USER MOD reduce.3.24.130724 H: found=0, std=0, add=965, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 963 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.913 K(o=-0.91,f=-1.9!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -0.776 K(o=-0.78,f=-0.11) USER MOD Single : A 36 SER OG : rot -124:sc= 0.345 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 114:sc= -0.986 USER MOD Single : A 48 TYR OH : rot 180:sc= 0.0462 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 150:sc= -0.742 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.329 USER MOD Single : A 66 ASN : amide:sc= -0.952 K(o=-0.95,f=-1.6) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot -136:sc= 0.714 USER MOD Single : A 73 ASN : amide:sc= -2.33 K(o=-2.3,f=-3.2!) USER MOD Single : A 75 THR OG1 : rot 67:sc= 0.966 USER MOD Single : A 76 SER OG : rot 23:sc= 1.19 USER MOD Single : A 83 THR OG1 : rot 29:sc= 1.46 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.491 X(o=-0.49,f=0) USER MOD Single : A 99 ASN : amide:sc= -3.24! C(o=-3.2!,f=-11!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -0.863 K(o=-0.86,f=-0.31) USER MOD Single : A 116 ASN : amide:sc= 0.103 K(o=0.1,f=-1.2) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= -0.966 K(o=-0.97,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.459 6.342 -14.030 1.00 0.00 N ATOM 2 CA GLY A 1 -14.621 5.476 -14.104 1.00 0.00 C ATOM 3 C GLY A 1 -15.922 6.236 -13.934 1.00 0.00 C ATOM 4 O GLY A 1 -16.056 7.056 -13.026 1.00 0.00 O ATOM 0 H1 GLY A 1 -12.595 5.775 -14.152 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.512 7.059 -14.782 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.436 6.813 -13.103 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.627 4.962 -15.065 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.548 4.709 -13.333 1.00 0.00 H new ATOM 8 N SER A 2 -16.883 5.965 -14.811 1.00 0.00 N ATOM 9 CA SER A 2 -18.178 6.633 -14.758 1.00 0.00 C ATOM 10 C SER A 2 -18.734 6.627 -13.337 1.00 0.00 C ATOM 11 O SER A 2 -19.085 7.673 -12.791 1.00 0.00 O ATOM 12 CB SER A 2 -19.166 5.954 -15.708 1.00 0.00 C ATOM 13 OG SER A 2 -18.947 6.359 -17.048 1.00 0.00 O ATOM 0 H SER A 2 -16.789 5.287 -15.567 1.00 0.00 H new ATOM 0 HA SER A 2 -18.038 7.668 -15.071 1.00 0.00 H new ATOM 0 HB2 SER A 2 -19.064 4.872 -15.631 1.00 0.00 H new ATOM 0 HB3 SER A 2 -20.186 6.200 -15.413 1.00 0.00 H new ATOM 0 HG SER A 2 -19.590 5.909 -17.635 1.00 0.00 H new ATOM 19 N SER A 3 -18.811 5.440 -12.744 1.00 0.00 N ATOM 20 CA SER A 3 -19.328 5.295 -11.388 1.00 0.00 C ATOM 21 C SER A 3 -18.193 5.316 -10.369 1.00 0.00 C ATOM 22 O SER A 3 -17.136 4.726 -10.588 1.00 0.00 O ATOM 23 CB SER A 3 -20.122 3.993 -11.259 1.00 0.00 C ATOM 24 OG SER A 3 -21.206 3.964 -12.170 1.00 0.00 O ATOM 0 H SER A 3 -18.522 4.565 -13.181 1.00 0.00 H new ATOM 0 HA SER A 3 -19.990 6.137 -11.185 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.465 3.143 -11.444 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.496 3.891 -10.240 1.00 0.00 H new ATOM 0 HG SER A 3 -21.696 3.121 -12.069 1.00 0.00 H new ATOM 30 N GLY A 4 -18.422 6.001 -9.252 1.00 0.00 N ATOM 31 CA GLY A 4 -17.410 6.087 -8.215 1.00 0.00 C ATOM 32 C GLY A 4 -18.009 6.287 -6.837 1.00 0.00 C ATOM 33 O GLY A 4 -19.146 6.740 -6.706 1.00 0.00 O ATOM 0 H GLY A 4 -19.289 6.497 -9.047 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.811 5.176 -8.219 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.735 6.913 -8.438 1.00 0.00 H new ATOM 37 N SER A 5 -17.242 5.948 -5.805 1.00 0.00 N ATOM 38 CA SER A 5 -17.705 6.088 -4.430 1.00 0.00 C ATOM 39 C SER A 5 -17.526 7.521 -3.939 1.00 0.00 C ATOM 40 O SER A 5 -16.871 8.335 -4.591 1.00 0.00 O ATOM 41 CB SER A 5 -16.948 5.125 -3.514 1.00 0.00 C ATOM 42 OG SER A 5 -17.631 4.946 -2.285 1.00 0.00 O ATOM 0 H SER A 5 -16.297 5.574 -5.896 1.00 0.00 H new ATOM 0 HA SER A 5 -18.767 5.844 -4.404 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.830 4.162 -4.011 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.946 5.511 -3.324 1.00 0.00 H new ATOM 0 HG SER A 5 -17.127 4.325 -1.718 1.00 0.00 H new ATOM 48 N SER A 6 -18.113 7.823 -2.786 1.00 0.00 N ATOM 49 CA SER A 6 -18.022 9.159 -2.208 1.00 0.00 C ATOM 50 C SER A 6 -16.895 9.232 -1.183 1.00 0.00 C ATOM 51 O SER A 6 -16.401 8.208 -0.712 1.00 0.00 O ATOM 52 CB SER A 6 -19.349 9.545 -1.552 1.00 0.00 C ATOM 53 OG SER A 6 -19.483 8.941 -0.277 1.00 0.00 O ATOM 0 H SER A 6 -18.657 7.161 -2.233 1.00 0.00 H new ATOM 0 HA SER A 6 -17.804 9.862 -3.012 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.407 10.629 -1.452 1.00 0.00 H new ATOM 0 HB3 SER A 6 -20.177 9.239 -2.192 1.00 0.00 H new ATOM 0 HG SER A 6 -20.338 9.205 0.122 1.00 0.00 H new ATOM 59 N GLY A 7 -16.491 10.453 -0.842 1.00 0.00 N ATOM 60 CA GLY A 7 -15.425 10.638 0.124 1.00 0.00 C ATOM 61 C GLY A 7 -14.119 11.052 -0.525 1.00 0.00 C ATOM 62 O GLY A 7 -13.813 10.631 -1.640 1.00 0.00 O ATOM 0 H GLY A 7 -16.883 11.316 -1.218 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.723 11.396 0.849 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.275 9.710 0.676 1.00 0.00 H new ATOM 66 N GLN A 8 -13.349 11.881 0.173 1.00 0.00 N ATOM 67 CA GLN A 8 -12.071 12.354 -0.344 1.00 0.00 C ATOM 68 C GLN A 8 -11.135 12.747 0.794 1.00 0.00 C ATOM 69 O GLN A 8 -11.551 13.385 1.761 1.00 0.00 O ATOM 70 CB GLN A 8 -12.284 13.545 -1.280 1.00 0.00 C ATOM 71 CG GLN A 8 -12.861 14.768 -0.586 1.00 0.00 C ATOM 72 CD GLN A 8 -13.284 15.848 -1.562 1.00 0.00 C ATOM 73 OE1 GLN A 8 -12.446 16.514 -2.171 1.00 0.00 O ATOM 74 NE2 GLN A 8 -14.590 16.027 -1.717 1.00 0.00 N ATOM 0 H GLN A 8 -13.588 12.239 1.098 1.00 0.00 H new ATOM 0 HA GLN A 8 -11.611 11.540 -0.904 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -11.331 13.812 -1.737 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.952 13.247 -2.088 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -13.721 14.469 0.014 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -12.119 15.175 0.101 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -15.249 15.452 -1.192 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -14.934 16.739 -2.361 1.00 0.00 H new ATOM 83 N LYS A 9 -9.869 12.363 0.672 1.00 0.00 N ATOM 84 CA LYS A 9 -8.872 12.676 1.689 1.00 0.00 C ATOM 85 C LYS A 9 -7.837 13.659 1.152 1.00 0.00 C ATOM 86 O LYS A 9 -7.306 13.478 0.056 1.00 0.00 O ATOM 87 CB LYS A 9 -8.179 11.397 2.164 1.00 0.00 C ATOM 88 CG LYS A 9 -9.091 10.464 2.942 1.00 0.00 C ATOM 89 CD LYS A 9 -9.800 9.484 2.023 1.00 0.00 C ATOM 90 CE LYS A 9 -10.989 8.833 2.714 1.00 0.00 C ATOM 91 NZ LYS A 9 -10.574 7.684 3.565 1.00 0.00 N ATOM 0 H LYS A 9 -9.509 11.834 -0.122 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.383 13.139 2.533 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -7.782 10.866 1.299 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.328 11.666 2.790 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.507 9.915 3.680 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -9.829 11.049 3.491 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -10.138 10.004 1.127 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -9.099 8.714 1.700 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -11.502 9.573 3.328 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -11.702 8.491 1.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -11.412 7.267 4.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -10.107 6.966 2.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.913 8.015 4.297 1.00 0.00 H new ATOM 105 N ARG A 10 -7.553 14.698 1.931 1.00 0.00 N ATOM 106 CA ARG A 10 -6.581 15.708 1.533 1.00 0.00 C ATOM 107 C ARG A 10 -5.422 15.767 2.524 1.00 0.00 C ATOM 108 O ARG A 10 -4.719 16.773 2.612 1.00 0.00 O ATOM 109 CB ARG A 10 -7.251 17.080 1.433 1.00 0.00 C ATOM 110 CG ARG A 10 -8.113 17.425 2.636 1.00 0.00 C ATOM 111 CD ARG A 10 -8.879 18.721 2.419 1.00 0.00 C ATOM 112 NE ARG A 10 -9.569 19.159 3.630 1.00 0.00 N ATOM 113 CZ ARG A 10 -10.362 20.223 3.679 1.00 0.00 C ATOM 114 NH1 ARG A 10 -10.566 20.954 2.592 1.00 0.00 N ATOM 115 NH2 ARG A 10 -10.955 20.558 4.818 1.00 0.00 N ATOM 0 H ARG A 10 -7.983 14.862 2.841 1.00 0.00 H new ATOM 0 HA ARG A 10 -6.187 15.432 0.555 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -6.482 17.843 1.317 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -7.867 17.110 0.534 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -8.815 16.613 2.827 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -7.484 17.517 3.521 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -8.189 19.500 2.093 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -9.605 18.583 1.618 1.00 0.00 H new ATOM 0 HE ARG A 10 -9.434 18.618 4.484 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -10.113 20.700 1.714 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -11.176 21.771 2.634 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -10.802 19.998 5.657 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -11.564 21.375 4.855 1.00 0.00 H new ATOM 129 N ALA A 11 -5.229 14.682 3.267 1.00 0.00 N ATOM 130 CA ALA A 11 -4.155 14.610 4.249 1.00 0.00 C ATOM 131 C ALA A 11 -3.086 13.610 3.822 1.00 0.00 C ATOM 132 O ALA A 11 -3.357 12.690 3.050 1.00 0.00 O ATOM 133 CB ALA A 11 -4.714 14.237 5.615 1.00 0.00 C ATOM 0 H ALA A 11 -5.803 13.841 3.207 1.00 0.00 H new ATOM 0 HA ALA A 11 -3.689 15.593 4.314 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -3.901 14.187 6.339 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -5.435 14.990 5.931 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -5.206 13.266 5.554 1.00 0.00 H new ATOM 139 N TRP A 12 -1.873 13.796 4.327 1.00 0.00 N ATOM 140 CA TRP A 12 -0.763 12.910 3.997 1.00 0.00 C ATOM 141 C TRP A 12 -0.819 11.633 4.828 1.00 0.00 C ATOM 142 O TRP A 12 0.184 11.214 5.407 1.00 0.00 O ATOM 143 CB TRP A 12 0.571 13.622 4.224 1.00 0.00 C ATOM 144 CG TRP A 12 1.762 12.740 3.999 1.00 0.00 C ATOM 145 CD1 TRP A 12 2.754 12.458 4.895 1.00 0.00 C ATOM 146 CD2 TRP A 12 2.086 12.028 2.801 1.00 0.00 C ATOM 147 NE1 TRP A 12 3.675 11.612 4.325 1.00 0.00 N ATOM 148 CE2 TRP A 12 3.288 11.333 3.041 1.00 0.00 C ATOM 149 CE3 TRP A 12 1.478 11.907 1.548 1.00 0.00 C ATOM 150 CZ2 TRP A 12 3.891 10.532 2.075 1.00 0.00 C ATOM 151 CZ3 TRP A 12 2.078 11.112 0.590 1.00 0.00 C ATOM 152 CH2 TRP A 12 3.273 10.432 0.858 1.00 0.00 C ATOM 0 H TRP A 12 -1.632 14.553 4.967 1.00 0.00 H new ATOM 0 HA TRP A 12 -0.848 12.640 2.944 1.00 0.00 H new ATOM 0 HB2 TRP A 12 0.634 14.482 3.557 1.00 0.00 H new ATOM 0 HB3 TRP A 12 0.600 14.007 5.243 1.00 0.00 H new ATOM 0 HD1 TRP A 12 2.807 12.843 5.903 1.00 0.00 H new ATOM 0 HE1 TRP A 12 4.511 11.250 4.784 1.00 0.00 H new ATOM 0 HE3 TRP A 12 0.556 12.426 1.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 4.813 10.008 2.279 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 1.618 11.013 -0.382 1.00 0.00 H new ATOM 0 HH2 TRP A 12 3.716 9.816 0.089 1.00 0.00 H new ATOM 163 N ILE A 13 -1.997 11.020 4.883 1.00 0.00 N ATOM 164 CA ILE A 13 -2.182 9.790 5.643 1.00 0.00 C ATOM 165 C ILE A 13 -2.500 8.617 4.722 1.00 0.00 C ATOM 166 O ILE A 13 -3.203 8.770 3.723 1.00 0.00 O ATOM 167 CB ILE A 13 -3.310 9.934 6.681 1.00 0.00 C ATOM 168 CG1 ILE A 13 -2.994 11.070 7.656 1.00 0.00 C ATOM 169 CG2 ILE A 13 -3.511 8.625 7.431 1.00 0.00 C ATOM 170 CD1 ILE A 13 -4.225 11.709 8.260 1.00 0.00 C ATOM 0 H ILE A 13 -2.837 11.355 4.411 1.00 0.00 H new ATOM 0 HA ILE A 13 -1.244 9.596 6.163 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.235 10.176 6.158 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -2.364 10.685 8.458 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -2.416 11.834 7.136 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.312 8.743 8.161 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.777 7.838 6.725 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -2.588 8.355 7.945 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -3.925 12.506 8.941 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -4.846 12.125 7.466 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -4.793 10.958 8.809 1.00 0.00 H new ATOM 182 N THR A 14 -1.980 7.443 5.066 1.00 0.00 N ATOM 183 CA THR A 14 -2.209 6.243 4.271 1.00 0.00 C ATOM 184 C THR A 14 -3.013 5.211 5.053 1.00 0.00 C ATOM 185 O THR A 14 -3.108 5.282 6.278 1.00 0.00 O ATOM 186 CB THR A 14 -0.881 5.607 3.819 1.00 0.00 C ATOM 187 OG1 THR A 14 -0.244 4.962 4.927 1.00 0.00 O ATOM 188 CG2 THR A 14 0.050 6.657 3.233 1.00 0.00 C ATOM 0 H THR A 14 -1.397 7.298 5.890 1.00 0.00 H new ATOM 0 HA THR A 14 -2.775 6.550 3.391 1.00 0.00 H new ATOM 0 HB THR A 14 -1.101 4.869 3.048 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.599 4.559 4.631 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.981 6.184 2.921 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.426 7.125 2.371 1.00 0.00 H new ATOM 0 HG23 THR A 14 0.263 7.416 3.986 1.00 0.00 H new ATOM 196 N ALA A 15 -3.591 4.251 4.337 1.00 0.00 N ATOM 197 CA ALA A 15 -4.385 3.203 4.965 1.00 0.00 C ATOM 198 C ALA A 15 -3.620 1.884 5.004 1.00 0.00 C ATOM 199 O ALA A 15 -2.829 1.571 4.115 1.00 0.00 O ATOM 200 CB ALA A 15 -5.705 3.028 4.229 1.00 0.00 C ATOM 0 H ALA A 15 -3.524 4.178 3.322 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.592 3.504 5.992 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -6.288 2.242 4.709 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.264 3.963 4.257 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.510 2.753 3.192 1.00 0.00 H new ATOM 206 N PRO A 16 -3.860 1.091 6.059 1.00 0.00 N ATOM 207 CA PRO A 16 -3.203 -0.207 6.238 1.00 0.00 C ATOM 208 C PRO A 16 -3.680 -1.244 5.226 1.00 0.00 C ATOM 209 O PRO A 16 -4.806 -1.736 5.310 1.00 0.00 O ATOM 210 CB PRO A 16 -3.610 -0.618 7.656 1.00 0.00 C ATOM 211 CG PRO A 16 -4.893 0.099 7.904 1.00 0.00 C ATOM 212 CD PRO A 16 -4.792 1.400 7.156 1.00 0.00 C ATOM 0 HA PRO A 16 -2.125 -0.141 6.091 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -3.738 -1.698 7.734 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -2.850 -0.334 8.384 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -5.742 -0.488 7.553 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -5.044 0.272 8.970 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.762 1.724 6.780 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.413 2.201 7.791 1.00 0.00 H new ATOM 220 N VAL A 17 -2.817 -1.572 4.270 1.00 0.00 N ATOM 221 CA VAL A 17 -3.150 -2.551 3.243 1.00 0.00 C ATOM 222 C VAL A 17 -3.050 -3.972 3.785 1.00 0.00 C ATOM 223 O VAL A 17 -1.977 -4.417 4.193 1.00 0.00 O ATOM 224 CB VAL A 17 -2.227 -2.414 2.017 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.738 -3.268 0.866 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.109 -0.956 1.599 1.00 0.00 C ATOM 0 H VAL A 17 -1.882 -1.174 4.186 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.178 -2.353 2.939 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.234 -2.771 2.290 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.074 -3.159 0.009 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.765 -4.314 1.173 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.742 -2.944 0.591 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.453 -0.878 0.732 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.096 -0.570 1.344 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.693 -0.374 2.422 1.00 0.00 H new ATOM 236 N ALA A 18 -4.174 -4.680 3.786 1.00 0.00 N ATOM 237 CA ALA A 18 -4.213 -6.053 4.276 1.00 0.00 C ATOM 238 C ALA A 18 -4.366 -7.042 3.125 1.00 0.00 C ATOM 239 O ALA A 18 -5.352 -7.004 2.388 1.00 0.00 O ATOM 240 CB ALA A 18 -5.345 -6.224 5.277 1.00 0.00 C ATOM 0 H ALA A 18 -5.071 -4.326 3.453 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.267 -6.262 4.776 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.362 -7.254 5.634 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.191 -5.550 6.120 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.295 -5.991 4.795 1.00 0.00 H new ATOM 246 N LEU A 19 -3.386 -7.926 2.977 1.00 0.00 N ATOM 247 CA LEU A 19 -3.412 -8.926 1.915 1.00 0.00 C ATOM 248 C LEU A 19 -3.210 -10.328 2.482 1.00 0.00 C ATOM 249 O LEU A 19 -2.115 -10.677 2.923 1.00 0.00 O ATOM 250 CB LEU A 19 -2.332 -8.623 0.876 1.00 0.00 C ATOM 251 CG LEU A 19 -2.415 -7.253 0.201 1.00 0.00 C ATOM 252 CD1 LEU A 19 -1.165 -6.988 -0.624 1.00 0.00 C ATOM 253 CD2 LEU A 19 -3.660 -7.163 -0.670 1.00 0.00 C ATOM 0 H LEU A 19 -2.564 -7.971 3.579 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.390 -8.886 1.435 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.358 -8.710 1.358 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.375 -9.390 0.103 1.00 0.00 H new ATOM 0 HG LEU A 19 -2.482 -6.490 0.977 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.242 -6.009 -1.097 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.289 -7.010 0.025 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.067 -7.755 -1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.703 -6.182 -1.143 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.623 -7.935 -1.439 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.547 -7.308 -0.053 1.00 0.00 H new ATOM 265 N ARG A 20 -4.272 -11.126 2.465 1.00 0.00 N ATOM 266 CA ARG A 20 -4.211 -12.490 2.976 1.00 0.00 C ATOM 267 C ARG A 20 -3.214 -13.325 2.179 1.00 0.00 C ATOM 268 O ARG A 20 -2.739 -12.903 1.125 1.00 0.00 O ATOM 269 CB ARG A 20 -5.595 -13.140 2.923 1.00 0.00 C ATOM 270 CG ARG A 20 -6.008 -13.580 1.528 1.00 0.00 C ATOM 271 CD ARG A 20 -7.030 -14.704 1.578 1.00 0.00 C ATOM 272 NE ARG A 20 -8.400 -14.198 1.596 1.00 0.00 N ATOM 273 CZ ARG A 20 -9.463 -14.946 1.325 1.00 0.00 C ATOM 274 NH1 ARG A 20 -9.316 -16.227 1.017 1.00 0.00 N ATOM 275 NH2 ARG A 20 -10.678 -14.413 1.361 1.00 0.00 N ATOM 0 H ARG A 20 -5.185 -10.852 2.103 1.00 0.00 H new ATOM 0 HA ARG A 20 -3.877 -12.448 4.013 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -5.606 -14.005 3.586 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.333 -12.435 3.306 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.425 -12.731 0.986 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.129 -13.910 0.974 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -6.895 -15.355 0.714 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -6.857 -15.312 2.466 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.548 -13.216 1.830 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.384 -16.641 0.988 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -10.135 -16.799 0.809 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -10.796 -13.428 1.597 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.494 -14.989 1.153 1.00 0.00 H new ATOM 289 N GLU A 21 -2.901 -14.512 2.690 1.00 0.00 N ATOM 290 CA GLU A 21 -1.959 -15.405 2.026 1.00 0.00 C ATOM 291 C GLU A 21 -2.681 -16.608 1.426 1.00 0.00 C ATOM 292 O GLU A 21 -3.822 -16.901 1.780 1.00 0.00 O ATOM 293 CB GLU A 21 -0.888 -15.878 3.011 1.00 0.00 C ATOM 294 CG GLU A 21 -1.278 -17.129 3.780 1.00 0.00 C ATOM 295 CD GLU A 21 -0.914 -18.403 3.044 1.00 0.00 C ATOM 296 OE1 GLU A 21 0.295 -18.657 2.859 1.00 0.00 O ATOM 297 OE2 GLU A 21 -1.838 -19.147 2.655 1.00 0.00 O ATOM 0 H GLU A 21 -3.286 -14.877 3.561 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.480 -14.851 1.219 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.036 -16.070 2.465 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.679 -15.077 3.720 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.785 -17.122 4.752 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.352 -17.116 3.967 1.00 0.00 H new ATOM 304 N GLY A 22 -2.005 -17.302 0.515 1.00 0.00 N ATOM 305 CA GLY A 22 -2.597 -18.465 -0.120 1.00 0.00 C ATOM 306 C GLY A 22 -3.764 -18.104 -1.019 1.00 0.00 C ATOM 307 O GLY A 22 -4.814 -18.743 -0.969 1.00 0.00 O ATOM 0 H GLY A 22 -1.059 -17.080 0.206 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -1.837 -18.981 -0.706 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -2.935 -19.161 0.647 1.00 0.00 H new ATOM 311 N GLU A 23 -3.579 -17.076 -1.841 1.00 0.00 N ATOM 312 CA GLU A 23 -4.626 -16.630 -2.753 1.00 0.00 C ATOM 313 C GLU A 23 -4.058 -15.701 -3.821 1.00 0.00 C ATOM 314 O GLU A 23 -3.168 -14.895 -3.548 1.00 0.00 O ATOM 315 CB GLU A 23 -5.737 -15.918 -1.979 1.00 0.00 C ATOM 316 CG GLU A 23 -6.915 -15.506 -2.846 1.00 0.00 C ATOM 317 CD GLU A 23 -8.206 -15.389 -2.059 1.00 0.00 C ATOM 318 OE1 GLU A 23 -8.620 -16.396 -1.446 1.00 0.00 O ATOM 319 OE2 GLU A 23 -8.803 -14.292 -2.056 1.00 0.00 O ATOM 0 H GLU A 23 -2.715 -16.537 -1.894 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.042 -17.509 -3.246 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.093 -16.574 -1.185 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -5.323 -15.032 -1.498 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -6.695 -14.550 -3.320 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.046 -16.236 -3.645 1.00 0.00 H new ATOM 326 N ASP A 24 -4.579 -15.819 -5.037 1.00 0.00 N ATOM 327 CA ASP A 24 -4.126 -14.989 -6.147 1.00 0.00 C ATOM 328 C ASP A 24 -4.743 -13.596 -6.073 1.00 0.00 C ATOM 329 O ASP A 24 -5.942 -13.424 -6.298 1.00 0.00 O ATOM 330 CB ASP A 24 -4.480 -15.647 -7.482 1.00 0.00 C ATOM 331 CG ASP A 24 -5.975 -15.829 -7.659 1.00 0.00 C ATOM 332 OD1 ASP A 24 -6.582 -16.565 -6.853 1.00 0.00 O ATOM 333 OD2 ASP A 24 -6.537 -15.236 -8.603 1.00 0.00 O ATOM 0 H ASP A 24 -5.316 -16.482 -5.279 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.043 -14.891 -6.075 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.092 -15.038 -8.298 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.988 -16.618 -7.547 1.00 0.00 H new ATOM 338 N LEU A 25 -3.918 -12.605 -5.755 1.00 0.00 N ATOM 339 CA LEU A 25 -4.383 -11.227 -5.649 1.00 0.00 C ATOM 340 C LEU A 25 -3.879 -10.391 -6.821 1.00 0.00 C ATOM 341 O LEU A 25 -3.228 -9.364 -6.630 1.00 0.00 O ATOM 342 CB LEU A 25 -3.916 -10.610 -4.330 1.00 0.00 C ATOM 343 CG LEU A 25 -4.747 -10.958 -3.094 1.00 0.00 C ATOM 344 CD1 LEU A 25 -4.453 -12.378 -2.636 1.00 0.00 C ATOM 345 CD2 LEU A 25 -4.475 -9.966 -1.972 1.00 0.00 C ATOM 0 H LEU A 25 -2.923 -12.730 -5.566 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.473 -11.234 -5.673 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.887 -10.922 -4.151 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.906 -9.526 -4.443 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.802 -10.895 -3.359 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -5.053 -12.608 -1.756 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.699 -13.077 -3.436 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.395 -12.469 -2.388 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.075 -10.229 -1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -3.418 -9.996 -1.708 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.737 -8.961 -2.303 1.00 0.00 H new ATOM 357 N SER A 26 -4.187 -10.837 -8.035 1.00 0.00 N ATOM 358 CA SER A 26 -3.764 -10.131 -9.239 1.00 0.00 C ATOM 359 C SER A 26 -4.910 -9.304 -9.815 1.00 0.00 C ATOM 360 O SER A 26 -4.714 -8.495 -10.722 1.00 0.00 O ATOM 361 CB SER A 26 -3.260 -11.124 -10.287 1.00 0.00 C ATOM 362 OG SER A 26 -4.194 -12.169 -10.491 1.00 0.00 O ATOM 0 H SER A 26 -4.728 -11.684 -8.211 1.00 0.00 H new ATOM 0 HA SER A 26 -2.952 -9.456 -8.968 1.00 0.00 H new ATOM 0 HB2 SER A 26 -3.080 -10.604 -11.228 1.00 0.00 H new ATOM 0 HB3 SER A 26 -2.306 -11.542 -9.967 1.00 0.00 H new ATOM 0 HG SER A 26 -3.849 -12.789 -11.167 1.00 0.00 H new ATOM 368 N LYS A 27 -6.109 -9.514 -9.282 1.00 0.00 N ATOM 369 CA LYS A 27 -7.289 -8.790 -9.740 1.00 0.00 C ATOM 370 C LYS A 27 -7.673 -7.695 -8.750 1.00 0.00 C ATOM 371 O LYS A 27 -8.522 -6.851 -9.039 1.00 0.00 O ATOM 372 CB LYS A 27 -8.462 -9.753 -9.932 1.00 0.00 C ATOM 373 CG LYS A 27 -8.422 -10.505 -11.251 1.00 0.00 C ATOM 374 CD LYS A 27 -8.778 -9.601 -12.419 1.00 0.00 C ATOM 375 CE LYS A 27 -8.712 -10.348 -13.742 1.00 0.00 C ATOM 376 NZ LYS A 27 -7.317 -10.445 -14.255 1.00 0.00 N ATOM 0 H LYS A 27 -6.289 -10.181 -8.531 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.050 -8.324 -10.696 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -8.468 -10.473 -9.113 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -9.395 -9.193 -9.871 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -7.427 -10.922 -11.403 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.117 -11.344 -11.214 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.781 -9.199 -12.277 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.095 -8.752 -12.445 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -9.123 -11.350 -13.614 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -9.335 -9.839 -14.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -7.314 -10.961 -15.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -6.934 -9.489 -14.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -6.728 -10.953 -13.565 1.00 0.00 H new ATOM 390 N LYS A 28 -7.042 -7.712 -7.581 1.00 0.00 N ATOM 391 CA LYS A 28 -7.315 -6.720 -6.548 1.00 0.00 C ATOM 392 C LYS A 28 -6.495 -5.454 -6.779 1.00 0.00 C ATOM 393 O LYS A 28 -6.967 -4.345 -6.537 1.00 0.00 O ATOM 394 CB LYS A 28 -7.006 -7.295 -5.164 1.00 0.00 C ATOM 395 CG LYS A 28 -8.017 -8.326 -4.694 1.00 0.00 C ATOM 396 CD LYS A 28 -8.103 -8.372 -3.178 1.00 0.00 C ATOM 397 CE LYS A 28 -8.552 -9.740 -2.687 1.00 0.00 C ATOM 398 NZ LYS A 28 -10.034 -9.884 -2.728 1.00 0.00 N ATOM 0 H LYS A 28 -6.337 -8.403 -7.325 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.373 -6.461 -6.599 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.016 -7.751 -5.182 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.968 -6.480 -4.441 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.997 -8.090 -5.108 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.739 -9.309 -5.074 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.130 -8.132 -2.750 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.801 -7.612 -2.829 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.094 -10.515 -3.302 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.200 -9.893 -1.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.301 -10.829 -2.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -10.470 -9.161 -2.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.368 -9.763 -3.706 1.00 0.00 H new ATOM 412 N ASN A 29 -5.264 -5.630 -7.250 1.00 0.00 N ATOM 413 CA ASN A 29 -4.379 -4.502 -7.515 1.00 0.00 C ATOM 414 C ASN A 29 -5.127 -3.378 -8.225 1.00 0.00 C ATOM 415 O ASN A 29 -6.112 -3.602 -8.929 1.00 0.00 O ATOM 416 CB ASN A 29 -3.186 -4.950 -8.362 1.00 0.00 C ATOM 417 CG ASN A 29 -3.614 -5.665 -9.630 1.00 0.00 C ATOM 418 OD1 ASN A 29 -4.652 -5.352 -10.212 1.00 0.00 O ATOM 419 ND2 ASN A 29 -2.812 -6.631 -10.062 1.00 0.00 N ATOM 0 H ASN A 29 -4.857 -6.543 -7.456 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.016 -4.125 -6.559 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -2.583 -4.081 -8.624 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -2.552 -5.611 -7.771 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -3.047 -7.148 -10.909 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -1.961 -6.856 -9.547 1.00 0.00 H new ATOM 426 N PRO A 30 -4.650 -2.138 -8.038 1.00 0.00 N ATOM 427 CA PRO A 30 -3.479 -1.859 -7.202 1.00 0.00 C ATOM 428 C PRO A 30 -3.759 -2.081 -5.719 1.00 0.00 C ATOM 429 O PRO A 30 -4.902 -2.303 -5.320 1.00 0.00 O ATOM 430 CB PRO A 30 -3.191 -0.381 -7.476 1.00 0.00 C ATOM 431 CG PRO A 30 -4.502 0.188 -7.896 1.00 0.00 C ATOM 432 CD PRO A 30 -5.217 -0.914 -8.627 1.00 0.00 C ATOM 0 HA PRO A 30 -2.645 -2.520 -7.436 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -2.809 0.120 -6.586 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.439 -0.262 -8.256 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -5.078 0.521 -7.032 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.362 1.056 -8.540 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.296 -0.860 -8.480 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.039 -0.865 -9.701 1.00 0.00 H new ATOM 440 N ILE A 31 -2.708 -2.019 -4.908 1.00 0.00 N ATOM 441 CA ILE A 31 -2.842 -2.212 -3.470 1.00 0.00 C ATOM 442 C ILE A 31 -2.197 -1.065 -2.699 1.00 0.00 C ATOM 443 O ILE A 31 -2.218 -1.041 -1.469 1.00 0.00 O ATOM 444 CB ILE A 31 -2.207 -3.541 -3.018 1.00 0.00 C ATOM 445 CG1 ILE A 31 -0.737 -3.597 -3.436 1.00 0.00 C ATOM 446 CG2 ILE A 31 -2.974 -4.719 -3.600 1.00 0.00 C ATOM 447 CD1 ILE A 31 0.060 -4.655 -2.705 1.00 0.00 C ATOM 0 H ILE A 31 -1.755 -1.837 -5.223 1.00 0.00 H new ATOM 0 HA ILE A 31 -3.910 -2.237 -3.253 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.258 -3.600 -1.931 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -0.680 -3.787 -4.508 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.280 -2.623 -3.260 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.514 -5.651 -3.272 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.008 -4.685 -3.257 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.951 -4.666 -4.688 1.00 0.00 H new ATOM 0 HD11 ILE A 31 1.093 -4.637 -3.052 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.034 -4.455 -1.634 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -0.372 -5.636 -2.902 1.00 0.00 H new ATOM 459 N ALA A 32 -1.625 -0.115 -3.431 1.00 0.00 N ATOM 460 CA ALA A 32 -0.976 1.036 -2.817 1.00 0.00 C ATOM 461 C ALA A 32 -1.171 2.291 -3.661 1.00 0.00 C ATOM 462 O ALA A 32 -0.765 2.341 -4.822 1.00 0.00 O ATOM 463 CB ALA A 32 0.506 0.761 -2.612 1.00 0.00 C ATOM 0 H ALA A 32 -1.598 -0.120 -4.451 1.00 0.00 H new ATOM 0 HA ALA A 32 -1.440 1.207 -1.845 1.00 0.00 H new ATOM 0 HB1 ALA A 32 0.977 1.630 -2.153 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.629 -0.105 -1.961 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.975 0.561 -3.575 1.00 0.00 H new ATOM 469 N LYS A 33 -1.797 3.304 -3.071 1.00 0.00 N ATOM 470 CA LYS A 33 -2.047 4.560 -3.769 1.00 0.00 C ATOM 471 C LYS A 33 -1.148 5.669 -3.230 1.00 0.00 C ATOM 472 O LYS A 33 -0.410 6.304 -3.985 1.00 0.00 O ATOM 473 CB LYS A 33 -3.515 4.965 -3.624 1.00 0.00 C ATOM 474 CG LYS A 33 -4.466 4.105 -4.439 1.00 0.00 C ATOM 475 CD LYS A 33 -4.417 4.466 -5.914 1.00 0.00 C ATOM 476 CE LYS A 33 -5.300 5.664 -6.225 1.00 0.00 C ATOM 477 NZ LYS A 33 -6.710 5.262 -6.489 1.00 0.00 N ATOM 0 H LYS A 33 -2.141 3.280 -2.111 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.820 4.411 -4.825 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.797 4.908 -2.573 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.628 6.006 -3.928 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.207 3.054 -4.312 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.482 4.231 -4.066 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.389 4.686 -6.202 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.739 3.612 -6.509 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.272 6.362 -5.388 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.904 6.191 -7.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.279 6.107 -6.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.740 4.616 -7.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -7.097 4.782 -5.651 1.00 0.00 H new ATOM 491 N ILE A 34 -1.213 5.895 -1.923 1.00 0.00 N ATOM 492 CA ILE A 34 -0.403 6.925 -1.285 1.00 0.00 C ATOM 493 C ILE A 34 -0.303 8.168 -2.162 1.00 0.00 C ATOM 494 O ILE A 34 0.769 8.759 -2.301 1.00 0.00 O ATOM 495 CB ILE A 34 1.016 6.414 -0.975 1.00 0.00 C ATOM 496 CG1 ILE A 34 1.741 6.040 -2.269 1.00 0.00 C ATOM 497 CG2 ILE A 34 0.955 5.221 -0.032 1.00 0.00 C ATOM 498 CD1 ILE A 34 3.233 5.858 -2.096 1.00 0.00 C ATOM 0 H ILE A 34 -1.818 5.379 -1.285 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.900 7.182 -0.350 1.00 0.00 H new ATOM 0 HB ILE A 34 1.575 7.212 -0.485 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.314 5.117 -2.661 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.562 6.816 -3.013 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.966 4.871 0.178 1.00 0.00 H new ATOM 0 HG22 ILE A 34 0.473 5.518 0.900 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.382 4.419 -0.497 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.681 5.594 -3.054 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.673 6.787 -1.733 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.421 5.062 -1.376 1.00 0.00 H new ATOM 510 N HIS A 35 -1.427 8.561 -2.753 1.00 0.00 N ATOM 511 CA HIS A 35 -1.467 9.736 -3.616 1.00 0.00 C ATOM 512 C HIS A 35 -0.938 10.966 -2.884 1.00 0.00 C ATOM 513 O HIS A 35 -1.081 11.086 -1.668 1.00 0.00 O ATOM 514 CB HIS A 35 -2.895 9.992 -4.100 1.00 0.00 C ATOM 515 CG HIS A 35 -3.859 10.286 -2.992 1.00 0.00 C ATOM 516 ND1 HIS A 35 -4.886 11.198 -3.112 1.00 0.00 N ATOM 517 CD2 HIS A 35 -3.948 9.782 -1.739 1.00 0.00 C ATOM 518 CE1 HIS A 35 -5.565 11.243 -1.980 1.00 0.00 C ATOM 519 NE2 HIS A 35 -5.017 10.393 -1.130 1.00 0.00 N ATOM 0 H HIS A 35 -2.322 8.083 -2.650 1.00 0.00 H new ATOM 0 HA HIS A 35 -0.828 9.544 -4.478 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -2.889 10.830 -4.797 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -3.244 9.120 -4.653 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -3.300 9.038 -1.300 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -6.423 11.869 -1.783 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -5.336 10.219 -0.177 1.00 0.00 H new ATOM 528 N SER A 36 -0.325 11.877 -3.634 1.00 0.00 N ATOM 529 CA SER A 36 0.230 13.095 -3.056 1.00 0.00 C ATOM 530 C SER A 36 -0.684 14.288 -3.321 1.00 0.00 C ATOM 531 O SER A 36 -0.892 14.682 -4.469 1.00 0.00 O ATOM 532 CB SER A 36 1.622 13.368 -3.628 1.00 0.00 C ATOM 533 OG SER A 36 2.559 12.408 -3.172 1.00 0.00 O ATOM 0 H SER A 36 -0.200 11.794 -4.643 1.00 0.00 H new ATOM 0 HA SER A 36 0.309 12.953 -1.978 1.00 0.00 H new ATOM 0 HB2 SER A 36 1.581 13.351 -4.717 1.00 0.00 H new ATOM 0 HB3 SER A 36 1.949 14.366 -3.337 1.00 0.00 H new ATOM 0 HG SER A 36 3.308 12.864 -2.735 1.00 0.00 H new ATOM 539 N ASP A 37 -1.228 14.857 -2.251 1.00 0.00 N ATOM 540 CA ASP A 37 -2.120 16.005 -2.366 1.00 0.00 C ATOM 541 C ASP A 37 -1.473 17.115 -3.189 1.00 0.00 C ATOM 542 O ASP A 37 -1.993 17.513 -4.232 1.00 0.00 O ATOM 543 CB ASP A 37 -2.490 16.532 -0.979 1.00 0.00 C ATOM 544 CG ASP A 37 -2.851 15.419 -0.015 1.00 0.00 C ATOM 545 OD1 ASP A 37 -3.694 14.571 -0.376 1.00 0.00 O ATOM 546 OD2 ASP A 37 -2.292 15.395 1.102 1.00 0.00 O ATOM 0 H ASP A 37 -1.067 14.542 -1.294 1.00 0.00 H new ATOM 0 HA ASP A 37 -3.027 15.680 -2.876 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -1.653 17.102 -0.575 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -3.331 17.220 -1.067 1.00 0.00 H new ATOM 551 N LEU A 38 -0.337 17.613 -2.712 1.00 0.00 N ATOM 552 CA LEU A 38 0.381 18.678 -3.403 1.00 0.00 C ATOM 553 C LEU A 38 0.356 18.462 -4.913 1.00 0.00 C ATOM 554 O LEU A 38 0.266 19.416 -5.685 1.00 0.00 O ATOM 555 CB LEU A 38 1.828 18.748 -2.910 1.00 0.00 C ATOM 556 CG LEU A 38 2.071 19.597 -1.662 1.00 0.00 C ATOM 557 CD1 LEU A 38 3.366 19.185 -0.980 1.00 0.00 C ATOM 558 CD2 LEU A 38 2.103 21.076 -2.022 1.00 0.00 C ATOM 0 H LEU A 38 0.106 17.296 -1.850 1.00 0.00 H new ATOM 0 HA LEU A 38 -0.118 19.621 -3.182 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.171 17.733 -2.707 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.447 19.139 -3.717 1.00 0.00 H new ATOM 0 HG LEU A 38 1.249 19.430 -0.966 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.522 19.800 -0.094 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.306 18.137 -0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.200 19.322 -1.669 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.277 21.666 -1.122 1.00 0.00 H new ATOM 0 HD22 LEU A 38 2.905 21.259 -2.737 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.150 21.363 -2.465 1.00 0.00 H new ATOM 570 N ALA A 39 0.435 17.201 -5.326 1.00 0.00 N ATOM 571 CA ALA A 39 0.417 16.859 -6.743 1.00 0.00 C ATOM 572 C ALA A 39 -0.873 17.332 -7.406 1.00 0.00 C ATOM 573 O ALA A 39 -0.847 17.904 -8.494 1.00 0.00 O ATOM 574 CB ALA A 39 0.587 15.358 -6.926 1.00 0.00 C ATOM 0 H ALA A 39 0.512 16.400 -4.700 1.00 0.00 H new ATOM 0 HA ALA A 39 1.251 17.370 -7.225 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.572 15.117 -7.989 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.539 15.045 -6.497 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.227 14.836 -6.424 1.00 0.00 H new ATOM 580 N GLU A 40 -1.998 17.088 -6.741 1.00 0.00 N ATOM 581 CA GLU A 40 -3.298 17.489 -7.268 1.00 0.00 C ATOM 582 C GLU A 40 -3.587 18.952 -6.948 1.00 0.00 C ATOM 583 O GLU A 40 -3.799 19.764 -7.849 1.00 0.00 O ATOM 584 CB GLU A 40 -4.402 16.601 -6.691 1.00 0.00 C ATOM 585 CG GLU A 40 -4.489 15.233 -7.345 1.00 0.00 C ATOM 586 CD GLU A 40 -5.896 14.668 -7.333 1.00 0.00 C ATOM 587 OE1 GLU A 40 -6.308 14.125 -6.286 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.584 14.768 -8.370 1.00 0.00 O ATOM 0 H GLU A 40 -2.036 16.615 -5.838 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.275 17.370 -8.351 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.232 16.473 -5.622 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.360 17.109 -6.802 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.139 15.304 -8.375 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.821 14.544 -6.828 1.00 0.00 H new ATOM 595 N GLU A 41 -3.594 19.281 -5.660 1.00 0.00 N ATOM 596 CA GLU A 41 -3.858 20.646 -5.222 1.00 0.00 C ATOM 597 C GLU A 41 -3.175 21.654 -6.141 1.00 0.00 C ATOM 598 O GLU A 41 -3.633 22.788 -6.286 1.00 0.00 O ATOM 599 CB GLU A 41 -3.379 20.845 -3.782 1.00 0.00 C ATOM 600 CG GLU A 41 -4.428 20.498 -2.739 1.00 0.00 C ATOM 601 CD GLU A 41 -5.655 21.385 -2.827 1.00 0.00 C ATOM 602 OE1 GLU A 41 -5.525 22.603 -2.584 1.00 0.00 O ATOM 603 OE2 GLU A 41 -6.744 20.860 -3.138 1.00 0.00 O ATOM 0 H GLU A 41 -3.420 18.621 -4.902 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.934 20.812 -5.265 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.494 20.231 -3.614 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.076 21.884 -3.649 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.727 19.457 -2.863 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.990 20.588 -1.745 1.00 0.00 H new ATOM 610 N ARG A 42 -2.076 21.233 -6.758 1.00 0.00 N ATOM 611 CA ARG A 42 -1.328 22.099 -7.662 1.00 0.00 C ATOM 612 C ARG A 42 -1.464 21.626 -9.106 1.00 0.00 C ATOM 613 O ARG A 42 -2.102 22.281 -9.928 1.00 0.00 O ATOM 614 CB ARG A 42 0.149 22.135 -7.262 1.00 0.00 C ATOM 615 CG ARG A 42 0.427 22.988 -6.035 1.00 0.00 C ATOM 616 CD ARG A 42 0.599 24.454 -6.403 1.00 0.00 C ATOM 617 NE ARG A 42 1.757 24.668 -7.268 1.00 0.00 N ATOM 618 CZ ARG A 42 1.924 25.753 -8.016 1.00 0.00 C ATOM 619 NH1 ARG A 42 1.013 26.716 -8.006 1.00 0.00 N ATOM 620 NH2 ARG A 42 3.004 25.876 -8.777 1.00 0.00 N ATOM 0 H ARG A 42 -1.684 20.298 -6.649 1.00 0.00 H new ATOM 0 HA ARG A 42 -1.742 23.104 -7.587 1.00 0.00 H new ATOM 0 HB2 ARG A 42 0.490 21.117 -7.071 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.734 22.516 -8.099 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -0.393 22.884 -5.325 1.00 0.00 H new ATOM 0 HG3 ARG A 42 1.328 22.629 -5.537 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -0.300 24.810 -6.906 1.00 0.00 H new ATOM 0 HD3 ARG A 42 0.711 25.045 -5.494 1.00 0.00 H new ATOM 0 HE ARG A 42 2.476 23.945 -7.299 1.00 0.00 H new ATOM 0 HH11 ARG A 42 0.181 26.625 -7.423 1.00 0.00 H new ATOM 0 HH12 ARG A 42 1.144 27.548 -8.581 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.707 25.137 -8.788 1.00 0.00 H new ATOM 0 HH22 ARG A 42 3.131 26.710 -9.351 1.00 0.00 H new ATOM 634 N GLY A 43 -0.857 20.482 -9.408 1.00 0.00 N ATOM 635 CA GLY A 43 -0.922 19.940 -10.753 1.00 0.00 C ATOM 636 C GLY A 43 0.424 19.445 -11.244 1.00 0.00 C ATOM 637 O GLY A 43 0.730 19.533 -12.434 1.00 0.00 O ATOM 0 H GLY A 43 -0.322 19.921 -8.745 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.638 19.119 -10.776 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.294 20.707 -11.433 1.00 0.00 H new ATOM 641 N LEU A 44 1.232 18.925 -10.326 1.00 0.00 N ATOM 642 CA LEU A 44 2.555 18.415 -10.672 1.00 0.00 C ATOM 643 C LEU A 44 2.547 16.892 -10.753 1.00 0.00 C ATOM 644 O LEU A 44 1.681 16.233 -10.177 1.00 0.00 O ATOM 645 CB LEU A 44 3.586 18.877 -9.640 1.00 0.00 C ATOM 646 CG LEU A 44 3.626 20.379 -9.357 1.00 0.00 C ATOM 647 CD1 LEU A 44 2.623 20.745 -8.274 1.00 0.00 C ATOM 648 CD2 LEU A 44 5.030 20.808 -8.954 1.00 0.00 C ATOM 0 H LEU A 44 0.995 18.845 -9.337 1.00 0.00 H new ATOM 0 HA LEU A 44 2.826 18.811 -11.651 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.391 18.356 -8.703 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.574 18.565 -9.978 1.00 0.00 H new ATOM 0 HG LEU A 44 3.353 20.909 -10.270 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.666 21.818 -8.086 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.619 20.474 -8.601 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.864 20.206 -7.358 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.040 21.880 -8.756 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.331 20.270 -8.055 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.726 20.581 -9.762 1.00 0.00 H new ATOM 660 N LYS A 45 3.518 16.339 -11.472 1.00 0.00 N ATOM 661 CA LYS A 45 3.627 14.893 -11.627 1.00 0.00 C ATOM 662 C LYS A 45 4.652 14.317 -10.655 1.00 0.00 C ATOM 663 O LYS A 45 5.844 14.260 -10.959 1.00 0.00 O ATOM 664 CB LYS A 45 4.017 14.541 -13.064 1.00 0.00 C ATOM 665 CG LYS A 45 2.826 14.342 -13.986 1.00 0.00 C ATOM 666 CD LYS A 45 3.186 13.477 -15.183 1.00 0.00 C ATOM 667 CE LYS A 45 1.946 12.889 -15.838 1.00 0.00 C ATOM 668 NZ LYS A 45 2.293 11.900 -16.896 1.00 0.00 N ATOM 0 H LYS A 45 4.241 16.871 -11.957 1.00 0.00 H new ATOM 0 HA LYS A 45 2.654 14.455 -11.404 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.648 15.334 -13.465 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.616 13.630 -13.056 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.010 13.878 -13.433 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.466 15.311 -14.331 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.736 14.073 -15.912 1.00 0.00 H new ATOM 0 HD3 LYS A 45 3.848 12.671 -14.865 1.00 0.00 H new ATOM 0 HE2 LYS A 45 1.328 12.408 -15.080 1.00 0.00 H new ATOM 0 HE3 LYS A 45 1.350 13.691 -16.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 1.421 11.522 -17.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 2.861 12.365 -17.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.840 11.121 -16.477 1.00 0.00 H new ATOM 682 N ILE A 46 4.180 13.890 -9.489 1.00 0.00 N ATOM 683 CA ILE A 46 5.056 13.316 -8.475 1.00 0.00 C ATOM 684 C ILE A 46 5.223 11.814 -8.679 1.00 0.00 C ATOM 685 O ILE A 46 4.264 11.108 -8.990 1.00 0.00 O ATOM 686 CB ILE A 46 4.518 13.573 -7.055 1.00 0.00 C ATOM 687 CG1 ILE A 46 4.907 14.976 -6.585 1.00 0.00 C ATOM 688 CG2 ILE A 46 5.045 12.521 -6.091 1.00 0.00 C ATOM 689 CD1 ILE A 46 3.898 15.601 -5.647 1.00 0.00 C ATOM 0 H ILE A 46 3.196 13.931 -9.223 1.00 0.00 H new ATOM 0 HA ILE A 46 6.024 13.805 -8.582 1.00 0.00 H new ATOM 0 HB ILE A 46 3.430 13.506 -7.077 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.874 14.928 -6.085 1.00 0.00 H new ATOM 0 HG13 ILE A 46 5.030 15.621 -7.455 1.00 0.00 H new ATOM 0 HG21 ILE A 46 4.656 12.716 -5.092 1.00 0.00 H new ATOM 0 HG22 ILE A 46 4.723 11.533 -6.419 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.134 12.559 -6.070 1.00 0.00 H new ATOM 0 HD11 ILE A 46 4.239 16.594 -5.355 1.00 0.00 H new ATOM 0 HD12 ILE A 46 2.935 15.682 -6.150 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.792 14.978 -4.759 1.00 0.00 H new ATOM 701 N THR A 47 6.449 11.331 -8.501 1.00 0.00 N ATOM 702 CA THR A 47 6.743 9.913 -8.665 1.00 0.00 C ATOM 703 C THR A 47 6.739 9.192 -7.322 1.00 0.00 C ATOM 704 O THR A 47 7.113 9.764 -6.298 1.00 0.00 O ATOM 705 CB THR A 47 8.107 9.697 -9.347 1.00 0.00 C ATOM 706 OG1 THR A 47 8.047 10.129 -10.711 1.00 0.00 O ATOM 707 CG2 THR A 47 8.513 8.232 -9.291 1.00 0.00 C ATOM 0 H THR A 47 7.254 11.902 -8.243 1.00 0.00 H new ATOM 0 HA THR A 47 5.959 9.499 -9.299 1.00 0.00 H new ATOM 0 HB THR A 47 8.853 10.286 -8.813 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.632 10.906 -10.834 1.00 0.00 H new ATOM 0 HG21 THR A 47 9.479 8.103 -9.779 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.586 7.914 -8.251 1.00 0.00 H new ATOM 0 HG23 THR A 47 7.765 7.627 -9.803 1.00 0.00 H new ATOM 715 N TYR A 48 6.314 7.933 -7.333 1.00 0.00 N ATOM 716 CA TYR A 48 6.260 7.134 -6.114 1.00 0.00 C ATOM 717 C TYR A 48 7.248 5.974 -6.179 1.00 0.00 C ATOM 718 O TYR A 48 7.351 5.287 -7.196 1.00 0.00 O ATOM 719 CB TYR A 48 4.844 6.602 -5.891 1.00 0.00 C ATOM 720 CG TYR A 48 3.774 7.665 -5.995 1.00 0.00 C ATOM 721 CD1 TYR A 48 3.588 8.593 -4.977 1.00 0.00 C ATOM 722 CD2 TYR A 48 2.947 7.740 -7.109 1.00 0.00 C ATOM 723 CE1 TYR A 48 2.611 9.565 -5.067 1.00 0.00 C ATOM 724 CE2 TYR A 48 1.969 8.710 -7.208 1.00 0.00 C ATOM 725 CZ TYR A 48 1.804 9.620 -6.185 1.00 0.00 C ATOM 726 OH TYR A 48 0.830 10.587 -6.279 1.00 0.00 O ATOM 0 H TYR A 48 6.002 7.444 -8.172 1.00 0.00 H new ATOM 0 HA TYR A 48 6.536 7.775 -5.277 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.640 5.820 -6.622 1.00 0.00 H new ATOM 0 HB3 TYR A 48 4.790 6.139 -4.906 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.218 8.553 -4.101 1.00 0.00 H new ATOM 0 HD2 TYR A 48 3.071 7.028 -7.911 1.00 0.00 H new ATOM 0 HE1 TYR A 48 2.479 10.278 -4.267 1.00 0.00 H new ATOM 0 HE2 TYR A 48 1.337 8.756 -8.082 1.00 0.00 H new ATOM 0 HH TYR A 48 0.351 10.488 -7.128 1.00 0.00 H new ATOM 736 N LYS A 49 7.972 5.760 -5.086 1.00 0.00 N ATOM 737 CA LYS A 49 8.951 4.681 -5.016 1.00 0.00 C ATOM 738 C LYS A 49 8.614 3.713 -3.887 1.00 0.00 C ATOM 739 O LYS A 49 7.920 4.072 -2.935 1.00 0.00 O ATOM 740 CB LYS A 49 10.356 5.253 -4.808 1.00 0.00 C ATOM 741 CG LYS A 49 11.460 4.371 -5.365 1.00 0.00 C ATOM 742 CD LYS A 49 12.686 5.184 -5.744 1.00 0.00 C ATOM 743 CE LYS A 49 13.473 5.611 -4.514 1.00 0.00 C ATOM 744 NZ LYS A 49 14.615 6.499 -4.867 1.00 0.00 N ATOM 0 H LYS A 49 7.900 6.319 -4.236 1.00 0.00 H new ATOM 0 HA LYS A 49 8.922 4.136 -5.959 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.413 6.234 -5.280 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.524 5.402 -3.741 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.735 3.620 -4.625 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.092 3.836 -6.241 1.00 0.00 H new ATOM 0 HD2 LYS A 49 13.326 4.595 -6.400 1.00 0.00 H new ATOM 0 HD3 LYS A 49 12.380 6.066 -6.306 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.811 6.130 -3.821 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.847 4.727 -3.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.126 6.768 -4.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.261 5.996 -5.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 14.257 7.355 -5.338 1.00 0.00 H new ATOM 758 N TYR A 50 9.108 2.485 -3.999 1.00 0.00 N ATOM 759 CA TYR A 50 8.858 1.465 -2.988 1.00 0.00 C ATOM 760 C TYR A 50 10.078 0.568 -2.805 1.00 0.00 C ATOM 761 O TYR A 50 10.654 0.076 -3.776 1.00 0.00 O ATOM 762 CB TYR A 50 7.644 0.619 -3.376 1.00 0.00 C ATOM 763 CG TYR A 50 6.374 1.423 -3.541 1.00 0.00 C ATOM 764 CD1 TYR A 50 6.086 2.067 -4.738 1.00 0.00 C ATOM 765 CD2 TYR A 50 5.462 1.540 -2.498 1.00 0.00 C ATOM 766 CE1 TYR A 50 4.927 2.803 -4.892 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.300 2.273 -2.644 1.00 0.00 C ATOM 768 CZ TYR A 50 4.037 2.903 -3.843 1.00 0.00 C ATOM 769 OH TYR A 50 2.882 3.635 -3.992 1.00 0.00 O ATOM 0 H TYR A 50 9.684 2.172 -4.780 1.00 0.00 H new ATOM 0 HA TYR A 50 8.655 1.969 -2.043 1.00 0.00 H new ATOM 0 HB2 TYR A 50 7.858 0.098 -4.309 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.485 -0.144 -2.614 1.00 0.00 H new ATOM 0 HD1 TYR A 50 6.780 1.991 -5.562 1.00 0.00 H new ATOM 0 HD2 TYR A 50 5.665 1.049 -1.558 1.00 0.00 H new ATOM 0 HE1 TYR A 50 4.719 3.298 -5.829 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.601 2.352 -1.824 1.00 0.00 H new ATOM 0 HH TYR A 50 2.178 3.254 -3.427 1.00 0.00 H new ATOM 779 N THR A 51 10.468 0.359 -1.552 1.00 0.00 N ATOM 780 CA THR A 51 11.620 -0.478 -1.239 1.00 0.00 C ATOM 781 C THR A 51 11.344 -1.365 -0.030 1.00 0.00 C ATOM 782 O THR A 51 10.396 -1.132 0.719 1.00 0.00 O ATOM 783 CB THR A 51 12.874 0.373 -0.961 1.00 0.00 C ATOM 784 OG1 THR A 51 12.868 0.824 0.398 1.00 0.00 O ATOM 785 CG2 THR A 51 12.933 1.570 -1.898 1.00 0.00 C ATOM 0 H THR A 51 10.003 0.758 -0.737 1.00 0.00 H new ATOM 0 HA THR A 51 11.801 -1.105 -2.112 1.00 0.00 H new ATOM 0 HB THR A 51 13.754 -0.247 -1.133 1.00 0.00 H new ATOM 0 HG1 THR A 51 13.669 1.363 0.567 1.00 0.00 H new ATOM 0 HG21 THR A 51 13.826 2.156 -1.683 1.00 0.00 H new ATOM 0 HG22 THR A 51 12.966 1.222 -2.931 1.00 0.00 H new ATOM 0 HG23 THR A 51 12.048 2.190 -1.752 1.00 0.00 H new ATOM 793 N GLY A 52 12.178 -2.383 0.154 1.00 0.00 N ATOM 794 CA GLY A 52 12.007 -3.289 1.275 1.00 0.00 C ATOM 795 C GLY A 52 11.957 -4.742 0.844 1.00 0.00 C ATOM 796 O GLY A 52 12.601 -5.130 -0.131 1.00 0.00 O ATOM 0 H GLY A 52 12.969 -2.597 -0.453 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.828 -3.150 1.979 1.00 0.00 H new ATOM 0 HA3 GLY A 52 11.087 -3.038 1.804 1.00 0.00 H new ATOM 800 N LYS A 53 11.193 -5.548 1.572 1.00 0.00 N ATOM 801 CA LYS A 53 11.061 -6.966 1.261 1.00 0.00 C ATOM 802 C LYS A 53 10.001 -7.192 0.188 1.00 0.00 C ATOM 803 O LYS A 53 8.860 -6.753 0.328 1.00 0.00 O ATOM 804 CB LYS A 53 10.702 -7.755 2.522 1.00 0.00 C ATOM 805 CG LYS A 53 11.137 -9.209 2.475 1.00 0.00 C ATOM 806 CD LYS A 53 10.703 -9.962 3.721 1.00 0.00 C ATOM 807 CE LYS A 53 11.672 -9.740 4.872 1.00 0.00 C ATOM 808 NZ LYS A 53 12.868 -10.620 4.769 1.00 0.00 N ATOM 0 H LYS A 53 10.655 -5.243 2.383 1.00 0.00 H new ATOM 0 HA LYS A 53 12.019 -7.319 0.880 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.163 -7.274 3.385 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.623 -7.712 2.672 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.712 -9.688 1.593 1.00 0.00 H new ATOM 0 HG3 LYS A 53 12.221 -9.262 2.376 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.706 -9.636 4.016 1.00 0.00 H new ATOM 0 HD3 LYS A 53 10.638 -11.027 3.499 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.989 -8.697 4.884 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.163 -9.929 5.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.503 -10.438 5.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.569 -11.616 4.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 13.369 -10.422 3.879 1.00 0.00 H new ATOM 822 N GLY A 54 10.385 -7.881 -0.882 1.00 0.00 N ATOM 823 CA GLY A 54 9.454 -8.154 -1.962 1.00 0.00 C ATOM 824 C GLY A 54 9.774 -7.365 -3.216 1.00 0.00 C ATOM 825 O GLY A 54 9.502 -7.818 -4.328 1.00 0.00 O ATOM 0 H GLY A 54 11.324 -8.255 -1.021 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.472 -9.219 -2.192 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.442 -7.915 -1.634 1.00 0.00 H new ATOM 829 N ILE A 55 10.352 -6.182 -3.038 1.00 0.00 N ATOM 830 CA ILE A 55 10.709 -5.329 -4.165 1.00 0.00 C ATOM 831 C ILE A 55 12.204 -5.399 -4.456 1.00 0.00 C ATOM 832 O ILE A 55 12.625 -5.954 -5.472 1.00 0.00 O ATOM 833 CB ILE A 55 10.315 -3.863 -3.907 1.00 0.00 C ATOM 834 CG1 ILE A 55 8.811 -3.753 -3.650 1.00 0.00 C ATOM 835 CG2 ILE A 55 10.722 -2.991 -5.086 1.00 0.00 C ATOM 836 CD1 ILE A 55 8.412 -2.482 -2.933 1.00 0.00 C ATOM 0 H ILE A 55 10.583 -5.792 -2.124 1.00 0.00 H new ATOM 0 HA ILE A 55 10.156 -5.699 -5.029 1.00 0.00 H new ATOM 0 HB ILE A 55 10.842 -3.511 -3.020 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.283 -3.804 -4.602 1.00 0.00 H new ATOM 0 HG13 ILE A 55 8.488 -4.610 -3.060 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.437 -1.957 -4.890 1.00 0.00 H new ATOM 0 HG22 ILE A 55 11.801 -3.050 -5.226 1.00 0.00 H new ATOM 0 HG23 ILE A 55 10.219 -3.341 -5.988 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.332 -2.472 -2.784 1.00 0.00 H new ATOM 0 HD12 ILE A 55 8.912 -2.438 -1.965 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.704 -1.619 -3.532 1.00 0.00 H new ATOM 848 N THR A 56 13.004 -4.834 -3.557 1.00 0.00 N ATOM 849 CA THR A 56 14.452 -4.833 -3.716 1.00 0.00 C ATOM 850 C THR A 56 15.071 -6.096 -3.129 1.00 0.00 C ATOM 851 O THR A 56 15.783 -6.826 -3.818 1.00 0.00 O ATOM 852 CB THR A 56 15.090 -3.603 -3.043 1.00 0.00 C ATOM 853 OG1 THR A 56 14.880 -3.654 -1.628 1.00 0.00 O ATOM 854 CG2 THR A 56 14.503 -2.315 -3.601 1.00 0.00 C ATOM 0 H THR A 56 12.673 -4.371 -2.711 1.00 0.00 H new ATOM 0 HA THR A 56 14.652 -4.797 -4.787 1.00 0.00 H new ATOM 0 HB THR A 56 16.160 -3.617 -3.252 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.290 -2.869 -1.208 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.969 -1.460 -3.111 1.00 0.00 H new ATOM 0 HG22 THR A 56 14.690 -2.264 -4.674 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.428 -2.296 -3.419 1.00 0.00 H new ATOM 862 N GLU A 57 14.794 -6.349 -1.854 1.00 0.00 N ATOM 863 CA GLU A 57 15.325 -7.525 -1.176 1.00 0.00 C ATOM 864 C GLU A 57 14.482 -8.759 -1.486 1.00 0.00 C ATOM 865 O GLU A 57 13.259 -8.690 -1.611 1.00 0.00 O ATOM 866 CB GLU A 57 15.372 -7.293 0.336 1.00 0.00 C ATOM 867 CG GLU A 57 16.609 -6.543 0.799 1.00 0.00 C ATOM 868 CD GLU A 57 17.811 -7.452 0.972 1.00 0.00 C ATOM 869 OE1 GLU A 57 18.505 -7.717 -0.031 1.00 0.00 O ATOM 870 OE2 GLU A 57 18.057 -7.898 2.113 1.00 0.00 O ATOM 0 H GLU A 57 14.205 -5.755 -1.270 1.00 0.00 H new ATOM 0 HA GLU A 57 16.338 -7.696 -1.541 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.485 -6.735 0.637 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.330 -8.256 0.844 1.00 0.00 H new ATOM 0 HG2 GLU A 57 16.849 -5.763 0.076 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.395 -6.046 1.745 1.00 0.00 H new ATOM 877 N PRO A 58 15.150 -9.915 -1.614 1.00 0.00 N ATOM 878 CA PRO A 58 14.483 -11.186 -1.911 1.00 0.00 C ATOM 879 C PRO A 58 13.643 -11.687 -0.742 1.00 0.00 C ATOM 880 O PRO A 58 13.883 -11.347 0.417 1.00 0.00 O ATOM 881 CB PRO A 58 15.647 -12.142 -2.183 1.00 0.00 C ATOM 882 CG PRO A 58 16.797 -11.561 -1.435 1.00 0.00 C ATOM 883 CD PRO A 58 16.608 -10.070 -1.478 1.00 0.00 C ATOM 0 HA PRO A 58 13.785 -11.095 -2.743 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.420 -13.151 -1.838 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.862 -12.210 -3.249 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.816 -11.922 -0.407 1.00 0.00 H new ATOM 0 HG3 PRO A 58 17.744 -11.848 -1.892 1.00 0.00 H new ATOM 0 HD2 PRO A 58 16.980 -9.591 -0.572 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.140 -9.622 -2.317 1.00 0.00 H new ATOM 891 N PRO A 59 12.635 -12.516 -1.049 1.00 0.00 N ATOM 892 CA PRO A 59 12.339 -12.928 -2.424 1.00 0.00 C ATOM 893 C PRO A 59 11.784 -11.784 -3.265 1.00 0.00 C ATOM 894 O PRO A 59 10.832 -11.113 -2.868 1.00 0.00 O ATOM 895 CB PRO A 59 11.284 -14.023 -2.248 1.00 0.00 C ATOM 896 CG PRO A 59 10.632 -13.714 -0.944 1.00 0.00 C ATOM 897 CD PRO A 59 11.705 -13.115 -0.077 1.00 0.00 C ATOM 0 HA PRO A 59 13.233 -13.260 -2.951 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.562 -14.012 -3.064 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.739 -15.013 -2.238 1.00 0.00 H new ATOM 0 HG2 PRO A 59 9.804 -13.018 -1.077 1.00 0.00 H new ATOM 0 HG3 PRO A 59 10.221 -14.616 -0.490 1.00 0.00 H new ATOM 0 HD2 PRO A 59 11.300 -12.367 0.605 1.00 0.00 H new ATOM 0 HD3 PRO A 59 12.196 -13.872 0.535 1.00 0.00 H new ATOM 905 N PHE A 60 12.386 -11.566 -4.430 1.00 0.00 N ATOM 906 CA PHE A 60 11.951 -10.502 -5.328 1.00 0.00 C ATOM 907 C PHE A 60 11.049 -11.053 -6.428 1.00 0.00 C ATOM 908 O PHE A 60 10.998 -12.260 -6.657 1.00 0.00 O ATOM 909 CB PHE A 60 13.163 -9.803 -5.948 1.00 0.00 C ATOM 910 CG PHE A 60 14.341 -10.712 -6.150 1.00 0.00 C ATOM 911 CD1 PHE A 60 14.236 -11.836 -6.952 1.00 0.00 C ATOM 912 CD2 PHE A 60 15.554 -10.443 -5.536 1.00 0.00 C ATOM 913 CE1 PHE A 60 15.319 -12.675 -7.140 1.00 0.00 C ATOM 914 CE2 PHE A 60 16.640 -11.277 -5.721 1.00 0.00 C ATOM 915 CZ PHE A 60 16.522 -12.396 -6.523 1.00 0.00 C ATOM 0 H PHE A 60 13.176 -12.112 -4.774 1.00 0.00 H new ATOM 0 HA PHE A 60 11.381 -9.778 -4.745 1.00 0.00 H new ATOM 0 HB2 PHE A 60 12.874 -9.377 -6.909 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.461 -8.973 -5.307 1.00 0.00 H new ATOM 0 HD1 PHE A 60 13.297 -12.060 -7.436 1.00 0.00 H new ATOM 0 HD2 PHE A 60 15.652 -9.571 -4.906 1.00 0.00 H new ATOM 0 HE1 PHE A 60 15.224 -13.548 -7.769 1.00 0.00 H new ATOM 0 HE2 PHE A 60 17.581 -11.054 -5.239 1.00 0.00 H new ATOM 0 HZ PHE A 60 17.369 -13.051 -6.667 1.00 0.00 H new ATOM 925 N GLY A 61 10.339 -10.157 -7.107 1.00 0.00 N ATOM 926 CA GLY A 61 9.447 -10.571 -8.174 1.00 0.00 C ATOM 927 C GLY A 61 8.005 -10.671 -7.719 1.00 0.00 C ATOM 928 O GLY A 61 7.109 -10.922 -8.526 1.00 0.00 O ATOM 0 H GLY A 61 10.366 -9.152 -6.937 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.516 -9.860 -8.997 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.771 -11.538 -8.559 1.00 0.00 H new ATOM 932 N ILE A 62 7.780 -10.477 -6.424 1.00 0.00 N ATOM 933 CA ILE A 62 6.436 -10.547 -5.864 1.00 0.00 C ATOM 934 C ILE A 62 5.657 -9.266 -6.141 1.00 0.00 C ATOM 935 O ILE A 62 4.485 -9.308 -6.516 1.00 0.00 O ATOM 936 CB ILE A 62 6.472 -10.795 -4.345 1.00 0.00 C ATOM 937 CG1 ILE A 62 6.955 -12.216 -4.049 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.097 -10.559 -3.737 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.146 -12.495 -2.574 1.00 0.00 C ATOM 0 H ILE A 62 8.511 -10.270 -5.743 1.00 0.00 H new ATOM 0 HA ILE A 62 5.935 -11.385 -6.349 1.00 0.00 H new ATOM 0 HB ILE A 62 7.173 -10.093 -3.894 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.236 -12.927 -4.455 1.00 0.00 H new ATOM 0 HG13 ILE A 62 7.899 -12.386 -4.568 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.139 -10.738 -2.663 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.789 -9.530 -3.921 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.377 -11.240 -4.191 1.00 0.00 H new ATOM 0 HD11 ILE A 62 7.489 -13.521 -2.439 1.00 0.00 H new ATOM 0 HD12 ILE A 62 7.888 -11.808 -2.167 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.199 -12.358 -2.052 1.00 0.00 H new ATOM 951 N PHE A 63 6.317 -8.127 -5.955 1.00 0.00 N ATOM 952 CA PHE A 63 5.687 -6.832 -6.186 1.00 0.00 C ATOM 953 C PHE A 63 6.317 -6.126 -7.382 1.00 0.00 C ATOM 954 O PHE A 63 7.518 -6.248 -7.628 1.00 0.00 O ATOM 955 CB PHE A 63 5.807 -5.954 -4.939 1.00 0.00 C ATOM 956 CG PHE A 63 5.048 -6.485 -3.756 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.731 -6.894 -3.888 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.653 -6.575 -2.513 1.00 0.00 C ATOM 959 CE1 PHE A 63 3.031 -7.382 -2.801 1.00 0.00 C ATOM 960 CE2 PHE A 63 4.957 -7.063 -1.422 1.00 0.00 C ATOM 961 CZ PHE A 63 3.645 -7.468 -1.567 1.00 0.00 C ATOM 0 H PHE A 63 7.287 -8.075 -5.645 1.00 0.00 H new ATOM 0 HA PHE A 63 4.632 -7.002 -6.402 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.859 -5.858 -4.672 1.00 0.00 H new ATOM 0 HB3 PHE A 63 5.445 -4.953 -5.173 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.246 -6.831 -4.851 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.679 -6.261 -2.395 1.00 0.00 H new ATOM 0 HE1 PHE A 63 2.004 -7.696 -2.916 1.00 0.00 H new ATOM 0 HE2 PHE A 63 5.439 -7.127 -0.458 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.100 -7.851 -0.717 1.00 0.00 H new ATOM 971 N VAL A 64 5.499 -5.387 -8.125 1.00 0.00 N ATOM 972 CA VAL A 64 5.975 -4.660 -9.295 1.00 0.00 C ATOM 973 C VAL A 64 5.466 -3.223 -9.295 1.00 0.00 C ATOM 974 O VAL A 64 4.272 -2.976 -9.121 1.00 0.00 O ATOM 975 CB VAL A 64 5.535 -5.349 -10.601 1.00 0.00 C ATOM 976 CG1 VAL A 64 6.024 -6.789 -10.636 1.00 0.00 C ATOM 977 CG2 VAL A 64 4.023 -5.287 -10.752 1.00 0.00 C ATOM 0 H VAL A 64 4.503 -5.276 -7.937 1.00 0.00 H new ATOM 0 HA VAL A 64 7.064 -4.656 -9.243 1.00 0.00 H new ATOM 0 HB VAL A 64 5.983 -4.818 -11.441 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.704 -7.260 -11.566 1.00 0.00 H new ATOM 0 HG12 VAL A 64 7.112 -6.805 -10.577 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.607 -7.336 -9.790 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.730 -5.778 -11.680 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.552 -5.793 -9.909 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.702 -4.246 -10.776 1.00 0.00 H new ATOM 987 N PHE A 65 6.379 -2.278 -9.491 1.00 0.00 N ATOM 988 CA PHE A 65 6.022 -0.864 -9.512 1.00 0.00 C ATOM 989 C PHE A 65 6.818 -0.119 -10.581 1.00 0.00 C ATOM 990 O PHE A 65 7.992 -0.405 -10.807 1.00 0.00 O ATOM 991 CB PHE A 65 6.272 -0.232 -8.141 1.00 0.00 C ATOM 992 CG PHE A 65 7.692 0.211 -7.935 1.00 0.00 C ATOM 993 CD1 PHE A 65 8.178 1.343 -8.570 1.00 0.00 C ATOM 994 CD2 PHE A 65 8.542 -0.505 -7.108 1.00 0.00 C ATOM 995 CE1 PHE A 65 9.484 1.754 -8.382 1.00 0.00 C ATOM 996 CE2 PHE A 65 9.849 -0.099 -6.916 1.00 0.00 C ATOM 997 CZ PHE A 65 10.321 1.031 -7.555 1.00 0.00 C ATOM 0 H PHE A 65 7.371 -2.465 -9.637 1.00 0.00 H new ATOM 0 HA PHE A 65 4.962 -0.786 -9.752 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.611 0.626 -8.019 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.008 -0.950 -7.365 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.528 1.911 -9.220 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.179 -1.391 -6.608 1.00 0.00 H new ATOM 0 HE1 PHE A 65 9.850 2.639 -8.881 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.501 -0.665 -6.267 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.343 1.349 -7.408 1.00 0.00 H new ATOM 1007 N ASN A 66 6.167 0.838 -11.235 1.00 0.00 N ATOM 1008 CA ASN A 66 6.812 1.624 -12.280 1.00 0.00 C ATOM 1009 C ASN A 66 6.866 3.100 -11.897 1.00 0.00 C ATOM 1010 O ASN A 66 6.162 3.543 -10.988 1.00 0.00 O ATOM 1011 CB ASN A 66 6.067 1.457 -13.606 1.00 0.00 C ATOM 1012 CG ASN A 66 6.901 1.889 -14.797 1.00 0.00 C ATOM 1013 OD1 ASN A 66 8.099 1.615 -14.861 1.00 0.00 O ATOM 1014 ND2 ASN A 66 6.268 2.567 -15.747 1.00 0.00 N ATOM 0 H ASN A 66 5.194 1.087 -11.060 1.00 0.00 H new ATOM 0 HA ASN A 66 7.833 1.260 -12.395 1.00 0.00 H new ATOM 0 HB2 ASN A 66 5.778 0.413 -13.728 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.147 2.041 -13.579 1.00 0.00 H new ATOM 0 HD21 ASN A 66 6.776 2.883 -16.573 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.273 2.771 -15.651 1.00 0.00 H new ATOM 1021 N LYS A 67 7.704 3.857 -12.596 1.00 0.00 N ATOM 1022 CA LYS A 67 7.850 5.283 -12.332 1.00 0.00 C ATOM 1023 C LYS A 67 6.906 6.098 -13.210 1.00 0.00 C ATOM 1024 O LYS A 67 6.426 7.157 -12.806 1.00 0.00 O ATOM 1025 CB LYS A 67 9.296 5.723 -12.573 1.00 0.00 C ATOM 1026 CG LYS A 67 9.424 7.164 -13.034 1.00 0.00 C ATOM 1027 CD LYS A 67 10.732 7.784 -12.570 1.00 0.00 C ATOM 1028 CE LYS A 67 10.644 9.302 -12.524 1.00 0.00 C ATOM 1029 NZ LYS A 67 10.886 9.912 -13.861 1.00 0.00 N ATOM 0 H LYS A 67 8.293 3.506 -13.351 1.00 0.00 H new ATOM 0 HA LYS A 67 7.592 5.462 -11.288 1.00 0.00 H new ATOM 0 HB2 LYS A 67 9.865 5.593 -11.652 1.00 0.00 H new ATOM 0 HB3 LYS A 67 9.746 5.070 -13.321 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.366 7.205 -14.122 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.587 7.746 -12.648 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.986 7.403 -11.581 1.00 0.00 H new ATOM 0 HD3 LYS A 67 11.536 7.485 -13.242 1.00 0.00 H new ATOM 0 HE2 LYS A 67 9.659 9.598 -12.163 1.00 0.00 H new ATOM 0 HE3 LYS A 67 11.374 9.687 -11.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.817 10.947 -13.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 11.836 9.651 -14.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.174 9.565 -14.535 1.00 0.00 H new ATOM 1043 N ASP A 68 6.644 5.598 -14.412 1.00 0.00 N ATOM 1044 CA ASP A 68 5.756 6.279 -15.347 1.00 0.00 C ATOM 1045 C ASP A 68 4.384 6.510 -14.722 1.00 0.00 C ATOM 1046 O ASP A 68 4.028 7.638 -14.379 1.00 0.00 O ATOM 1047 CB ASP A 68 5.613 5.464 -16.634 1.00 0.00 C ATOM 1048 CG ASP A 68 6.946 5.214 -17.312 1.00 0.00 C ATOM 1049 OD1 ASP A 68 7.780 6.142 -17.340 1.00 0.00 O ATOM 1050 OD2 ASP A 68 7.154 4.090 -17.816 1.00 0.00 O ATOM 0 H ASP A 68 7.034 4.723 -14.762 1.00 0.00 H new ATOM 0 HA ASP A 68 6.195 7.248 -15.587 1.00 0.00 H new ATOM 0 HB2 ASP A 68 5.140 4.509 -16.405 1.00 0.00 H new ATOM 0 HB3 ASP A 68 4.952 5.990 -17.322 1.00 0.00 H new ATOM 1055 N THR A 69 3.616 5.435 -14.577 1.00 0.00 N ATOM 1056 CA THR A 69 2.282 5.521 -13.996 1.00 0.00 C ATOM 1057 C THR A 69 2.352 5.688 -12.482 1.00 0.00 C ATOM 1058 O THR A 69 1.675 6.541 -11.910 1.00 0.00 O ATOM 1059 CB THR A 69 1.444 4.271 -14.325 1.00 0.00 C ATOM 1060 OG1 THR A 69 0.121 4.415 -13.795 1.00 0.00 O ATOM 1061 CG2 THR A 69 2.092 3.019 -13.753 1.00 0.00 C ATOM 0 H THR A 69 3.895 4.494 -14.854 1.00 0.00 H new ATOM 0 HA THR A 69 1.802 6.396 -14.434 1.00 0.00 H new ATOM 0 HB THR A 69 1.392 4.170 -15.409 1.00 0.00 H new ATOM 0 HG1 THR A 69 -0.155 3.575 -13.372 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.482 2.149 -13.998 1.00 0.00 H new ATOM 0 HG22 THR A 69 3.087 2.897 -14.181 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.171 3.113 -12.670 1.00 0.00 H new ATOM 1069 N GLY A 70 3.176 4.866 -11.838 1.00 0.00 N ATOM 1070 CA GLY A 70 3.319 4.940 -10.396 1.00 0.00 C ATOM 1071 C GLY A 70 2.234 4.174 -9.666 1.00 0.00 C ATOM 1072 O GLY A 70 1.224 4.750 -9.262 1.00 0.00 O ATOM 0 H GLY A 70 3.746 4.151 -12.289 1.00 0.00 H new ATOM 0 HA2 GLY A 70 4.294 4.545 -10.110 1.00 0.00 H new ATOM 0 HA3 GLY A 70 3.295 5.984 -10.085 1.00 0.00 H new ATOM 1076 N GLU A 71 2.441 2.872 -9.497 1.00 0.00 N ATOM 1077 CA GLU A 71 1.470 2.026 -8.813 1.00 0.00 C ATOM 1078 C GLU A 71 2.128 0.750 -8.297 1.00 0.00 C ATOM 1079 O GLU A 71 3.171 0.329 -8.799 1.00 0.00 O ATOM 1080 CB GLU A 71 0.315 1.674 -9.753 1.00 0.00 C ATOM 1081 CG GLU A 71 0.675 0.627 -10.793 1.00 0.00 C ATOM 1082 CD GLU A 71 -0.195 0.712 -12.032 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -0.153 1.757 -12.715 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -0.918 -0.265 -12.319 1.00 0.00 O ATOM 0 H GLU A 71 3.272 2.380 -9.824 1.00 0.00 H new ATOM 0 HA GLU A 71 1.079 2.582 -7.961 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -0.526 1.312 -9.162 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.018 2.579 -10.261 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.720 0.748 -11.078 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.578 -0.365 -10.353 1.00 0.00 H new ATOM 1091 N LEU A 72 1.512 0.139 -7.291 1.00 0.00 N ATOM 1092 CA LEU A 72 2.036 -1.090 -6.705 1.00 0.00 C ATOM 1093 C LEU A 72 1.069 -2.250 -6.916 1.00 0.00 C ATOM 1094 O LEU A 72 -0.132 -2.120 -6.683 1.00 0.00 O ATOM 1095 CB LEU A 72 2.298 -0.894 -5.210 1.00 0.00 C ATOM 1096 CG LEU A 72 2.988 -2.054 -4.492 1.00 0.00 C ATOM 1097 CD1 LEU A 72 4.490 -2.011 -4.728 1.00 0.00 C ATOM 1098 CD2 LEU A 72 2.679 -2.019 -3.003 1.00 0.00 C ATOM 0 H LEU A 72 0.649 0.475 -6.864 1.00 0.00 H new ATOM 0 HA LEU A 72 2.975 -1.330 -7.204 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.908 0.000 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.345 -0.703 -4.717 1.00 0.00 H new ATOM 0 HG LEU A 72 2.604 -2.989 -4.901 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.964 -2.844 -4.209 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.693 -2.086 -5.796 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.891 -1.072 -4.348 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.178 -2.852 -2.508 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.034 -1.080 -2.580 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.602 -2.100 -2.853 1.00 0.00 H new ATOM 1110 N ASN A 73 1.602 -3.385 -7.356 1.00 0.00 N ATOM 1111 CA ASN A 73 0.786 -4.570 -7.596 1.00 0.00 C ATOM 1112 C ASN A 73 1.483 -5.825 -7.080 1.00 0.00 C ATOM 1113 O ASN A 73 2.660 -5.791 -6.720 1.00 0.00 O ATOM 1114 CB ASN A 73 0.489 -4.715 -9.090 1.00 0.00 C ATOM 1115 CG ASN A 73 0.028 -3.414 -9.717 1.00 0.00 C ATOM 1116 OD1 ASN A 73 -0.572 -2.569 -9.052 1.00 0.00 O ATOM 1117 ND2 ASN A 73 0.307 -3.247 -11.005 1.00 0.00 N ATOM 0 H ASN A 73 2.595 -3.509 -7.554 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.153 -4.450 -7.055 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.385 -5.065 -9.603 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.278 -5.476 -9.233 1.00 0.00 H new ATOM 0 HD21 ASN A 73 0.022 -2.392 -11.482 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.806 -3.974 -11.517 1.00 0.00 H new ATOM 1124 N VAL A 74 0.749 -6.932 -7.048 1.00 0.00 N ATOM 1125 CA VAL A 74 1.296 -8.199 -6.578 1.00 0.00 C ATOM 1126 C VAL A 74 1.101 -9.300 -7.613 1.00 0.00 C ATOM 1127 O VAL A 74 -0.025 -9.607 -8.006 1.00 0.00 O ATOM 1128 CB VAL A 74 0.644 -8.635 -5.252 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -0.852 -8.840 -5.434 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.304 -9.901 -4.725 1.00 0.00 C ATOM 0 H VAL A 74 -0.227 -6.977 -7.342 1.00 0.00 H new ATOM 0 HA VAL A 74 2.362 -8.042 -6.416 1.00 0.00 H new ATOM 0 HB VAL A 74 0.791 -7.843 -4.518 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.295 -9.148 -4.487 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.310 -7.907 -5.763 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.025 -9.613 -6.183 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.831 -10.195 -3.788 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.190 -10.702 -5.456 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.364 -9.714 -4.554 1.00 0.00 H new ATOM 1140 N THR A 75 2.206 -9.895 -8.053 1.00 0.00 N ATOM 1141 CA THR A 75 2.157 -10.962 -9.044 1.00 0.00 C ATOM 1142 C THR A 75 2.681 -12.272 -8.468 1.00 0.00 C ATOM 1143 O THR A 75 3.419 -13.001 -9.130 1.00 0.00 O ATOM 1144 CB THR A 75 2.976 -10.602 -10.298 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.367 -10.845 -10.061 1.00 0.00 O ATOM 1146 CG2 THR A 75 2.769 -9.144 -10.680 1.00 0.00 C ATOM 0 H THR A 75 3.146 -9.655 -7.738 1.00 0.00 H new ATOM 0 HA THR A 75 1.111 -11.084 -9.325 1.00 0.00 H new ATOM 0 HB THR A 75 2.633 -11.229 -11.121 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.518 -11.808 -9.960 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.357 -8.914 -11.568 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.714 -8.969 -10.888 1.00 0.00 H new ATOM 0 HG23 THR A 75 3.088 -8.504 -9.857 1.00 0.00 H new ATOM 1154 N SER A 76 2.294 -12.566 -7.231 1.00 0.00 N ATOM 1155 CA SER A 76 2.728 -13.787 -6.563 1.00 0.00 C ATOM 1156 C SER A 76 1.892 -14.051 -5.315 1.00 0.00 C ATOM 1157 O SER A 76 1.401 -13.121 -4.675 1.00 0.00 O ATOM 1158 CB SER A 76 4.208 -13.691 -6.188 1.00 0.00 C ATOM 1159 OG SER A 76 5.036 -14.063 -7.277 1.00 0.00 O ATOM 0 H SER A 76 1.680 -11.975 -6.671 1.00 0.00 H new ATOM 0 HA SER A 76 2.589 -14.618 -7.255 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.443 -12.672 -5.880 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.413 -14.337 -5.334 1.00 0.00 H new ATOM 0 HG SER A 76 4.541 -13.956 -8.116 1.00 0.00 H new ATOM 1165 N ILE A 77 1.733 -15.326 -4.976 1.00 0.00 N ATOM 1166 CA ILE A 77 0.957 -15.713 -3.804 1.00 0.00 C ATOM 1167 C ILE A 77 1.728 -15.435 -2.518 1.00 0.00 C ATOM 1168 O ILE A 77 2.726 -16.093 -2.224 1.00 0.00 O ATOM 1169 CB ILE A 77 0.577 -17.205 -3.848 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.521 -17.443 -4.887 1.00 0.00 C ATOM 1171 CG2 ILE A 77 0.125 -17.678 -2.475 1.00 0.00 C ATOM 1172 CD1 ILE A 77 -0.182 -16.903 -6.259 1.00 0.00 C ATOM 0 H ILE A 77 2.131 -16.108 -5.496 1.00 0.00 H new ATOM 0 HA ILE A 77 0.047 -15.114 -3.816 1.00 0.00 H new ATOM 0 HB ILE A 77 1.457 -17.780 -4.137 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.712 -18.513 -4.964 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -1.444 -16.979 -4.541 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.140 -18.734 -2.523 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.934 -17.539 -1.758 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.743 -17.100 -2.159 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.005 -17.107 -6.944 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.020 -15.827 -6.197 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.724 -17.385 -6.626 1.00 0.00 H new ATOM 1184 N LEU A 78 1.256 -14.456 -1.753 1.00 0.00 N ATOM 1185 CA LEU A 78 1.900 -14.091 -0.495 1.00 0.00 C ATOM 1186 C LEU A 78 2.146 -15.324 0.369 1.00 0.00 C ATOM 1187 O LEU A 78 1.578 -16.388 0.125 1.00 0.00 O ATOM 1188 CB LEU A 78 1.038 -13.084 0.267 1.00 0.00 C ATOM 1189 CG LEU A 78 0.701 -11.790 -0.476 1.00 0.00 C ATOM 1190 CD1 LEU A 78 0.105 -10.766 0.478 1.00 0.00 C ATOM 1191 CD2 LEU A 78 1.939 -11.229 -1.158 1.00 0.00 C ATOM 0 H LEU A 78 0.431 -13.901 -1.981 1.00 0.00 H new ATOM 0 HA LEU A 78 2.863 -13.635 -0.726 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.105 -13.573 0.546 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.551 -12.824 1.193 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.040 -12.016 -1.242 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.128 -9.852 -0.068 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.807 -11.168 0.920 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.823 -10.543 1.268 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.680 -10.309 -1.682 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.703 -11.018 -0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.322 -11.957 -1.873 1.00 0.00 H new ATOM 1203 N ASP A 79 2.994 -15.171 1.379 1.00 0.00 N ATOM 1204 CA ASP A 79 3.314 -16.271 2.282 1.00 0.00 C ATOM 1205 C ASP A 79 3.479 -15.769 3.713 1.00 0.00 C ATOM 1206 O ASP A 79 4.399 -15.008 4.012 1.00 0.00 O ATOM 1207 CB ASP A 79 4.590 -16.980 1.826 1.00 0.00 C ATOM 1208 CG ASP A 79 4.451 -17.592 0.446 1.00 0.00 C ATOM 1209 OD1 ASP A 79 3.376 -18.157 0.153 1.00 0.00 O ATOM 1210 OD2 ASP A 79 5.416 -17.506 -0.341 1.00 0.00 O ATOM 0 H ASP A 79 3.473 -14.296 1.594 1.00 0.00 H new ATOM 0 HA ASP A 79 2.486 -16.980 2.258 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.416 -16.269 1.823 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.844 -17.761 2.543 1.00 0.00 H new ATOM 1215 N ARG A 80 2.582 -16.200 4.594 1.00 0.00 N ATOM 1216 CA ARG A 80 2.627 -15.792 5.993 1.00 0.00 C ATOM 1217 C ARG A 80 3.708 -16.560 6.748 1.00 0.00 C ATOM 1218 O ARG A 80 4.465 -15.980 7.526 1.00 0.00 O ATOM 1219 CB ARG A 80 1.268 -16.019 6.656 1.00 0.00 C ATOM 1220 CG ARG A 80 1.239 -15.646 8.130 1.00 0.00 C ATOM 1221 CD ARG A 80 -0.092 -16.006 8.770 1.00 0.00 C ATOM 1222 NE ARG A 80 -0.303 -15.298 10.030 1.00 0.00 N ATOM 1223 CZ ARG A 80 0.253 -15.663 11.180 1.00 0.00 C ATOM 1224 NH1 ARG A 80 1.048 -16.722 11.229 1.00 0.00 N ATOM 1225 NH2 ARG A 80 0.013 -14.968 12.284 1.00 0.00 N ATOM 0 H ARG A 80 1.815 -16.832 4.364 1.00 0.00 H new ATOM 0 HA ARG A 80 2.868 -14.730 6.029 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.514 -15.436 6.128 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.992 -17.068 6.550 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.046 -16.160 8.652 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.419 -14.577 8.239 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.902 -15.768 8.080 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.130 -17.081 8.947 1.00 0.00 H new ATOM 0 HE ARG A 80 -0.910 -14.479 10.027 1.00 0.00 H new ATOM 0 HH11 ARG A 80 1.234 -17.259 10.382 1.00 0.00 H new ATOM 0 HH12 ARG A 80 1.473 -17.000 12.113 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.599 -14.153 12.250 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.440 -15.249 13.167 1.00 0.00 H new ATOM 1239 N GLU A 81 3.773 -17.867 6.512 1.00 0.00 N ATOM 1240 CA GLU A 81 4.761 -18.713 7.171 1.00 0.00 C ATOM 1241 C GLU A 81 6.166 -18.143 7.001 1.00 0.00 C ATOM 1242 O GLU A 81 6.988 -18.210 7.914 1.00 0.00 O ATOM 1243 CB GLU A 81 4.703 -20.135 6.609 1.00 0.00 C ATOM 1244 CG GLU A 81 4.952 -20.208 5.112 1.00 0.00 C ATOM 1245 CD GLU A 81 4.842 -21.620 4.570 1.00 0.00 C ATOM 1246 OE1 GLU A 81 3.708 -22.057 4.280 1.00 0.00 O ATOM 1247 OE2 GLU A 81 5.888 -22.287 4.436 1.00 0.00 O ATOM 0 H GLU A 81 3.154 -18.362 5.870 1.00 0.00 H new ATOM 0 HA GLU A 81 4.526 -18.741 8.235 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.442 -20.750 7.122 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.725 -20.563 6.828 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.235 -19.568 4.597 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.945 -19.815 4.893 1.00 0.00 H new ATOM 1254 N GLU A 82 6.433 -17.584 5.825 1.00 0.00 N ATOM 1255 CA GLU A 82 7.739 -17.004 5.535 1.00 0.00 C ATOM 1256 C GLU A 82 7.743 -15.504 5.815 1.00 0.00 C ATOM 1257 O GLU A 82 8.475 -15.023 6.680 1.00 0.00 O ATOM 1258 CB GLU A 82 8.124 -17.263 4.077 1.00 0.00 C ATOM 1259 CG GLU A 82 9.603 -17.060 3.793 1.00 0.00 C ATOM 1260 CD GLU A 82 10.417 -18.321 4.009 1.00 0.00 C ATOM 1261 OE1 GLU A 82 9.870 -19.424 3.797 1.00 0.00 O ATOM 1262 OE2 GLU A 82 11.600 -18.205 4.390 1.00 0.00 O ATOM 0 H GLU A 82 5.763 -17.521 5.058 1.00 0.00 H new ATOM 0 HA GLU A 82 8.472 -17.479 6.187 1.00 0.00 H new ATOM 0 HB2 GLU A 82 7.849 -18.284 3.813 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.545 -16.600 3.434 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.729 -16.723 2.764 1.00 0.00 H new ATOM 0 HG3 GLU A 82 9.988 -16.269 4.437 1.00 0.00 H new ATOM 1269 N THR A 83 6.919 -14.768 5.075 1.00 0.00 N ATOM 1270 CA THR A 83 6.827 -13.323 5.241 1.00 0.00 C ATOM 1271 C THR A 83 5.562 -12.935 5.999 1.00 0.00 C ATOM 1272 O THR A 83 4.485 -12.786 5.421 1.00 0.00 O ATOM 1273 CB THR A 83 6.840 -12.599 3.882 1.00 0.00 C ATOM 1274 OG1 THR A 83 5.867 -13.183 3.007 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.217 -12.676 3.240 1.00 0.00 C ATOM 0 H THR A 83 6.306 -15.150 4.355 1.00 0.00 H new ATOM 0 HA THR A 83 7.700 -13.016 5.816 1.00 0.00 H new ATOM 0 HB THR A 83 6.594 -11.551 4.051 1.00 0.00 H new ATOM 0 HG1 THR A 83 5.128 -13.548 3.537 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.201 -12.158 2.281 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.951 -12.206 3.895 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.488 -13.720 3.083 1.00 0.00 H new ATOM 1283 N PRO A 84 5.693 -12.767 7.323 1.00 0.00 N ATOM 1284 CA PRO A 84 4.570 -12.393 8.188 1.00 0.00 C ATOM 1285 C PRO A 84 4.109 -10.959 7.952 1.00 0.00 C ATOM 1286 O PRO A 84 2.941 -10.630 8.158 1.00 0.00 O ATOM 1287 CB PRO A 84 5.143 -12.545 9.599 1.00 0.00 C ATOM 1288 CG PRO A 84 6.613 -12.367 9.432 1.00 0.00 C ATOM 1289 CD PRO A 84 6.947 -12.928 8.078 1.00 0.00 C ATOM 0 HA PRO A 84 3.690 -13.009 8.002 1.00 0.00 H new ATOM 0 HB2 PRO A 84 4.728 -11.799 10.277 1.00 0.00 H new ATOM 0 HB3 PRO A 84 4.908 -13.523 10.019 1.00 0.00 H new ATOM 0 HG2 PRO A 84 6.888 -11.314 9.497 1.00 0.00 H new ATOM 0 HG3 PRO A 84 7.161 -12.889 10.217 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.770 -12.387 7.611 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.248 -13.974 8.139 1.00 0.00 H new ATOM 1297 N PHE A 85 5.034 -10.108 7.519 1.00 0.00 N ATOM 1298 CA PHE A 85 4.722 -8.708 7.256 1.00 0.00 C ATOM 1299 C PHE A 85 5.676 -8.125 6.217 1.00 0.00 C ATOM 1300 O PHE A 85 6.896 -8.225 6.352 1.00 0.00 O ATOM 1301 CB PHE A 85 4.800 -7.895 8.549 1.00 0.00 C ATOM 1302 CG PHE A 85 6.002 -8.217 9.390 1.00 0.00 C ATOM 1303 CD1 PHE A 85 5.949 -9.225 10.340 1.00 0.00 C ATOM 1304 CD2 PHE A 85 7.185 -7.514 9.229 1.00 0.00 C ATOM 1305 CE1 PHE A 85 7.054 -9.523 11.115 1.00 0.00 C ATOM 1306 CE2 PHE A 85 8.293 -7.808 10.001 1.00 0.00 C ATOM 1307 CZ PHE A 85 8.228 -8.815 10.945 1.00 0.00 C ATOM 0 H PHE A 85 6.006 -10.364 7.343 1.00 0.00 H new ATOM 0 HA PHE A 85 3.707 -8.655 6.862 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.814 -6.834 8.301 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.898 -8.073 9.135 1.00 0.00 H new ATOM 0 HD1 PHE A 85 5.035 -9.783 10.476 1.00 0.00 H new ATOM 0 HD2 PHE A 85 7.242 -6.727 8.492 1.00 0.00 H new ATOM 0 HE1 PHE A 85 7.000 -10.309 11.853 1.00 0.00 H new ATOM 0 HE2 PHE A 85 9.209 -7.251 9.867 1.00 0.00 H new ATOM 0 HZ PHE A 85 9.093 -9.048 11.548 1.00 0.00 H new ATOM 1317 N PHE A 86 5.111 -7.516 5.180 1.00 0.00 N ATOM 1318 CA PHE A 86 5.909 -6.918 4.116 1.00 0.00 C ATOM 1319 C PHE A 86 6.307 -5.489 4.473 1.00 0.00 C ATOM 1320 O PHE A 86 5.687 -4.527 4.017 1.00 0.00 O ATOM 1321 CB PHE A 86 5.132 -6.929 2.798 1.00 0.00 C ATOM 1322 CG PHE A 86 5.224 -8.233 2.059 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.326 -8.521 1.271 1.00 0.00 C ATOM 1324 CD2 PHE A 86 4.208 -9.170 2.152 1.00 0.00 C ATOM 1325 CE1 PHE A 86 6.415 -9.721 0.589 1.00 0.00 C ATOM 1326 CE2 PHE A 86 4.291 -10.371 1.473 1.00 0.00 C ATOM 1327 CZ PHE A 86 5.395 -10.646 0.690 1.00 0.00 C ATOM 0 H PHE A 86 4.103 -7.424 5.054 1.00 0.00 H new ATOM 0 HA PHE A 86 6.816 -7.511 3.999 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.084 -6.709 3.001 1.00 0.00 H new ATOM 0 HB3 PHE A 86 5.507 -6.130 2.158 1.00 0.00 H new ATOM 0 HD1 PHE A 86 7.126 -7.800 1.188 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.342 -8.960 2.762 1.00 0.00 H new ATOM 0 HE1 PHE A 86 7.280 -9.934 -0.021 1.00 0.00 H new ATOM 0 HE2 PHE A 86 3.493 -11.094 1.555 1.00 0.00 H new ATOM 0 HZ PHE A 86 5.460 -11.583 0.157 1.00 0.00 H new ATOM 1337 N LEU A 87 7.345 -5.357 5.292 1.00 0.00 N ATOM 1338 CA LEU A 87 7.826 -4.046 5.712 1.00 0.00 C ATOM 1339 C LEU A 87 8.368 -3.259 4.523 1.00 0.00 C ATOM 1340 O LEU A 87 9.417 -3.592 3.970 1.00 0.00 O ATOM 1341 CB LEU A 87 8.914 -4.197 6.777 1.00 0.00 C ATOM 1342 CG LEU A 87 8.967 -3.103 7.843 1.00 0.00 C ATOM 1343 CD1 LEU A 87 9.329 -1.765 7.217 1.00 0.00 C ATOM 1344 CD2 LEU A 87 7.637 -3.008 8.576 1.00 0.00 C ATOM 0 H LEU A 87 7.869 -6.142 5.678 1.00 0.00 H new ATOM 0 HA LEU A 87 6.986 -3.496 6.136 1.00 0.00 H new ATOM 0 HB2 LEU A 87 8.775 -5.156 7.276 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.881 -4.235 6.276 1.00 0.00 H new ATOM 0 HG LEU A 87 9.740 -3.364 8.566 1.00 0.00 H new ATOM 0 HD11 LEU A 87 9.362 -0.998 7.991 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.305 -1.840 6.738 1.00 0.00 H new ATOM 0 HD13 LEU A 87 8.579 -1.497 6.472 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.693 -2.224 9.331 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.846 -2.771 7.865 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.418 -3.961 9.058 1.00 0.00 H new ATOM 1356 N LEU A 88 7.648 -2.211 4.137 1.00 0.00 N ATOM 1357 CA LEU A 88 8.058 -1.374 3.015 1.00 0.00 C ATOM 1358 C LEU A 88 8.035 0.102 3.400 1.00 0.00 C ATOM 1359 O LEU A 88 7.547 0.469 4.469 1.00 0.00 O ATOM 1360 CB LEU A 88 7.141 -1.613 1.813 1.00 0.00 C ATOM 1361 CG LEU A 88 6.929 -3.073 1.412 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.588 -3.246 0.716 1.00 0.00 C ATOM 1363 CD2 LEU A 88 8.062 -3.550 0.515 1.00 0.00 C ATOM 0 H LEU A 88 6.778 -1.921 4.584 1.00 0.00 H new ATOM 0 HA LEU A 88 9.079 -1.645 2.746 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.168 -1.171 2.030 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.550 -1.077 0.957 1.00 0.00 H new ATOM 0 HG LEU A 88 6.927 -3.681 2.317 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.455 -4.291 0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.786 -2.945 1.390 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.560 -2.626 -0.180 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.894 -4.591 0.240 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.095 -2.937 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 88 9.009 -3.464 1.048 1.00 0.00 H new ATOM 1375 N THR A 89 8.564 0.946 2.520 1.00 0.00 N ATOM 1376 CA THR A 89 8.604 2.382 2.767 1.00 0.00 C ATOM 1377 C THR A 89 8.343 3.168 1.487 1.00 0.00 C ATOM 1378 O THR A 89 8.944 2.899 0.448 1.00 0.00 O ATOM 1379 CB THR A 89 9.962 2.814 3.352 1.00 0.00 C ATOM 1380 OG1 THR A 89 10.231 2.084 4.554 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.974 4.307 3.646 1.00 0.00 C ATOM 0 H THR A 89 8.971 0.660 1.630 1.00 0.00 H new ATOM 0 HA THR A 89 7.819 2.600 3.491 1.00 0.00 H new ATOM 0 HB THR A 89 10.736 2.599 2.615 1.00 0.00 H new ATOM 0 HG1 THR A 89 11.097 2.363 4.919 1.00 0.00 H new ATOM 0 HG21 THR A 89 10.943 4.589 4.058 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.797 4.861 2.724 1.00 0.00 H new ATOM 0 HG23 THR A 89 9.191 4.542 4.367 1.00 0.00 H new ATOM 1389 N GLY A 90 7.441 4.141 1.569 1.00 0.00 N ATOM 1390 CA GLY A 90 7.116 4.951 0.409 1.00 0.00 C ATOM 1391 C GLY A 90 7.959 6.208 0.326 1.00 0.00 C ATOM 1392 O GLY A 90 8.266 6.827 1.345 1.00 0.00 O ATOM 0 H GLY A 90 6.929 4.383 2.418 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.260 4.360 -0.495 1.00 0.00 H new ATOM 0 HA3 GLY A 90 6.062 5.226 0.445 1.00 0.00 H new ATOM 1396 N TYR A 91 8.337 6.585 -0.891 1.00 0.00 N ATOM 1397 CA TYR A 91 9.153 7.774 -1.103 1.00 0.00 C ATOM 1398 C TYR A 91 8.595 8.622 -2.242 1.00 0.00 C ATOM 1399 O TYR A 91 8.866 8.363 -3.414 1.00 0.00 O ATOM 1400 CB TYR A 91 10.599 7.378 -1.409 1.00 0.00 C ATOM 1401 CG TYR A 91 11.326 6.782 -0.225 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.195 5.436 0.092 1.00 0.00 C ATOM 1403 CD2 TYR A 91 12.146 7.567 0.577 1.00 0.00 C ATOM 1404 CE1 TYR A 91 11.857 4.888 1.173 1.00 0.00 C ATOM 1405 CE2 TYR A 91 12.814 7.027 1.660 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.666 5.687 1.954 1.00 0.00 C ATOM 1407 OH TYR A 91 13.328 5.145 3.031 1.00 0.00 O ATOM 0 H TYR A 91 8.091 6.084 -1.745 1.00 0.00 H new ATOM 0 HA TYR A 91 9.131 8.366 -0.188 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.605 6.659 -2.228 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.143 8.258 -1.754 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.564 4.807 -0.518 1.00 0.00 H new ATOM 0 HD2 TYR A 91 12.263 8.616 0.350 1.00 0.00 H new ATOM 0 HE1 TYR A 91 11.742 3.840 1.406 1.00 0.00 H new ATOM 0 HE2 TYR A 91 13.448 7.650 2.273 1.00 0.00 H new ATOM 0 HH TYR A 91 13.856 5.841 3.475 1.00 0.00 H new ATOM 1417 N ALA A 92 7.815 9.638 -1.887 1.00 0.00 N ATOM 1418 CA ALA A 92 7.220 10.527 -2.878 1.00 0.00 C ATOM 1419 C ALA A 92 8.174 11.659 -3.242 1.00 0.00 C ATOM 1420 O ALA A 92 8.389 12.581 -2.454 1.00 0.00 O ATOM 1421 CB ALA A 92 5.904 11.088 -2.361 1.00 0.00 C ATOM 0 H ALA A 92 7.580 9.866 -0.921 1.00 0.00 H new ATOM 0 HA ALA A 92 7.025 9.947 -3.780 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.471 11.750 -3.111 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.214 10.269 -2.158 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.083 11.648 -1.443 1.00 0.00 H new ATOM 1427 N LEU A 93 8.744 11.584 -4.440 1.00 0.00 N ATOM 1428 CA LEU A 93 9.676 12.604 -4.909 1.00 0.00 C ATOM 1429 C LEU A 93 9.129 13.317 -6.141 1.00 0.00 C ATOM 1430 O LEU A 93 8.298 12.772 -6.868 1.00 0.00 O ATOM 1431 CB LEU A 93 11.032 11.973 -5.231 1.00 0.00 C ATOM 1432 CG LEU A 93 11.473 10.827 -4.320 1.00 0.00 C ATOM 1433 CD1 LEU A 93 12.560 10.000 -4.990 1.00 0.00 C ATOM 1434 CD2 LEU A 93 11.958 11.365 -2.982 1.00 0.00 C ATOM 0 H LEU A 93 8.577 10.828 -5.104 1.00 0.00 H new ATOM 0 HA LEU A 93 9.803 13.339 -4.114 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.004 11.605 -6.257 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.792 12.754 -5.193 1.00 0.00 H new ATOM 0 HG LEU A 93 10.614 10.181 -4.139 1.00 0.00 H new ATOM 0 HD11 LEU A 93 12.861 9.189 -4.327 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.178 9.583 -5.922 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.421 10.634 -5.202 1.00 0.00 H new ATOM 0 HD21 LEU A 93 12.268 10.535 -2.347 1.00 0.00 H new ATOM 0 HD22 LEU A 93 12.804 12.034 -3.144 1.00 0.00 H new ATOM 0 HD23 LEU A 93 11.151 11.912 -2.496 1.00 0.00 H new ATOM 1446 N ASP A 94 9.601 14.537 -6.370 1.00 0.00 N ATOM 1447 CA ASP A 94 9.162 15.325 -7.516 1.00 0.00 C ATOM 1448 C ASP A 94 9.906 14.906 -8.780 1.00 0.00 C ATOM 1449 O ASP A 94 10.694 13.962 -8.764 1.00 0.00 O ATOM 1450 CB ASP A 94 9.379 16.815 -7.251 1.00 0.00 C ATOM 1451 CG ASP A 94 10.709 17.096 -6.579 1.00 0.00 C ATOM 1452 OD1 ASP A 94 11.757 16.875 -7.222 1.00 0.00 O ATOM 1453 OD2 ASP A 94 10.701 17.538 -5.412 1.00 0.00 O ATOM 0 H ASP A 94 10.288 15.002 -5.777 1.00 0.00 H new ATOM 0 HA ASP A 94 8.098 15.143 -7.665 1.00 0.00 H new ATOM 0 HB2 ASP A 94 9.329 17.360 -8.194 1.00 0.00 H new ATOM 0 HB3 ASP A 94 8.571 17.191 -6.623 1.00 0.00 H new ATOM 1458 N ALA A 95 9.648 15.615 -9.874 1.00 0.00 N ATOM 1459 CA ALA A 95 10.294 15.318 -11.147 1.00 0.00 C ATOM 1460 C ALA A 95 11.808 15.469 -11.043 1.00 0.00 C ATOM 1461 O ALA A 95 12.556 14.850 -11.799 1.00 0.00 O ATOM 1462 CB ALA A 95 9.745 16.221 -12.241 1.00 0.00 C ATOM 0 H ALA A 95 8.996 16.399 -9.904 1.00 0.00 H new ATOM 0 HA ALA A 95 10.076 14.281 -11.404 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.236 15.988 -13.186 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.672 16.060 -12.341 1.00 0.00 H new ATOM 0 HB3 ALA A 95 9.933 17.263 -11.981 1.00 0.00 H new ATOM 1468 N ARG A 96 12.251 16.297 -10.103 1.00 0.00 N ATOM 1469 CA ARG A 96 13.676 16.531 -9.902 1.00 0.00 C ATOM 1470 C ARG A 96 14.286 15.448 -9.017 1.00 0.00 C ATOM 1471 O ARG A 96 15.428 15.037 -9.219 1.00 0.00 O ATOM 1472 CB ARG A 96 13.905 17.907 -9.273 1.00 0.00 C ATOM 1473 CG ARG A 96 13.963 19.038 -10.286 1.00 0.00 C ATOM 1474 CD ARG A 96 14.239 20.374 -9.614 1.00 0.00 C ATOM 1475 NE ARG A 96 14.089 21.494 -10.540 1.00 0.00 N ATOM 1476 CZ ARG A 96 13.813 22.734 -10.154 1.00 0.00 C ATOM 1477 NH1 ARG A 96 13.658 23.013 -8.867 1.00 0.00 N ATOM 1478 NH2 ARG A 96 13.692 23.700 -11.057 1.00 0.00 N ATOM 0 H ARG A 96 11.644 16.817 -9.469 1.00 0.00 H new ATOM 0 HA ARG A 96 14.164 16.498 -10.876 1.00 0.00 H new ATOM 0 HB2 ARG A 96 13.105 18.109 -8.561 1.00 0.00 H new ATOM 0 HB3 ARG A 96 14.837 17.888 -8.708 1.00 0.00 H new ATOM 0 HG2 ARG A 96 14.742 18.831 -11.020 1.00 0.00 H new ATOM 0 HG3 ARG A 96 13.019 19.091 -10.829 1.00 0.00 H new ATOM 0 HD2 ARG A 96 13.557 20.505 -8.774 1.00 0.00 H new ATOM 0 HD3 ARG A 96 15.250 20.373 -9.207 1.00 0.00 H new ATOM 0 HE ARG A 96 14.203 21.313 -11.537 1.00 0.00 H new ATOM 0 HH11 ARG A 96 13.751 22.274 -8.170 1.00 0.00 H new ATOM 0 HH12 ARG A 96 13.446 23.967 -8.574 1.00 0.00 H new ATOM 0 HH21 ARG A 96 13.811 23.490 -12.048 1.00 0.00 H new ATOM 0 HH22 ARG A 96 13.480 24.652 -10.760 1.00 0.00 H new ATOM 1492 N GLY A 97 13.515 14.989 -8.035 1.00 0.00 N ATOM 1493 CA GLY A 97 13.997 13.959 -7.134 1.00 0.00 C ATOM 1494 C GLY A 97 14.702 14.532 -5.921 1.00 0.00 C ATOM 1495 O GLY A 97 15.547 13.873 -5.317 1.00 0.00 O ATOM 0 H GLY A 97 12.566 15.312 -7.848 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.158 13.346 -6.806 1.00 0.00 H new ATOM 0 HA3 GLY A 97 14.681 13.302 -7.671 1.00 0.00 H new ATOM 1499 N ASN A 98 14.355 15.764 -5.564 1.00 0.00 N ATOM 1500 CA ASN A 98 14.963 16.428 -4.416 1.00 0.00 C ATOM 1501 C ASN A 98 14.175 16.140 -3.142 1.00 0.00 C ATOM 1502 O ASN A 98 14.340 16.821 -2.131 1.00 0.00 O ATOM 1503 CB ASN A 98 15.036 17.937 -4.653 1.00 0.00 C ATOM 1504 CG ASN A 98 16.332 18.355 -5.322 1.00 0.00 C ATOM 1505 OD1 ASN A 98 17.396 18.341 -4.704 1.00 0.00 O ATOM 1506 ND2 ASN A 98 16.247 18.730 -6.594 1.00 0.00 N ATOM 0 H ASN A 98 13.656 16.323 -6.053 1.00 0.00 H new ATOM 0 HA ASN A 98 15.973 16.037 -4.294 1.00 0.00 H new ATOM 0 HB2 ASN A 98 14.194 18.246 -5.273 1.00 0.00 H new ATOM 0 HB3 ASN A 98 14.938 18.457 -3.700 1.00 0.00 H new ATOM 0 HD21 ASN A 98 17.085 19.022 -7.097 1.00 0.00 H new ATOM 0 HD22 ASN A 98 15.344 18.726 -7.068 1.00 0.00 H new ATOM 1513 N ASN A 99 13.319 15.125 -3.199 1.00 0.00 N ATOM 1514 CA ASN A 99 12.505 14.746 -2.049 1.00 0.00 C ATOM 1515 C ASN A 99 11.395 15.764 -1.809 1.00 0.00 C ATOM 1516 O ASN A 99 11.262 16.307 -0.713 1.00 0.00 O ATOM 1517 CB ASN A 99 13.378 14.623 -0.799 1.00 0.00 C ATOM 1518 CG ASN A 99 14.668 13.871 -1.066 1.00 0.00 C ATOM 1519 OD1 ASN A 99 15.421 14.212 -1.978 1.00 0.00 O ATOM 1520 ND2 ASN A 99 14.928 12.841 -0.269 1.00 0.00 N ATOM 0 H ASN A 99 13.171 14.550 -4.029 1.00 0.00 H new ATOM 0 HA ASN A 99 12.048 13.780 -2.262 1.00 0.00 H new ATOM 0 HB2 ASN A 99 13.612 15.619 -0.423 1.00 0.00 H new ATOM 0 HB3 ASN A 99 12.818 14.111 -0.017 1.00 0.00 H new ATOM 0 HD21 ASN A 99 15.781 12.297 -0.401 1.00 0.00 H new ATOM 0 HD22 ASN A 99 14.275 12.594 0.475 1.00 0.00 H new ATOM 1527 N VAL A 100 10.598 16.018 -2.843 1.00 0.00 N ATOM 1528 CA VAL A 100 9.498 16.969 -2.745 1.00 0.00 C ATOM 1529 C VAL A 100 8.865 16.936 -1.359 1.00 0.00 C ATOM 1530 O VAL A 100 8.439 17.966 -0.836 1.00 0.00 O ATOM 1531 CB VAL A 100 8.413 16.683 -3.800 1.00 0.00 C ATOM 1532 CG1 VAL A 100 7.475 15.587 -3.317 1.00 0.00 C ATOM 1533 CG2 VAL A 100 7.640 17.952 -4.127 1.00 0.00 C ATOM 0 H VAL A 100 10.694 15.578 -3.758 1.00 0.00 H new ATOM 0 HA VAL A 100 9.918 17.958 -2.926 1.00 0.00 H new ATOM 0 HB VAL A 100 8.899 16.336 -4.712 1.00 0.00 H new ATOM 0 HG11 VAL A 100 6.715 15.398 -4.075 1.00 0.00 H new ATOM 0 HG12 VAL A 100 8.043 14.674 -3.138 1.00 0.00 H new ATOM 0 HG13 VAL A 100 6.994 15.902 -2.391 1.00 0.00 H new ATOM 0 HG21 VAL A 100 6.878 17.731 -4.874 1.00 0.00 H new ATOM 0 HG22 VAL A 100 7.163 18.331 -3.223 1.00 0.00 H new ATOM 0 HG23 VAL A 100 8.325 18.704 -4.519 1.00 0.00 H new ATOM 1543 N GLU A 101 8.808 15.747 -0.768 1.00 0.00 N ATOM 1544 CA GLU A 101 8.226 15.580 0.558 1.00 0.00 C ATOM 1545 C GLU A 101 8.859 14.397 1.286 1.00 0.00 C ATOM 1546 O GLU A 101 9.538 13.570 0.676 1.00 0.00 O ATOM 1547 CB GLU A 101 6.713 15.379 0.454 1.00 0.00 C ATOM 1548 CG GLU A 101 6.315 13.997 -0.037 1.00 0.00 C ATOM 1549 CD GLU A 101 4.913 13.964 -0.614 1.00 0.00 C ATOM 1550 OE1 GLU A 101 3.949 13.867 0.174 1.00 0.00 O ATOM 1551 OE2 GLU A 101 4.781 14.036 -1.854 1.00 0.00 O ATOM 0 H GLU A 101 9.158 14.885 -1.187 1.00 0.00 H new ATOM 0 HA GLU A 101 8.426 16.486 1.131 1.00 0.00 H new ATOM 0 HB2 GLU A 101 6.264 15.551 1.432 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.301 16.128 -0.222 1.00 0.00 H new ATOM 0 HG2 GLU A 101 7.024 13.667 -0.796 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.381 13.289 0.789 1.00 0.00 H new ATOM 1558 N LYS A 102 8.632 14.324 2.593 1.00 0.00 N ATOM 1559 CA LYS A 102 9.178 13.243 3.405 1.00 0.00 C ATOM 1560 C LYS A 102 8.413 11.944 3.168 1.00 0.00 C ATOM 1561 O LYS A 102 7.194 11.936 2.997 1.00 0.00 O ATOM 1562 CB LYS A 102 9.124 13.615 4.888 1.00 0.00 C ATOM 1563 CG LYS A 102 9.502 12.473 5.816 1.00 0.00 C ATOM 1564 CD LYS A 102 8.947 12.685 7.215 1.00 0.00 C ATOM 1565 CE LYS A 102 9.739 11.903 8.252 1.00 0.00 C ATOM 1566 NZ LYS A 102 9.336 10.471 8.295 1.00 0.00 N ATOM 0 H LYS A 102 8.073 15.001 3.113 1.00 0.00 H new ATOM 0 HA LYS A 102 10.217 13.091 3.112 1.00 0.00 H new ATOM 0 HB2 LYS A 102 9.795 14.455 5.068 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.117 13.953 5.133 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.124 11.534 5.412 1.00 0.00 H new ATOM 0 HG3 LYS A 102 10.587 12.385 5.863 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.972 13.747 7.461 1.00 0.00 H new ATOM 0 HD3 LYS A 102 7.902 12.376 7.244 1.00 0.00 H new ATOM 0 HE2 LYS A 102 10.803 11.974 8.025 1.00 0.00 H new ATOM 0 HE3 LYS A 102 9.592 12.351 9.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 9.899 9.973 9.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 8.327 10.401 8.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 9.500 10.036 7.365 1.00 0.00 H new ATOM 1580 N PRO A 103 9.144 10.820 3.158 1.00 0.00 N ATOM 1581 CA PRO A 103 8.554 9.495 2.945 1.00 0.00 C ATOM 1582 C PRO A 103 7.698 9.045 4.124 1.00 0.00 C ATOM 1583 O PRO A 103 7.475 9.804 5.068 1.00 0.00 O ATOM 1584 CB PRO A 103 9.775 8.584 2.792 1.00 0.00 C ATOM 1585 CG PRO A 103 10.865 9.285 3.527 1.00 0.00 C ATOM 1586 CD PRO A 103 10.602 10.755 3.355 1.00 0.00 C ATOM 0 HA PRO A 103 7.884 9.481 2.086 1.00 0.00 H new ATOM 0 HB2 PRO A 103 9.587 7.596 3.211 1.00 0.00 H new ATOM 0 HB3 PRO A 103 10.033 8.441 1.743 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.864 9.009 4.582 1.00 0.00 H new ATOM 0 HG3 PRO A 103 11.842 9.014 3.127 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.915 11.324 4.230 1.00 0.00 H new ATOM 0 HD3 PRO A 103 11.142 11.162 2.500 1.00 0.00 H new ATOM 1594 N LEU A 104 7.222 7.806 4.065 1.00 0.00 N ATOM 1595 CA LEU A 104 6.390 7.254 5.129 1.00 0.00 C ATOM 1596 C LEU A 104 6.554 5.740 5.218 1.00 0.00 C ATOM 1597 O LEU A 104 7.135 5.116 4.331 1.00 0.00 O ATOM 1598 CB LEU A 104 4.921 7.607 4.889 1.00 0.00 C ATOM 1599 CG LEU A 104 4.263 6.952 3.674 1.00 0.00 C ATOM 1600 CD1 LEU A 104 5.225 6.926 2.496 1.00 0.00 C ATOM 1601 CD2 LEU A 104 3.795 5.545 4.014 1.00 0.00 C ATOM 0 H LEU A 104 7.398 7.165 3.292 1.00 0.00 H new ATOM 0 HA LEU A 104 6.713 7.692 6.074 1.00 0.00 H new ATOM 0 HB2 LEU A 104 4.352 7.332 5.777 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.841 8.689 4.781 1.00 0.00 H new ATOM 0 HG LEU A 104 3.392 7.544 3.393 1.00 0.00 H new ATOM 0 HD11 LEU A 104 4.740 6.456 1.640 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.511 7.946 2.237 1.00 0.00 H new ATOM 0 HD13 LEU A 104 6.115 6.357 2.766 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.329 5.095 3.137 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.649 4.942 4.321 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.071 5.589 4.827 1.00 0.00 H new ATOM 1613 N GLU A 105 6.035 5.157 6.294 1.00 0.00 N ATOM 1614 CA GLU A 105 6.123 3.716 6.497 1.00 0.00 C ATOM 1615 C GLU A 105 4.864 3.017 5.993 1.00 0.00 C ATOM 1616 O GLU A 105 3.757 3.295 6.457 1.00 0.00 O ATOM 1617 CB GLU A 105 6.336 3.399 7.979 1.00 0.00 C ATOM 1618 CG GLU A 105 6.604 1.929 8.256 1.00 0.00 C ATOM 1619 CD GLU A 105 7.385 1.710 9.537 1.00 0.00 C ATOM 1620 OE1 GLU A 105 8.565 2.116 9.588 1.00 0.00 O ATOM 1621 OE2 GLU A 105 6.818 1.131 10.487 1.00 0.00 O ATOM 0 H GLU A 105 5.550 5.660 7.037 1.00 0.00 H new ATOM 0 HA GLU A 105 6.976 3.347 5.927 1.00 0.00 H new ATOM 0 HB2 GLU A 105 7.174 3.989 8.351 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.454 3.710 8.539 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.655 1.396 8.318 1.00 0.00 H new ATOM 0 HG3 GLU A 105 7.157 1.500 7.420 1.00 0.00 H new ATOM 1628 N LEU A 106 5.040 2.109 5.040 1.00 0.00 N ATOM 1629 CA LEU A 106 3.918 1.370 4.471 1.00 0.00 C ATOM 1630 C LEU A 106 3.993 -0.107 4.846 1.00 0.00 C ATOM 1631 O LEU A 106 4.672 -0.892 4.185 1.00 0.00 O ATOM 1632 CB LEU A 106 3.902 1.520 2.949 1.00 0.00 C ATOM 1633 CG LEU A 106 3.027 0.526 2.185 1.00 0.00 C ATOM 1634 CD1 LEU A 106 1.619 0.502 2.760 1.00 0.00 C ATOM 1635 CD2 LEU A 106 2.994 0.873 0.704 1.00 0.00 C ATOM 0 H LEU A 106 5.949 1.867 4.645 1.00 0.00 H new ATOM 0 HA LEU A 106 2.997 1.785 4.881 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.567 2.529 2.707 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.925 1.428 2.584 1.00 0.00 H new ATOM 0 HG LEU A 106 3.459 -0.468 2.295 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.011 -0.211 2.203 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.659 0.205 3.808 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.177 1.495 2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.367 0.155 0.176 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.586 1.876 0.574 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.005 0.837 0.299 1.00 0.00 H new ATOM 1647 N ARG A 107 3.288 -0.478 5.910 1.00 0.00 N ATOM 1648 CA ARG A 107 3.273 -1.861 6.373 1.00 0.00 C ATOM 1649 C ARG A 107 2.067 -2.609 5.812 1.00 0.00 C ATOM 1650 O ARG A 107 0.940 -2.116 5.864 1.00 0.00 O ATOM 1651 CB ARG A 107 3.252 -1.909 7.901 1.00 0.00 C ATOM 1652 CG ARG A 107 3.123 -3.315 8.464 1.00 0.00 C ATOM 1653 CD ARG A 107 2.603 -3.297 9.894 1.00 0.00 C ATOM 1654 NE ARG A 107 3.247 -2.261 10.697 1.00 0.00 N ATOM 1655 CZ ARG A 107 3.149 -2.190 12.020 1.00 0.00 C ATOM 1656 NH1 ARG A 107 2.439 -3.091 12.685 1.00 0.00 N ATOM 1657 NH2 ARG A 107 3.764 -1.218 12.680 1.00 0.00 N ATOM 0 H ARG A 107 2.720 0.160 6.468 1.00 0.00 H new ATOM 0 HA ARG A 107 4.180 -2.348 6.014 1.00 0.00 H new ATOM 0 HB2 ARG A 107 4.167 -1.456 8.283 1.00 0.00 H new ATOM 0 HB3 ARG A 107 2.421 -1.304 8.264 1.00 0.00 H new ATOM 0 HG2 ARG A 107 2.448 -3.898 7.838 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.093 -3.810 8.435 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.526 -3.132 9.886 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.773 -4.270 10.354 1.00 0.00 H new ATOM 0 HE ARG A 107 3.802 -1.553 10.216 1.00 0.00 H new ATOM 0 HH11 ARG A 107 1.966 -3.841 12.181 1.00 0.00 H new ATOM 0 HH12 ARG A 107 2.366 -3.034 13.701 1.00 0.00 H new ATOM 0 HH21 ARG A 107 4.313 -0.524 12.172 1.00 0.00 H new ATOM 0 HH22 ARG A 107 3.688 -1.164 13.696 1.00 0.00 H new ATOM 1671 N ILE A 108 2.313 -3.800 5.277 1.00 0.00 N ATOM 1672 CA ILE A 108 1.247 -4.615 4.708 1.00 0.00 C ATOM 1673 C ILE A 108 1.023 -5.879 5.531 1.00 0.00 C ATOM 1674 O ILE A 108 1.765 -6.854 5.408 1.00 0.00 O ATOM 1675 CB ILE A 108 1.559 -5.013 3.253 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.739 -3.764 2.387 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.452 -5.895 2.696 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.428 -4.037 1.068 1.00 0.00 C ATOM 0 H ILE A 108 3.240 -4.222 5.226 1.00 0.00 H new ATOM 0 HA ILE A 108 0.342 -4.008 4.725 1.00 0.00 H new ATOM 0 HB ILE A 108 2.490 -5.580 3.239 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.761 -3.323 2.192 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.317 -3.026 2.944 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.687 -6.168 1.667 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.367 -6.798 3.301 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.493 -5.352 2.721 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.522 -3.107 0.507 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.419 -4.450 1.254 1.00 0.00 H new ATOM 0 HD13 ILE A 108 1.840 -4.751 0.491 1.00 0.00 H new ATOM 1690 N LYS A 109 -0.007 -5.856 6.370 1.00 0.00 N ATOM 1691 CA LYS A 109 -0.334 -7.000 7.213 1.00 0.00 C ATOM 1692 C LYS A 109 -0.773 -8.191 6.367 1.00 0.00 C ATOM 1693 O LYS A 109 -1.412 -8.025 5.328 1.00 0.00 O ATOM 1694 CB LYS A 109 -1.439 -6.630 8.205 1.00 0.00 C ATOM 1695 CG LYS A 109 -1.567 -7.604 9.364 1.00 0.00 C ATOM 1696 CD LYS A 109 -2.543 -8.724 9.046 1.00 0.00 C ATOM 1697 CE LYS A 109 -2.264 -9.962 9.884 1.00 0.00 C ATOM 1698 NZ LYS A 109 -2.740 -9.801 11.286 1.00 0.00 N ATOM 0 H LYS A 109 -0.630 -5.057 6.484 1.00 0.00 H new ATOM 0 HA LYS A 109 0.563 -7.280 7.766 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.243 -5.633 8.599 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.390 -6.582 7.675 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.589 -8.027 9.595 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.901 -7.070 10.254 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -3.562 -8.382 9.228 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -2.476 -8.977 7.988 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -2.753 -10.825 9.431 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -1.193 -10.166 9.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -2.532 -10.666 11.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -2.255 -8.993 11.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.766 -9.631 11.287 1.00 0.00 H new ATOM 1712 N VAL A 110 -0.429 -9.393 6.820 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.790 -10.611 6.107 1.00 0.00 C ATOM 1714 C VAL A 110 -1.734 -11.475 6.936 1.00 0.00 C ATOM 1715 O VAL A 110 -1.385 -11.919 8.031 1.00 0.00 O ATOM 1716 CB VAL A 110 0.457 -11.438 5.741 1.00 0.00 C ATOM 1717 CG1 VAL A 110 0.077 -12.612 4.851 1.00 0.00 C ATOM 1718 CG2 VAL A 110 1.498 -10.560 5.064 1.00 0.00 C ATOM 0 H VAL A 110 0.100 -9.548 7.678 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.294 -10.303 5.191 1.00 0.00 H new ATOM 0 HB VAL A 110 0.891 -11.835 6.659 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.971 -13.185 4.603 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.630 -13.253 5.377 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.382 -12.240 3.935 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.372 -11.160 4.812 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.077 -10.133 4.154 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.792 -9.757 5.740 1.00 0.00 H new ATOM 1728 N LEU A 111 -2.929 -11.710 6.408 1.00 0.00 N ATOM 1729 CA LEU A 111 -3.925 -12.522 7.099 1.00 0.00 C ATOM 1730 C LEU A 111 -3.740 -14.001 6.777 1.00 0.00 C ATOM 1731 O LEU A 111 -2.802 -14.382 6.076 1.00 0.00 O ATOM 1732 CB LEU A 111 -5.335 -12.076 6.711 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.567 -10.566 6.645 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.691 -10.240 5.674 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.878 -10.013 8.029 1.00 0.00 C ATOM 0 H LEU A 111 -3.233 -11.350 5.503 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.790 -12.383 8.172 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.574 -12.503 5.737 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.039 -12.501 7.427 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.654 -10.093 6.283 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.841 -9.161 5.641 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.429 -10.601 4.679 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.610 -10.724 6.005 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -6.040 -8.937 7.963 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.776 -10.492 8.419 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -5.041 -10.213 8.697 1.00 0.00 H new ATOM 1747 N ASP A 112 -4.643 -14.830 7.290 1.00 0.00 N ATOM 1748 CA ASP A 112 -4.582 -16.268 7.054 1.00 0.00 C ATOM 1749 C ASP A 112 -5.675 -16.707 6.085 1.00 0.00 C ATOM 1750 O ASP A 112 -6.686 -16.022 5.924 1.00 0.00 O ATOM 1751 CB ASP A 112 -4.718 -17.030 8.374 1.00 0.00 C ATOM 1752 CG ASP A 112 -3.405 -17.124 9.125 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -2.992 -16.112 9.729 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -2.790 -18.211 9.111 1.00 0.00 O ATOM 0 H ASP A 112 -5.426 -14.531 7.872 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.614 -16.497 6.609 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.458 -16.534 9.002 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.092 -18.034 8.174 1.00 0.00 H new ATOM 1759 N ILE A 113 -5.465 -17.850 5.441 1.00 0.00 N ATOM 1760 CA ILE A 113 -6.432 -18.379 4.488 1.00 0.00 C ATOM 1761 C ILE A 113 -7.807 -18.532 5.129 1.00 0.00 C ATOM 1762 O ILE A 113 -8.827 -18.224 4.514 1.00 0.00 O ATOM 1763 CB ILE A 113 -5.984 -19.742 3.928 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -6.716 -20.046 2.620 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -6.233 -20.842 4.949 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -6.088 -19.392 1.409 1.00 0.00 C ATOM 0 H ILE A 113 -4.633 -18.428 5.562 1.00 0.00 H new ATOM 0 HA ILE A 113 -6.493 -17.662 3.669 1.00 0.00 H new ATOM 0 HB ILE A 113 -4.914 -19.700 3.722 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -6.739 -21.125 2.469 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.751 -19.714 2.707 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -5.911 -21.799 4.538 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -5.670 -20.629 5.858 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.297 -20.887 5.183 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.660 -19.651 0.518 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.089 -18.310 1.538 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.062 -19.743 1.297 1.00 0.00 H new ATOM 1778 N ASN A 114 -7.826 -19.010 6.369 1.00 0.00 N ATOM 1779 CA ASN A 114 -9.077 -19.203 7.095 1.00 0.00 C ATOM 1780 C ASN A 114 -9.652 -17.867 7.553 1.00 0.00 C ATOM 1781 O ASN A 114 -10.769 -17.803 8.067 1.00 0.00 O ATOM 1782 CB ASN A 114 -8.854 -20.117 8.301 1.00 0.00 C ATOM 1783 CG ASN A 114 -7.460 -19.977 8.883 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -7.228 -19.167 9.780 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -6.524 -20.769 8.372 1.00 0.00 N ATOM 0 H ASN A 114 -6.990 -19.271 6.892 1.00 0.00 H new ATOM 0 HA ASN A 114 -9.792 -19.672 6.419 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -9.591 -19.885 9.070 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -9.018 -21.153 8.004 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -5.567 -20.720 8.723 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.762 -21.426 7.629 1.00 0.00 H new ATOM 1792 N ASP A 115 -8.881 -16.801 7.364 1.00 0.00 N ATOM 1793 CA ASP A 115 -9.314 -15.465 7.756 1.00 0.00 C ATOM 1794 C ASP A 115 -10.214 -14.850 6.689 1.00 0.00 C ATOM 1795 O ASP A 115 -9.740 -14.410 5.642 1.00 0.00 O ATOM 1796 CB ASP A 115 -8.102 -14.564 8.001 1.00 0.00 C ATOM 1797 CG ASP A 115 -8.422 -13.400 8.917 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -9.184 -12.504 8.496 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -7.911 -13.384 10.056 1.00 0.00 O ATOM 0 H ASP A 115 -7.953 -16.837 6.942 1.00 0.00 H new ATOM 0 HA ASP A 115 -9.885 -15.552 8.680 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -7.296 -15.155 8.437 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -7.738 -14.182 7.047 1.00 0.00 H new ATOM 1804 N ASN A 116 -11.514 -14.824 6.962 1.00 0.00 N ATOM 1805 CA ASN A 116 -12.481 -14.264 6.024 1.00 0.00 C ATOM 1806 C ASN A 116 -12.328 -12.750 5.924 1.00 0.00 C ATOM 1807 O ASN A 116 -11.712 -12.120 6.784 1.00 0.00 O ATOM 1808 CB ASN A 116 -13.906 -14.616 6.457 1.00 0.00 C ATOM 1809 CG ASN A 116 -14.045 -16.072 6.858 1.00 0.00 C ATOM 1810 OD1 ASN A 116 -13.681 -16.459 7.969 1.00 0.00 O ATOM 1811 ND2 ASN A 116 -14.573 -16.887 5.952 1.00 0.00 N ATOM 0 H ASN A 116 -11.923 -15.184 7.825 1.00 0.00 H new ATOM 0 HA ASN A 116 -12.289 -14.697 5.042 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -14.195 -13.982 7.295 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -14.595 -14.399 5.641 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -14.691 -17.878 6.164 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -14.861 -16.522 5.044 1.00 0.00 H new ATOM 1818 N GLU A 117 -12.892 -12.171 4.868 1.00 0.00 N ATOM 1819 CA GLU A 117 -12.818 -10.731 4.656 1.00 0.00 C ATOM 1820 C GLU A 117 -13.258 -9.973 5.906 1.00 0.00 C ATOM 1821 O GLU A 117 -14.169 -10.386 6.624 1.00 0.00 O ATOM 1822 CB GLU A 117 -13.688 -10.322 3.466 1.00 0.00 C ATOM 1823 CG GLU A 117 -15.175 -10.520 3.703 1.00 0.00 C ATOM 1824 CD GLU A 117 -16.028 -9.878 2.626 1.00 0.00 C ATOM 1825 OE1 GLU A 117 -15.792 -10.163 1.433 1.00 0.00 O ATOM 1826 OE2 GLU A 117 -16.933 -9.091 2.976 1.00 0.00 O ATOM 0 H GLU A 117 -13.405 -12.678 4.147 1.00 0.00 H new ATOM 0 HA GLU A 117 -11.780 -10.475 4.443 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -13.502 -9.273 3.234 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -13.388 -10.900 2.592 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -15.393 -11.587 3.746 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -15.444 -10.100 4.672 1.00 0.00 H new ATOM 1833 N PRO A 118 -12.597 -8.837 6.173 1.00 0.00 N ATOM 1834 CA PRO A 118 -12.902 -7.998 7.335 1.00 0.00 C ATOM 1835 C PRO A 118 -14.250 -7.298 7.206 1.00 0.00 C ATOM 1836 O PRO A 118 -14.676 -6.945 6.106 1.00 0.00 O ATOM 1837 CB PRO A 118 -11.765 -6.973 7.340 1.00 0.00 C ATOM 1838 CG PRO A 118 -11.311 -6.904 5.923 1.00 0.00 C ATOM 1839 CD PRO A 118 -11.500 -8.285 5.360 1.00 0.00 C ATOM 0 HA PRO A 118 -12.972 -8.582 8.253 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -12.110 -6.001 7.693 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -10.955 -7.283 8.000 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -11.892 -6.171 5.362 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -10.267 -6.597 5.862 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -11.759 -8.256 4.302 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -10.593 -8.883 5.449 1.00 0.00 H new ATOM 1847 N VAL A 119 -14.919 -7.098 8.338 1.00 0.00 N ATOM 1848 CA VAL A 119 -16.218 -6.438 8.352 1.00 0.00 C ATOM 1849 C VAL A 119 -16.065 -4.925 8.455 1.00 0.00 C ATOM 1850 O VAL A 119 -15.012 -4.422 8.847 1.00 0.00 O ATOM 1851 CB VAL A 119 -17.088 -6.936 9.522 1.00 0.00 C ATOM 1852 CG1 VAL A 119 -17.396 -8.417 9.366 1.00 0.00 C ATOM 1853 CG2 VAL A 119 -16.400 -6.663 10.850 1.00 0.00 C ATOM 0 H VAL A 119 -14.582 -7.384 9.257 1.00 0.00 H new ATOM 0 HA VAL A 119 -16.710 -6.687 7.412 1.00 0.00 H new ATOM 0 HB VAL A 119 -18.032 -6.390 9.509 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -18.011 -8.751 10.202 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -17.933 -8.580 8.432 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -16.465 -8.983 9.353 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -17.028 -7.021 11.666 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -15.441 -7.181 10.876 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -16.237 -5.591 10.962 1.00 0.00 H new ATOM 1863 N PHE A 120 -17.123 -4.203 8.100 1.00 0.00 N ATOM 1864 CA PHE A 120 -17.107 -2.746 8.152 1.00 0.00 C ATOM 1865 C PHE A 120 -17.974 -2.233 9.298 1.00 0.00 C ATOM 1866 O PHE A 120 -19.023 -2.802 9.602 1.00 0.00 O ATOM 1867 CB PHE A 120 -17.598 -2.162 6.825 1.00 0.00 C ATOM 1868 CG PHE A 120 -16.699 -2.475 5.663 1.00 0.00 C ATOM 1869 CD1 PHE A 120 -16.516 -3.783 5.245 1.00 0.00 C ATOM 1870 CD2 PHE A 120 -16.037 -1.461 4.989 1.00 0.00 C ATOM 1871 CE1 PHE A 120 -15.689 -4.074 4.176 1.00 0.00 C ATOM 1872 CE2 PHE A 120 -15.209 -1.746 3.920 1.00 0.00 C ATOM 1873 CZ PHE A 120 -15.036 -3.054 3.512 1.00 0.00 C ATOM 0 H PHE A 120 -18.002 -4.604 7.773 1.00 0.00 H new ATOM 0 HA PHE A 120 -16.080 -2.425 8.325 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -18.596 -2.546 6.615 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -17.687 -1.080 6.924 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -17.025 -4.584 5.760 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -16.170 -0.436 5.303 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -15.554 -5.098 3.860 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -14.698 -0.947 3.404 1.00 0.00 H new ATOM 0 HZ PHE A 120 -14.391 -3.279 2.675 1.00 0.00 H new ATOM 1883 N THR A 121 -17.527 -1.153 9.932 1.00 0.00 N ATOM 1884 CA THR A 121 -18.259 -0.563 11.046 1.00 0.00 C ATOM 1885 C THR A 121 -18.702 0.859 10.721 1.00 0.00 C ATOM 1886 O THR A 121 -17.955 1.628 10.117 1.00 0.00 O ATOM 1887 CB THR A 121 -17.408 -0.542 12.329 1.00 0.00 C ATOM 1888 OG1 THR A 121 -17.048 -1.878 12.700 1.00 0.00 O ATOM 1889 CG2 THR A 121 -18.166 0.119 13.470 1.00 0.00 C ATOM 0 H THR A 121 -16.661 -0.669 9.693 1.00 0.00 H new ATOM 0 HA THR A 121 -19.138 -1.186 11.212 1.00 0.00 H new ATOM 0 HB THR A 121 -16.505 0.036 12.130 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.505 -1.856 13.516 1.00 0.00 H new ATOM 0 HG21 THR A 121 -17.545 0.122 14.366 1.00 0.00 H new ATOM 0 HG22 THR A 121 -18.414 1.145 13.196 1.00 0.00 H new ATOM 0 HG23 THR A 121 -19.084 -0.436 13.667 1.00 0.00 H new ATOM 1897 N GLN A 122 -19.921 1.201 11.125 1.00 0.00 N ATOM 1898 CA GLN A 122 -20.463 2.532 10.876 1.00 0.00 C ATOM 1899 C GLN A 122 -19.944 3.532 11.904 1.00 0.00 C ATOM 1900 O GLN A 122 -19.943 3.259 13.105 1.00 0.00 O ATOM 1901 CB GLN A 122 -21.992 2.497 10.908 1.00 0.00 C ATOM 1902 CG GLN A 122 -22.642 3.593 10.080 1.00 0.00 C ATOM 1903 CD GLN A 122 -22.313 3.483 8.604 1.00 0.00 C ATOM 1904 OE1 GLN A 122 -21.565 2.598 8.188 1.00 0.00 O ATOM 1905 NE2 GLN A 122 -22.872 4.382 7.803 1.00 0.00 N ATOM 0 H GLN A 122 -20.552 0.575 11.626 1.00 0.00 H new ATOM 0 HA GLN A 122 -20.134 2.852 9.887 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -22.333 1.528 10.544 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -22.328 2.586 11.941 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -23.723 3.549 10.211 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -22.315 4.565 10.450 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -23.486 5.099 8.190 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -22.688 4.356 6.800 1.00 0.00 H new ATOM 1914 N ASP A 123 -19.503 4.690 11.425 1.00 0.00 N ATOM 1915 CA ASP A 123 -18.981 5.731 12.303 1.00 0.00 C ATOM 1916 C ASP A 123 -20.090 6.688 12.728 1.00 0.00 C ATOM 1917 O ASP A 123 -20.702 7.356 11.893 1.00 0.00 O ATOM 1918 CB ASP A 123 -17.863 6.505 11.602 1.00 0.00 C ATOM 1919 CG ASP A 123 -18.349 7.227 10.360 1.00 0.00 C ATOM 1920 OD1 ASP A 123 -18.709 6.543 9.379 1.00 0.00 O ATOM 1921 OD2 ASP A 123 -18.369 8.475 10.370 1.00 0.00 O ATOM 0 H ASP A 123 -19.497 4.932 10.434 1.00 0.00 H new ATOM 0 HA ASP A 123 -18.577 5.252 13.195 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -17.436 7.229 12.296 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -17.064 5.816 11.329 1.00 0.00 H new TER 1926 ASP A 123