ATOM 477 N VAL A 30 6.914 11.078 6.150 1.00 0.00 N ATOM 478 CA VAL A 30 8.064 10.188 6.041 1.00 0.00 C ATOM 479 C VAL A 30 7.764 8.848 6.694 1.00 0.00 C ATOM 480 O VAL A 30 8.263 7.808 6.267 1.00 0.00 O ATOM 481 CB VAL A 30 9.315 10.802 6.695 1.00 0.00 C ATOM 482 CG1 VAL A 30 9.860 11.933 5.840 1.00 0.00 C ATOM 483 CG2 VAL A 30 8.994 11.295 8.097 1.00 0.00 C ATOM 0 H VAL A 30 7.118 11.978 6.585 1.00 0.00 H new ATOM 0 HA VAL A 30 8.262 10.042 4.979 1.00 0.00 H new ATOM 0 HB VAL A 30 10.081 10.030 6.771 1.00 0.00 H new ATOM 0 HG11 VAL A 30 10.744 12.356 6.317 1.00 0.00 H new ATOM 0 HG12 VAL A 30 10.127 11.549 4.856 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.100 12.707 5.733 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.889 11.726 8.545 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.213 12.053 8.046 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.650 10.460 8.707 1.00 0.00 H new ATOM 493 N HIS A 31 6.937 8.883 7.728 1.00 0.00 N ATOM 494 CA HIS A 31 6.556 7.672 8.436 1.00 0.00 C ATOM 495 C HIS A 31 5.623 6.828 7.577 1.00 0.00 C ATOM 496 O HIS A 31 5.581 5.604 7.707 1.00 0.00 O ATOM 497 CB HIS A 31 5.883 8.019 9.763 1.00 0.00 C ATOM 498 CG HIS A 31 6.823 8.023 10.929 1.00 0.00 C ATOM 499 ND1 HIS A 31 8.096 7.498 10.872 1.00 0.00 N ATOM 500 CD2 HIS A 31 6.668 8.494 12.190 1.00 0.00 C ATOM 501 CE1 HIS A 31 8.684 7.643 12.046 1.00 0.00 C ATOM 502 NE2 HIS A 31 7.839 8.244 12.863 1.00 0.00 N ATOM 0 H HIS A 31 6.517 9.737 8.095 1.00 0.00 H new ATOM 0 HA HIS A 31 7.457 7.095 8.644 1.00 0.00 H new ATOM 0 HB2 HIS A 31 5.418 9.001 9.679 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.084 7.303 9.954 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.788 8.976 12.591 1.00 0.00 H new ATOM 0 HE1 HIS A 31 9.685 7.324 12.295 1.00 0.00 H new ATOM 0 HE2 HIS A 31 8.026 8.484 13.837 1.00 0.00 H new ATOM 511 N ALA A 32 4.873 7.489 6.695 1.00 0.00 N ATOM 512 CA ALA A 32 3.946 6.789 5.817 1.00 0.00 C ATOM 513 C ALA A 32 4.700 5.988 4.764 1.00 0.00 C ATOM 514 O ALA A 32 4.435 4.802 4.573 1.00 0.00 O ATOM 515 CB ALA A 32 2.996 7.776 5.154 1.00 0.00 C ATOM 0 H ALA A 32 4.891 8.501 6.573 1.00 0.00 H new ATOM 0 HA ALA A 32 3.362 6.094 6.420 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.309 7.237 4.501 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.429 8.305 5.920 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.569 8.493 4.566 1.00 0.00 H new ATOM 521 N ARG A 33 5.653 6.634 4.098 1.00 0.00 N ATOM 522 CA ARG A 33 6.454 5.969 3.081 1.00 0.00 C ATOM 523 C ARG A 33 7.222 4.806 3.691 1.00 0.00 C ATOM 524 O ARG A 33 7.337 3.740 3.086 1.00 0.00 O ATOM 525 CB ARG A 33 7.419 6.953 2.413 1.00 0.00 C ATOM 526 CG ARG A 33 8.411 7.588 3.371 1.00 0.00 C ATOM 527 CD ARG A 33 9.846 7.336 2.936 1.00 0.00 C ATOM 528 NE ARG A 33 10.743 8.406 3.363 1.00 0.00 N ATOM 529 CZ ARG A 33 12.023 8.480 3.009 1.00 0.00 C ATOM 530 NH1 ARG A 33 12.554 7.551 2.225 1.00 0.00 N ATOM 531 NH2 ARG A 33 12.775 9.485 3.440 1.00 0.00 N ATOM 0 H ARG A 33 5.887 7.616 4.246 1.00 0.00 H new ATOM 0 HA ARG A 33 5.780 5.583 2.316 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.969 6.432 1.629 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.842 7.740 1.928 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.230 8.661 3.426 1.00 0.00 H new ATOM 0 HG3 ARG A 33 8.258 7.188 4.373 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.189 6.388 3.350 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.885 7.242 1.851 1.00 0.00 H new ATOM 0 HE ARG A 33 10.367 9.137 3.966 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.980 6.776 1.891 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.536 7.611 1.956 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.372 10.202 4.043 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.756 9.541 3.168 1.00 0.00 H new ATOM 545 N TYR A 34 7.729 5.011 4.902 1.00 0.00 N ATOM 546 CA TYR A 34 8.465 3.965 5.600 1.00 0.00 C ATOM 547 C TYR A 34 7.543 2.788 5.874 1.00 0.00 C ATOM 548 O TYR A 34 7.961 1.630 5.828 1.00 0.00 O ATOM 549 CB TYR A 34 9.050 4.498 6.909 1.00 0.00 C ATOM 550 CG TYR A 34 10.560 4.444 6.964 1.00 0.00 C ATOM 551 CD1 TYR A 34 11.225 3.236 7.141 1.00 0.00 C ATOM 552 CD2 TYR A 34 11.322 5.599 6.839 1.00 0.00 C ATOM 553 CE1 TYR A 34 12.605 3.182 7.192 1.00 0.00 C ATOM 554 CE2 TYR A 34 12.701 5.553 6.888 1.00 0.00 C ATOM 555 CZ TYR A 34 13.338 4.343 7.066 1.00 0.00 C ATOM 556 OH TYR A 34 14.713 4.293 7.115 1.00 0.00 O ATOM 0 H TYR A 34 7.644 5.887 5.418 1.00 0.00 H new ATOM 0 HA TYR A 34 9.290 3.634 4.970 1.00 0.00 H new ATOM 0 HB2 TYR A 34 8.726 5.530 7.048 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.644 3.921 7.740 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.654 2.325 7.240 1.00 0.00 H new ATOM 0 HD2 TYR A 34 10.827 6.549 6.701 1.00 0.00 H new ATOM 0 HE1 TYR A 34 13.107 2.236 7.330 1.00 0.00 H new ATOM 0 HE2 TYR A 34 13.278 6.460 6.787 1.00 0.00 H new ATOM 0 HH TYR A 34 15.077 5.197 7.009 1.00 0.00 H new ATOM 566 N ALA A 35 6.276 3.095 6.134 1.00 0.00 N ATOM 567 CA ALA A 35 5.280 2.066 6.387 1.00 0.00 C ATOM 568 C ALA A 35 5.047 1.259 5.120 1.00 0.00 C ATOM 569 O ALA A 35 4.879 0.040 5.164 1.00 0.00 O ATOM 570 CB ALA A 35 3.981 2.689 6.875 1.00 0.00 C ATOM 0 H ALA A 35 5.917 4.049 6.174 1.00 0.00 H new ATOM 0 HA ALA A 35 5.647 1.399 7.168 1.00 0.00 H new ATOM 0 HB1 ALA A 35 3.248 1.904 7.059 1.00 0.00 H new ATOM 0 HB2 ALA A 35 4.165 3.237 7.799 1.00 0.00 H new ATOM 0 HB3 ALA A 35 3.598 3.373 6.117 1.00 0.00 H new ATOM 576 N CYS A 36 5.060 1.955 3.986 1.00 0.00 N ATOM 577 CA CYS A 36 4.874 1.319 2.695 1.00 0.00 C ATOM 578 C CYS A 36 5.931 0.249 2.488 1.00 0.00 C ATOM 579 O CYS A 36 5.625 -0.888 2.134 1.00 0.00 O ATOM 580 CB CYS A 36 4.970 2.352 1.575 1.00 0.00 C ATOM 581 SG CYS A 36 4.103 3.916 1.918 1.00 0.00 S ATOM 0 H CYS A 36 5.199 2.965 3.941 1.00 0.00 H new ATOM 0 HA CYS A 36 3.885 0.862 2.673 1.00 0.00 H new ATOM 0 HB2 CYS A 36 6.021 2.568 1.385 1.00 0.00 H new ATOM 0 HB3 CYS A 36 4.564 1.918 0.661 1.00 0.00 H new ATOM 586 N ASP A 37 7.180 0.634 2.718 1.00 0.00 N ATOM 587 CA ASP A 37 8.302 -0.281 2.566 1.00 0.00 C ATOM 588 C ASP A 37 8.109 -1.519 3.436 1.00 0.00 C ATOM 589 O ASP A 37 8.503 -2.622 3.060 1.00 0.00 O ATOM 590 CB ASP A 37 9.612 0.418 2.935 1.00 0.00 C ATOM 591 CG ASP A 37 10.757 0.020 2.024 1.00 0.00 C ATOM 592 OD1 ASP A 37 10.622 0.188 0.793 1.00 0.00 O ATOM 593 OD2 ASP A 37 11.787 -0.461 2.541 1.00 0.00 O ATOM 0 H ASP A 37 7.441 1.576 3.011 1.00 0.00 H new ATOM 0 HA ASP A 37 8.349 -0.593 1.523 1.00 0.00 H new ATOM 0 HB2 ASP A 37 9.471 1.498 2.886 1.00 0.00 H new ATOM 0 HB3 ASP A 37 9.871 0.177 3.966 1.00 0.00 H new ATOM 598 N ASP A 38 7.493 -1.325 4.599 1.00 0.00 N ATOM 599 CA ASP A 38 7.239 -2.425 5.522 1.00 0.00 C ATOM 600 C ASP A 38 6.194 -3.378 4.950 1.00 0.00 C ATOM 601 O ASP A 38 6.171 -4.564 5.282 1.00 0.00 O ATOM 602 CB ASP A 38 6.769 -1.886 6.875 1.00 0.00 C ATOM 603 CG ASP A 38 7.223 -2.754 8.032 1.00 0.00 C ATOM 604 OD1 ASP A 38 8.442 -2.997 8.150 1.00 0.00 O ATOM 605 OD2 ASP A 38 6.358 -3.191 8.820 1.00 0.00 O ATOM 0 H ASP A 38 7.161 -0.417 4.924 1.00 0.00 H new ATOM 0 HA ASP A 38 8.170 -2.974 5.663 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.150 -0.874 7.012 1.00 0.00 H new ATOM 0 HB3 ASP A 38 5.681 -1.820 6.879 1.00 0.00 H new ATOM 610 N MET A 39 5.336 -2.851 4.082 1.00 0.00 N ATOM 611 CA MET A 39 4.291 -3.647 3.453 1.00 0.00 C ATOM 612 C MET A 39 4.719 -4.068 2.052 1.00 0.00 C ATOM 613 O MET A 39 4.047 -4.864 1.396 1.00 0.00 O ATOM 614 CB MET A 39 2.985 -2.855 3.385 1.00 0.00 C ATOM 615 CG MET A 39 2.567 -2.256 4.718 1.00 0.00 C ATOM 616 SD MET A 39 2.228 -3.510 5.968 1.00 0.00 S ATOM 617 CE MET A 39 2.945 -2.744 7.419 1.00 0.00 C ATOM 0 H MET A 39 5.345 -1.871 3.798 1.00 0.00 H new ATOM 0 HA MET A 39 4.128 -4.540 4.056 1.00 0.00 H new ATOM 0 HB2 MET A 39 3.093 -2.054 2.654 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.191 -3.510 3.025 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.355 -1.594 5.077 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.677 -1.643 4.573 1.00 0.00 H new ATOM 0 HE1 MET A 39 3.944 -3.147 7.587 1.00 0.00 H new ATOM 0 HE2 MET A 39 3.009 -1.666 7.267 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.319 -2.952 8.287 1.00 0.00 H new ATOM 627 N GLU A 40 5.847 -3.516 1.611 1.00 0.00 N ATOM 628 CA GLU A 40 6.404 -3.808 0.293 1.00 0.00 C ATOM 629 C GLU A 40 5.562 -3.179 -0.810 1.00 0.00 C ATOM 630 O GLU A 40 5.350 -3.779 -1.864 1.00 0.00 O ATOM 631 CB GLU A 40 6.511 -5.317 0.073 1.00 0.00 C ATOM 632 CG GLU A 40 7.885 -5.884 0.390 1.00 0.00 C ATOM 633 CD GLU A 40 8.349 -6.897 -0.639 1.00 0.00 C ATOM 634 OE1 GLU A 40 8.326 -6.571 -1.845 1.00 0.00 O ATOM 635 OE2 GLU A 40 8.737 -8.015 -0.240 1.00 0.00 O ATOM 0 H GLU A 40 6.400 -2.855 2.157 1.00 0.00 H new ATOM 0 HA GLU A 40 7.404 -3.375 0.253 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.768 -5.819 0.693 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.265 -5.542 -0.965 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.607 -5.069 0.443 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.862 -6.354 1.373 1.00 0.00 H new ATOM 642 N GLY A 41 5.087 -1.966 -0.558 1.00 0.00 N ATOM 643 CA GLY A 41 4.271 -1.271 -1.535 1.00 0.00 C ATOM 644 C GLY A 41 4.856 0.061 -1.959 1.00 0.00 C ATOM 645 O GLY A 41 6.001 0.133 -2.404 1.00 0.00 O ATOM 0 H GLY A 41 5.252 -1.450 0.306 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.149 -1.904 -2.414 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.277 -1.108 -1.119 1.00 0.00 H new ATOM 649 N GLN A 42 4.052 1.110 -1.841 1.00 0.00 N ATOM 650 CA GLN A 42 4.467 2.451 -2.235 1.00 0.00 C ATOM 651 C GLN A 42 3.558 3.464 -1.583 1.00 0.00 C ATOM 652 O GLN A 42 2.452 3.122 -1.178 1.00 0.00 O ATOM 653 CB GLN A 42 4.384 2.609 -3.754 1.00 0.00 C ATOM 654 CG GLN A 42 4.642 4.029 -4.238 1.00 0.00 C ATOM 655 CD GLN A 42 4.381 4.196 -5.721 1.00 0.00 C ATOM 656 OE1 GLN A 42 5.094 3.639 -6.556 1.00 0.00 O ATOM 657 NE2 GLN A 42 3.353 4.966 -6.056 1.00 0.00 N ATOM 0 H GLN A 42 3.102 1.057 -1.473 1.00 0.00 H new ATOM 0 HA GLN A 42 5.497 2.610 -1.917 1.00 0.00 H new ATOM 0 HB2 GLN A 42 5.107 1.939 -4.220 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.396 2.294 -4.089 1.00 0.00 H new ATOM 0 HG2 GLN A 42 4.008 4.719 -3.681 1.00 0.00 H new ATOM 0 HG3 GLN A 42 5.675 4.300 -4.022 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.789 5.408 -5.330 1.00 0.00 H new ATOM 0 HE22 GLN A 42 3.127 5.116 -7.039 1.00 0.00 H new ATOM 666 N LEU A 43 3.979 4.713 -1.487 1.00 0.00 N ATOM 667 CA LEU A 43 3.099 5.683 -0.893 1.00 0.00 C ATOM 668 C LEU A 43 2.038 6.005 -1.934 1.00 0.00 C ATOM 669 O LEU A 43 2.326 6.573 -2.988 1.00 0.00 O ATOM 670 CB LEU A 43 3.885 6.940 -0.493 1.00 0.00 C ATOM 671 CG LEU A 43 3.361 7.734 0.715 1.00 0.00 C ATOM 672 CD1 LEU A 43 2.634 6.845 1.703 1.00 0.00 C ATOM 673 CD2 LEU A 43 4.508 8.451 1.406 1.00 0.00 C ATOM 0 H LEU A 43 4.885 5.062 -1.800 1.00 0.00 H new ATOM 0 HA LEU A 43 2.637 5.297 0.015 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.913 6.645 -0.284 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.914 7.610 -1.352 1.00 0.00 H new ATOM 0 HG LEU A 43 2.646 8.467 0.342 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.280 7.446 2.541 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.784 6.373 1.211 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.314 6.076 2.069 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.126 9.010 2.260 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.240 7.720 1.749 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.982 9.138 0.705 1.00 0.00 H new ATOM 685 N VAL A 44 0.821 5.584 -1.611 1.00 0.00 N ATOM 686 CA VAL A 44 -0.357 5.737 -2.464 1.00 0.00 C ATOM 687 C VAL A 44 -0.103 6.526 -3.737 1.00 0.00 C ATOM 688 O VAL A 44 -0.027 5.957 -4.828 1.00 0.00 O ATOM 689 CB VAL A 44 -1.503 6.398 -1.694 1.00 0.00 C ATOM 690 CG1 VAL A 44 -2.678 5.442 -1.588 1.00 0.00 C ATOM 691 CG2 VAL A 44 -1.027 6.836 -0.321 1.00 0.00 C ATOM 0 H VAL A 44 0.618 5.115 -0.728 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.625 4.723 -2.761 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.834 7.285 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.488 5.921 -1.039 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.024 5.178 -2.587 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.367 4.540 -1.062 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.851 7.305 0.217 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -0.677 5.968 0.237 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.211 7.551 -0.430 1.00 0.00 H new ATOM 701 N SER A 45 -0.011 7.836 -3.594 1.00 0.00 N ATOM 702 CA SER A 45 0.194 8.719 -4.735 1.00 0.00 C ATOM 703 C SER A 45 -1.028 8.664 -5.646 1.00 0.00 C ATOM 704 O SER A 45 -0.918 8.410 -6.845 1.00 0.00 O ATOM 705 CB SER A 45 1.450 8.317 -5.513 1.00 0.00 C ATOM 706 OG SER A 45 2.352 9.403 -5.622 1.00 0.00 O ATOM 0 H SER A 45 -0.075 8.316 -2.696 1.00 0.00 H new ATOM 0 HA SER A 45 0.331 9.738 -4.372 1.00 0.00 H new ATOM 0 HB2 SER A 45 1.940 7.482 -5.012 1.00 0.00 H new ATOM 0 HB3 SER A 45 1.170 7.972 -6.508 1.00 0.00 H new ATOM 0 HG SER A 45 2.447 9.656 -6.564 1.00 0.00 H new ATOM 712 N ILE A 46 -2.197 8.885 -5.048 1.00 0.00 N ATOM 713 CA ILE A 46 -3.462 8.846 -5.776 1.00 0.00 C ATOM 714 C ILE A 46 -3.410 9.701 -7.036 1.00 0.00 C ATOM 715 O ILE A 46 -2.842 10.793 -7.038 1.00 0.00 O ATOM 716 CB ILE A 46 -4.656 9.309 -4.907 1.00 0.00 C ATOM 717 CG1 ILE A 46 -4.178 9.867 -3.558 1.00 0.00 C ATOM 718 CG2 ILE A 46 -5.635 8.161 -4.701 1.00 0.00 C ATOM 719 CD1 ILE A 46 -3.858 8.804 -2.526 1.00 0.00 C ATOM 0 H ILE A 46 -2.293 9.094 -4.054 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.614 7.802 -6.050 1.00 0.00 H new ATOM 0 HB ILE A 46 -5.169 10.113 -5.434 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.290 10.476 -3.724 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.947 10.527 -3.157 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -6.470 8.500 -4.088 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -6.008 7.823 -5.668 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -5.128 7.336 -4.199 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.528 9.281 -1.603 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.749 8.209 -2.328 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.066 8.157 -2.903 1.00 0.00 H new ATOM 731 N HIS A 47 -4.008 9.189 -8.108 1.00 0.00 N ATOM 732 CA HIS A 47 -4.037 9.894 -9.382 1.00 0.00 C ATOM 733 C HIS A 47 -5.443 9.901 -9.966 1.00 0.00 C ATOM 734 O HIS A 47 -5.680 10.473 -11.031 1.00 0.00 O ATOM 735 CB HIS A 47 -3.069 9.243 -10.371 1.00 0.00 C ATOM 736 CG HIS A 47 -3.101 7.746 -10.344 1.00 0.00 C ATOM 737 ND1 HIS A 47 -2.311 6.992 -9.502 1.00 0.00 N ATOM 738 CD2 HIS A 47 -3.833 6.863 -11.062 1.00 0.00 C ATOM 739 CE1 HIS A 47 -2.556 5.709 -9.704 1.00 0.00 C ATOM 740 NE2 HIS A 47 -3.476 5.604 -10.645 1.00 0.00 N ATOM 0 H HIS A 47 -4.480 8.285 -8.118 1.00 0.00 H new ATOM 0 HA HIS A 47 -3.729 10.924 -9.205 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.307 9.585 -11.378 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.056 9.580 -10.151 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -1.642 7.366 -8.829 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.562 7.103 -11.822 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.084 4.887 -9.187 1.00 0.00 H new ATOM 749 N SER A 48 -6.376 9.266 -9.263 1.00 0.00 N ATOM 750 CA SER A 48 -7.756 9.204 -9.713 1.00 0.00 C ATOM 751 C SER A 48 -8.676 9.850 -8.689 1.00 0.00 C ATOM 752 O SER A 48 -8.714 9.430 -7.534 1.00 0.00 O ATOM 753 CB SER A 48 -8.175 7.753 -9.952 1.00 0.00 C ATOM 754 OG SER A 48 -8.345 7.491 -11.334 1.00 0.00 O ATOM 0 H SER A 48 -6.198 8.788 -8.380 1.00 0.00 H new ATOM 0 HA SER A 48 -7.836 9.751 -10.652 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.421 7.081 -9.542 1.00 0.00 H new ATOM 0 HB3 SER A 48 -9.106 7.548 -9.423 1.00 0.00 H new ATOM 0 HG SER A 48 -8.611 6.556 -11.459 1.00 0.00 H new ATOM 760 N PRO A 49 -9.435 10.882 -9.097 1.00 0.00 N ATOM 761 CA PRO A 49 -10.359 11.573 -8.198 1.00 0.00 C ATOM 762 C PRO A 49 -11.194 10.586 -7.394 1.00 0.00 C ATOM 763 O PRO A 49 -11.607 10.874 -6.271 1.00 0.00 O ATOM 764 CB PRO A 49 -11.234 12.381 -9.155 1.00 0.00 C ATOM 765 CG PRO A 49 -10.348 12.657 -10.320 1.00 0.00 C ATOM 766 CD PRO A 49 -9.458 11.451 -10.459 1.00 0.00 C ATOM 0 HA PRO A 49 -9.850 12.189 -7.456 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -12.120 11.820 -9.453 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -11.582 13.305 -8.692 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -10.933 12.817 -11.226 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -9.759 13.560 -10.157 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -9.855 10.741 -11.184 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -8.459 11.726 -10.796 1.00 0.00 H new ATOM 774 N GLU A 50 -11.421 9.411 -7.975 1.00 0.00 N ATOM 775 CA GLU A 50 -12.186 8.367 -7.314 1.00 0.00 C ATOM 776 C GLU A 50 -11.378 7.735 -6.195 1.00 0.00 C ATOM 777 O GLU A 50 -11.883 7.529 -5.095 1.00 0.00 O ATOM 778 CB GLU A 50 -12.601 7.285 -8.308 1.00 0.00 C ATOM 779 CG GLU A 50 -13.281 6.098 -7.654 1.00 0.00 C ATOM 780 CD GLU A 50 -13.252 4.857 -8.523 1.00 0.00 C ATOM 781 OE1 GLU A 50 -12.173 4.238 -8.639 1.00 0.00 O ATOM 782 OE2 GLU A 50 -14.308 4.504 -9.089 1.00 0.00 O ATOM 0 H GLU A 50 -11.084 9.161 -8.905 1.00 0.00 H new ATOM 0 HA GLU A 50 -13.080 8.829 -6.895 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -13.275 7.719 -9.047 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.719 6.938 -8.846 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -12.793 5.883 -6.704 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -14.316 6.355 -7.429 1.00 0.00 H new ATOM 789 N GLU A 51 -10.123 7.418 -6.490 1.00 0.00 N ATOM 790 CA GLU A 51 -9.249 6.798 -5.514 1.00 0.00 C ATOM 791 C GLU A 51 -9.018 7.732 -4.334 1.00 0.00 C ATOM 792 O GLU A 51 -9.130 7.324 -3.179 1.00 0.00 O ATOM 793 CB GLU A 51 -7.919 6.410 -6.160 1.00 0.00 C ATOM 794 CG GLU A 51 -8.056 5.348 -7.240 1.00 0.00 C ATOM 795 CD GLU A 51 -6.732 5.016 -7.901 1.00 0.00 C ATOM 796 OE1 GLU A 51 -6.013 5.957 -8.297 1.00 0.00 O ATOM 797 OE2 GLU A 51 -6.415 3.813 -8.022 1.00 0.00 O ATOM 0 H GLU A 51 -9.692 7.582 -7.400 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.731 5.892 -5.145 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -7.461 7.300 -6.592 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.241 6.046 -5.388 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.477 4.443 -6.803 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -8.760 5.694 -7.997 1.00 0.00 H new ATOM 804 N GLN A 52 -8.713 8.993 -4.630 1.00 0.00 N ATOM 805 CA GLN A 52 -8.486 9.982 -3.587 1.00 0.00 C ATOM 806 C GLN A 52 -9.742 10.133 -2.737 1.00 0.00 C ATOM 807 O GLN A 52 -9.669 10.243 -1.515 1.00 0.00 O ATOM 808 CB GLN A 52 -8.076 11.331 -4.195 1.00 0.00 C ATOM 809 CG GLN A 52 -9.249 12.214 -4.601 1.00 0.00 C ATOM 810 CD GLN A 52 -9.556 13.302 -3.585 1.00 0.00 C ATOM 811 OE1 GLN A 52 -10.191 14.305 -3.913 1.00 0.00 O ATOM 812 NE2 GLN A 52 -9.106 13.117 -2.347 1.00 0.00 N ATOM 0 H GLN A 52 -8.618 9.350 -5.581 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.669 9.641 -2.951 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.462 11.870 -3.474 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.453 11.148 -5.071 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -9.032 12.676 -5.564 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -10.134 11.592 -4.737 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.584 12.272 -2.115 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -9.283 13.820 -1.630 1.00 0.00 H new ATOM 821 N ASP A 53 -10.893 10.109 -3.401 1.00 0.00 N ATOM 822 CA ASP A 53 -12.178 10.212 -2.731 1.00 0.00 C ATOM 823 C ASP A 53 -12.444 8.940 -1.942 1.00 0.00 C ATOM 824 O ASP A 53 -13.055 8.967 -0.876 1.00 0.00 O ATOM 825 CB ASP A 53 -13.296 10.443 -3.748 1.00 0.00 C ATOM 826 CG ASP A 53 -14.590 10.886 -3.095 1.00 0.00 C ATOM 827 OD1 ASP A 53 -14.551 11.826 -2.274 1.00 0.00 O ATOM 828 OD2 ASP A 53 -15.645 10.291 -3.404 1.00 0.00 O ATOM 0 H ASP A 53 -10.958 10.018 -4.415 1.00 0.00 H new ATOM 0 HA ASP A 53 -12.154 11.062 -2.049 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -12.978 11.198 -4.467 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -13.471 9.524 -4.307 1.00 0.00 H new ATOM 833 N PHE A 54 -11.986 7.824 -2.497 1.00 0.00 N ATOM 834 CA PHE A 54 -12.165 6.521 -1.887 1.00 0.00 C ATOM 835 C PHE A 54 -11.526 6.476 -0.508 1.00 0.00 C ATOM 836 O PHE A 54 -12.165 6.100 0.475 1.00 0.00 O ATOM 837 CB PHE A 54 -11.516 5.470 -2.785 1.00 0.00 C ATOM 838 CG PHE A 54 -12.469 4.446 -3.313 1.00 0.00 C ATOM 839 CD1 PHE A 54 -12.719 3.286 -2.603 1.00 0.00 C ATOM 840 CD2 PHE A 54 -13.108 4.642 -4.523 1.00 0.00 C ATOM 841 CE1 PHE A 54 -13.594 2.336 -3.091 1.00 0.00 C ATOM 842 CE2 PHE A 54 -13.983 3.698 -5.020 1.00 0.00 C ATOM 843 CZ PHE A 54 -14.228 2.541 -4.302 1.00 0.00 C ATOM 0 H PHE A 54 -11.481 7.802 -3.383 1.00 0.00 H new ATOM 0 HA PHE A 54 -13.231 6.322 -1.775 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -11.036 5.972 -3.625 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.730 4.964 -2.225 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -12.225 3.121 -1.657 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.920 5.544 -5.086 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -13.783 1.434 -2.527 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -14.475 3.862 -5.967 1.00 0.00 H new ATOM 0 HZ PHE A 54 -14.913 1.800 -4.687 1.00 0.00 H new ATOM 853 N LEU A 55 -10.270 6.888 -0.440 1.00 0.00 N ATOM 854 CA LEU A 55 -9.547 6.924 0.820 1.00 0.00 C ATOM 855 C LEU A 55 -10.051 8.076 1.670 1.00 0.00 C ATOM 856 O LEU A 55 -10.093 7.991 2.895 1.00 0.00 O ATOM 857 CB LEU A 55 -8.052 7.076 0.580 1.00 0.00 C ATOM 858 CG LEU A 55 -7.682 7.957 -0.605 1.00 0.00 C ATOM 859 CD1 LEU A 55 -7.113 9.277 -0.123 1.00 0.00 C ATOM 860 CD2 LEU A 55 -6.699 7.238 -1.507 1.00 0.00 C ATOM 0 H LEU A 55 -9.729 7.203 -1.246 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.719 5.984 1.344 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.594 7.489 1.479 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.620 6.087 0.428 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.582 8.167 -1.183 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.853 9.896 -0.981 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.856 9.793 0.485 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.220 9.092 0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.443 7.879 -2.350 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.796 7.000 -0.945 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.150 6.317 -1.876 1.00 0.00 H new ATOM 872 N THR A 56 -10.432 9.157 0.996 1.00 0.00 N ATOM 873 CA THR A 56 -10.939 10.340 1.666 1.00 0.00 C ATOM 874 C THR A 56 -12.192 9.987 2.458 1.00 0.00 C ATOM 875 O THR A 56 -12.381 10.442 3.585 1.00 0.00 O ATOM 876 CB THR A 56 -11.239 11.442 0.638 1.00 0.00 C ATOM 877 OG1 THR A 56 -10.350 12.533 0.790 1.00 0.00 O ATOM 878 CG2 THR A 56 -12.646 11.989 0.717 1.00 0.00 C ATOM 0 H THR A 56 -10.397 9.233 -0.021 1.00 0.00 H new ATOM 0 HA THR A 56 -10.183 10.713 2.357 1.00 0.00 H new ATOM 0 HB THR A 56 -11.113 10.957 -0.330 1.00 0.00 H new ATOM 0 HG1 THR A 56 -10.688 13.136 1.485 1.00 0.00 H new ATOM 0 HG21 THR A 56 -12.779 12.762 -0.040 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.360 11.184 0.543 1.00 0.00 H new ATOM 0 HG23 THR A 56 -12.815 12.416 1.705 1.00 0.00 H new ATOM 886 N LYS A 57 -13.033 9.153 1.859 1.00 0.00 N ATOM 887 CA LYS A 57 -14.257 8.710 2.501 1.00 0.00 C ATOM 888 C LYS A 57 -13.925 7.690 3.578 1.00 0.00 C ATOM 889 O LYS A 57 -14.567 7.644 4.628 1.00 0.00 O ATOM 890 CB LYS A 57 -15.213 8.101 1.473 1.00 0.00 C ATOM 891 CG LYS A 57 -16.635 8.630 1.576 1.00 0.00 C ATOM 892 CD LYS A 57 -17.353 8.557 0.238 1.00 0.00 C ATOM 893 CE LYS A 57 -17.152 9.827 -0.572 1.00 0.00 C ATOM 894 NZ LYS A 57 -17.591 11.039 0.174 1.00 0.00 N ATOM 0 H LYS A 57 -12.886 8.770 0.925 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.749 9.569 2.957 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.832 8.301 0.472 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -15.227 7.018 1.599 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -17.186 8.053 2.318 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -16.616 9.663 1.925 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -16.984 7.701 -0.328 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -18.418 8.395 0.404 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -16.099 9.926 -0.837 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -17.710 9.754 -1.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -18.163 11.642 -0.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -18.160 10.753 0.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -16.757 11.569 0.498 1.00 0.00 H new ATOM 907 N HIS A 58 -12.905 6.878 3.309 1.00 0.00 N ATOM 908 CA HIS A 58 -12.470 5.864 4.255 1.00 0.00 C ATOM 909 C HIS A 58 -11.789 6.511 5.455 1.00 0.00 C ATOM 910 O HIS A 58 -11.757 5.941 6.545 1.00 0.00 O ATOM 911 CB HIS A 58 -11.513 4.879 3.579 1.00 0.00 C ATOM 912 CG HIS A 58 -11.414 3.563 4.283 1.00 0.00 C ATOM 913 ND1 HIS A 58 -10.827 3.415 5.523 1.00 0.00 N ATOM 914 CD2 HIS A 58 -11.832 2.328 3.918 1.00 0.00 C ATOM 915 CE1 HIS A 58 -10.887 2.146 5.888 1.00 0.00 C ATOM 916 NE2 HIS A 58 -11.493 1.466 4.933 1.00 0.00 N ATOM 0 H HIS A 58 -12.367 6.906 2.443 1.00 0.00 H new ATOM 0 HA HIS A 58 -13.348 5.320 4.602 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -11.843 4.710 2.554 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -10.521 5.328 3.524 1.00 0.00 H new ATOM 0 HD1 HIS A 58 -10.412 4.167 6.072 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -12.338 2.069 3.000 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -10.505 1.735 6.811 1.00 0.00 H new ATOM 925 N ALA A 59 -11.244 7.709 5.247 1.00 0.00 N ATOM 926 CA ALA A 59 -10.566 8.433 6.310 1.00 0.00 C ATOM 927 C ALA A 59 -11.483 9.481 6.932 1.00 0.00 C ATOM 928 O ALA A 59 -11.579 10.606 6.441 1.00 0.00 O ATOM 929 CB ALA A 59 -9.298 9.081 5.777 1.00 0.00 C ATOM 0 H ALA A 59 -11.261 8.195 4.350 1.00 0.00 H new ATOM 0 HA ALA A 59 -10.296 7.721 7.090 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -8.799 9.620 6.582 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -8.632 8.311 5.388 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -9.553 9.777 4.978 1.00 0.00 H new ATOM 935 N SER A 60 -12.158 9.103 8.014 1.00 0.00 N ATOM 936 CA SER A 60 -13.071 10.008 8.703 1.00 0.00 C ATOM 937 C SER A 60 -12.455 10.530 9.997 1.00 0.00 C ATOM 938 O SER A 60 -12.354 11.739 10.205 1.00 0.00 O ATOM 939 CB SER A 60 -14.393 9.300 9.004 1.00 0.00 C ATOM 940 OG SER A 60 -14.886 8.630 7.857 1.00 0.00 O ATOM 0 H SER A 60 -12.089 8.175 8.432 1.00 0.00 H new ATOM 0 HA SER A 60 -13.261 10.857 8.047 1.00 0.00 H new ATOM 0 HB2 SER A 60 -14.250 8.584 9.813 1.00 0.00 H new ATOM 0 HB3 SER A 60 -15.128 10.027 9.348 1.00 0.00 H new ATOM 0 HG SER A 60 -15.731 8.184 8.076 1.00 0.00 H new ATOM 946 N HIS A 61 -12.045 9.609 10.866 1.00 0.00 N ATOM 947 CA HIS A 61 -11.440 9.975 12.142 1.00 0.00 C ATOM 948 C HIS A 61 -10.204 10.843 11.929 1.00 0.00 C ATOM 949 O HIS A 61 -9.881 11.695 12.756 1.00 0.00 O ATOM 950 CB HIS A 61 -11.065 8.720 12.932 1.00 0.00 C ATOM 951 CG HIS A 61 -11.714 8.644 14.279 1.00 0.00 C ATOM 952 ND1 HIS A 61 -12.346 9.717 14.871 1.00 0.00 N ATOM 953 CD2 HIS A 61 -11.827 7.614 15.152 1.00 0.00 C ATOM 954 CE1 HIS A 61 -12.820 9.351 16.051 1.00 0.00 C ATOM 955 NE2 HIS A 61 -12.518 8.080 16.244 1.00 0.00 N ATOM 0 H HIS A 61 -12.121 8.604 10.709 1.00 0.00 H new ATOM 0 HA HIS A 61 -12.172 10.549 12.711 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -11.344 7.840 12.353 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -9.983 8.689 13.057 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -11.445 6.613 15.015 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -13.361 9.984 16.739 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -12.759 7.533 17.070 1.00 0.00 H new ATOM 964 N THR A 62 -9.519 10.621 10.812 1.00 0.00 N ATOM 965 CA THR A 62 -8.319 11.383 10.485 1.00 0.00 C ATOM 966 C THR A 62 -8.021 11.306 8.991 1.00 0.00 C ATOM 967 O THR A 62 -8.480 10.394 8.304 1.00 0.00 O ATOM 968 CB THR A 62 -7.124 10.861 11.285 1.00 0.00 C ATOM 969 OG1 THR A 62 -5.937 11.535 10.908 1.00 0.00 O ATOM 970 CG2 THR A 62 -6.885 9.377 11.108 1.00 0.00 C ATOM 0 H THR A 62 -9.775 9.919 10.117 1.00 0.00 H new ATOM 0 HA THR A 62 -8.494 12.426 10.750 1.00 0.00 H new ATOM 0 HB THR A 62 -7.372 11.049 12.330 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.647 12.120 11.639 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.023 9.074 11.703 1.00 0.00 H new ATOM 0 HG22 THR A 62 -7.765 8.825 11.437 1.00 0.00 H new ATOM 0 HG23 THR A 62 -6.694 9.162 10.057 1.00 0.00 H new ATOM 978 N GLY A 63 -7.250 12.269 8.496 1.00 0.00 N ATOM 979 CA GLY A 63 -6.903 12.295 7.085 1.00 0.00 C ATOM 980 C GLY A 63 -6.039 11.119 6.674 1.00 0.00 C ATOM 981 O GLY A 63 -5.889 10.155 7.424 1.00 0.00 O ATOM 0 H GLY A 63 -6.858 13.033 9.047 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -7.816 12.295 6.490 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.377 13.223 6.861 1.00 0.00 H new ATOM 985 N SER A 64 -5.473 11.201 5.474 1.00 0.00 N ATOM 986 CA SER A 64 -4.620 10.137 4.956 1.00 0.00 C ATOM 987 C SER A 64 -3.347 10.709 4.339 1.00 0.00 C ATOM 988 O SER A 64 -3.284 11.893 4.007 1.00 0.00 O ATOM 989 CB SER A 64 -5.380 9.313 3.915 1.00 0.00 C ATOM 990 OG SER A 64 -5.054 9.725 2.599 1.00 0.00 O ATOM 0 H SER A 64 -5.590 11.993 4.842 1.00 0.00 H new ATOM 0 HA SER A 64 -4.338 9.492 5.788 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.141 8.257 4.038 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.453 9.418 4.077 1.00 0.00 H new ATOM 0 HG SER A 64 -5.802 10.232 2.220 1.00 0.00 H new ATOM 996 N TRP A 65 -2.338 9.858 4.182 1.00 0.00 N ATOM 997 CA TRP A 65 -1.070 10.273 3.597 1.00 0.00 C ATOM 998 C TRP A 65 -0.945 9.733 2.182 1.00 0.00 C ATOM 999 O TRP A 65 -1.240 8.569 1.929 1.00 0.00 O ATOM 1000 CB TRP A 65 0.101 9.775 4.446 1.00 0.00 C ATOM 1001 CG TRP A 65 0.479 10.712 5.549 1.00 0.00 C ATOM 1002 CD1 TRP A 65 0.934 11.994 5.420 1.00 0.00 C ATOM 1003 CD2 TRP A 65 0.435 10.440 6.952 1.00 0.00 C ATOM 1004 NE1 TRP A 65 1.175 12.534 6.660 1.00 0.00 N ATOM 1005 CE2 TRP A 65 0.875 11.599 7.616 1.00 0.00 C ATOM 1006 CE3 TRP A 65 0.064 9.329 7.711 1.00 0.00 C ATOM 1007 CZ2 TRP A 65 0.954 11.676 9.004 1.00 0.00 C ATOM 1008 CZ3 TRP A 65 0.143 9.406 9.087 1.00 0.00 C ATOM 1009 CH2 TRP A 65 0.583 10.573 9.721 1.00 0.00 C ATOM 0 H TRP A 65 -2.375 8.875 4.453 1.00 0.00 H new ATOM 0 HA TRP A 65 -1.044 11.362 3.568 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -0.157 8.807 4.875 1.00 0.00 H new ATOM 0 HB3 TRP A 65 0.966 9.617 3.801 1.00 0.00 H new ATOM 0 HD1 TRP A 65 1.082 12.507 4.481 1.00 0.00 H new ATOM 0 HE1 TRP A 65 1.521 13.477 6.840 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -0.279 8.425 7.230 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 1.296 12.574 9.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 -0.139 8.551 9.684 1.00 0.00 H new ATOM 0 HH2 TRP A 65 0.631 10.603 10.800 1.00 0.00 H new ATOM 1020 N ILE A 66 -0.516 10.584 1.264 1.00 0.00 N ATOM 1021 CA ILE A 66 -0.369 10.180 -0.127 1.00 0.00 C ATOM 1022 C ILE A 66 1.078 10.264 -0.582 1.00 0.00 C ATOM 1023 O ILE A 66 1.921 10.848 0.096 1.00 0.00 O ATOM 1024 CB ILE A 66 -1.247 11.029 -1.058 1.00 0.00 C ATOM 1025 CG1 ILE A 66 -0.579 12.375 -1.344 1.00 0.00 C ATOM 1026 CG2 ILE A 66 -2.622 11.224 -0.437 1.00 0.00 C ATOM 1027 CD1 ILE A 66 -1.529 13.427 -1.859 1.00 0.00 C ATOM 0 H ILE A 66 -0.264 11.554 1.454 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.697 9.142 -0.185 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.367 10.507 -2.007 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.109 12.739 -0.430 1.00 0.00 H new ATOM 0 HG13 ILE A 66 0.216 12.228 -2.075 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.240 11.827 -1.103 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.094 10.253 -0.285 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.519 11.732 0.522 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.983 14.353 -2.039 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.980 13.085 -2.790 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.311 13.604 -1.121 1.00 0.00 H new ATOM 1039 N GLY A 67 1.354 9.664 -1.732 1.00 0.00 N ATOM 1040 CA GLY A 67 2.697 9.666 -2.273 1.00 0.00 C ATOM 1041 C GLY A 67 3.092 10.999 -2.878 1.00 0.00 C ATOM 1042 O GLY A 67 3.496 11.060 -4.037 1.00 0.00 O ATOM 0 H GLY A 67 0.666 9.173 -2.303 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.402 9.410 -1.482 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.777 8.890 -3.034 1.00 0.00 H new ATOM 1046 N LEU A 68 2.983 12.068 -2.096 1.00 0.00 N ATOM 1047 CA LEU A 68 3.342 13.396 -2.578 1.00 0.00 C ATOM 1048 C LEU A 68 4.363 14.076 -1.669 1.00 0.00 C ATOM 1049 O LEU A 68 4.156 14.209 -0.462 1.00 0.00 O ATOM 1050 CB LEU A 68 2.095 14.281 -2.693 1.00 0.00 C ATOM 1051 CG LEU A 68 2.258 15.533 -3.562 1.00 0.00 C ATOM 1052 CD1 LEU A 68 3.119 16.575 -2.864 1.00 0.00 C ATOM 1053 CD2 LEU A 68 2.855 15.170 -4.907 1.00 0.00 C ATOM 0 H LEU A 68 2.651 12.041 -1.132 1.00 0.00 H new ATOM 0 HA LEU A 68 3.794 13.267 -3.562 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.280 13.681 -3.098 1.00 0.00 H new ATOM 0 HB3 LEU A 68 1.796 14.590 -1.692 1.00 0.00 H new ATOM 0 HG LEU A 68 1.269 15.963 -3.722 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.218 17.452 -3.503 1.00 0.00 H new ATOM 0 HD12 LEU A 68 2.651 16.863 -1.923 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.106 16.158 -2.665 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.964 16.070 -5.512 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.833 14.712 -4.759 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.198 14.467 -5.419 1.00 0.00 H new ATOM 1065 N ARG A 69 5.450 14.533 -2.280 1.00 0.00 N ATOM 1066 CA ARG A 69 6.508 15.241 -1.572 1.00 0.00 C ATOM 1067 C ARG A 69 6.992 16.417 -2.420 1.00 0.00 C ATOM 1068 O ARG A 69 7.438 16.228 -3.550 1.00 0.00 O ATOM 1069 CB ARG A 69 7.667 14.290 -1.256 1.00 0.00 C ATOM 1070 CG ARG A 69 8.993 14.995 -1.012 1.00 0.00 C ATOM 1071 CD ARG A 69 9.987 14.710 -2.125 1.00 0.00 C ATOM 1072 NE ARG A 69 11.229 15.460 -1.955 1.00 0.00 N ATOM 1073 CZ ARG A 69 12.035 15.789 -2.959 1.00 0.00 C ATOM 1074 NH1 ARG A 69 11.731 15.438 -4.202 1.00 0.00 N ATOM 1075 NH2 ARG A 69 13.147 16.472 -2.723 1.00 0.00 N ATOM 0 H ARG A 69 5.622 14.423 -3.279 1.00 0.00 H new ATOM 0 HA ARG A 69 6.116 15.622 -0.629 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.412 13.702 -0.375 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.786 13.590 -2.083 1.00 0.00 H new ATOM 0 HG2 ARG A 69 8.827 16.070 -0.937 1.00 0.00 H new ATOM 0 HG3 ARG A 69 9.409 14.670 -0.059 1.00 0.00 H new ATOM 0 HD2 ARG A 69 10.208 13.643 -2.149 1.00 0.00 H new ATOM 0 HD3 ARG A 69 9.539 14.964 -3.085 1.00 0.00 H new ATOM 0 HE ARG A 69 11.492 15.747 -1.012 1.00 0.00 H new ATOM 0 HH11 ARG A 69 10.876 14.914 -4.389 1.00 0.00 H new ATOM 0 HH12 ARG A 69 12.352 15.692 -4.970 1.00 0.00 H new ATOM 0 HH21 ARG A 69 13.385 16.746 -1.770 1.00 0.00 H new ATOM 0 HH22 ARG A 69 13.764 16.724 -3.495 1.00 0.00 H new ATOM 1089 N ASN A 70 6.902 17.630 -1.883 1.00 0.00 N ATOM 1090 CA ASN A 70 7.333 18.812 -2.622 1.00 0.00 C ATOM 1091 C ASN A 70 8.785 19.155 -2.311 1.00 0.00 C ATOM 1092 O ASN A 70 9.299 18.824 -1.242 1.00 0.00 O ATOM 1093 CB ASN A 70 6.420 20.003 -2.310 1.00 0.00 C ATOM 1094 CG ASN A 70 7.176 21.193 -1.749 1.00 0.00 C ATOM 1095 OD1 ASN A 70 7.616 21.180 -0.600 1.00 0.00 O ATOM 1096 ND2 ASN A 70 7.330 22.231 -2.563 1.00 0.00 N ATOM 0 H ASN A 70 6.539 17.820 -0.949 1.00 0.00 H new ATOM 0 HA ASN A 70 7.261 18.588 -3.686 1.00 0.00 H new ATOM 0 HB2 ASN A 70 5.900 20.305 -3.220 1.00 0.00 H new ATOM 0 HB3 ASN A 70 5.658 19.693 -1.595 1.00 0.00 H new ATOM 0 HD21 ASN A 70 7.830 23.060 -2.243 1.00 0.00 H new ATOM 0 HD22 ASN A 70 6.949 22.199 -3.508 1.00 0.00 H new ATOM 1103 N LEU A 71 9.442 19.819 -3.258 1.00 0.00 N ATOM 1104 CA LEU A 71 10.839 20.208 -3.097 1.00 0.00 C ATOM 1105 C LEU A 71 11.041 21.016 -1.817 1.00 0.00 C ATOM 1106 O LEU A 71 11.499 20.487 -0.805 1.00 0.00 O ATOM 1107 CB LEU A 71 11.305 21.021 -4.307 1.00 0.00 C ATOM 1108 CG LEU A 71 12.328 20.318 -5.201 1.00 0.00 C ATOM 1109 CD1 LEU A 71 12.286 20.889 -6.610 1.00 0.00 C ATOM 1110 CD2 LEU A 71 13.725 20.445 -4.615 1.00 0.00 C ATOM 0 H LEU A 71 9.028 20.099 -4.147 1.00 0.00 H new ATOM 0 HA LEU A 71 11.436 19.299 -3.025 1.00 0.00 H new ATOM 0 HB2 LEU A 71 10.434 21.279 -4.910 1.00 0.00 H new ATOM 0 HB3 LEU A 71 11.737 21.957 -3.953 1.00 0.00 H new ATOM 0 HG LEU A 71 12.072 19.260 -5.251 1.00 0.00 H new ATOM 0 HD11 LEU A 71 13.020 20.377 -7.232 1.00 0.00 H new ATOM 0 HD12 LEU A 71 11.291 20.746 -7.031 1.00 0.00 H new ATOM 0 HD13 LEU A 71 12.517 21.954 -6.578 1.00 0.00 H new ATOM 0 HD21 LEU A 71 14.439 19.939 -5.264 1.00 0.00 H new ATOM 0 HD22 LEU A 71 13.991 21.499 -4.534 1.00 0.00 H new ATOM 0 HD23 LEU A 71 13.747 19.988 -3.626 1.00 0.00 H new ATOM 1122 N ASP A 72 10.701 22.300 -1.872 1.00 0.00 N ATOM 1123 CA ASP A 72 10.849 23.180 -0.717 1.00 0.00 C ATOM 1124 C ASP A 72 9.524 23.336 0.024 1.00 0.00 C ATOM 1125 O ASP A 72 9.354 22.811 1.125 1.00 0.00 O ATOM 1126 CB ASP A 72 11.362 24.552 -1.159 1.00 0.00 C ATOM 1127 CG ASP A 72 12.491 24.450 -2.167 1.00 0.00 C ATOM 1128 OD1 ASP A 72 13.486 23.753 -1.875 1.00 0.00 O ATOM 1129 OD2 ASP A 72 12.380 25.066 -3.247 1.00 0.00 O ATOM 0 H ASP A 72 10.322 22.754 -2.703 1.00 0.00 H new ATOM 0 HA ASP A 72 11.573 22.728 -0.039 1.00 0.00 H new ATOM 0 HB2 ASP A 72 10.540 25.121 -1.594 1.00 0.00 H new ATOM 0 HB3 ASP A 72 11.707 25.106 -0.286 1.00 0.00 H new ATOM 1134 N LEU A 73 8.593 24.061 -0.586 1.00 0.00 N ATOM 1135 CA LEU A 73 7.284 24.288 0.017 1.00 0.00 C ATOM 1136 C LEU A 73 6.249 24.643 -1.047 1.00 0.00 C ATOM 1137 O LEU A 73 5.294 23.899 -1.272 1.00 0.00 O ATOM 1138 CB LEU A 73 7.366 25.406 1.059 1.00 0.00 C ATOM 1139 CG LEU A 73 8.383 26.506 0.751 1.00 0.00 C ATOM 1140 CD1 LEU A 73 7.752 27.880 0.915 1.00 0.00 C ATOM 1141 CD2 LEU A 73 9.604 26.368 1.648 1.00 0.00 C ATOM 0 H LEU A 73 8.720 24.502 -1.497 1.00 0.00 H new ATOM 0 HA LEU A 73 6.973 23.366 0.508 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.381 25.861 1.159 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.613 24.964 2.025 1.00 0.00 H new ATOM 0 HG LEU A 73 8.703 26.398 -0.285 1.00 0.00 H new ATOM 0 HD11 LEU A 73 8.491 28.649 0.691 1.00 0.00 H new ATOM 0 HD12 LEU A 73 6.909 27.977 0.231 1.00 0.00 H new ATOM 0 HD13 LEU A 73 7.403 28.000 1.940 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.317 27.159 1.416 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.300 26.449 2.692 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.071 25.397 1.480 1.00 0.00 H new ATOM 1153 N LYS A 74 6.447 25.784 -1.700 1.00 0.00 N ATOM 1154 CA LYS A 74 5.532 26.242 -2.739 1.00 0.00 C ATOM 1155 C LYS A 74 6.083 25.940 -4.129 1.00 0.00 C ATOM 1156 O LYS A 74 5.525 26.377 -5.136 1.00 0.00 O ATOM 1157 CB LYS A 74 5.275 27.744 -2.595 1.00 0.00 C ATOM 1158 CG LYS A 74 6.544 28.566 -2.446 1.00 0.00 C ATOM 1159 CD LYS A 74 6.264 29.908 -1.788 1.00 0.00 C ATOM 1160 CE LYS A 74 7.230 30.977 -2.272 1.00 0.00 C ATOM 1161 NZ LYS A 74 8.450 31.050 -1.420 1.00 0.00 N ATOM 0 H LYS A 74 7.234 26.409 -1.527 1.00 0.00 H new ATOM 0 HA LYS A 74 4.591 25.704 -2.619 1.00 0.00 H new ATOM 0 HB2 LYS A 74 4.725 28.095 -3.468 1.00 0.00 H new ATOM 0 HB3 LYS A 74 4.638 27.914 -1.727 1.00 0.00 H new ATOM 0 HG2 LYS A 74 7.270 28.012 -1.851 1.00 0.00 H new ATOM 0 HG3 LYS A 74 6.992 28.727 -3.427 1.00 0.00 H new ATOM 0 HD2 LYS A 74 5.241 30.215 -2.006 1.00 0.00 H new ATOM 0 HD3 LYS A 74 6.343 29.807 -0.706 1.00 0.00 H new ATOM 0 HE2 LYS A 74 7.518 30.766 -3.302 1.00 0.00 H new ATOM 0 HE3 LYS A 74 6.729 31.945 -2.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 9.083 31.791 -1.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 8.178 31.276 -0.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 8.942 30.134 -1.439 1.00 0.00 H new ATOM 1174 N GLY A 75 7.182 25.193 -4.177 1.00 0.00 N ATOM 1175 CA GLY A 75 7.792 24.847 -5.450 1.00 0.00 C ATOM 1176 C GLY A 75 6.958 23.863 -6.247 1.00 0.00 C ATOM 1177 O GLY A 75 5.764 24.077 -6.457 1.00 0.00 O ATOM 0 H GLY A 75 7.662 24.821 -3.357 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.938 25.754 -6.037 1.00 0.00 H new ATOM 0 HA3 GLY A 75 8.779 24.420 -5.272 1.00 0.00 H new ATOM 1181 N GLU A 76 7.589 22.781 -6.692 1.00 0.00 N ATOM 1182 CA GLU A 76 6.902 21.759 -7.470 1.00 0.00 C ATOM 1183 C GLU A 76 6.690 20.500 -6.640 1.00 0.00 C ATOM 1184 O GLU A 76 7.603 20.032 -5.958 1.00 0.00 O ATOM 1185 CB GLU A 76 7.699 21.423 -8.733 1.00 0.00 C ATOM 1186 CG GLU A 76 8.354 22.633 -9.379 1.00 0.00 C ATOM 1187 CD GLU A 76 9.205 22.263 -10.580 1.00 0.00 C ATOM 1188 OE1 GLU A 76 8.637 21.781 -11.583 1.00 0.00 O ATOM 1189 OE2 GLU A 76 10.437 22.456 -10.517 1.00 0.00 O ATOM 0 H GLU A 76 8.577 22.590 -6.526 1.00 0.00 H new ATOM 0 HA GLU A 76 5.928 22.153 -7.760 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.469 20.693 -8.483 1.00 0.00 H new ATOM 0 HB3 GLU A 76 7.035 20.950 -9.457 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.582 23.338 -9.688 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.974 23.143 -8.642 1.00 0.00 H new ATOM 1196 N PHE A 77 5.478 19.958 -6.697 1.00 0.00 N ATOM 1197 CA PHE A 77 5.142 18.756 -5.946 1.00 0.00 C ATOM 1198 C PHE A 77 5.495 17.508 -6.747 1.00 0.00 C ATOM 1199 O PHE A 77 4.996 17.303 -7.853 1.00 0.00 O ATOM 1200 CB PHE A 77 3.649 18.738 -5.588 1.00 0.00 C ATOM 1201 CG PHE A 77 3.129 20.001 -4.943 1.00 0.00 C ATOM 1202 CD1 PHE A 77 3.960 21.089 -4.704 1.00 0.00 C ATOM 1203 CD2 PHE A 77 1.793 20.099 -4.584 1.00 0.00 C ATOM 1204 CE1 PHE A 77 3.470 22.242 -4.125 1.00 0.00 C ATOM 1205 CE2 PHE A 77 1.300 21.251 -4.002 1.00 0.00 C ATOM 1206 CZ PHE A 77 2.139 22.324 -3.773 1.00 0.00 C ATOM 0 H PHE A 77 4.712 20.333 -7.256 1.00 0.00 H new ATOM 0 HA PHE A 77 5.724 18.762 -5.024 1.00 0.00 H new ATOM 0 HB2 PHE A 77 3.076 18.550 -6.496 1.00 0.00 H new ATOM 0 HB3 PHE A 77 3.463 17.901 -4.914 1.00 0.00 H new ATOM 0 HD1 PHE A 77 5.004 21.031 -4.975 1.00 0.00 H new ATOM 0 HD2 PHE A 77 1.130 19.265 -4.761 1.00 0.00 H new ATOM 0 HE1 PHE A 77 4.128 23.080 -3.948 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.258 21.313 -3.726 1.00 0.00 H new ATOM 0 HZ PHE A 77 1.754 23.225 -3.319 1.00 0.00 H new ATOM 1216 N ILE A 78 6.360 16.680 -6.177 1.00 0.00 N ATOM 1217 CA ILE A 78 6.790 15.449 -6.823 1.00 0.00 C ATOM 1218 C ILE A 78 6.362 14.240 -6.001 1.00 0.00 C ATOM 1219 O ILE A 78 6.414 14.266 -4.777 1.00 0.00 O ATOM 1220 CB ILE A 78 8.322 15.431 -7.023 1.00 0.00 C ATOM 1221 CG1 ILE A 78 8.656 15.675 -8.505 1.00 0.00 C ATOM 1222 CG2 ILE A 78 8.926 14.127 -6.510 1.00 0.00 C ATOM 1223 CD1 ILE A 78 9.427 14.553 -9.175 1.00 0.00 C ATOM 0 H ILE A 78 6.780 16.841 -5.262 1.00 0.00 H new ATOM 0 HA ILE A 78 6.314 15.402 -7.802 1.00 0.00 H new ATOM 0 HB ILE A 78 8.767 16.236 -6.438 1.00 0.00 H new ATOM 0 HG12 ILE A 78 7.726 15.835 -9.051 1.00 0.00 H new ATOM 0 HG13 ILE A 78 9.236 16.595 -8.586 1.00 0.00 H new ATOM 0 HG21 ILE A 78 10.005 14.141 -6.663 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.712 14.020 -5.447 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.493 13.287 -7.053 1.00 0.00 H new ATOM 0 HD11 ILE A 78 9.617 14.813 -10.216 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.376 14.405 -8.659 1.00 0.00 H new ATOM 0 HD13 ILE A 78 8.843 13.634 -9.132 1.00 0.00 H new ATOM 1235 N TRP A 79 5.941 13.182 -6.677 1.00 0.00 N ATOM 1236 CA TRP A 79 5.505 11.975 -5.991 1.00 0.00 C ATOM 1237 C TRP A 79 6.700 11.211 -5.438 1.00 0.00 C ATOM 1238 O TRP A 79 7.803 11.293 -5.976 1.00 0.00 O ATOM 1239 CB TRP A 79 4.718 11.061 -6.939 1.00 0.00 C ATOM 1240 CG TRP A 79 3.428 11.646 -7.436 1.00 0.00 C ATOM 1241 CD1 TRP A 79 2.961 12.911 -7.231 1.00 0.00 C ATOM 1242 CD2 TRP A 79 2.440 10.978 -8.230 1.00 0.00 C ATOM 1243 NE1 TRP A 79 1.743 13.071 -7.846 1.00 0.00 N ATOM 1244 CE2 TRP A 79 1.403 11.898 -8.466 1.00 0.00 C ATOM 1245 CE3 TRP A 79 2.335 9.692 -8.764 1.00 0.00 C ATOM 1246 CZ2 TRP A 79 0.273 11.571 -9.214 1.00 0.00 C ATOM 1247 CZ3 TRP A 79 1.214 9.368 -9.506 1.00 0.00 C ATOM 1248 CH2 TRP A 79 0.197 10.304 -9.724 1.00 0.00 C ATOM 0 H TRP A 79 5.892 13.134 -7.695 1.00 0.00 H new ATOM 0 HA TRP A 79 4.858 12.279 -5.168 1.00 0.00 H new ATOM 0 HB2 TRP A 79 5.347 10.819 -7.796 1.00 0.00 H new ATOM 0 HB3 TRP A 79 4.504 10.124 -6.426 1.00 0.00 H new ATOM 0 HD1 TRP A 79 3.474 13.676 -6.667 1.00 0.00 H new ATOM 0 HE1 TRP A 79 1.183 13.924 -7.842 1.00 0.00 H new ATOM 0 HE3 TRP A 79 3.115 8.963 -8.600 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -0.513 12.291 -9.385 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 1.122 8.376 -9.924 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -0.666 10.020 -10.307 1.00 0.00 H new ATOM 1259 N VAL A 80 6.470 10.466 -4.363 1.00 0.00 N ATOM 1260 CA VAL A 80 7.525 9.676 -3.736 1.00 0.00 C ATOM 1261 C VAL A 80 8.105 8.674 -4.733 1.00 0.00 C ATOM 1262 O VAL A 80 9.253 8.245 -4.606 1.00 0.00 O ATOM 1263 CB VAL A 80 6.980 8.915 -2.509 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.597 8.372 -2.808 1.00 0.00 C ATOM 1265 CG2 VAL A 80 7.924 7.798 -2.087 1.00 0.00 C ATOM 0 H VAL A 80 5.561 10.392 -3.906 1.00 0.00 H new ATOM 0 HA VAL A 80 8.309 10.360 -3.413 1.00 0.00 H new ATOM 0 HB VAL A 80 6.909 9.613 -1.675 1.00 0.00 H new ATOM 0 HG11 VAL A 80 5.220 7.836 -1.937 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.926 9.197 -3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.649 7.691 -3.658 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.512 7.281 -1.220 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.042 7.091 -2.909 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.895 8.220 -1.829 1.00 0.00 H new ATOM 1275 N ASP A 81 7.299 8.311 -5.726 1.00 0.00 N ATOM 1276 CA ASP A 81 7.722 7.364 -6.750 1.00 0.00 C ATOM 1277 C ASP A 81 8.632 8.040 -7.768 1.00 0.00 C ATOM 1278 O ASP A 81 9.142 7.397 -8.687 1.00 0.00 O ATOM 1279 CB ASP A 81 6.503 6.764 -7.454 1.00 0.00 C ATOM 1280 CG ASP A 81 6.844 5.505 -8.227 1.00 0.00 C ATOM 1281 OD1 ASP A 81 7.530 4.627 -7.661 1.00 0.00 O ATOM 1282 OD2 ASP A 81 6.425 5.396 -9.399 1.00 0.00 O ATOM 0 H ASP A 81 6.348 8.660 -5.843 1.00 0.00 H new ATOM 0 HA ASP A 81 8.281 6.564 -6.264 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.735 6.536 -6.715 1.00 0.00 H new ATOM 0 HB3 ASP A 81 6.080 7.502 -8.135 1.00 0.00 H new ATOM 1287 N GLY A 82 8.834 9.340 -7.593 1.00 0.00 N ATOM 1288 CA GLY A 82 9.683 10.090 -8.493 1.00 0.00 C ATOM 1289 C GLY A 82 8.951 10.566 -9.732 1.00 0.00 C ATOM 1290 O GLY A 82 9.542 10.668 -10.808 1.00 0.00 O ATOM 0 H GLY A 82 8.422 9.889 -6.839 1.00 0.00 H new ATOM 0 HA2 GLY A 82 10.093 10.951 -7.965 1.00 0.00 H new ATOM 0 HA3 GLY A 82 10.527 9.468 -8.792 1.00 0.00 H new ATOM 1294 N SER A 83 7.662 10.858 -9.586 1.00 0.00 N ATOM 1295 CA SER A 83 6.857 11.327 -10.709 1.00 0.00 C ATOM 1296 C SER A 83 6.069 12.579 -10.338 1.00 0.00 C ATOM 1297 O SER A 83 5.295 12.575 -9.385 1.00 0.00 O ATOM 1298 CB SER A 83 5.899 10.226 -11.171 1.00 0.00 C ATOM 1299 OG SER A 83 5.479 10.442 -12.507 1.00 0.00 O ATOM 0 H SER A 83 7.154 10.779 -8.705 1.00 0.00 H new ATOM 0 HA SER A 83 7.535 11.579 -11.525 1.00 0.00 H new ATOM 0 HB2 SER A 83 6.390 9.256 -11.093 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.030 10.197 -10.514 1.00 0.00 H new ATOM 0 HG SER A 83 4.869 9.724 -12.778 1.00 0.00 H new ATOM 1305 N HIS A 84 6.267 13.651 -11.099 1.00 0.00 N ATOM 1306 CA HIS A 84 5.572 14.907 -10.847 1.00 0.00 C ATOM 1307 C HIS A 84 4.059 14.708 -10.874 1.00 0.00 C ATOM 1308 O HIS A 84 3.548 13.862 -11.608 1.00 0.00 O ATOM 1309 CB HIS A 84 5.979 15.958 -11.881 1.00 0.00 C ATOM 1310 CG HIS A 84 5.754 15.524 -13.296 1.00 0.00 C ATOM 1311 ND1 HIS A 84 4.642 15.883 -14.028 1.00 0.00 N ATOM 1312 CD2 HIS A 84 6.509 14.754 -14.118 1.00 0.00 C ATOM 1313 CE1 HIS A 84 4.720 15.353 -15.236 1.00 0.00 C ATOM 1314 NE2 HIS A 84 5.843 14.664 -15.316 1.00 0.00 N ATOM 0 H HIS A 84 6.904 13.674 -11.896 1.00 0.00 H new ATOM 0 HA HIS A 84 5.856 15.256 -9.854 1.00 0.00 H new ATOM 0 HB2 HIS A 84 5.417 16.874 -11.697 1.00 0.00 H new ATOM 0 HB3 HIS A 84 7.034 16.199 -11.747 1.00 0.00 H new ATOM 0 HD2 HIS A 84 7.457 14.297 -13.876 1.00 0.00 H new ATOM 0 HE1 HIS A 84 3.989 15.465 -16.024 1.00 0.00 H new ATOM 0 HE2 HIS A 84 6.164 14.148 -16.135 1.00 0.00 H new ATOM 1323 N VAL A 85 3.352 15.494 -10.067 1.00 0.00 N ATOM 1324 CA VAL A 85 1.897 15.411 -9.992 1.00 0.00 C ATOM 1325 C VAL A 85 1.265 15.533 -11.376 1.00 0.00 C ATOM 1326 O VAL A 85 1.853 16.115 -12.287 1.00 0.00 O ATOM 1327 CB VAL A 85 1.318 16.508 -9.076 1.00 0.00 C ATOM 1328 CG1 VAL A 85 -0.171 16.302 -8.867 1.00 0.00 C ATOM 1329 CG2 VAL A 85 2.045 16.533 -7.741 1.00 0.00 C ATOM 0 H VAL A 85 3.765 16.197 -9.454 1.00 0.00 H new ATOM 0 HA VAL A 85 1.658 14.434 -9.573 1.00 0.00 H new ATOM 0 HB VAL A 85 1.466 17.471 -9.565 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.559 17.087 -8.218 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.682 16.341 -9.829 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.342 15.330 -8.404 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.621 17.314 -7.110 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.933 15.567 -7.248 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.103 16.735 -7.907 1.00 0.00 H new ATOM 1339 N ASP A 86 0.065 14.977 -11.527 1.00 0.00 N ATOM 1340 CA ASP A 86 -0.641 15.022 -12.802 1.00 0.00 C ATOM 1341 C ASP A 86 -2.023 15.654 -12.648 1.00 0.00 C ATOM 1342 O ASP A 86 -2.490 16.366 -13.538 1.00 0.00 O ATOM 1343 CB ASP A 86 -0.777 13.613 -13.382 1.00 0.00 C ATOM 1344 CG ASP A 86 0.550 13.054 -13.857 1.00 0.00 C ATOM 1345 OD1 ASP A 86 1.202 13.708 -14.699 1.00 0.00 O ATOM 1346 OD2 ASP A 86 0.937 11.963 -13.389 1.00 0.00 O ATOM 0 H ASP A 86 -0.437 14.492 -10.783 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.057 15.639 -13.485 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -1.198 12.950 -12.626 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.480 13.632 -14.215 1.00 0.00 H new ATOM 1351 N TYR A 87 -2.676 15.388 -11.520 1.00 0.00 N ATOM 1352 CA TYR A 87 -4.006 15.933 -11.264 1.00 0.00 C ATOM 1353 C TYR A 87 -3.994 16.902 -10.087 1.00 0.00 C ATOM 1354 O TYR A 87 -4.526 18.008 -10.179 1.00 0.00 O ATOM 1355 CB TYR A 87 -5.004 14.801 -11.000 1.00 0.00 C ATOM 1356 CG TYR A 87 -5.402 14.042 -12.246 1.00 0.00 C ATOM 1357 CD1 TYR A 87 -4.610 13.011 -12.736 1.00 0.00 C ATOM 1358 CD2 TYR A 87 -6.568 14.358 -12.930 1.00 0.00 C ATOM 1359 CE1 TYR A 87 -4.971 12.315 -13.873 1.00 0.00 C ATOM 1360 CE2 TYR A 87 -6.935 13.666 -14.069 1.00 0.00 C ATOM 1361 CZ TYR A 87 -6.134 12.645 -14.537 1.00 0.00 C ATOM 1362 OH TYR A 87 -6.497 11.955 -15.670 1.00 0.00 O ATOM 0 H TYR A 87 -2.308 14.801 -10.772 1.00 0.00 H new ATOM 0 HA TYR A 87 -4.315 16.484 -12.152 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.569 14.104 -10.284 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -5.899 15.217 -10.537 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.698 12.750 -12.220 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -7.198 15.157 -12.567 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -4.345 11.515 -14.241 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -7.845 13.924 -14.590 1.00 0.00 H new ATOM 0 HH TYR A 87 -7.342 12.312 -16.014 1.00 0.00 H new ATOM 1372 N SER A 88 -3.387 16.473 -8.984 1.00 0.00 N ATOM 1373 CA SER A 88 -3.300 17.291 -7.771 1.00 0.00 C ATOM 1374 C SER A 88 -4.691 17.596 -7.220 1.00 0.00 C ATOM 1375 O SER A 88 -5.653 17.726 -7.976 1.00 0.00 O ATOM 1376 CB SER A 88 -2.545 18.594 -8.043 1.00 0.00 C ATOM 1377 OG SER A 88 -2.060 18.646 -9.375 1.00 0.00 O ATOM 0 H SER A 88 -2.944 15.558 -8.902 1.00 0.00 H new ATOM 0 HA SER A 88 -2.748 16.720 -7.025 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.205 19.443 -7.862 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.711 18.684 -7.347 1.00 0.00 H new ATOM 0 HG SER A 88 -1.584 19.491 -9.517 1.00 0.00 H new ATOM 1383 N ASN A 89 -4.798 17.696 -5.897 1.00 0.00 N ATOM 1384 CA ASN A 89 -6.084 17.968 -5.266 1.00 0.00 C ATOM 1385 C ASN A 89 -5.987 19.036 -4.173 1.00 0.00 C ATOM 1386 O ASN A 89 -7.015 19.469 -3.655 1.00 0.00 O ATOM 1387 CB ASN A 89 -6.653 16.676 -4.678 1.00 0.00 C ATOM 1388 CG ASN A 89 -7.133 15.706 -5.737 1.00 0.00 C ATOM 1389 OD1 ASN A 89 -7.343 16.077 -6.891 1.00 0.00 O ATOM 1390 ND2 ASN A 89 -7.313 14.452 -5.343 1.00 0.00 N ATOM 0 H ASN A 89 -4.018 17.594 -5.248 1.00 0.00 H new ATOM 0 HA ASN A 89 -6.749 18.355 -6.038 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -5.889 16.192 -4.070 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.482 16.920 -4.014 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.638 13.750 -6.008 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.126 14.190 -4.375 1.00 0.00 H new ATOM 1397 N TRP A 90 -4.765 19.456 -3.813 1.00 0.00 N ATOM 1398 CA TRP A 90 -4.585 20.468 -2.773 1.00 0.00 C ATOM 1399 C TRP A 90 -5.545 21.638 -2.965 1.00 0.00 C ATOM 1400 O TRP A 90 -5.244 22.596 -3.675 1.00 0.00 O ATOM 1401 CB TRP A 90 -3.145 20.984 -2.746 1.00 0.00 C ATOM 1402 CG TRP A 90 -2.397 20.798 -4.031 1.00 0.00 C ATOM 1403 CD1 TRP A 90 -1.687 19.696 -4.412 1.00 0.00 C ATOM 1404 CD2 TRP A 90 -2.271 21.747 -5.098 1.00 0.00 C ATOM 1405 NE1 TRP A 90 -1.129 19.901 -5.650 1.00 0.00 N ATOM 1406 CE2 TRP A 90 -1.475 21.152 -6.093 1.00 0.00 C ATOM 1407 CE3 TRP A 90 -2.757 23.041 -5.309 1.00 0.00 C ATOM 1408 CZ2 TRP A 90 -1.153 21.805 -7.280 1.00 0.00 C ATOM 1409 CZ3 TRP A 90 -2.437 23.688 -6.486 1.00 0.00 C ATOM 1410 CH2 TRP A 90 -1.641 23.070 -7.459 1.00 0.00 C ATOM 0 H TRP A 90 -3.897 19.112 -4.225 1.00 0.00 H new ATOM 0 HA TRP A 90 -4.805 19.988 -1.819 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -3.157 22.045 -2.497 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -2.604 20.475 -1.948 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -1.580 18.795 -3.826 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -0.551 19.231 -6.158 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.372 23.526 -4.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -0.540 21.330 -8.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -2.807 24.688 -6.659 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -1.408 23.603 -8.369 1.00 0.00 H new ATOM 1421 N ALA A 91 -6.702 21.542 -2.318 1.00 0.00 N ATOM 1422 CA ALA A 91 -7.733 22.574 -2.393 1.00 0.00 C ATOM 1423 C ALA A 91 -8.231 22.769 -3.826 1.00 0.00 C ATOM 1424 O ALA A 91 -7.442 22.828 -4.768 1.00 0.00 O ATOM 1425 CB ALA A 91 -7.213 23.886 -1.827 1.00 0.00 C ATOM 0 H ALA A 91 -6.952 20.749 -1.728 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.579 22.242 -1.792 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -7.993 24.644 -1.890 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.928 23.745 -0.784 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -6.344 24.211 -2.400 1.00 0.00 H new ATOM 1431 N PRO A 92 -9.560 22.873 -4.010 1.00 0.00 N ATOM 1432 CA PRO A 92 -10.162 23.064 -5.335 1.00 0.00 C ATOM 1433 C PRO A 92 -9.609 24.292 -6.050 1.00 0.00 C ATOM 1434 O PRO A 92 -9.282 24.236 -7.236 1.00 0.00 O ATOM 1435 CB PRO A 92 -11.653 23.249 -5.032 1.00 0.00 C ATOM 1436 CG PRO A 92 -11.857 22.605 -3.705 1.00 0.00 C ATOM 1437 CD PRO A 92 -10.579 22.814 -2.945 1.00 0.00 C ATOM 0 HA PRO A 92 -9.951 22.226 -6.000 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -11.923 24.305 -5.004 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -12.273 22.782 -5.797 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.701 23.052 -3.180 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -12.076 21.543 -3.816 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.604 23.733 -2.360 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.387 21.998 -2.248 1.00 0.00 H new ATOM 1445 N GLY A 93 -9.507 25.399 -5.321 1.00 0.00 N ATOM 1446 CA GLY A 93 -8.992 26.625 -5.902 1.00 0.00 C ATOM 1447 C GLY A 93 -8.814 27.724 -4.873 1.00 0.00 C ATOM 1448 O GLY A 93 -8.879 28.909 -5.202 1.00 0.00 O ATOM 0 H GLY A 93 -9.772 25.469 -4.338 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -8.034 26.422 -6.382 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -9.672 26.968 -6.681 1.00 0.00 H new ATOM 1452 N GLU A 94 -8.589 27.331 -3.623 1.00 0.00 N ATOM 1453 CA GLU A 94 -8.401 28.290 -2.541 1.00 0.00 C ATOM 1454 C GLU A 94 -6.937 28.343 -2.107 1.00 0.00 C ATOM 1455 O GLU A 94 -6.462 27.459 -1.395 1.00 0.00 O ATOM 1456 CB GLU A 94 -9.285 27.923 -1.347 1.00 0.00 C ATOM 1457 CG GLU A 94 -10.328 28.979 -1.015 1.00 0.00 C ATOM 1458 CD GLU A 94 -10.559 29.120 0.476 1.00 0.00 C ATOM 1459 OE1 GLU A 94 -11.281 28.274 1.046 1.00 0.00 O ATOM 1460 OE2 GLU A 94 -10.021 30.074 1.074 1.00 0.00 O ATOM 0 H GLU A 94 -8.532 26.354 -3.335 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.688 29.275 -2.909 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.789 26.979 -1.555 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -8.653 27.761 -0.474 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.010 29.939 -1.422 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.268 28.721 -1.502 1.00 0.00 H new ATOM 1467 N PRO A 95 -6.200 29.384 -2.536 1.00 0.00 N ATOM 1468 CA PRO A 95 -4.784 29.544 -2.186 1.00 0.00 C ATOM 1469 C PRO A 95 -4.586 29.919 -0.722 1.00 0.00 C ATOM 1470 O PRO A 95 -3.456 29.992 -0.238 1.00 0.00 O ATOM 1471 CB PRO A 95 -4.322 30.682 -3.098 1.00 0.00 C ATOM 1472 CG PRO A 95 -5.554 31.475 -3.366 1.00 0.00 C ATOM 1473 CD PRO A 95 -6.687 30.484 -3.390 1.00 0.00 C ATOM 0 HA PRO A 95 -4.224 28.618 -2.318 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -3.557 31.290 -2.616 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -3.889 30.298 -4.022 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -5.710 32.227 -2.593 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -5.478 32.005 -4.316 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -7.608 30.918 -3.000 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -6.900 30.142 -4.403 1.00 0.00 H new ATOM 1481 N THR A 96 -5.693 30.157 -0.023 1.00 0.00 N ATOM 1482 CA THR A 96 -5.652 30.528 1.390 1.00 0.00 C ATOM 1483 C THR A 96 -4.736 31.727 1.617 1.00 0.00 C ATOM 1484 O THR A 96 -4.382 32.438 0.675 1.00 0.00 O ATOM 1485 CB THR A 96 -5.185 29.343 2.241 1.00 0.00 C ATOM 1486 OG1 THR A 96 -3.771 29.252 2.245 1.00 0.00 O ATOM 1487 CG2 THR A 96 -5.731 28.012 1.768 1.00 0.00 C ATOM 0 H THR A 96 -6.633 30.099 -0.414 1.00 0.00 H new ATOM 0 HA THR A 96 -6.662 30.806 1.692 1.00 0.00 H new ATOM 0 HB THR A 96 -5.570 29.539 3.242 1.00 0.00 H new ATOM 0 HG1 THR A 96 -3.419 29.590 1.395 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.361 27.216 2.415 1.00 0.00 H new ATOM 0 HG22 THR A 96 -6.820 28.032 1.804 1.00 0.00 H new ATOM 0 HG23 THR A 96 -5.405 27.828 0.744 1.00 0.00 H new ATOM 1495 N SER A 97 -4.355 31.948 2.871 1.00 0.00 N ATOM 1496 CA SER A 97 -3.481 33.062 3.221 1.00 0.00 C ATOM 1497 C SER A 97 -2.540 32.679 4.358 1.00 0.00 C ATOM 1498 O SER A 97 -1.570 33.384 4.638 1.00 0.00 O ATOM 1499 CB SER A 97 -4.312 34.284 3.620 1.00 0.00 C ATOM 1500 OG SER A 97 -5.326 33.931 4.545 1.00 0.00 O ATOM 0 H SER A 97 -4.638 31.370 3.662 1.00 0.00 H new ATOM 0 HA SER A 97 -2.881 33.310 2.345 1.00 0.00 H new ATOM 0 HB2 SER A 97 -3.663 35.042 4.059 1.00 0.00 H new ATOM 0 HB3 SER A 97 -4.763 34.726 2.732 1.00 0.00 H new ATOM 0 HG SER A 97 -5.842 34.729 4.785 1.00 0.00 H new ATOM 1506 N ARG A 98 -2.833 31.559 5.011 1.00 0.00 N ATOM 1507 CA ARG A 98 -2.014 31.080 6.118 1.00 0.00 C ATOM 1508 C ARG A 98 -0.830 30.267 5.606 1.00 0.00 C ATOM 1509 O ARG A 98 -0.806 29.042 5.727 1.00 0.00 O ATOM 1510 CB ARG A 98 -2.856 30.235 7.076 1.00 0.00 C ATOM 1511 CG ARG A 98 -4.066 30.968 7.631 1.00 0.00 C ATOM 1512 CD ARG A 98 -4.428 30.470 9.021 1.00 0.00 C ATOM 1513 NE ARG A 98 -4.331 31.527 10.023 1.00 0.00 N ATOM 1514 CZ ARG A 98 -4.461 31.319 11.330 1.00 0.00 C ATOM 1515 NH1 ARG A 98 -4.694 30.097 11.792 1.00 0.00 N ATOM 1516 NH2 ARG A 98 -4.358 32.334 12.178 1.00 0.00 N ATOM 0 H ARG A 98 -3.633 30.965 4.792 1.00 0.00 H new ATOM 0 HA ARG A 98 -1.630 31.947 6.655 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -3.192 29.338 6.556 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -2.229 29.907 7.905 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -3.859 32.038 7.669 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -4.915 30.831 6.961 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -5.443 30.072 9.011 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -3.766 29.648 9.295 1.00 0.00 H new ATOM 0 HE ARG A 98 -4.153 32.479 9.703 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -4.774 29.313 11.144 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -4.793 29.941 12.795 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -4.179 33.275 11.828 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -4.458 32.173 13.180 1.00 0.00 H new ATOM 1530 N SER A 99 0.151 30.956 5.033 1.00 0.00 N ATOM 1531 CA SER A 99 1.340 30.299 4.502 1.00 0.00 C ATOM 1532 C SER A 99 2.383 30.097 5.597 1.00 0.00 C ATOM 1533 O SER A 99 2.823 31.054 6.233 1.00 0.00 O ATOM 1534 CB SER A 99 1.936 31.121 3.359 1.00 0.00 C ATOM 1535 OG SER A 99 1.569 32.485 3.466 1.00 0.00 O ATOM 0 H SER A 99 0.146 31.970 4.924 1.00 0.00 H new ATOM 0 HA SER A 99 1.045 29.322 4.120 1.00 0.00 H new ATOM 0 HB2 SER A 99 3.022 31.032 3.371 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.594 30.723 2.404 1.00 0.00 H new ATOM 0 HG SER A 99 1.964 32.989 2.724 1.00 0.00 H new ATOM 1541 N GLN A 100 2.775 28.844 5.810 1.00 0.00 N ATOM 1542 CA GLN A 100 3.767 28.516 6.826 1.00 0.00 C ATOM 1543 C GLN A 100 4.722 27.438 6.326 1.00 0.00 C ATOM 1544 O GLN A 100 5.839 27.302 6.827 1.00 0.00 O ATOM 1545 CB GLN A 100 3.076 28.047 8.109 1.00 0.00 C ATOM 1546 CG GLN A 100 3.947 28.166 9.348 1.00 0.00 C ATOM 1547 CD GLN A 100 3.176 28.657 10.558 1.00 0.00 C ATOM 1548 OE1 GLN A 100 2.398 27.914 11.156 1.00 0.00 O ATOM 1549 NE2 GLN A 100 3.387 29.916 10.924 1.00 0.00 N ATOM 0 H GLN A 100 2.420 28.040 5.292 1.00 0.00 H new ATOM 0 HA GLN A 100 4.344 29.416 7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 100 2.167 28.631 8.257 1.00 0.00 H new ATOM 0 HB3 GLN A 100 2.771 27.008 7.988 1.00 0.00 H new ATOM 0 HG2 GLN A 100 4.388 27.195 9.572 1.00 0.00 H new ATOM 0 HG3 GLN A 100 4.771 28.850 9.144 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.041 30.497 10.399 1.00 0.00 H new ATOM 0 HE22 GLN A 100 2.895 30.302 11.730 1.00 0.00 H new ATOM 1558 N GLY A 101 4.275 26.673 5.334 1.00 0.00 N ATOM 1559 CA GLY A 101 5.102 25.616 4.780 1.00 0.00 C ATOM 1560 C GLY A 101 4.282 24.459 4.246 1.00 0.00 C ATOM 1561 O GLY A 101 3.171 24.207 4.714 1.00 0.00 O ATOM 0 H GLY A 101 3.355 26.766 4.904 1.00 0.00 H new ATOM 0 HA2 GLY A 101 5.717 26.023 3.977 1.00 0.00 H new ATOM 0 HA3 GLY A 101 5.783 25.251 5.549 1.00 0.00 H new ATOM 1565 N GLU A 102 4.832 23.751 3.263 1.00 0.00 N ATOM 1566 CA GLU A 102 4.146 22.612 2.661 1.00 0.00 C ATOM 1567 C GLU A 102 5.128 21.721 1.909 1.00 0.00 C ATOM 1568 O GLU A 102 5.423 21.959 0.737 1.00 0.00 O ATOM 1569 CB GLU A 102 3.042 23.092 1.714 1.00 0.00 C ATOM 1570 CG GLU A 102 3.347 24.421 1.042 1.00 0.00 C ATOM 1571 CD GLU A 102 2.253 25.448 1.261 1.00 0.00 C ATOM 1572 OE1 GLU A 102 1.092 25.166 0.899 1.00 0.00 O ATOM 1573 OE2 GLU A 102 2.559 26.536 1.794 1.00 0.00 O ATOM 0 H GLU A 102 5.751 23.946 2.866 1.00 0.00 H new ATOM 0 HA GLU A 102 3.695 22.028 3.463 1.00 0.00 H new ATOM 0 HB2 GLU A 102 2.880 22.336 0.946 1.00 0.00 H new ATOM 0 HB3 GLU A 102 2.111 23.183 2.273 1.00 0.00 H new ATOM 0 HG2 GLU A 102 4.289 24.811 1.427 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.482 24.261 -0.028 1.00 0.00 H new ATOM 1580 N ASP A 103 5.635 20.697 2.589 1.00 0.00 N ATOM 1581 CA ASP A 103 6.587 19.774 1.982 1.00 0.00 C ATOM 1582 C ASP A 103 5.908 18.477 1.556 1.00 0.00 C ATOM 1583 O ASP A 103 6.508 17.652 0.869 1.00 0.00 O ATOM 1584 CB ASP A 103 7.731 19.474 2.950 1.00 0.00 C ATOM 1585 CG ASP A 103 8.817 18.624 2.319 1.00 0.00 C ATOM 1586 OD1 ASP A 103 9.635 19.177 1.556 1.00 0.00 O ATOM 1587 OD2 ASP A 103 8.849 17.405 2.588 1.00 0.00 O ATOM 0 H ASP A 103 5.403 20.486 3.559 1.00 0.00 H new ATOM 0 HA ASP A 103 6.992 20.253 1.091 1.00 0.00 H new ATOM 0 HB2 ASP A 103 8.164 20.412 3.298 1.00 0.00 H new ATOM 0 HB3 ASP A 103 7.336 18.961 3.827 1.00 0.00 H new ATOM 1592 N CYS A 104 4.653 18.302 1.959 1.00 0.00 N ATOM 1593 CA CYS A 104 3.900 17.104 1.601 1.00 0.00 C ATOM 1594 C CYS A 104 2.415 17.419 1.490 1.00 0.00 C ATOM 1595 O CYS A 104 1.973 18.510 1.846 1.00 0.00 O ATOM 1596 CB CYS A 104 4.124 15.986 2.626 1.00 0.00 C ATOM 1597 SG CYS A 104 5.875 15.556 2.898 1.00 0.00 S ATOM 0 H CYS A 104 4.138 18.971 2.531 1.00 0.00 H new ATOM 0 HA CYS A 104 4.261 16.760 0.632 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.684 16.287 3.577 1.00 0.00 H new ATOM 0 HB3 CYS A 104 3.590 15.095 2.296 1.00 0.00 H new ATOM 1602 N VAL A 105 1.650 16.465 0.982 1.00 0.00 N ATOM 1603 CA VAL A 105 0.220 16.654 0.819 1.00 0.00 C ATOM 1604 C VAL A 105 -0.578 15.669 1.664 1.00 0.00 C ATOM 1605 O VAL A 105 -0.242 14.488 1.759 1.00 0.00 O ATOM 1606 CB VAL A 105 -0.197 16.523 -0.656 1.00 0.00 C ATOM 1607 CG1 VAL A 105 -1.710 16.500 -0.794 1.00 0.00 C ATOM 1608 CG2 VAL A 105 0.385 17.667 -1.464 1.00 0.00 C ATOM 0 H VAL A 105 1.996 15.555 0.677 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.003 17.665 1.161 1.00 0.00 H new ATOM 0 HB VAL A 105 0.193 15.580 -1.039 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.978 16.407 -1.846 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -2.113 15.652 -0.240 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.126 17.425 -0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.084 17.566 -2.507 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.017 18.615 -1.071 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.473 17.644 -1.396 1.00 0.00 H new ATOM 1618 N MET A 106 -1.644 16.176 2.266 1.00 0.00 N ATOM 1619 CA MET A 106 -2.523 15.378 3.103 1.00 0.00 C ATOM 1620 C MET A 106 -3.924 15.368 2.511 1.00 0.00 C ATOM 1621 O MET A 106 -4.214 16.114 1.581 1.00 0.00 O ATOM 1622 CB MET A 106 -2.557 15.928 4.531 1.00 0.00 C ATOM 1623 CG MET A 106 -3.123 17.335 4.629 1.00 0.00 C ATOM 1624 SD MET A 106 -2.179 18.388 5.746 1.00 0.00 S ATOM 1625 CE MET A 106 -0.537 18.243 5.046 1.00 0.00 C ATOM 0 H MET A 106 -1.923 17.154 2.187 1.00 0.00 H new ATOM 0 HA MET A 106 -2.141 14.358 3.140 1.00 0.00 H new ATOM 0 HB2 MET A 106 -3.154 15.261 5.154 1.00 0.00 H new ATOM 0 HB3 MET A 106 -1.546 15.923 4.937 1.00 0.00 H new ATOM 0 HG2 MET A 106 -3.138 17.786 3.637 1.00 0.00 H new ATOM 0 HG3 MET A 106 -4.157 17.283 4.971 1.00 0.00 H new ATOM 0 HE1 MET A 106 0.124 18.972 5.514 1.00 0.00 H new ATOM 0 HE2 MET A 106 -0.153 17.238 5.224 1.00 0.00 H new ATOM 0 HE3 MET A 106 -0.581 18.430 3.973 1.00 0.00 H new ATOM 1635 N MET A 107 -4.785 14.515 3.037 1.00 0.00 N ATOM 1636 CA MET A 107 -6.149 14.418 2.541 1.00 0.00 C ATOM 1637 C MET A 107 -7.142 14.646 3.677 1.00 0.00 C ATOM 1638 O MET A 107 -7.023 14.051 4.746 1.00 0.00 O ATOM 1639 CB MET A 107 -6.368 13.046 1.894 1.00 0.00 C ATOM 1640 CG MET A 107 -7.764 12.490 2.085 1.00 0.00 C ATOM 1641 SD MET A 107 -7.920 11.487 3.575 1.00 0.00 S ATOM 1642 CE MET A 107 -9.443 12.134 4.262 1.00 0.00 C ATOM 0 H MET A 107 -4.566 13.881 3.805 1.00 0.00 H new ATOM 0 HA MET A 107 -6.313 15.189 1.788 1.00 0.00 H new ATOM 0 HB2 MET A 107 -6.161 13.122 0.826 1.00 0.00 H new ATOM 0 HB3 MET A 107 -5.647 12.341 2.309 1.00 0.00 H new ATOM 0 HG2 MET A 107 -8.475 13.315 2.132 1.00 0.00 H new ATOM 0 HG3 MET A 107 -8.032 11.887 1.217 1.00 0.00 H new ATOM 0 HE1 MET A 107 -9.961 11.344 4.806 1.00 0.00 H new ATOM 0 HE2 MET A 107 -9.215 12.954 4.943 1.00 0.00 H new ATOM 0 HE3 MET A 107 -10.080 12.498 3.456 1.00 0.00 H new ATOM 1652 N ARG A 108 -8.114 15.522 3.440 1.00 0.00 N ATOM 1653 CA ARG A 108 -9.120 15.841 4.447 1.00 0.00 C ATOM 1654 C ARG A 108 -10.458 15.191 4.115 1.00 0.00 C ATOM 1655 O ARG A 108 -10.697 14.781 2.979 1.00 0.00 O ATOM 1656 CB ARG A 108 -9.293 17.356 4.559 1.00 0.00 C ATOM 1657 CG ARG A 108 -9.322 17.862 5.992 1.00 0.00 C ATOM 1658 CD ARG A 108 -10.226 19.075 6.136 1.00 0.00 C ATOM 1659 NE ARG A 108 -10.417 19.455 7.533 1.00 0.00 N ATOM 1660 CZ ARG A 108 -11.078 20.542 7.920 1.00 0.00 C ATOM 1661 NH1 ARG A 108 -11.609 21.356 7.016 1.00 0.00 N ATOM 1662 NH2 ARG A 108 -11.209 20.817 9.210 1.00 0.00 N ATOM 0 H ARG A 108 -8.226 16.024 2.559 1.00 0.00 H new ATOM 0 HA ARG A 108 -8.775 15.445 5.402 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -8.478 17.846 4.026 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -10.219 17.645 4.062 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -9.669 17.068 6.653 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -8.311 18.120 6.308 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -9.797 19.914 5.588 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -11.194 18.861 5.683 1.00 0.00 H new ATOM 0 HE ARG A 108 -10.020 18.852 8.254 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -11.510 21.148 6.022 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -12.116 22.189 7.315 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -10.802 20.194 9.908 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -11.716 21.651 9.505 1.00 0.00 H new ATOM 1676 N GLY A 109 -11.328 15.101 5.117 1.00 0.00 N ATOM 1677 CA GLY A 109 -12.634 14.502 4.916 1.00 0.00 C ATOM 1678 C GLY A 109 -13.509 15.318 3.984 1.00 0.00 C ATOM 1679 O GLY A 109 -14.551 14.846 3.531 1.00 0.00 O ATOM 0 H GLY A 109 -11.151 15.433 6.065 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -12.511 13.499 4.508 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -13.134 14.396 5.879 1.00 0.00 H new ATOM 1683 N SER A 110 -13.081 16.544 3.698 1.00 0.00 N ATOM 1684 CA SER A 110 -13.830 17.428 2.812 1.00 0.00 C ATOM 1685 C SER A 110 -14.077 16.759 1.465 1.00 0.00 C ATOM 1686 O SER A 110 -15.095 16.999 0.817 1.00 0.00 O ATOM 1687 CB SER A 110 -13.073 18.742 2.611 1.00 0.00 C ATOM 1688 OG SER A 110 -12.676 19.299 3.852 1.00 0.00 O ATOM 0 H SER A 110 -12.220 16.947 4.067 1.00 0.00 H new ATOM 0 HA SER A 110 -14.793 17.640 3.276 1.00 0.00 H new ATOM 0 HB2 SER A 110 -12.194 18.567 1.990 1.00 0.00 H new ATOM 0 HB3 SER A 110 -13.705 19.451 2.077 1.00 0.00 H new ATOM 0 HG SER A 110 -12.942 20.241 3.888 1.00 0.00 H new ATOM 1694 N GLY A 111 -13.137 15.913 1.052 1.00 0.00 N ATOM 1695 CA GLY A 111 -13.270 15.214 -0.212 1.00 0.00 C ATOM 1696 C GLY A 111 -12.129 15.506 -1.164 1.00 0.00 C ATOM 1697 O GLY A 111 -12.251 15.292 -2.371 1.00 0.00 O ATOM 0 H GLY A 111 -12.285 15.700 1.571 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -13.317 14.141 -0.026 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -14.212 15.498 -0.682 1.00 0.00 H new ATOM 1701 N ARG A 112 -11.016 15.999 -0.628 1.00 0.00 N ATOM 1702 CA ARG A 112 -9.858 16.318 -1.448 1.00 0.00 C ATOM 1703 C ARG A 112 -8.574 16.330 -0.622 1.00 0.00 C ATOM 1704 O ARG A 112 -8.512 15.764 0.469 1.00 0.00 O ATOM 1705 CB ARG A 112 -10.051 17.677 -2.125 1.00 0.00 C ATOM 1706 CG ARG A 112 -10.677 18.730 -1.223 1.00 0.00 C ATOM 1707 CD ARG A 112 -9.618 19.536 -0.484 1.00 0.00 C ATOM 1708 NE ARG A 112 -10.028 19.857 0.880 1.00 0.00 N ATOM 1709 CZ ARG A 112 -10.594 21.009 1.228 1.00 0.00 C ATOM 1710 NH1 ARG A 112 -10.819 21.944 0.316 1.00 0.00 N ATOM 1711 NH2 ARG A 112 -10.935 21.226 2.491 1.00 0.00 N ATOM 0 H ARG A 112 -10.894 16.185 0.368 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.765 15.542 -2.208 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -9.084 18.039 -2.473 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.679 17.547 -3.006 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.295 19.401 -1.820 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -11.336 18.247 -0.502 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -8.685 18.972 -0.459 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -9.419 20.459 -1.029 1.00 0.00 H new ATOM 0 HE ARG A 112 -9.872 19.159 1.607 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -10.558 21.781 -0.656 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -11.253 22.826 0.587 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -10.763 20.509 3.196 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -11.369 22.110 2.757 1.00 0.00 H new ATOM 1725 N TRP A 113 -7.555 16.985 -1.164 1.00 0.00 N ATOM 1726 CA TRP A 113 -6.257 17.098 -0.517 1.00 0.00 C ATOM 1727 C TRP A 113 -6.016 18.498 -0.003 1.00 0.00 C ATOM 1728 O TRP A 113 -6.606 19.466 -0.478 1.00 0.00 O ATOM 1729 CB TRP A 113 -5.114 16.837 -1.486 1.00 0.00 C ATOM 1730 CG TRP A 113 -5.087 15.505 -2.149 1.00 0.00 C ATOM 1731 CD1 TRP A 113 -5.923 14.445 -1.969 1.00 0.00 C ATOM 1732 CD2 TRP A 113 -4.138 15.116 -3.132 1.00 0.00 C ATOM 1733 NE1 TRP A 113 -5.543 13.411 -2.794 1.00 0.00 N ATOM 1734 CE2 TRP A 113 -4.441 13.801 -3.515 1.00 0.00 C ATOM 1735 CE3 TRP A 113 -3.053 15.770 -3.722 1.00 0.00 C ATOM 1736 CZ2 TRP A 113 -3.690 13.118 -4.471 1.00 0.00 C ATOM 1737 CZ3 TRP A 113 -2.310 15.094 -4.672 1.00 0.00 C ATOM 1738 CH2 TRP A 113 -2.630 13.778 -5.037 1.00 0.00 C ATOM 0 H TRP A 113 -7.607 17.454 -2.068 1.00 0.00 H new ATOM 0 HA TRP A 113 -6.277 16.363 0.288 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -5.145 17.602 -2.262 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -4.175 16.967 -0.947 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -6.757 14.420 -1.283 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -6.004 12.504 -2.859 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -2.800 16.782 -3.442 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -3.935 12.105 -4.755 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -1.471 15.587 -5.140 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -2.029 13.274 -5.779 1.00 0.00 H new ATOM 1749 N ASN A 114 -5.070 18.596 0.904 1.00 0.00 N ATOM 1750 CA ASN A 114 -4.644 19.867 1.420 1.00 0.00 C ATOM 1751 C ASN A 114 -3.123 19.871 1.448 1.00 0.00 C ATOM 1752 O ASN A 114 -2.500 19.042 2.111 1.00 0.00 O ATOM 1753 CB ASN A 114 -5.208 20.107 2.821 1.00 0.00 C ATOM 1754 CG ASN A 114 -6.682 20.461 2.798 1.00 0.00 C ATOM 1755 OD1 ASN A 114 -7.541 19.609 3.025 1.00 0.00 O ATOM 1756 ND2 ASN A 114 -6.982 21.724 2.521 1.00 0.00 N ATOM 0 H ASN A 114 -4.578 17.795 1.301 1.00 0.00 H new ATOM 0 HA ASN A 114 -5.014 20.670 0.783 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -5.061 19.213 3.427 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -4.651 20.912 3.301 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -7.957 22.022 2.490 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.237 22.397 2.339 1.00 0.00 H new ATOM 1763 N ASP A 115 -2.532 20.797 0.712 1.00 0.00 N ATOM 1764 CA ASP A 115 -1.087 20.903 0.632 1.00 0.00 C ATOM 1765 C ASP A 115 -0.524 21.675 1.822 1.00 0.00 C ATOM 1766 O ASP A 115 -0.739 22.880 1.952 1.00 0.00 O ATOM 1767 CB ASP A 115 -0.697 21.579 -0.679 1.00 0.00 C ATOM 1768 CG ASP A 115 0.803 21.581 -0.894 1.00 0.00 C ATOM 1769 OD1 ASP A 115 1.381 20.487 -1.060 1.00 0.00 O ATOM 1770 OD2 ASP A 115 1.400 22.678 -0.894 1.00 0.00 O ATOM 0 H ASP A 115 -3.036 21.490 0.158 1.00 0.00 H new ATOM 0 HA ASP A 115 -0.662 19.900 0.660 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.181 21.065 -1.510 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -1.065 22.605 -0.681 1.00 0.00 H new ATOM 1775 N ALA A 116 0.195 20.967 2.691 1.00 0.00 N ATOM 1776 CA ALA A 116 0.788 21.575 3.871 1.00 0.00 C ATOM 1777 C ALA A 116 1.971 20.757 4.372 1.00 0.00 C ATOM 1778 O ALA A 116 2.111 19.585 4.032 1.00 0.00 O ATOM 1779 CB ALA A 116 -0.250 21.718 4.969 1.00 0.00 C ATOM 0 H ALA A 116 0.379 19.968 2.596 1.00 0.00 H new ATOM 0 HA ALA A 116 1.150 22.565 3.594 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.209 22.175 5.846 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -1.067 22.348 4.617 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -0.638 20.734 5.233 1.00 0.00 H new ATOM 1785 N PHE A 117 2.814 21.384 5.185 1.00 0.00 N ATOM 1786 CA PHE A 117 3.987 20.716 5.740 1.00 0.00 C ATOM 1787 C PHE A 117 3.641 19.298 6.187 1.00 0.00 C ATOM 1788 O PHE A 117 2.584 19.062 6.773 1.00 0.00 O ATOM 1789 CB PHE A 117 4.543 21.515 6.922 1.00 0.00 C ATOM 1790 CG PHE A 117 6.035 21.675 6.887 1.00 0.00 C ATOM 1791 CD1 PHE A 117 6.632 22.543 5.987 1.00 0.00 C ATOM 1792 CD2 PHE A 117 6.843 20.958 7.755 1.00 0.00 C ATOM 1793 CE1 PHE A 117 8.005 22.694 5.953 1.00 0.00 C ATOM 1794 CE2 PHE A 117 8.217 21.103 7.726 1.00 0.00 C ATOM 1795 CZ PHE A 117 8.799 21.972 6.824 1.00 0.00 C ATOM 0 H PHE A 117 2.707 22.356 5.475 1.00 0.00 H new ATOM 0 HA PHE A 117 4.747 20.658 4.961 1.00 0.00 H new ATOM 0 HB2 PHE A 117 4.080 22.502 6.933 1.00 0.00 H new ATOM 0 HB3 PHE A 117 4.260 21.019 7.851 1.00 0.00 H new ATOM 0 HD1 PHE A 117 6.016 23.109 5.303 1.00 0.00 H new ATOM 0 HD2 PHE A 117 6.393 20.277 8.463 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.457 23.375 5.247 1.00 0.00 H new ATOM 0 HE2 PHE A 117 8.835 20.538 8.408 1.00 0.00 H new ATOM 0 HZ PHE A 117 9.873 22.087 6.799 1.00 0.00 H new ATOM 1805 N CYS A 118 4.534 18.357 5.895 1.00 0.00 N ATOM 1806 CA CYS A 118 4.324 16.956 6.253 1.00 0.00 C ATOM 1807 C CYS A 118 4.035 16.797 7.744 1.00 0.00 C ATOM 1808 O CYS A 118 3.474 15.788 8.170 1.00 0.00 O ATOM 1809 CB CYS A 118 5.547 16.126 5.867 1.00 0.00 C ATOM 1810 SG CYS A 118 6.451 16.769 4.421 1.00 0.00 S ATOM 0 H CYS A 118 5.413 18.539 5.410 1.00 0.00 H new ATOM 0 HA CYS A 118 3.455 16.598 5.702 1.00 0.00 H new ATOM 0 HB2 CYS A 118 6.227 16.082 6.718 1.00 0.00 H new ATOM 0 HB3 CYS A 118 5.229 15.104 5.659 1.00 0.00 H new ATOM 1815 N ASP A 119 4.419 17.797 8.531 1.00 0.00 N ATOM 1816 CA ASP A 119 4.196 17.761 9.972 1.00 0.00 C ATOM 1817 C ASP A 119 2.959 18.570 10.350 1.00 0.00 C ATOM 1818 O ASP A 119 3.051 19.572 11.061 1.00 0.00 O ATOM 1819 CB ASP A 119 5.422 18.300 10.712 1.00 0.00 C ATOM 1820 CG ASP A 119 6.557 17.296 10.759 1.00 0.00 C ATOM 1821 OD1 ASP A 119 6.917 16.757 9.691 1.00 0.00 O ATOM 1822 OD2 ASP A 119 7.086 17.048 11.863 1.00 0.00 O ATOM 0 H ASP A 119 4.885 18.640 8.196 1.00 0.00 H new ATOM 0 HA ASP A 119 4.032 16.724 10.265 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.767 19.211 10.223 1.00 0.00 H new ATOM 0 HB3 ASP A 119 5.139 18.572 11.729 1.00 0.00 H new ATOM 1827 N ARG A 120 1.800 18.132 9.865 1.00 0.00 N ATOM 1828 CA ARG A 120 0.545 18.818 10.149 1.00 0.00 C ATOM 1829 C ARG A 120 -0.152 18.213 11.367 1.00 0.00 C ATOM 1830 O ARG A 120 0.107 18.618 12.500 1.00 0.00 O ATOM 1831 CB ARG A 120 -0.378 18.765 8.930 1.00 0.00 C ATOM 1832 CG ARG A 120 -0.435 20.071 8.155 1.00 0.00 C ATOM 1833 CD ARG A 120 -1.311 21.099 8.856 1.00 0.00 C ATOM 1834 NE ARG A 120 -1.891 22.055 7.916 1.00 0.00 N ATOM 1835 CZ ARG A 120 -2.412 23.223 8.281 1.00 0.00 C ATOM 1836 NH1 ARG A 120 -2.425 23.578 9.559 1.00 0.00 N ATOM 1837 NH2 ARG A 120 -2.921 24.038 7.367 1.00 0.00 N ATOM 0 H ARG A 120 1.705 17.306 9.274 1.00 0.00 H new ATOM 0 HA ARG A 120 0.775 19.860 10.374 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -0.041 17.971 8.264 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -1.384 18.502 9.257 1.00 0.00 H new ATOM 0 HG2 ARG A 120 0.573 20.470 8.038 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -0.822 19.884 7.153 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -2.110 20.588 9.393 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -0.719 21.634 9.598 1.00 0.00 H new ATOM 0 HE ARG A 120 -1.897 21.813 6.925 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -2.035 22.954 10.266 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -2.825 24.475 9.835 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -2.913 23.769 6.383 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -3.320 24.934 7.648 1.00 0.00 H new ATOM 1851 N LYS A 121 -1.036 17.243 11.128 1.00 0.00 N ATOM 1852 CA LYS A 121 -1.767 16.591 12.211 1.00 0.00 C ATOM 1853 C LYS A 121 -2.676 15.489 11.674 1.00 0.00 C ATOM 1854 O LYS A 121 -3.897 15.643 11.631 1.00 0.00 O ATOM 1855 CB LYS A 121 -2.599 17.616 12.986 1.00 0.00 C ATOM 1856 CG LYS A 121 -2.952 17.171 14.396 1.00 0.00 C ATOM 1857 CD LYS A 121 -2.098 17.884 15.434 1.00 0.00 C ATOM 1858 CE LYS A 121 -1.228 16.905 16.205 1.00 0.00 C ATOM 1859 NZ LYS A 121 -0.859 17.430 17.549 1.00 0.00 N ATOM 0 H LYS A 121 -1.261 16.894 10.197 1.00 0.00 H new ATOM 0 HA LYS A 121 -1.037 16.140 12.883 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -2.048 18.555 13.037 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.519 17.816 12.436 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -4.006 17.372 14.589 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -2.812 16.094 14.485 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -1.467 18.624 14.942 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -2.742 18.425 16.128 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -1.758 15.959 16.318 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -0.322 16.697 15.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -0.266 16.733 18.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -0.331 18.320 17.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.722 17.604 18.103 1.00 0.00 H new ATOM 1872 N LEU A 122 -2.073 14.375 11.272 1.00 0.00 N ATOM 1873 CA LEU A 122 -2.829 13.245 10.743 1.00 0.00 C ATOM 1874 C LEU A 122 -2.883 12.112 11.765 1.00 0.00 C ATOM 1875 O LEU A 122 -2.616 12.326 12.948 1.00 0.00 O ATOM 1876 CB LEU A 122 -2.197 12.757 9.439 1.00 0.00 C ATOM 1877 CG LEU A 122 -2.626 13.524 8.187 1.00 0.00 C ATOM 1878 CD1 LEU A 122 -1.502 14.430 7.708 1.00 0.00 C ATOM 1879 CD2 LEU A 122 -3.041 12.558 7.087 1.00 0.00 C ATOM 0 H LEU A 122 -1.064 14.230 11.302 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.849 13.571 10.539 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -1.113 12.820 9.532 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -2.444 11.704 9.304 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.485 14.146 8.439 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.824 14.968 6.817 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.251 15.144 8.492 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.625 13.828 7.471 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.343 13.121 6.204 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.201 11.911 6.835 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.877 11.950 7.433 1.00 0.00 H new ATOM 1891 N GLY A 123 -3.231 10.909 11.312 1.00 0.00 N ATOM 1892 CA GLY A 123 -3.309 9.780 12.225 1.00 0.00 C ATOM 1893 C GLY A 123 -3.456 8.443 11.522 1.00 0.00 C ATOM 1894 O GLY A 123 -3.479 7.399 12.175 1.00 0.00 O ATOM 0 H GLY A 123 -3.458 10.697 10.340 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -2.411 9.760 12.843 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -4.155 9.924 12.897 1.00 0.00 H new ATOM 1898 N ALA A 124 -3.558 8.462 10.197 1.00 0.00 N ATOM 1899 CA ALA A 124 -3.703 7.229 9.432 1.00 0.00 C ATOM 1900 C ALA A 124 -2.687 7.157 8.299 1.00 0.00 C ATOM 1901 O ALA A 124 -2.551 8.096 7.516 1.00 0.00 O ATOM 1902 CB ALA A 124 -5.117 7.115 8.881 1.00 0.00 C ATOM 0 H ALA A 124 -3.543 9.312 9.634 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.515 6.392 10.104 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.212 6.190 8.312 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -5.829 7.108 9.706 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.323 7.965 8.230 1.00 0.00 H new ATOM 1908 N TRP A 125 -1.980 6.031 8.209 1.00 0.00 N ATOM 1909 CA TRP A 125 -0.983 5.837 7.166 1.00 0.00 C ATOM 1910 C TRP A 125 -1.557 4.995 6.037 1.00 0.00 C ATOM 1911 O TRP A 125 -2.213 3.975 6.275 1.00 0.00 O ATOM 1912 CB TRP A 125 0.267 5.166 7.734 1.00 0.00 C ATOM 1913 CG TRP A 125 -0.017 3.856 8.400 1.00 0.00 C ATOM 1914 CD1 TRP A 125 -0.473 3.670 9.670 1.00 0.00 C ATOM 1915 CD2 TRP A 125 0.130 2.552 7.829 1.00 0.00 C ATOM 1916 NE1 TRP A 125 -0.622 2.330 9.926 1.00 0.00 N ATOM 1917 CE2 TRP A 125 -0.256 1.621 8.812 1.00 0.00 C ATOM 1918 CE3 TRP A 125 0.549 2.079 6.582 1.00 0.00 C ATOM 1919 CZ2 TRP A 125 -0.236 0.247 8.587 1.00 0.00 C ATOM 1920 CZ3 TRP A 125 0.570 0.714 6.360 1.00 0.00 C ATOM 1921 CH2 TRP A 125 0.179 -0.188 7.358 1.00 0.00 C ATOM 0 H TRP A 125 -2.082 5.242 8.847 1.00 0.00 H new ATOM 0 HA TRP A 125 -0.705 6.815 6.773 1.00 0.00 H new ATOM 0 HB2 TRP A 125 0.985 5.009 6.929 1.00 0.00 H new ATOM 0 HB3 TRP A 125 0.737 5.837 8.453 1.00 0.00 H new ATOM 0 HD1 TRP A 125 -0.686 4.462 10.373 1.00 0.00 H new ATOM 0 HE1 TRP A 125 -0.952 1.927 10.803 1.00 0.00 H new ATOM 0 HE3 TRP A 125 0.851 2.767 5.806 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 -0.537 -0.450 9.355 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 0.893 0.337 5.401 1.00 0.00 H new ATOM 0 HH2 TRP A 125 0.206 -1.248 7.153 1.00 0.00 H new ATOM 1932 N VAL A 126 -1.320 5.430 4.809 1.00 0.00 N ATOM 1933 CA VAL A 126 -1.829 4.717 3.655 1.00 0.00 C ATOM 1934 C VAL A 126 -0.759 4.510 2.578 1.00 0.00 C ATOM 1935 O VAL A 126 -0.080 5.447 2.159 1.00 0.00 O ATOM 1936 CB VAL A 126 -3.061 5.435 3.063 1.00 0.00 C ATOM 1937 CG1 VAL A 126 -3.059 6.905 3.422 1.00 0.00 C ATOM 1938 CG2 VAL A 126 -3.148 5.239 1.558 1.00 0.00 C ATOM 0 H VAL A 126 -0.782 6.268 4.590 1.00 0.00 H new ATOM 0 HA VAL A 126 -2.131 3.729 4.003 1.00 0.00 H new ATOM 0 HB VAL A 126 -3.949 4.983 3.505 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -3.938 7.386 2.992 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.079 7.015 4.506 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -2.158 7.375 3.027 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -4.027 5.757 1.174 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -2.253 5.644 1.086 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -3.227 4.175 1.334 1.00 0.00 H new ATOM 1948 N CYS A 127 -0.637 3.259 2.139 1.00 0.00 N ATOM 1949 CA CYS A 127 0.321 2.858 1.101 1.00 0.00 C ATOM 1950 C CYS A 127 -0.326 1.835 0.181 1.00 0.00 C ATOM 1951 O CYS A 127 -1.337 1.254 0.533 1.00 0.00 O ATOM 1952 CB CYS A 127 1.588 2.260 1.712 1.00 0.00 C ATOM 1953 SG CYS A 127 2.427 3.342 2.908 1.00 0.00 S ATOM 0 H CYS A 127 -1.202 2.487 2.493 1.00 0.00 H new ATOM 0 HA CYS A 127 0.601 3.748 0.537 1.00 0.00 H new ATOM 0 HB2 CYS A 127 1.331 1.323 2.206 1.00 0.00 H new ATOM 0 HB3 CYS A 127 2.284 2.017 0.909 1.00 0.00 H new ATOM 1958 N ASP A 128 0.244 1.593 -0.989 1.00 0.00 N ATOM 1959 CA ASP A 128 -0.342 0.617 -1.888 1.00 0.00 C ATOM 1960 C ASP A 128 0.665 -0.454 -2.263 1.00 0.00 C ATOM 1961 O ASP A 128 1.849 -0.183 -2.442 1.00 0.00 O ATOM 1962 CB ASP A 128 -0.870 1.303 -3.149 1.00 0.00 C ATOM 1963 CG ASP A 128 0.221 2.030 -3.910 1.00 0.00 C ATOM 1964 OD1 ASP A 128 0.795 2.990 -3.355 1.00 0.00 O ATOM 1965 OD2 ASP A 128 0.500 1.641 -5.064 1.00 0.00 O ATOM 0 H ASP A 128 1.091 2.047 -1.331 1.00 0.00 H new ATOM 0 HA ASP A 128 -1.173 0.139 -1.368 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -1.329 0.558 -3.800 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -1.652 2.011 -2.874 1.00 0.00 H new ATOM 1970 N ARG A 129 0.164 -1.673 -2.378 1.00 0.00 N ATOM 1971 CA ARG A 129 0.981 -2.826 -2.725 1.00 0.00 C ATOM 1972 C ARG A 129 0.117 -3.902 -3.366 1.00 0.00 C ATOM 1973 O ARG A 129 -1.077 -3.992 -3.088 1.00 0.00 O ATOM 1974 CB ARG A 129 1.664 -3.383 -1.472 1.00 0.00 C ATOM 1975 CG ARG A 129 2.415 -4.685 -1.706 1.00 0.00 C ATOM 1976 CD ARG A 129 1.970 -5.767 -0.735 1.00 0.00 C ATOM 1977 NE ARG A 129 2.934 -6.861 -0.655 1.00 0.00 N ATOM 1978 CZ ARG A 129 3.005 -7.707 0.368 1.00 0.00 C ATOM 1979 NH1 ARG A 129 2.174 -7.585 1.394 1.00 0.00 N ATOM 1980 NH2 ARG A 129 3.910 -8.678 0.365 1.00 0.00 N ATOM 0 H ARG A 129 -0.822 -1.892 -2.233 1.00 0.00 H new ATOM 0 HA ARG A 129 1.746 -2.514 -3.436 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.360 -2.637 -1.088 1.00 0.00 H new ATOM 0 HB3 ARG A 129 0.911 -3.543 -0.700 1.00 0.00 H new ATOM 0 HG2 ARG A 129 2.250 -5.023 -2.729 1.00 0.00 H new ATOM 0 HG3 ARG A 129 3.486 -4.514 -1.596 1.00 0.00 H new ATOM 0 HD2 ARG A 129 1.833 -5.332 0.255 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.002 -6.159 -1.048 1.00 0.00 H new ATOM 0 HE ARG A 129 3.589 -6.983 -1.427 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.477 -6.840 1.400 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.232 -8.236 2.177 1.00 0.00 H new ATOM 0 HH21 ARG A 129 4.551 -8.775 -0.422 1.00 0.00 H new ATOM 0 HH22 ARG A 129 3.964 -9.327 1.150 1.00 0.00 H new ATOM 1994 N LEU A 130 0.721 -4.717 -4.217 1.00 0.00 N ATOM 1995 CA LEU A 130 -0.012 -5.783 -4.888 1.00 0.00 C ATOM 1996 C LEU A 130 -0.476 -6.835 -3.886 1.00 0.00 C ATOM 1997 O LEU A 130 0.172 -7.062 -2.865 1.00 0.00 O ATOM 1998 CB LEU A 130 0.856 -6.427 -5.972 1.00 0.00 C ATOM 1999 CG LEU A 130 1.529 -5.445 -6.939 1.00 0.00 C ATOM 2000 CD1 LEU A 130 1.914 -6.150 -8.230 1.00 0.00 C ATOM 2001 CD2 LEU A 130 0.618 -4.259 -7.232 1.00 0.00 C ATOM 0 H LEU A 130 1.710 -4.663 -4.459 1.00 0.00 H new ATOM 0 HA LEU A 130 -0.893 -5.347 -5.359 1.00 0.00 H new ATOM 0 HB2 LEU A 130 1.630 -7.024 -5.489 1.00 0.00 H new ATOM 0 HB3 LEU A 130 0.238 -7.114 -6.549 1.00 0.00 H new ATOM 0 HG LEU A 130 2.435 -5.068 -6.464 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.390 -5.439 -8.905 1.00 0.00 H new ATOM 0 HD12 LEU A 130 2.608 -6.961 -8.009 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.020 -6.556 -8.703 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.118 -3.577 -7.920 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -0.309 -4.615 -7.683 1.00 0.00 H new ATOM 0 HD23 LEU A 130 0.392 -3.736 -6.303 1.00 0.00 H new ATOM 2013 N ALA A 131 -1.610 -7.465 -4.181 1.00 0.00 N ATOM 2014 CA ALA A 131 -2.177 -8.486 -3.305 1.00 0.00 C ATOM 2015 C ALA A 131 -1.158 -9.573 -2.976 1.00 0.00 C ATOM 2016 O ALA A 131 -0.071 -9.617 -3.551 1.00 0.00 O ATOM 2017 CB ALA A 131 -3.414 -9.100 -3.943 1.00 0.00 C ATOM 0 H ALA A 131 -2.156 -7.285 -5.024 1.00 0.00 H new ATOM 0 HA ALA A 131 -2.460 -8.002 -2.370 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.827 -9.860 -3.279 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.159 -8.323 -4.113 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -3.143 -9.558 -4.895 1.00 0.00 H new ATOM 2023 N THR A 132 -1.522 -10.450 -2.046 1.00 0.00 N ATOM 2024 CA THR A 132 -0.646 -11.537 -1.634 1.00 0.00 C ATOM 2025 C THR A 132 -0.954 -12.809 -2.416 1.00 0.00 C ATOM 2026 O THR A 132 -0.592 -13.910 -1.999 1.00 0.00 O ATOM 2027 CB THR A 132 -0.792 -11.797 -0.135 1.00 0.00 C ATOM 2028 OG1 THR A 132 -2.130 -11.588 0.283 1.00 0.00 O ATOM 2029 CG2 THR A 132 0.098 -10.917 0.716 1.00 0.00 C ATOM 0 H THR A 132 -2.420 -10.427 -1.563 1.00 0.00 H new ATOM 0 HA THR A 132 0.382 -11.243 -1.845 1.00 0.00 H new ATOM 0 HB THR A 132 -0.491 -12.835 0.008 1.00 0.00 H new ATOM 0 HG1 THR A 132 -2.331 -12.175 1.042 1.00 0.00 H new ATOM 0 HG21 THR A 132 -0.056 -11.154 1.769 1.00 0.00 H new ATOM 0 HG22 THR A 132 1.141 -11.092 0.453 1.00 0.00 H new ATOM 0 HG23 THR A 132 -0.150 -9.870 0.540 1.00 0.00 H new ATOM 2037 N CYS A 133 -1.625 -12.651 -3.553 1.00 0.00 N ATOM 2038 CA CYS A 133 -1.982 -13.786 -4.395 1.00 0.00 C ATOM 2039 C CYS A 133 -1.043 -13.894 -5.591 1.00 0.00 C ATOM 2040 O CYS A 133 -1.201 -13.184 -6.584 1.00 0.00 O ATOM 2041 CB CYS A 133 -3.428 -13.652 -4.879 1.00 0.00 C ATOM 2042 SG CYS A 133 -4.249 -15.243 -5.217 1.00 0.00 S ATOM 0 H CYS A 133 -1.932 -11.747 -3.912 1.00 0.00 H new ATOM 0 HA CYS A 133 -1.886 -14.693 -3.798 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -4.003 -13.111 -4.127 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -3.442 -13.048 -5.786 1.00 0.00 H new ATOM 2047 N THR A 134 -0.062 -14.786 -5.487 1.00 0.00 N ATOM 2048 CA THR A 134 0.905 -14.987 -6.560 1.00 0.00 C ATOM 2049 C THR A 134 1.480 -16.403 -6.519 1.00 0.00 C ATOM 2050 O THR A 134 2.514 -16.644 -5.895 1.00 0.00 O ATOM 2051 CB THR A 134 2.034 -13.959 -6.458 1.00 0.00 C ATOM 2052 OG1 THR A 134 3.163 -14.376 -7.205 1.00 0.00 O ATOM 2053 CG2 THR A 134 2.490 -13.707 -5.036 1.00 0.00 C ATOM 0 H THR A 134 0.084 -15.380 -4.671 1.00 0.00 H new ATOM 0 HA THR A 134 0.388 -14.853 -7.510 1.00 0.00 H new ATOM 0 HB THR A 134 1.617 -13.034 -6.857 1.00 0.00 H new ATOM 0 HG1 THR A 134 3.542 -15.185 -6.801 1.00 0.00 H new ATOM 0 HG21 THR A 134 3.292 -12.968 -5.036 1.00 0.00 H new ATOM 0 HG22 THR A 134 1.653 -13.334 -4.446 1.00 0.00 H new ATOM 0 HG23 THR A 134 2.854 -14.637 -4.600 1.00 0.00 H new ATOM 2061 N PRO A 135 0.812 -17.361 -7.185 1.00 0.00 N ATOM 2062 CA PRO A 135 1.262 -18.756 -7.221 1.00 0.00 C ATOM 2063 C PRO A 135 2.522 -18.939 -8.065 1.00 0.00 C ATOM 2064 O PRO A 135 2.729 -18.222 -9.045 1.00 0.00 O ATOM 2065 CB PRO A 135 0.082 -19.494 -7.856 1.00 0.00 C ATOM 2066 CG PRO A 135 -0.604 -18.465 -8.686 1.00 0.00 C ATOM 2067 CD PRO A 135 -0.430 -17.161 -7.955 1.00 0.00 C ATOM 0 HA PRO A 135 1.528 -19.123 -6.230 1.00 0.00 H new ATOM 0 HB2 PRO A 135 0.420 -20.333 -8.465 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.586 -19.900 -7.097 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -0.168 -18.414 -9.684 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -1.660 -18.705 -8.811 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -0.343 -16.322 -8.646 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -1.277 -16.950 -7.302 1.00 0.00 H new ATOM 2075 N PRO A 136 3.384 -19.903 -7.694 1.00 0.00 N ATOM 2076 CA PRO A 136 4.628 -20.175 -8.423 1.00 0.00 C ATOM 2077 C PRO A 136 4.380 -20.479 -9.897 1.00 0.00 C ATOM 2078 O PRO A 136 3.834 -21.527 -10.241 1.00 0.00 O ATOM 2079 CB PRO A 136 5.203 -21.405 -7.714 1.00 0.00 C ATOM 2080 CG PRO A 136 4.585 -21.390 -6.359 1.00 0.00 C ATOM 2081 CD PRO A 136 3.215 -20.802 -6.538 1.00 0.00 C ATOM 0 HA PRO A 136 5.297 -19.314 -8.416 1.00 0.00 H new ATOM 0 HB2 PRO A 136 4.957 -22.321 -8.250 1.00 0.00 H new ATOM 0 HB3 PRO A 136 6.290 -21.354 -7.653 1.00 0.00 H new ATOM 0 HG2 PRO A 136 4.527 -22.397 -5.945 1.00 0.00 H new ATOM 0 HG3 PRO A 136 5.178 -20.794 -5.666 1.00 0.00 H new ATOM 0 HD2 PRO A 136 2.468 -21.572 -6.732 1.00 0.00 H new ATOM 0 HD3 PRO A 136 2.890 -20.260 -5.650 1.00 0.00 H new ATOM 2089 N ALA A 137 4.785 -19.555 -10.762 1.00 0.00 N ATOM 2090 CA ALA A 137 4.608 -19.723 -12.200 1.00 0.00 C ATOM 2091 C ALA A 137 5.510 -20.829 -12.738 1.00 0.00 C ATOM 2092 O ALA A 137 6.722 -20.651 -12.856 1.00 0.00 O ATOM 2093 CB ALA A 137 4.885 -18.413 -12.922 1.00 0.00 C ATOM 0 H ALA A 137 5.238 -18.682 -10.492 1.00 0.00 H new ATOM 0 HA ALA A 137 3.574 -20.013 -12.383 1.00 0.00 H new ATOM 0 HB1 ALA A 137 4.749 -18.553 -13.994 1.00 0.00 H new ATOM 0 HB2 ALA A 137 4.195 -17.648 -12.566 1.00 0.00 H new ATOM 0 HB3 ALA A 137 5.910 -18.098 -12.724 1.00 0.00 H new ATOM 2099 N SER A 138 4.910 -21.969 -13.063 1.00 0.00 N ATOM 2100 CA SER A 138 5.658 -23.105 -13.589 1.00 0.00 C ATOM 2101 C SER A 138 5.519 -23.192 -15.106 1.00 0.00 C ATOM 2102 O SER A 138 6.490 -23.006 -15.839 1.00 0.00 O ATOM 2103 CB SER A 138 5.173 -24.405 -12.945 1.00 0.00 C ATOM 2104 OG SER A 138 6.173 -25.408 -13.006 1.00 0.00 O ATOM 0 H SER A 138 3.907 -22.131 -12.971 1.00 0.00 H new ATOM 0 HA SER A 138 6.711 -22.959 -13.346 1.00 0.00 H new ATOM 0 HB2 SER A 138 4.901 -24.220 -11.906 1.00 0.00 H new ATOM 0 HB3 SER A 138 4.273 -24.753 -13.453 1.00 0.00 H new ATOM 0 HG SER A 138 5.839 -26.228 -12.586 1.00 0.00 H new ATOM 2110 N GLU A 139 4.306 -23.476 -15.568 1.00 0.00 N ATOM 2111 CA GLU A 139 4.039 -23.587 -16.997 1.00 0.00 C ATOM 2112 C GLU A 139 4.005 -22.211 -17.654 1.00 0.00 C ATOM 2113 O GLU A 139 3.166 -21.375 -17.319 1.00 0.00 O ATOM 2114 CB GLU A 139 2.713 -24.312 -17.235 1.00 0.00 C ATOM 2115 CG GLU A 139 2.793 -25.393 -18.302 1.00 0.00 C ATOM 2116 CD GLU A 139 1.549 -25.449 -19.167 1.00 0.00 C ATOM 2117 OE1 GLU A 139 1.513 -24.745 -20.199 1.00 0.00 O ATOM 2118 OE2 GLU A 139 0.613 -26.196 -18.815 1.00 0.00 O ATOM 0 H GLU A 139 3.492 -23.633 -14.973 1.00 0.00 H new ATOM 0 HA GLU A 139 4.847 -24.164 -17.448 1.00 0.00 H new ATOM 0 HB2 GLU A 139 2.381 -24.761 -16.299 1.00 0.00 H new ATOM 0 HB3 GLU A 139 1.957 -23.583 -17.525 1.00 0.00 H new ATOM 0 HG2 GLU A 139 3.663 -25.212 -18.934 1.00 0.00 H new ATOM 0 HG3 GLU A 139 2.943 -26.361 -17.823 1.00 0.00 H new ATOM 2125 N GLY A 140 4.923 -21.983 -18.588 1.00 0.00 N ATOM 2126 CA GLY A 140 4.981 -20.707 -19.277 1.00 0.00 C ATOM 2127 C GLY A 140 3.761 -20.459 -20.142 1.00 0.00 C ATOM 2128 O GLY A 140 3.394 -21.296 -20.965 1.00 0.00 O ATOM 0 H GLY A 140 5.628 -22.660 -18.880 1.00 0.00 H new ATOM 0 HA2 GLY A 140 5.072 -19.906 -18.544 1.00 0.00 H new ATOM 0 HA3 GLY A 140 5.876 -20.673 -19.898 1.00 0.00 H new ATOM 2132 N SER A 141 3.130 -19.304 -19.953 1.00 0.00 N ATOM 2133 CA SER A 141 1.943 -18.945 -20.721 1.00 0.00 C ATOM 2134 C SER A 141 2.294 -18.716 -22.188 1.00 0.00 C ATOM 2135 O SER A 141 3.355 -18.180 -22.504 1.00 0.00 O ATOM 2136 CB SER A 141 1.292 -17.690 -20.137 1.00 0.00 C ATOM 2137 OG SER A 141 2.239 -16.647 -19.986 1.00 0.00 O ATOM 0 H SER A 141 3.421 -18.601 -19.274 1.00 0.00 H new ATOM 0 HA SER A 141 1.237 -19.773 -20.660 1.00 0.00 H new ATOM 0 HB2 SER A 141 0.483 -17.359 -20.789 1.00 0.00 H new ATOM 0 HB3 SER A 141 0.847 -17.924 -19.170 1.00 0.00 H new ATOM 0 HG SER A 141 1.797 -15.856 -19.613 1.00 0.00 H new ATOM 2143 N ALA A 142 1.392 -19.126 -23.077 1.00 0.00 N ATOM 2144 CA ALA A 142 1.601 -18.969 -24.512 1.00 0.00 C ATOM 2145 C ALA A 142 2.906 -19.622 -24.954 1.00 0.00 C ATOM 2146 O ALA A 142 3.924 -18.951 -25.119 1.00 0.00 O ATOM 2147 CB ALA A 142 1.591 -17.493 -24.889 1.00 0.00 C ATOM 0 H ALA A 142 0.508 -19.570 -22.827 1.00 0.00 H new ATOM 0 HA ALA A 142 0.783 -19.471 -25.029 1.00 0.00 H new ATOM 0 HB1 ALA A 142 1.748 -17.391 -25.963 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.630 -17.055 -24.620 1.00 0.00 H new ATOM 0 HB3 ALA A 142 2.388 -16.976 -24.355 1.00 0.00 H new ATOM 2153 N GLU A 143 2.868 -20.938 -25.142 1.00 0.00 N ATOM 2154 CA GLU A 143 4.047 -21.685 -25.565 1.00 0.00 C ATOM 2155 C GLU A 143 4.271 -21.543 -27.067 1.00 0.00 C ATOM 2156 O GLU A 143 3.275 -21.364 -27.799 1.00 0.00 O ATOM 2157 CB GLU A 143 3.899 -23.163 -25.197 1.00 0.00 C ATOM 2158 CG GLU A 143 5.128 -23.746 -24.520 1.00 0.00 C ATOM 2159 CD GLU A 143 4.792 -24.901 -23.597 1.00 0.00 C ATOM 2160 OE1 GLU A 143 4.196 -25.890 -24.076 1.00 0.00 O ATOM 2161 OE2 GLU A 143 5.124 -24.819 -22.396 1.00 0.00 O ATOM 2162 OXT GLU A 143 5.442 -21.611 -27.499 1.00 0.00 O ATOM 0 H GLU A 143 2.033 -21.509 -25.008 1.00 0.00 H new ATOM 0 HA GLU A 143 4.913 -21.273 -25.046 1.00 0.00 H new ATOM 0 HB2 GLU A 143 3.040 -23.280 -24.536 1.00 0.00 H new ATOM 0 HB3 GLU A 143 3.686 -23.734 -26.100 1.00 0.00 H new ATOM 0 HG2 GLU A 143 5.830 -24.086 -25.281 1.00 0.00 H new ATOM 0 HG3 GLU A 143 5.630 -22.964 -23.950 1.00 0.00 H new TER 2169 GLU A 143