USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 775 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 SER OG : rot 90:sc= 1.76 USER MOD Set 1.2: A 56 LYS NZ :NH3+ -163:sc= 0.602 (180deg=-0.0378) USER MOD Set 2.1: A 42 ASN : amide:sc= -0.226 K(o=-0.0063,f=-4.4) USER MOD Set 2.2: A 64 GLN : amide:sc= 0.219 K(o=-0.0063,f=-4.1!) USER MOD Single : A 1 SER N :NH3+ 141:sc= 0.771 (180deg=0.297) USER MOD Single : A 1 SER OG : rot 180:sc= 0.206 USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 GLN : amide:sc=-0.00606 X(o=-0.0061,f=-0.18) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot -161:sc= 1.45 USER MOD Single : A 13 SER OG : rot -42:sc= 0.551 USER MOD Single : A 14 SER OG : rot -44:sc= 0.834 USER MOD Single : A 16 GLN : amide:sc= -0.408 K(o=-0.41,f=-9.8!) USER MOD Single : A 20 ASN : amide:sc= -0.133 K(o=-0.13,f=-2.4!) USER MOD Single : A 27 MET CE :methyl -166:sc= 0 (180deg=-0.16) USER MOD Single : A 31 ASN : amide:sc= -1.3 K(o=-1.3,f=-5.6!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0681 USER MOD Single : A 65 GLN : amide:sc= 0.0427 K(o=0.043,f=-0.59) USER MOD Single : A 66 GLN : amide:sc= -0.0286 X(o=-0.029,f=0) USER MOD Single : A 73 GLN : amide:sc= 0.397 X(o=0.4,f=-0.014) USER MOD Single : A 80 SER OG : rot 110:sc= 0.139 USER MOD Single : A 89 GLN : amide:sc= 0.585 K(o=0.59,f=0) USER MOD Single : A 91 LYS NZ :NH3+ -179:sc= 0.916 (180deg=0.916) USER MOD Single : A 98 GLN : amide:sc= 0.513 K(o=0.51,f=-1.6) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 4.951 42.755 3.195 1.00 25.00 N ATOM 2 CA SER A 1 4.959 41.479 3.990 1.00 25.00 C ATOM 3 C SER A 1 4.937 40.192 3.174 1.00 25.00 C ATOM 4 O SER A 1 4.138 39.305 3.366 1.00 25.00 O ATOM 5 CB SER A 1 3.750 41.570 4.907 1.00 25.00 C ATOM 6 OG SER A 1 3.536 42.965 5.016 1.00 25.00 O ATOM 0 H1 SER A 1 4.346 43.456 3.669 1.00 25.00 H new ATOM 0 H2 SER A 1 5.920 43.126 3.124 1.00 25.00 H new ATOM 0 H3 SER A 1 4.581 42.568 2.241 1.00 25.00 H new ATOM 0 HA SER A 1 5.906 41.405 4.525 1.00 25.00 H new ATOM 0 HB2 SER A 1 2.884 41.061 4.484 1.00 25.00 H new ATOM 0 HB3 SER A 1 3.945 41.115 5.878 1.00 25.00 H new ATOM 0 HG SER A 1 2.764 43.133 5.595 1.00 25.00 H new ATOM 14 N GLN A 2 5.882 40.143 2.207 1.00 25.00 N ATOM 15 CA GLN A 2 6.052 39.051 1.232 1.00 25.00 C ATOM 16 C GLN A 2 4.787 38.861 0.376 1.00 25.00 C ATOM 17 O GLN A 2 3.846 39.649 0.457 1.00 25.00 O ATOM 18 CB GLN A 2 6.439 37.732 1.937 1.00 25.00 C ATOM 19 CG GLN A 2 7.723 37.823 2.763 1.00 25.00 C ATOM 20 CD GLN A 2 8.072 36.504 3.426 1.00 25.00 C ATOM 21 OE1 GLN A 2 7.339 36.009 4.260 1.00 25.00 O ATOM 22 NE2 GLN A 2 9.196 35.942 3.061 1.00 25.00 N ATOM 0 H GLN A 2 6.567 40.888 2.083 1.00 25.00 H new ATOM 0 HA GLN A 2 6.867 39.332 0.565 1.00 25.00 H new ATOM 0 HB2 GLN A 2 5.621 37.426 2.589 1.00 25.00 H new ATOM 0 HB3 GLN A 2 6.557 36.951 1.186 1.00 25.00 H new ATOM 0 HG2 GLN A 2 8.546 38.133 2.119 1.00 25.00 H new ATOM 0 HG3 GLN A 2 7.608 38.592 3.526 1.00 25.00 H new ATOM 0 HE21 GLN A 2 9.784 36.388 2.358 1.00 25.00 H new ATOM 0 HE22 GLN A 2 9.484 35.058 3.480 1.00 25.00 H new ATOM 31 N GLN A 3 4.802 37.849 -0.483 1.00 25.00 N ATOM 32 CA GLN A 3 3.676 37.508 -1.357 1.00 25.00 C ATOM 33 C GLN A 3 3.769 36.008 -1.569 1.00 25.00 C ATOM 34 O GLN A 3 4.853 35.438 -1.441 1.00 25.00 O ATOM 35 CB GLN A 3 3.787 38.209 -2.722 1.00 25.00 C ATOM 36 CG GLN A 3 3.345 39.671 -2.728 1.00 25.00 C ATOM 37 CD GLN A 3 1.871 39.827 -2.408 1.00 25.00 C ATOM 38 OE1 GLN A 3 1.016 39.428 -3.179 1.00 25.00 O ATOM 39 NE2 GLN A 3 1.570 40.392 -1.270 1.00 25.00 N ATOM 0 H GLN A 3 5.606 37.231 -0.597 1.00 25.00 H new ATOM 0 HA GLN A 3 2.734 37.821 -0.907 1.00 25.00 H new ATOM 0 HB2 GLN A 3 4.822 38.155 -3.059 1.00 25.00 H new ATOM 0 HB3 GLN A 3 3.187 37.659 -3.447 1.00 25.00 H new ATOM 0 HG2 GLN A 3 3.934 40.229 -2.000 1.00 25.00 H new ATOM 0 HG3 GLN A 3 3.550 40.107 -3.706 1.00 25.00 H new ATOM 0 HE21 GLN A 3 2.312 40.714 -0.649 1.00 25.00 H new ATOM 0 HE22 GLN A 3 0.593 40.511 -1.002 1.00 25.00 H new ATOM 48 N SER A 4 2.658 35.371 -1.901 1.00 25.00 N ATOM 49 CA SER A 4 2.662 33.942 -2.200 1.00 25.00 C ATOM 50 C SER A 4 2.999 33.753 -3.674 1.00 25.00 C ATOM 51 O SER A 4 2.532 34.517 -4.517 1.00 25.00 O ATOM 52 CB SER A 4 1.287 33.344 -1.909 1.00 25.00 C ATOM 53 OG SER A 4 0.914 33.593 -0.564 1.00 25.00 O ATOM 0 H SER A 4 1.743 35.816 -1.971 1.00 25.00 H new ATOM 0 HA SER A 4 3.403 33.439 -1.579 1.00 25.00 H new ATOM 0 HB2 SER A 4 0.547 33.773 -2.584 1.00 25.00 H new ATOM 0 HB3 SER A 4 1.304 32.270 -2.096 1.00 25.00 H new ATOM 0 HG SER A 4 0.030 33.206 -0.393 1.00 25.00 H new ATOM 59 N HIS A 5 3.801 32.745 -3.987 1.00 25.00 N ATOM 60 CA HIS A 5 4.181 32.463 -5.367 1.00 25.00 C ATOM 61 C HIS A 5 4.644 31.017 -5.456 1.00 25.00 C ATOM 62 O HIS A 5 4.931 30.396 -4.432 1.00 25.00 O ATOM 63 CB HIS A 5 5.314 33.396 -5.808 1.00 25.00 C ATOM 64 CG HIS A 5 5.265 33.744 -7.261 1.00 25.00 C ATOM 65 ND1 HIS A 5 4.408 34.670 -7.800 1.00 25.00 N ATOM 66 CD2 HIS A 5 5.981 33.266 -8.320 1.00 25.00 C ATOM 67 CE1 HIS A 5 4.621 34.723 -9.110 1.00 25.00 C ATOM 68 NE2 HIS A 5 5.570 33.889 -9.482 1.00 25.00 N ATOM 0 H HIS A 5 4.203 32.106 -3.302 1.00 25.00 H new ATOM 0 HA HIS A 5 3.325 32.625 -6.022 1.00 25.00 H new ATOM 0 HB2 HIS A 5 5.269 34.313 -5.221 1.00 25.00 H new ATOM 0 HB3 HIS A 5 6.271 32.923 -5.587 1.00 25.00 H new ATOM 0 HD2 HIS A 5 6.753 32.513 -8.259 1.00 25.00 H new ATOM 0 HE1 HIS A 5 4.082 35.370 -9.787 1.00 25.00 H new ATOM 0 HE2 HIS A 5 5.925 33.736 -10.426 1.00 25.00 H new ATOM 76 N SER A 6 4.728 30.488 -6.667 1.00 25.00 N ATOM 77 CA SER A 6 5.248 29.145 -6.903 1.00 25.00 C ATOM 78 C SER A 6 5.919 29.195 -8.263 1.00 25.00 C ATOM 79 O SER A 6 5.531 30.011 -9.093 1.00 25.00 O ATOM 80 CB SER A 6 4.116 28.121 -6.901 1.00 25.00 C ATOM 81 OG SER A 6 3.426 28.156 -5.662 1.00 25.00 O ATOM 0 H SER A 6 4.438 30.975 -7.515 1.00 25.00 H new ATOM 0 HA SER A 6 5.946 28.844 -6.122 1.00 25.00 H new ATOM 0 HB2 SER A 6 3.424 28.331 -7.717 1.00 25.00 H new ATOM 0 HB3 SER A 6 4.518 27.123 -7.073 1.00 25.00 H new ATOM 0 HG SER A 6 2.701 27.496 -5.672 1.00 25.00 H new ATOM 87 N SER A 7 6.925 28.359 -8.477 1.00 25.00 N ATOM 88 CA SER A 7 7.696 28.377 -9.722 1.00 25.00 C ATOM 89 C SER A 7 7.681 27.025 -10.433 1.00 25.00 C ATOM 90 O SER A 7 8.601 26.231 -10.270 1.00 25.00 O ATOM 91 CB SER A 7 9.143 28.762 -9.413 1.00 25.00 C ATOM 92 OG SER A 7 9.193 29.991 -8.704 1.00 25.00 O ATOM 0 H SER A 7 7.231 27.656 -7.805 1.00 25.00 H new ATOM 0 HA SER A 7 7.232 29.107 -10.386 1.00 25.00 H new ATOM 0 HB2 SER A 7 9.616 27.977 -8.824 1.00 25.00 H new ATOM 0 HB3 SER A 7 9.708 28.848 -10.341 1.00 25.00 H new ATOM 0 HG SER A 7 10.126 30.221 -8.513 1.00 25.00 H new ATOM 98 N PRO A 8 6.628 26.740 -11.223 1.00 25.00 N ATOM 99 CA PRO A 8 6.672 25.474 -11.949 1.00 25.00 C ATOM 100 C PRO A 8 7.683 25.542 -13.083 1.00 25.00 C ATOM 101 O PRO A 8 8.080 26.619 -13.529 1.00 25.00 O ATOM 102 CB PRO A 8 5.247 25.332 -12.477 1.00 25.00 C ATOM 103 CG PRO A 8 4.817 26.717 -12.706 1.00 25.00 C ATOM 104 CD PRO A 8 5.411 27.496 -11.558 1.00 25.00 C ATOM 0 HA PRO A 8 6.981 24.628 -11.335 1.00 25.00 H new ATOM 0 HB2 PRO A 8 5.218 24.747 -13.396 1.00 25.00 H new ATOM 0 HB3 PRO A 8 4.603 24.827 -11.757 1.00 25.00 H new ATOM 0 HG2 PRO A 8 5.176 27.090 -13.665 1.00 25.00 H new ATOM 0 HG3 PRO A 8 3.730 26.797 -12.719 1.00 25.00 H new ATOM 0 HD2 PRO A 8 5.642 28.522 -11.846 1.00 25.00 H new ATOM 0 HD3 PRO A 8 4.726 27.549 -10.712 1.00 25.00 H new ATOM 112 N GLY A 9 8.095 24.376 -13.530 1.00 25.00 N ATOM 113 CA GLY A 9 9.159 24.267 -14.520 1.00 25.00 C ATOM 114 C GLY A 9 10.439 23.946 -13.779 1.00 25.00 C ATOM 115 O GLY A 9 11.505 24.487 -14.059 1.00 25.00 O ATOM 0 H GLY A 9 7.711 23.482 -13.225 1.00 25.00 H new ATOM 0 HA2 GLY A 9 8.930 23.486 -15.245 1.00 25.00 H new ATOM 0 HA3 GLY A 9 9.262 25.198 -15.077 1.00 25.00 H new ATOM 119 N GLU A 10 10.289 23.068 -12.798 1.00 25.00 N ATOM 120 CA GLU A 10 11.325 22.663 -11.844 1.00 25.00 C ATOM 121 C GLU A 10 12.429 21.771 -12.441 1.00 25.00 C ATOM 122 O GLU A 10 12.860 20.797 -11.843 1.00 25.00 O ATOM 123 CB GLU A 10 10.630 21.918 -10.691 1.00 25.00 C ATOM 124 CG GLU A 10 9.487 22.718 -10.025 1.00 25.00 C ATOM 125 CD GLU A 10 8.079 22.360 -10.535 1.00 25.00 C ATOM 126 OE1 GLU A 10 7.140 22.364 -9.707 1.00 25.00 O ATOM 127 OE2 GLU A 10 7.885 22.168 -11.766 1.00 25.00 O ATOM 0 H GLU A 10 9.402 22.593 -12.633 1.00 25.00 H new ATOM 0 HA GLU A 10 11.833 23.568 -11.511 1.00 25.00 H new ATOM 0 HB2 GLU A 10 10.229 20.977 -11.069 1.00 25.00 H new ATOM 0 HB3 GLU A 10 11.373 21.667 -9.934 1.00 25.00 H new ATOM 0 HG2 GLU A 10 9.523 22.552 -8.948 1.00 25.00 H new ATOM 0 HG3 GLU A 10 9.660 23.781 -10.190 1.00 25.00 H new ATOM 134 N ILE A 11 12.863 22.111 -13.644 1.00 25.00 N ATOM 135 CA ILE A 11 13.852 21.358 -14.388 1.00 25.00 C ATOM 136 C ILE A 11 15.260 21.913 -14.127 1.00 25.00 C ATOM 137 O ILE A 11 16.279 21.455 -14.655 1.00 25.00 O ATOM 138 CB ILE A 11 13.356 21.376 -15.880 1.00 25.00 C ATOM 139 CG1 ILE A 11 12.730 20.017 -16.184 1.00 25.00 C ATOM 140 CG2 ILE A 11 14.417 21.830 -16.880 1.00 25.00 C ATOM 141 CD1 ILE A 11 11.957 19.942 -17.512 1.00 25.00 C ATOM 0 H ILE A 11 12.528 22.938 -14.139 1.00 25.00 H new ATOM 0 HA ILE A 11 13.947 20.317 -14.079 1.00 25.00 H new ATOM 0 HB ILE A 11 12.593 22.145 -16.001 1.00 25.00 H new ATOM 0 HG12 ILE A 11 13.519 19.265 -16.197 1.00 25.00 H new ATOM 0 HG13 ILE A 11 12.053 19.755 -15.371 1.00 25.00 H new ATOM 0 HG21 ILE A 11 13.998 21.815 -17.886 1.00 25.00 H new ATOM 0 HG22 ILE A 11 14.738 22.842 -16.635 1.00 25.00 H new ATOM 0 HG23 ILE A 11 15.273 21.157 -16.833 1.00 25.00 H new ATOM 0 HD11 ILE A 11 11.550 18.939 -17.640 1.00 25.00 H new ATOM 0 HD12 ILE A 11 11.142 20.666 -17.500 1.00 25.00 H new ATOM 0 HD13 ILE A 11 12.631 20.168 -18.338 1.00 25.00 H new ATOM 153 N THR A 12 15.290 22.896 -13.253 1.00 25.00 N ATOM 154 CA THR A 12 16.533 23.575 -12.890 1.00 25.00 C ATOM 155 C THR A 12 17.457 22.685 -12.059 1.00 25.00 C ATOM 156 O THR A 12 17.028 21.770 -11.361 1.00 25.00 O ATOM 157 CB THR A 12 16.275 24.907 -12.117 1.00 25.00 C ATOM 158 OG1 THR A 12 17.508 25.631 -12.020 1.00 25.00 O ATOM 159 CG2 THR A 12 15.737 24.669 -10.707 1.00 25.00 C ATOM 0 H THR A 12 14.464 23.251 -12.772 1.00 25.00 H new ATOM 0 HA THR A 12 17.024 23.807 -13.835 1.00 25.00 H new ATOM 0 HB THR A 12 15.523 25.469 -12.670 1.00 25.00 H new ATOM 0 HG1 THR A 12 17.441 26.297 -11.304 1.00 25.00 H new ATOM 0 HG21 THR A 12 15.575 25.627 -10.213 1.00 25.00 H new ATOM 0 HG22 THR A 12 14.794 24.126 -10.764 1.00 25.00 H new ATOM 0 HG23 THR A 12 16.458 24.084 -10.136 1.00 25.00 H new ATOM 167 N SER A 13 18.743 22.995 -12.134 1.00 25.00 N ATOM 168 CA SER A 13 19.782 22.309 -11.364 1.00 25.00 C ATOM 169 C SER A 13 20.621 23.362 -10.652 1.00 25.00 C ATOM 170 O SER A 13 21.679 23.070 -10.105 1.00 25.00 O ATOM 171 CB SER A 13 20.669 21.522 -12.316 1.00 25.00 C ATOM 172 OG SER A 13 21.621 20.740 -11.616 1.00 25.00 O ATOM 0 H SER A 13 19.103 23.736 -12.735 1.00 25.00 H new ATOM 0 HA SER A 13 19.333 21.629 -10.640 1.00 25.00 H new ATOM 0 HB2 SER A 13 20.051 20.874 -12.938 1.00 25.00 H new ATOM 0 HB3 SER A 13 21.184 22.210 -12.986 1.00 25.00 H new ATOM 0 HG SER A 13 21.998 21.266 -10.880 1.00 25.00 H new ATOM 178 N SER A 14 20.161 24.599 -10.753 1.00 25.00 N ATOM 179 CA SER A 14 20.876 25.779 -10.246 1.00 25.00 C ATOM 180 C SER A 14 22.351 25.846 -10.682 1.00 25.00 C ATOM 181 O SER A 14 23.263 25.909 -9.845 1.00 25.00 O ATOM 182 CB SER A 14 20.763 25.841 -8.723 1.00 25.00 C ATOM 183 OG SER A 14 19.402 25.747 -8.337 1.00 25.00 O ATOM 0 H SER A 14 19.269 24.824 -11.194 1.00 25.00 H new ATOM 0 HA SER A 14 20.394 26.649 -10.692 1.00 25.00 H new ATOM 0 HB2 SER A 14 21.335 25.029 -8.274 1.00 25.00 H new ATOM 0 HB3 SER A 14 21.191 26.774 -8.355 1.00 25.00 H new ATOM 0 HG SER A 14 18.858 26.326 -8.911 1.00 25.00 H new ATOM 189 N PRO A 15 22.612 25.860 -12.008 1.00 25.00 N ATOM 190 CA PRO A 15 24.022 25.862 -12.422 1.00 25.00 C ATOM 191 C PRO A 15 24.766 27.141 -12.075 1.00 25.00 C ATOM 192 O PRO A 15 25.976 27.125 -11.871 1.00 25.00 O ATOM 193 CB PRO A 15 23.933 25.671 -13.934 1.00 25.00 C ATOM 194 CG PRO A 15 22.622 26.264 -14.305 1.00 25.00 C ATOM 195 CD PRO A 15 21.713 25.860 -13.181 1.00 25.00 C ATOM 0 HA PRO A 15 24.592 25.091 -11.904 1.00 25.00 H new ATOM 0 HB2 PRO A 15 24.755 26.171 -14.447 1.00 25.00 H new ATOM 0 HB3 PRO A 15 23.983 24.616 -14.205 1.00 25.00 H new ATOM 0 HG2 PRO A 15 22.686 27.348 -14.398 1.00 25.00 H new ATOM 0 HG3 PRO A 15 22.267 25.883 -15.263 1.00 25.00 H new ATOM 0 HD2 PRO A 15 20.888 26.562 -13.057 1.00 25.00 H new ATOM 0 HD3 PRO A 15 21.273 24.878 -13.352 1.00 25.00 H new ATOM 203 N GLN A 16 24.026 28.229 -11.917 1.00 25.00 N ATOM 204 CA GLN A 16 24.613 29.518 -11.546 1.00 25.00 C ATOM 205 C GLN A 16 25.254 29.468 -10.169 1.00 25.00 C ATOM 206 O GLN A 16 26.030 30.340 -9.809 1.00 25.00 O ATOM 207 CB GLN A 16 23.545 30.612 -11.548 1.00 25.00 C ATOM 208 CG GLN A 16 22.439 30.402 -10.510 1.00 25.00 C ATOM 209 CD GLN A 16 21.589 31.628 -10.305 1.00 25.00 C ATOM 210 OE1 GLN A 16 21.050 32.190 -11.246 1.00 25.00 O ATOM 211 NE2 GLN A 16 21.454 32.043 -9.075 1.00 25.00 N ATOM 0 H GLN A 16 23.014 28.249 -12.039 1.00 25.00 H new ATOM 0 HA GLN A 16 25.382 29.742 -12.285 1.00 25.00 H new ATOM 0 HB2 GLN A 16 24.024 31.574 -11.365 1.00 25.00 H new ATOM 0 HB3 GLN A 16 23.094 30.664 -12.539 1.00 25.00 H new ATOM 0 HG2 GLN A 16 21.804 29.574 -10.825 1.00 25.00 H new ATOM 0 HG3 GLN A 16 22.889 30.115 -9.560 1.00 25.00 H new ATOM 0 HE21 GLN A 16 21.920 31.547 -8.315 1.00 25.00 H new ATOM 0 HE22 GLN A 16 20.882 32.863 -8.873 1.00 25.00 H new ATOM 220 N GLY A 17 24.915 28.446 -9.397 1.00 25.00 N ATOM 221 CA GLY A 17 25.464 28.300 -8.071 1.00 25.00 C ATOM 222 C GLY A 17 26.348 27.094 -7.927 1.00 25.00 C ATOM 223 O GLY A 17 27.308 27.112 -7.165 1.00 25.00 O ATOM 0 H GLY A 17 24.263 27.711 -9.671 1.00 25.00 H new ATOM 0 HA2 GLY A 17 26.036 29.194 -7.821 1.00 25.00 H new ATOM 0 HA3 GLY A 17 24.648 28.232 -7.352 1.00 25.00 H new ATOM 227 N LEU A 18 26.022 26.035 -8.654 1.00 25.00 N ATOM 228 CA LEU A 18 26.770 24.796 -8.550 1.00 25.00 C ATOM 229 C LEU A 18 28.097 24.913 -9.302 1.00 25.00 C ATOM 230 O LEU A 18 29.129 24.450 -8.817 1.00 25.00 O ATOM 231 CB LEU A 18 25.882 23.623 -9.021 1.00 25.00 C ATOM 232 CG LEU A 18 26.099 22.994 -10.403 1.00 25.00 C ATOM 233 CD1 LEU A 18 27.238 22.001 -10.335 1.00 25.00 C ATOM 234 CD2 LEU A 18 24.838 22.287 -10.872 1.00 25.00 C ATOM 0 H LEU A 18 25.248 26.011 -9.318 1.00 25.00 H new ATOM 0 HA LEU A 18 27.036 24.592 -7.513 1.00 25.00 H new ATOM 0 HB2 LEU A 18 25.983 22.826 -8.284 1.00 25.00 H new ATOM 0 HB3 LEU A 18 24.848 23.965 -8.981 1.00 25.00 H new ATOM 0 HG LEU A 18 26.342 23.786 -11.112 1.00 25.00 H new ATOM 0 HD11 LEU A 18 27.391 21.555 -11.318 1.00 25.00 H new ATOM 0 HD12 LEU A 18 28.149 22.513 -10.023 1.00 25.00 H new ATOM 0 HD13 LEU A 18 26.996 21.219 -9.615 1.00 25.00 H new ATOM 0 HD21 LEU A 18 25.011 21.847 -11.854 1.00 25.00 H new ATOM 0 HD22 LEU A 18 24.577 21.501 -10.163 1.00 25.00 H new ATOM 0 HD23 LEU A 18 24.020 23.005 -10.935 1.00 25.00 H new ATOM 246 N ASP A 19 28.079 25.571 -10.452 1.00 25.00 N ATOM 247 CA ASP A 19 29.298 25.726 -11.257 1.00 25.00 C ATOM 248 C ASP A 19 30.073 26.896 -10.713 1.00 25.00 C ATOM 249 O ASP A 19 31.303 26.926 -10.732 1.00 25.00 O ATOM 250 CB ASP A 19 28.991 26.036 -12.728 1.00 25.00 C ATOM 251 CG ASP A 19 28.463 24.842 -13.494 1.00 25.00 C ATOM 252 OD1 ASP A 19 28.630 23.690 -13.052 1.00 25.00 O ATOM 253 OD2 ASP A 19 27.943 25.069 -14.609 1.00 25.00 O ATOM 0 H ASP A 19 27.247 26.005 -10.852 1.00 25.00 H new ATOM 0 HA ASP A 19 29.851 24.788 -11.204 1.00 25.00 H new ATOM 0 HB2 ASP A 19 28.260 26.843 -12.777 1.00 25.00 H new ATOM 0 HB3 ASP A 19 29.898 26.398 -13.213 1.00 25.00 H new ATOM 258 N ASN A 20 29.324 27.907 -10.298 1.00 25.00 N ATOM 259 CA ASN A 20 29.878 29.158 -9.865 1.00 25.00 C ATOM 260 C ASN A 20 29.724 29.482 -8.375 1.00 25.00 C ATOM 261 O ASN A 20 28.869 30.279 -7.969 1.00 25.00 O ATOM 262 CB ASN A 20 29.234 30.228 -10.714 1.00 25.00 C ATOM 263 CG ASN A 20 30.173 31.268 -11.078 1.00 25.00 C ATOM 264 OD1 ASN A 20 30.890 31.807 -10.242 1.00 25.00 O ATOM 265 ND2 ASN A 20 30.251 31.528 -12.335 1.00 25.00 N ATOM 0 H ASN A 20 28.306 27.870 -10.256 1.00 25.00 H new ATOM 0 HA ASN A 20 30.959 29.101 -9.993 1.00 25.00 H new ATOM 0 HB2 ASN A 20 28.824 29.777 -11.618 1.00 25.00 H new ATOM 0 HB3 ASN A 20 28.398 30.668 -10.170 1.00 25.00 H new ATOM 0 HD21 ASN A 20 30.931 32.208 -12.674 1.00 25.00 H new ATOM 0 HD22 ASN A 20 29.633 31.054 -12.993 1.00 25.00 H new ATOM 272 N PRO A 21 30.627 28.946 -7.542 1.00 25.00 N ATOM 273 CA PRO A 21 30.588 29.349 -6.136 1.00 25.00 C ATOM 274 C PRO A 21 30.877 30.822 -5.940 1.00 25.00 C ATOM 275 O PRO A 21 30.490 31.391 -4.938 1.00 25.00 O ATOM 276 CB PRO A 21 31.720 28.535 -5.511 1.00 25.00 C ATOM 277 CG PRO A 21 32.594 28.198 -6.622 1.00 25.00 C ATOM 278 CD PRO A 21 31.734 28.013 -7.798 1.00 25.00 C ATOM 0 HA PRO A 21 29.603 29.180 -5.702 1.00 25.00 H new ATOM 0 HB2 PRO A 21 32.249 29.112 -4.752 1.00 25.00 H new ATOM 0 HB3 PRO A 21 31.339 27.639 -5.022 1.00 25.00 H new ATOM 0 HG2 PRO A 21 33.321 28.991 -6.796 1.00 25.00 H new ATOM 0 HG3 PRO A 21 33.158 27.290 -6.409 1.00 25.00 H new ATOM 0 HD2 PRO A 21 32.258 28.251 -8.724 1.00 25.00 H new ATOM 0 HD3 PRO A 21 31.384 26.984 -7.885 1.00 25.00 H new ATOM 286 N ALA A 22 31.584 31.440 -6.873 1.00 25.00 N ATOM 287 CA ALA A 22 31.922 32.847 -6.740 1.00 25.00 C ATOM 288 C ALA A 22 30.653 33.692 -6.826 1.00 25.00 C ATOM 289 O ALA A 22 30.457 34.594 -6.016 1.00 25.00 O ATOM 290 CB ALA A 22 32.927 33.251 -7.815 1.00 25.00 C ATOM 0 H ALA A 22 31.932 30.995 -7.722 1.00 25.00 H new ATOM 0 HA ALA A 22 32.384 33.018 -5.768 1.00 25.00 H new ATOM 0 HB1 ALA A 22 33.172 34.307 -7.705 1.00 25.00 H new ATOM 0 HB2 ALA A 22 33.833 32.655 -7.708 1.00 25.00 H new ATOM 0 HB3 ALA A 22 32.494 33.080 -8.801 1.00 25.00 H new ATOM 296 N LEU A 23 29.785 33.367 -7.776 1.00 25.00 N ATOM 297 CA LEU A 23 28.519 34.091 -7.929 1.00 25.00 C ATOM 298 C LEU A 23 27.615 33.799 -6.755 1.00 25.00 C ATOM 299 O LEU A 23 27.013 34.697 -6.187 1.00 25.00 O ATOM 300 CB LEU A 23 27.772 33.666 -9.200 1.00 25.00 C ATOM 301 CG LEU A 23 28.263 34.214 -10.547 1.00 25.00 C ATOM 302 CD1 LEU A 23 27.421 33.609 -11.671 1.00 25.00 C ATOM 303 CD2 LEU A 23 28.162 35.734 -10.597 1.00 25.00 C ATOM 0 H LEU A 23 29.928 32.614 -8.449 1.00 25.00 H new ATOM 0 HA LEU A 23 28.763 35.152 -7.988 1.00 25.00 H new ATOM 0 HB2 LEU A 23 27.799 32.578 -9.254 1.00 25.00 H new ATOM 0 HB3 LEU A 23 26.727 33.954 -9.084 1.00 25.00 H new ATOM 0 HG LEU A 23 29.311 33.940 -10.670 1.00 25.00 H new ATOM 0 HD11 LEU A 23 27.765 33.994 -12.631 1.00 25.00 H new ATOM 0 HD12 LEU A 23 27.523 32.524 -11.658 1.00 25.00 H new ATOM 0 HD13 LEU A 23 26.374 33.877 -11.526 1.00 25.00 H new ATOM 0 HD21 LEU A 23 28.517 36.091 -11.564 1.00 25.00 H new ATOM 0 HD22 LEU A 23 27.123 36.034 -10.459 1.00 25.00 H new ATOM 0 HD23 LEU A 23 28.773 36.166 -9.804 1.00 25.00 H new ATOM 315 N LEU A 24 27.515 32.532 -6.389 1.00 25.00 N ATOM 316 CA LEU A 24 26.623 32.135 -5.309 1.00 25.00 C ATOM 317 C LEU A 24 27.048 32.747 -3.983 1.00 25.00 C ATOM 318 O LEU A 24 26.212 33.212 -3.225 1.00 25.00 O ATOM 319 CB LEU A 24 26.577 30.614 -5.206 1.00 25.00 C ATOM 320 CG LEU A 24 25.587 30.019 -4.191 1.00 25.00 C ATOM 321 CD1 LEU A 24 24.195 30.636 -4.289 1.00 25.00 C ATOM 322 CD2 LEU A 24 25.498 28.510 -4.392 1.00 25.00 C ATOM 0 H LEU A 24 28.034 31.766 -6.818 1.00 25.00 H new ATOM 0 HA LEU A 24 25.625 32.508 -5.538 1.00 25.00 H new ATOM 0 HB2 LEU A 24 26.336 30.214 -6.191 1.00 25.00 H new ATOM 0 HB3 LEU A 24 27.577 30.260 -4.954 1.00 25.00 H new ATOM 0 HG LEU A 24 25.967 30.249 -3.196 1.00 25.00 H new ATOM 0 HD11 LEU A 24 23.540 30.176 -3.548 1.00 25.00 H new ATOM 0 HD12 LEU A 24 24.258 31.708 -4.102 1.00 25.00 H new ATOM 0 HD13 LEU A 24 23.791 30.465 -5.287 1.00 25.00 H new ATOM 0 HD21 LEU A 24 24.796 28.088 -3.673 1.00 25.00 H new ATOM 0 HD22 LEU A 24 25.152 28.297 -5.404 1.00 25.00 H new ATOM 0 HD23 LEU A 24 26.482 28.065 -4.244 1.00 25.00 H new ATOM 334 N ARG A 25 28.347 32.800 -3.726 1.00 25.00 N ATOM 335 CA ARG A 25 28.866 33.437 -2.514 1.00 25.00 C ATOM 336 C ARG A 25 28.414 34.877 -2.506 1.00 25.00 C ATOM 337 O ARG A 25 27.973 35.390 -1.492 1.00 25.00 O ATOM 338 CB ARG A 25 30.401 33.352 -2.508 1.00 25.00 C ATOM 339 CG ARG A 25 31.141 34.265 -1.519 1.00 25.00 C ATOM 340 CD ARG A 25 31.673 35.560 -2.200 1.00 25.00 C ATOM 341 NE ARG A 25 32.600 35.241 -3.257 1.00 25.00 N ATOM 342 CZ ARG A 25 32.913 36.048 -4.275 1.00 25.00 C ATOM 343 NH1 ARG A 25 32.392 37.242 -4.446 1.00 25.00 N ATOM 344 NH2 ARG A 25 33.778 35.667 -5.160 1.00 25.00 N ATOM 0 H ARG A 25 29.065 32.411 -4.338 1.00 25.00 H new ATOM 0 HA ARG A 25 28.491 32.932 -1.623 1.00 25.00 H new ATOM 0 HB2 ARG A 25 30.683 32.321 -2.295 1.00 25.00 H new ATOM 0 HB3 ARG A 25 30.758 33.579 -3.513 1.00 25.00 H new ATOM 0 HG2 ARG A 25 30.470 34.535 -0.704 1.00 25.00 H new ATOM 0 HG3 ARG A 25 31.975 33.719 -1.078 1.00 25.00 H new ATOM 0 HD2 ARG A 25 30.838 36.133 -2.604 1.00 25.00 H new ATOM 0 HD3 ARG A 25 32.164 36.191 -1.458 1.00 25.00 H new ATOM 0 HE ARG A 25 33.053 34.327 -3.225 1.00 25.00 H new ATOM 0 HH11 ARG A 25 31.707 37.600 -3.780 1.00 25.00 H new ATOM 0 HH12 ARG A 25 32.672 37.811 -5.245 1.00 25.00 H new ATOM 0 HH21 ARG A 25 34.220 34.751 -5.080 1.00 25.00 H new ATOM 0 HH22 ARG A 25 34.017 36.283 -5.937 1.00 25.00 H new ATOM 358 N ASP A 26 28.538 35.538 -3.639 1.00 25.00 N ATOM 359 CA ASP A 26 28.234 36.955 -3.703 1.00 25.00 C ATOM 360 C ASP A 26 26.733 37.209 -3.534 1.00 25.00 C ATOM 361 O ASP A 26 26.320 38.083 -2.773 1.00 25.00 O ATOM 362 CB ASP A 26 28.743 37.512 -5.023 1.00 25.00 C ATOM 363 CG ASP A 26 29.268 38.924 -4.880 1.00 25.00 C ATOM 364 OD1 ASP A 26 28.863 39.815 -5.649 1.00 25.00 O ATOM 365 OD2 ASP A 26 30.168 39.116 -4.024 1.00 25.00 O ATOM 0 H ASP A 26 28.844 35.124 -4.519 1.00 25.00 H new ATOM 0 HA ASP A 26 28.735 37.467 -2.882 1.00 25.00 H new ATOM 0 HB2 ASP A 26 29.535 36.868 -5.406 1.00 25.00 H new ATOM 0 HB3 ASP A 26 27.937 37.498 -5.757 1.00 25.00 H new ATOM 370 N MET A 27 25.920 36.388 -4.185 1.00 25.00 N ATOM 371 CA MET A 27 24.459 36.468 -4.079 1.00 25.00 C ATOM 372 C MET A 27 24.000 36.218 -2.658 1.00 25.00 C ATOM 373 O MET A 27 23.123 36.905 -2.154 1.00 25.00 O ATOM 374 CB MET A 27 23.826 35.420 -4.994 1.00 25.00 C ATOM 375 CG MET A 27 22.320 35.547 -5.123 1.00 25.00 C ATOM 376 SD MET A 27 21.650 34.276 -6.214 1.00 25.00 S ATOM 377 CE MET A 27 21.343 32.923 -5.058 1.00 25.00 C ATOM 0 H MET A 27 26.249 35.646 -4.803 1.00 25.00 H new ATOM 0 HA MET A 27 24.150 37.471 -4.375 1.00 25.00 H new ATOM 0 HB2 MET A 27 24.274 35.499 -5.985 1.00 25.00 H new ATOM 0 HB3 MET A 27 24.066 34.427 -4.614 1.00 25.00 H new ATOM 0 HG2 MET A 27 21.860 35.465 -4.138 1.00 25.00 H new ATOM 0 HG3 MET A 27 22.067 36.534 -5.511 1.00 25.00 H new ATOM 0 HE1 MET A 27 21.168 32.002 -5.614 1.00 25.00 H new ATOM 0 HE2 MET A 27 22.209 32.796 -4.409 1.00 25.00 H new ATOM 0 HE3 MET A 27 20.466 33.154 -4.453 1.00 25.00 H new ATOM 387 N LEU A 28 24.594 35.232 -2.008 1.00 25.00 N ATOM 388 CA LEU A 28 24.230 34.889 -0.639 1.00 25.00 C ATOM 389 C LEU A 28 24.588 36.009 0.310 1.00 25.00 C ATOM 390 O LEU A 28 23.811 36.365 1.179 1.00 25.00 O ATOM 391 CB LEU A 28 24.933 33.635 -0.214 1.00 25.00 C ATOM 392 CG LEU A 28 24.250 32.391 -0.783 1.00 25.00 C ATOM 393 CD1 LEU A 28 25.166 31.272 -0.558 1.00 25.00 C ATOM 394 CD2 LEU A 28 22.895 32.114 -0.144 1.00 25.00 C ATOM 0 H LEU A 28 25.333 34.652 -2.405 1.00 25.00 H new ATOM 0 HA LEU A 28 23.152 34.731 -0.608 1.00 25.00 H new ATOM 0 HB2 LEU A 28 25.970 33.667 -0.548 1.00 25.00 H new ATOM 0 HB3 LEU A 28 24.950 33.577 0.874 1.00 25.00 H new ATOM 0 HG LEU A 28 24.045 32.540 -1.843 1.00 25.00 H new ATOM 0 HD11 LEU A 28 24.723 30.355 -0.948 1.00 25.00 H new ATOM 0 HD12 LEU A 28 26.109 31.465 -1.069 1.00 25.00 H new ATOM 0 HD13 LEU A 28 25.349 31.160 0.511 1.00 25.00 H new ATOM 0 HD21 LEU A 28 22.459 31.219 -0.589 1.00 25.00 H new ATOM 0 HD22 LEU A 28 23.022 31.961 0.928 1.00 25.00 H new ATOM 0 HD23 LEU A 28 22.233 32.963 -0.313 1.00 25.00 H new ATOM 406 N LEU A 29 25.767 36.582 0.124 1.00 25.00 N ATOM 407 CA LEU A 29 26.219 37.692 0.973 1.00 25.00 C ATOM 408 C LEU A 29 25.290 38.885 0.818 1.00 25.00 C ATOM 409 O LEU A 29 24.983 39.585 1.783 1.00 25.00 O ATOM 410 CB LEU A 29 27.640 38.122 0.593 1.00 25.00 C ATOM 411 CG LEU A 29 28.776 37.216 1.084 1.00 25.00 C ATOM 412 CD1 LEU A 29 30.038 37.517 0.295 1.00 25.00 C ATOM 413 CD2 LEU A 29 29.037 37.397 2.581 1.00 25.00 C ATOM 0 H LEU A 29 26.430 36.305 -0.600 1.00 25.00 H new ATOM 0 HA LEU A 29 26.210 37.347 2.007 1.00 25.00 H new ATOM 0 HB2 LEU A 29 27.699 38.187 -0.493 1.00 25.00 H new ATOM 0 HB3 LEU A 29 27.810 39.126 0.982 1.00 25.00 H new ATOM 0 HG LEU A 29 28.478 36.180 0.926 1.00 25.00 H new ATOM 0 HD11 LEU A 29 30.847 36.874 0.643 1.00 25.00 H new ATOM 0 HD12 LEU A 29 29.858 37.333 -0.764 1.00 25.00 H new ATOM 0 HD13 LEU A 29 30.317 38.561 0.439 1.00 25.00 H new ATOM 0 HD21 LEU A 29 29.848 36.738 2.891 1.00 25.00 H new ATOM 0 HD22 LEU A 29 29.314 38.432 2.779 1.00 25.00 H new ATOM 0 HD23 LEU A 29 28.135 37.149 3.140 1.00 25.00 H new ATOM 425 N ALA A 30 24.841 39.102 -0.405 1.00 25.00 N ATOM 426 CA ALA A 30 23.956 40.216 -0.721 1.00 25.00 C ATOM 427 C ALA A 30 22.511 39.955 -0.276 1.00 25.00 C ATOM 428 O ALA A 30 21.694 40.876 -0.242 1.00 25.00 O ATOM 429 CB ALA A 30 23.998 40.487 -2.230 1.00 25.00 C ATOM 0 H ALA A 30 25.076 38.516 -1.206 1.00 25.00 H new ATOM 0 HA ALA A 30 24.310 41.089 -0.172 1.00 25.00 H new ATOM 0 HB1 ALA A 30 23.337 41.320 -2.469 1.00 25.00 H new ATOM 0 HB2 ALA A 30 25.017 40.736 -2.527 1.00 25.00 H new ATOM 0 HB3 ALA A 30 23.670 39.598 -2.769 1.00 25.00 H new ATOM 435 N ASN A 31 22.181 38.703 0.019 1.00 25.00 N ATOM 436 CA ASN A 31 20.807 38.331 0.345 1.00 25.00 C ATOM 437 C ASN A 31 20.652 37.988 1.828 1.00 25.00 C ATOM 438 O ASN A 31 20.913 36.859 2.250 1.00 25.00 O ATOM 439 CB ASN A 31 20.395 37.146 -0.520 1.00 25.00 C ATOM 440 CG ASN A 31 18.916 36.944 -0.551 1.00 25.00 C ATOM 441 OD1 ASN A 31 18.223 37.081 0.459 1.00 25.00 O ATOM 442 ND2 ASN A 31 18.412 36.626 -1.709 1.00 25.00 N ATOM 0 H ASN A 31 22.844 37.928 0.040 1.00 25.00 H new ATOM 0 HA ASN A 31 20.158 39.183 0.142 1.00 25.00 H new ATOM 0 HB2 ASN A 31 20.758 37.299 -1.536 1.00 25.00 H new ATOM 0 HB3 ASN A 31 20.874 36.242 -0.143 1.00 25.00 H new ATOM 0 HD21 ASN A 31 17.407 36.480 -1.805 1.00 25.00 H new ATOM 0 HD22 ASN A 31 19.022 36.523 -2.520 1.00 25.00 H new ATOM 449 N PRO A 32 20.195 38.955 2.645 1.00 25.00 N ATOM 450 CA PRO A 32 20.136 38.691 4.087 1.00 25.00 C ATOM 451 C PRO A 32 19.160 37.589 4.502 1.00 25.00 C ATOM 452 O PRO A 32 19.339 36.961 5.540 1.00 25.00 O ATOM 453 CB PRO A 32 19.726 40.050 4.664 1.00 25.00 C ATOM 454 CG PRO A 32 18.987 40.709 3.553 1.00 25.00 C ATOM 455 CD PRO A 32 19.757 40.329 2.339 1.00 25.00 C ATOM 0 HA PRO A 32 21.088 38.310 4.456 1.00 25.00 H new ATOM 0 HB2 PRO A 32 19.098 39.935 5.547 1.00 25.00 H new ATOM 0 HB3 PRO A 32 20.596 40.634 4.965 1.00 25.00 H new ATOM 0 HG2 PRO A 32 17.955 40.361 3.497 1.00 25.00 H new ATOM 0 HG3 PRO A 32 18.952 41.791 3.682 1.00 25.00 H new ATOM 0 HD2 PRO A 32 19.140 40.366 1.441 1.00 25.00 H new ATOM 0 HD3 PRO A 32 20.603 40.995 2.172 1.00 25.00 H new ATOM 463 N HIS A 33 18.131 37.346 3.703 1.00 25.00 N ATOM 464 CA HIS A 33 17.169 36.294 4.017 1.00 25.00 C ATOM 465 C HIS A 33 17.748 34.920 3.716 1.00 25.00 C ATOM 466 O HIS A 33 17.571 33.974 4.481 1.00 25.00 O ATOM 467 CB HIS A 33 15.893 36.492 3.198 1.00 25.00 C ATOM 468 CG HIS A 33 14.803 35.524 3.545 1.00 25.00 C ATOM 469 ND1 HIS A 33 13.987 35.637 4.642 1.00 25.00 N ATOM 470 CD2 HIS A 33 14.399 34.383 2.920 1.00 25.00 C ATOM 471 CE1 HIS A 33 13.146 34.607 4.643 1.00 25.00 C ATOM 472 NE2 HIS A 33 13.346 33.814 3.612 1.00 25.00 N ATOM 0 H HIS A 33 17.940 37.856 2.841 1.00 25.00 H new ATOM 0 HA HIS A 33 16.939 36.354 5.081 1.00 25.00 H new ATOM 0 HB2 HIS A 33 15.528 37.508 3.349 1.00 25.00 H new ATOM 0 HB3 HIS A 33 16.132 36.394 2.139 1.00 25.00 H new ATOM 0 HD2 HIS A 33 14.836 33.982 2.018 1.00 25.00 H new ATOM 0 HE1 HIS A 33 12.391 34.442 5.398 1.00 25.00 H new ATOM 0 HE2 HIS A 33 12.835 32.964 3.375 1.00 25.00 H new ATOM 480 N GLU A 34 18.429 34.810 2.590 1.00 25.00 N ATOM 481 CA GLU A 34 18.943 33.526 2.144 1.00 25.00 C ATOM 482 C GLU A 34 20.106 33.138 3.018 1.00 25.00 C ATOM 483 O GLU A 34 20.177 32.040 3.518 1.00 25.00 O ATOM 484 CB GLU A 34 19.388 33.608 0.692 1.00 25.00 C ATOM 485 CG GLU A 34 18.589 32.721 -0.239 1.00 25.00 C ATOM 486 CD GLU A 34 18.842 31.227 -0.014 1.00 25.00 C ATOM 487 OE1 GLU A 34 17.962 30.426 -0.383 1.00 25.00 O ATOM 488 OE2 GLU A 34 19.897 30.859 0.549 1.00 25.00 O ATOM 0 H GLU A 34 18.639 35.591 1.969 1.00 25.00 H new ATOM 0 HA GLU A 34 18.157 32.775 2.218 1.00 25.00 H new ATOM 0 HB2 GLU A 34 19.307 34.641 0.354 1.00 25.00 H new ATOM 0 HB3 GLU A 34 20.441 33.333 0.627 1.00 25.00 H new ATOM 0 HG2 GLU A 34 17.527 32.927 -0.105 1.00 25.00 H new ATOM 0 HG3 GLU A 34 18.835 32.973 -1.271 1.00 25.00 H new ATOM 495 N LEU A 35 20.980 34.086 3.294 1.00 25.00 N ATOM 496 CA LEU A 35 22.106 33.833 4.173 1.00 25.00 C ATOM 497 C LEU A 35 21.640 33.366 5.558 1.00 25.00 C ATOM 498 O LEU A 35 22.344 32.628 6.237 1.00 25.00 O ATOM 499 CB LEU A 35 23.000 35.046 4.195 1.00 25.00 C ATOM 500 CG LEU A 35 22.864 36.218 5.160 1.00 25.00 C ATOM 501 CD1 LEU A 35 23.055 35.889 6.626 1.00 25.00 C ATOM 502 CD2 LEU A 35 23.936 37.153 4.689 1.00 25.00 C ATOM 0 H LEU A 35 20.933 35.035 2.924 1.00 25.00 H new ATOM 0 HA LEU A 35 22.703 33.005 3.791 1.00 25.00 H new ATOM 0 HB2 LEU A 35 24.014 34.668 4.326 1.00 25.00 H new ATOM 0 HB3 LEU A 35 22.946 35.475 3.194 1.00 25.00 H new ATOM 0 HG LEU A 35 21.848 36.613 5.138 1.00 25.00 H new ATOM 0 HD11 LEU A 35 22.937 36.795 7.221 1.00 25.00 H new ATOM 0 HD12 LEU A 35 22.312 35.153 6.934 1.00 25.00 H new ATOM 0 HD13 LEU A 35 24.054 35.482 6.780 1.00 25.00 H new ATOM 0 HD21 LEU A 35 23.939 38.047 5.313 1.00 25.00 H new ATOM 0 HD22 LEU A 35 24.905 36.659 4.758 1.00 25.00 H new ATOM 0 HD23 LEU A 35 23.745 37.434 3.653 1.00 25.00 H new ATOM 514 N SER A 36 20.463 33.823 5.974 1.00 25.00 N ATOM 515 CA SER A 36 19.862 33.468 7.259 1.00 25.00 C ATOM 516 C SER A 36 19.310 32.051 7.238 1.00 25.00 C ATOM 517 O SER A 36 19.443 31.310 8.203 1.00 25.00 O ATOM 518 CB SER A 36 18.746 34.444 7.628 1.00 25.00 C ATOM 519 OG SER A 36 18.291 34.204 8.951 1.00 25.00 O ATOM 0 H SER A 36 19.890 34.460 5.421 1.00 25.00 H new ATOM 0 HA SER A 36 20.650 33.526 8.010 1.00 25.00 H new ATOM 0 HB2 SER A 36 19.108 35.469 7.542 1.00 25.00 H new ATOM 0 HB3 SER A 36 17.917 34.339 6.928 1.00 25.00 H new ATOM 0 HG SER A 36 17.578 34.839 9.172 1.00 25.00 H new ATOM 525 N LEU A 37 18.695 31.659 6.136 1.00 25.00 N ATOM 526 CA LEU A 37 18.181 30.300 6.027 1.00 25.00 C ATOM 527 C LEU A 37 19.329 29.375 5.889 1.00 25.00 C ATOM 528 O LEU A 37 19.305 28.276 6.363 1.00 25.00 O ATOM 529 CB LEU A 37 17.209 30.161 4.872 1.00 25.00 C ATOM 530 CG LEU A 37 17.528 30.070 3.374 1.00 25.00 C ATOM 531 CD1 LEU A 37 18.125 28.744 2.967 1.00 25.00 C ATOM 532 CD2 LEU A 37 16.214 30.294 2.619 1.00 25.00 C ATOM 0 H LEU A 37 18.540 32.247 5.317 1.00 25.00 H new ATOM 0 HA LEU A 37 17.619 30.050 6.927 1.00 25.00 H new ATOM 0 HB2 LEU A 37 16.630 29.264 5.094 1.00 25.00 H new ATOM 0 HB3 LEU A 37 16.532 31.010 4.967 1.00 25.00 H new ATOM 0 HG LEU A 37 18.279 30.823 3.134 1.00 25.00 H new ATOM 0 HD11 LEU A 37 18.326 28.749 1.896 1.00 25.00 H new ATOM 0 HD12 LEU A 37 19.056 28.582 3.510 1.00 25.00 H new ATOM 0 HD13 LEU A 37 17.425 27.942 3.201 1.00 25.00 H new ATOM 0 HD21 LEU A 37 16.397 30.237 1.546 1.00 25.00 H new ATOM 0 HD22 LEU A 37 15.494 29.527 2.906 1.00 25.00 H new ATOM 0 HD23 LEU A 37 15.815 31.277 2.867 1.00 25.00 H new ATOM 544 N LEU A 38 20.352 29.854 5.234 1.00 25.00 N ATOM 545 CA LEU A 38 21.542 29.084 5.001 1.00 25.00 C ATOM 546 C LEU A 38 22.199 28.669 6.301 1.00 25.00 C ATOM 547 O LEU A 38 22.510 27.508 6.484 1.00 25.00 O ATOM 548 CB LEU A 38 22.463 29.932 4.162 1.00 25.00 C ATOM 549 CG LEU A 38 23.724 29.245 3.638 1.00 25.00 C ATOM 550 CD1 LEU A 38 23.361 28.173 2.664 1.00 25.00 C ATOM 551 CD2 LEU A 38 24.645 30.264 3.013 1.00 25.00 C ATOM 0 H LEU A 38 20.382 30.796 4.845 1.00 25.00 H new ATOM 0 HA LEU A 38 21.299 28.158 4.480 1.00 25.00 H new ATOM 0 HB2 LEU A 38 21.899 30.309 3.309 1.00 25.00 H new ATOM 0 HB3 LEU A 38 22.765 30.797 4.752 1.00 25.00 H new ATOM 0 HG LEU A 38 24.250 28.777 4.470 1.00 25.00 H new ATOM 0 HD11 LEU A 38 24.268 27.691 2.298 1.00 25.00 H new ATOM 0 HD12 LEU A 38 22.730 27.433 3.156 1.00 25.00 H new ATOM 0 HD13 LEU A 38 22.820 28.611 1.826 1.00 25.00 H new ATOM 0 HD21 LEU A 38 25.541 29.766 2.642 1.00 25.00 H new ATOM 0 HD22 LEU A 38 24.135 30.756 2.185 1.00 25.00 H new ATOM 0 HD23 LEU A 38 24.926 31.007 3.759 1.00 25.00 H new ATOM 563 N LYS A 39 22.348 29.589 7.237 1.00 25.00 N ATOM 564 CA LYS A 39 22.876 29.214 8.567 1.00 25.00 C ATOM 565 C LYS A 39 21.941 28.292 9.349 1.00 25.00 C ATOM 566 O LYS A 39 22.405 27.513 10.169 1.00 25.00 O ATOM 567 CB LYS A 39 23.268 30.439 9.411 1.00 25.00 C ATOM 568 CG LYS A 39 22.280 31.599 9.372 1.00 25.00 C ATOM 569 CD LYS A 39 22.711 32.780 10.224 1.00 25.00 C ATOM 570 CE LYS A 39 23.799 33.582 9.515 1.00 25.00 C ATOM 571 NZ LYS A 39 24.087 34.882 10.210 1.00 25.00 N ATOM 0 H LYS A 39 22.123 30.577 7.122 1.00 25.00 H new ATOM 0 HA LYS A 39 23.784 28.646 8.362 1.00 25.00 H new ATOM 0 HB2 LYS A 39 23.390 30.122 10.447 1.00 25.00 H new ATOM 0 HB3 LYS A 39 24.239 30.799 9.071 1.00 25.00 H new ATOM 0 HG2 LYS A 39 22.157 31.929 8.340 1.00 25.00 H new ATOM 0 HG3 LYS A 39 21.305 31.250 9.713 1.00 25.00 H new ATOM 0 HD2 LYS A 39 21.853 33.421 10.428 1.00 25.00 H new ATOM 0 HD3 LYS A 39 23.081 32.426 11.186 1.00 25.00 H new ATOM 0 HE2 LYS A 39 24.712 32.988 9.465 1.00 25.00 H new ATOM 0 HE3 LYS A 39 23.491 33.781 8.488 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 24.832 35.394 9.695 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 23.223 35.461 10.236 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 24.406 34.693 11.182 1.00 25.00 H new ATOM 585 N GLU A 40 20.648 28.347 9.077 1.00 25.00 N ATOM 586 CA GLU A 40 19.693 27.470 9.758 1.00 25.00 C ATOM 587 C GLU A 40 19.613 26.070 9.116 1.00 25.00 C ATOM 588 O GLU A 40 19.569 25.054 9.804 1.00 25.00 O ATOM 589 CB GLU A 40 18.305 28.109 9.732 1.00 25.00 C ATOM 590 CG GLU A 40 17.596 28.073 11.077 1.00 25.00 C ATOM 591 CD GLU A 40 16.090 28.211 10.928 1.00 25.00 C ATOM 592 OE1 GLU A 40 15.363 27.404 11.549 1.00 25.00 O ATOM 593 OE2 GLU A 40 15.632 28.998 10.077 1.00 25.00 O ATOM 0 H GLU A 40 20.232 28.982 8.396 1.00 25.00 H new ATOM 0 HA GLU A 40 20.044 27.345 10.782 1.00 25.00 H new ATOM 0 HB2 GLU A 40 18.397 29.145 9.406 1.00 25.00 H new ATOM 0 HB3 GLU A 40 17.691 27.595 8.992 1.00 25.00 H new ATOM 0 HG2 GLU A 40 17.826 27.136 11.584 1.00 25.00 H new ATOM 0 HG3 GLU A 40 17.974 28.878 11.708 1.00 25.00 H new ATOM 600 N ARG A 41 19.543 26.029 7.789 1.00 25.00 N ATOM 601 CA ARG A 41 19.385 24.769 7.040 1.00 25.00 C ATOM 602 C ARG A 41 20.693 24.085 6.665 1.00 25.00 C ATOM 603 O ARG A 41 20.742 22.864 6.520 1.00 25.00 O ATOM 604 CB ARG A 41 18.623 25.043 5.738 1.00 25.00 C ATOM 605 CG ARG A 41 17.252 25.711 5.901 1.00 25.00 C ATOM 606 CD ARG A 41 16.162 24.760 6.434 1.00 25.00 C ATOM 607 NE ARG A 41 16.256 24.556 7.891 1.00 25.00 N ATOM 608 CZ ARG A 41 15.768 25.376 8.818 1.00 25.00 C ATOM 609 NH1 ARG A 41 15.117 26.471 8.521 1.00 25.00 N ATOM 610 NH2 ARG A 41 15.955 25.086 10.070 1.00 25.00 N ATOM 0 H ARG A 41 19.593 26.859 7.198 1.00 25.00 H new ATOM 0 HA ARG A 41 18.848 24.100 7.713 1.00 25.00 H new ATOM 0 HB2 ARG A 41 19.242 25.676 5.102 1.00 25.00 H new ATOM 0 HB3 ARG A 41 18.487 24.098 5.212 1.00 25.00 H new ATOM 0 HG2 ARG A 41 17.348 26.558 6.581 1.00 25.00 H new ATOM 0 HG3 ARG A 41 16.935 26.110 4.938 1.00 25.00 H new ATOM 0 HD2 ARG A 41 15.180 25.164 6.189 1.00 25.00 H new ATOM 0 HD3 ARG A 41 16.245 23.798 5.929 1.00 25.00 H new ATOM 0 HE ARG A 41 16.735 23.716 8.215 1.00 25.00 H new ATOM 0 HH11 ARG A 41 14.966 26.726 7.545 1.00 25.00 H new ATOM 0 HH12 ARG A 41 14.760 27.070 9.265 1.00 25.00 H new ATOM 0 HH21 ARG A 41 16.468 24.243 10.327 1.00 25.00 H new ATOM 0 HH22 ARG A 41 15.589 25.702 10.796 1.00 25.00 H new ATOM 624 N ASN A 42 21.731 24.873 6.439 1.00 25.00 N ATOM 625 CA ASN A 42 23.038 24.356 6.007 1.00 25.00 C ATOM 626 C ASN A 42 24.216 25.008 6.741 1.00 25.00 C ATOM 627 O ASN A 42 25.044 25.683 6.113 1.00 25.00 O ATOM 628 CB ASN A 42 23.215 24.606 4.505 1.00 25.00 C ATOM 629 CG ASN A 42 24.262 23.718 3.895 1.00 25.00 C ATOM 630 OD1 ASN A 42 24.844 22.877 4.557 1.00 25.00 O ATOM 631 ND2 ASN A 42 24.479 23.872 2.624 1.00 25.00 N ATOM 0 H ASN A 42 21.702 25.887 6.547 1.00 25.00 H new ATOM 0 HA ASN A 42 23.044 23.292 6.242 1.00 25.00 H new ATOM 0 HB2 ASN A 42 22.264 24.443 3.998 1.00 25.00 H new ATOM 0 HB3 ASN A 42 23.488 25.649 4.343 1.00 25.00 H new ATOM 0 HD21 ASN A 42 25.156 23.277 2.147 1.00 25.00 H new ATOM 0 HD22 ASN A 42 23.972 24.587 2.103 1.00 25.00 H new ATOM 638 N PRO A 43 24.328 24.810 8.067 1.00 25.00 N ATOM 639 CA PRO A 43 25.437 25.504 8.740 1.00 25.00 C ATOM 640 C PRO A 43 26.877 25.297 8.208 1.00 25.00 C ATOM 641 O PRO A 43 27.644 26.258 8.223 1.00 25.00 O ATOM 642 CB PRO A 43 25.292 25.062 10.204 1.00 25.00 C ATOM 643 CG PRO A 43 24.460 23.827 10.167 1.00 25.00 C ATOM 644 CD PRO A 43 23.514 24.037 9.025 1.00 25.00 C ATOM 0 HA PRO A 43 25.339 26.574 8.558 1.00 25.00 H new ATOM 0 HB2 PRO A 43 26.266 24.866 10.653 1.00 25.00 H new ATOM 0 HB3 PRO A 43 24.816 25.838 10.803 1.00 25.00 H new ATOM 0 HG2 PRO A 43 25.075 22.940 10.013 1.00 25.00 H new ATOM 0 HG3 PRO A 43 23.923 23.684 11.105 1.00 25.00 H new ATOM 0 HD2 PRO A 43 23.177 23.092 8.600 1.00 25.00 H new ATOM 0 HD3 PRO A 43 22.623 24.584 9.333 1.00 25.00 H new ATOM 652 N PRO A 44 27.256 24.097 7.690 1.00 25.00 N ATOM 653 CA PRO A 44 28.648 24.105 7.207 1.00 25.00 C ATOM 654 C PRO A 44 28.911 24.973 5.964 1.00 25.00 C ATOM 655 O PRO A 44 29.982 25.557 5.841 1.00 25.00 O ATOM 656 CB PRO A 44 28.915 22.627 6.906 1.00 25.00 C ATOM 657 CG PRO A 44 27.600 22.085 6.554 1.00 25.00 C ATOM 658 CD PRO A 44 26.653 22.760 7.505 1.00 25.00 C ATOM 0 HA PRO A 44 29.307 24.552 7.951 1.00 25.00 H new ATOM 0 HB2 PRO A 44 29.625 22.510 6.088 1.00 25.00 H new ATOM 0 HB3 PRO A 44 29.338 22.115 7.771 1.00 25.00 H new ATOM 0 HG2 PRO A 44 27.345 22.303 5.517 1.00 25.00 H new ATOM 0 HG3 PRO A 44 27.573 21.001 6.668 1.00 25.00 H new ATOM 0 HD2 PRO A 44 25.646 22.826 7.092 1.00 25.00 H new ATOM 0 HD3 PRO A 44 26.576 22.219 8.448 1.00 25.00 H new ATOM 666 N LEU A 45 27.955 25.088 5.044 1.00 25.00 N ATOM 667 CA LEU A 45 28.167 25.966 3.892 1.00 25.00 C ATOM 668 C LEU A 45 28.012 27.389 4.365 1.00 25.00 C ATOM 669 O LEU A 45 28.684 28.298 3.890 1.00 25.00 O ATOM 670 CB LEU A 45 27.184 25.682 2.761 1.00 25.00 C ATOM 671 CG LEU A 45 27.421 26.473 1.452 1.00 25.00 C ATOM 672 CD1 LEU A 45 28.825 26.252 0.864 1.00 25.00 C ATOM 673 CD2 LEU A 45 26.375 26.061 0.426 1.00 25.00 C ATOM 0 H LEU A 45 27.057 24.605 5.068 1.00 25.00 H new ATOM 0 HA LEU A 45 29.165 25.789 3.490 1.00 25.00 H new ATOM 0 HB2 LEU A 45 27.220 24.617 2.532 1.00 25.00 H new ATOM 0 HB3 LEU A 45 26.177 25.898 3.117 1.00 25.00 H new ATOM 0 HG LEU A 45 27.338 27.533 1.693 1.00 25.00 H new ATOM 0 HD11 LEU A 45 28.931 26.832 -0.053 1.00 25.00 H new ATOM 0 HD12 LEU A 45 29.576 26.573 1.586 1.00 25.00 H new ATOM 0 HD13 LEU A 45 28.964 25.194 0.642 1.00 25.00 H new ATOM 0 HD21 LEU A 45 26.535 26.614 -0.499 1.00 25.00 H new ATOM 0 HD22 LEU A 45 26.460 24.992 0.229 1.00 25.00 H new ATOM 0 HD23 LEU A 45 25.380 26.281 0.812 1.00 25.00 H new ATOM 685 N ALA A 46 27.126 27.583 5.327 1.00 25.00 N ATOM 686 CA ALA A 46 26.914 28.912 5.847 1.00 25.00 C ATOM 687 C ALA A 46 28.165 29.488 6.479 1.00 25.00 C ATOM 688 O ALA A 46 28.526 30.583 6.139 1.00 25.00 O ATOM 689 CB ALA A 46 25.812 28.902 6.850 1.00 25.00 C ATOM 0 H ALA A 46 26.556 26.852 5.752 1.00 25.00 H new ATOM 0 HA ALA A 46 26.644 29.546 5.002 1.00 25.00 H new ATOM 0 HB1 ALA A 46 25.661 29.910 7.235 1.00 25.00 H new ATOM 0 HB2 ALA A 46 24.894 28.553 6.378 1.00 25.00 H new ATOM 0 HB3 ALA A 46 26.074 28.235 7.672 1.00 25.00 H new ATOM 695 N GLU A 47 28.846 28.766 7.360 1.00 25.00 N ATOM 696 CA GLU A 47 30.017 29.336 8.052 1.00 25.00 C ATOM 697 C GLU A 47 31.109 29.703 7.054 1.00 25.00 C ATOM 698 O GLU A 47 31.837 30.687 7.228 1.00 25.00 O ATOM 699 CB GLU A 47 30.566 28.385 9.127 1.00 25.00 C ATOM 700 CG GLU A 47 31.083 27.050 8.604 1.00 25.00 C ATOM 701 CD GLU A 47 31.773 26.243 9.682 1.00 25.00 C ATOM 702 OE1 GLU A 47 32.898 26.630 10.074 1.00 25.00 O ATOM 703 OE2 GLU A 47 31.210 25.219 10.124 1.00 25.00 O ATOM 0 H GLU A 47 28.622 27.804 7.615 1.00 25.00 H new ATOM 0 HA GLU A 47 29.685 30.244 8.556 1.00 25.00 H new ATOM 0 HB2 GLU A 47 31.375 28.888 9.657 1.00 25.00 H new ATOM 0 HB3 GLU A 47 29.779 28.192 9.856 1.00 25.00 H new ATOM 0 HG2 GLU A 47 30.252 26.474 8.198 1.00 25.00 H new ATOM 0 HG3 GLU A 47 31.779 27.228 7.784 1.00 25.00 H new ATOM 710 N ALA A 48 31.170 28.940 5.978 1.00 25.00 N ATOM 711 CA ALA A 48 32.081 29.185 4.895 1.00 25.00 C ATOM 712 C ALA A 48 31.756 30.519 4.229 1.00 25.00 C ATOM 713 O ALA A 48 32.646 31.323 3.949 1.00 25.00 O ATOM 714 CB ALA A 48 31.991 28.025 3.895 1.00 25.00 C ATOM 0 H ALA A 48 30.576 28.123 5.838 1.00 25.00 H new ATOM 0 HA ALA A 48 33.102 29.244 5.272 1.00 25.00 H new ATOM 0 HB1 ALA A 48 32.680 28.203 3.069 1.00 25.00 H new ATOM 0 HB2 ALA A 48 32.256 27.093 4.394 1.00 25.00 H new ATOM 0 HB3 ALA A 48 30.974 27.954 3.510 1.00 25.00 H new ATOM 720 N LEU A 49 30.473 30.760 4.025 1.00 25.00 N ATOM 721 CA LEU A 49 29.992 31.990 3.422 1.00 25.00 C ATOM 722 C LEU A 49 30.227 33.170 4.349 1.00 25.00 C ATOM 723 O LEU A 49 30.644 34.236 3.911 1.00 25.00 O ATOM 724 CB LEU A 49 28.488 31.836 3.138 1.00 25.00 C ATOM 725 CG LEU A 49 27.737 32.900 2.329 1.00 25.00 C ATOM 726 CD1 LEU A 49 27.279 34.076 3.151 1.00 25.00 C ATOM 727 CD2 LEU A 49 28.552 33.375 1.156 1.00 25.00 C ATOM 0 H LEU A 49 29.732 30.105 4.274 1.00 25.00 H new ATOM 0 HA LEU A 49 30.534 32.178 2.495 1.00 25.00 H new ATOM 0 HB2 LEU A 49 28.353 30.885 2.622 1.00 25.00 H new ATOM 0 HB3 LEU A 49 27.986 31.750 4.101 1.00 25.00 H new ATOM 0 HG LEU A 49 26.838 32.403 1.965 1.00 25.00 H new ATOM 0 HD11 LEU A 49 26.756 34.786 2.510 1.00 25.00 H new ATOM 0 HD12 LEU A 49 26.606 33.731 3.936 1.00 25.00 H new ATOM 0 HD13 LEU A 49 28.143 34.563 3.602 1.00 25.00 H new ATOM 0 HD21 LEU A 49 27.990 34.129 0.604 1.00 25.00 H new ATOM 0 HD22 LEU A 49 29.486 33.808 1.514 1.00 25.00 H new ATOM 0 HD23 LEU A 49 28.771 32.533 0.500 1.00 25.00 H new ATOM 739 N LEU A 50 29.943 32.982 5.631 1.00 25.00 N ATOM 740 CA LEU A 50 29.997 34.086 6.590 1.00 25.00 C ATOM 741 C LEU A 50 31.418 34.607 6.726 1.00 25.00 C ATOM 742 O LEU A 50 31.644 35.779 6.990 1.00 25.00 O ATOM 743 CB LEU A 50 29.537 33.659 7.997 1.00 25.00 C ATOM 744 CG LEU A 50 28.227 32.889 8.194 1.00 25.00 C ATOM 745 CD1 LEU A 50 27.891 32.781 9.653 1.00 25.00 C ATOM 746 CD2 LEU A 50 27.062 33.442 7.380 1.00 25.00 C ATOM 0 H LEU A 50 29.674 32.084 6.032 1.00 25.00 H new ATOM 0 HA LEU A 50 29.328 34.854 6.202 1.00 25.00 H new ATOM 0 HB2 LEU A 50 30.334 33.050 8.423 1.00 25.00 H new ATOM 0 HB3 LEU A 50 29.470 34.564 8.601 1.00 25.00 H new ATOM 0 HG LEU A 50 28.395 31.886 7.802 1.00 25.00 H new ATOM 0 HD11 LEU A 50 26.957 32.231 9.772 1.00 25.00 H new ATOM 0 HD12 LEU A 50 28.691 32.254 10.173 1.00 25.00 H new ATOM 0 HD13 LEU A 50 27.780 33.780 10.076 1.00 25.00 H new ATOM 0 HD21 LEU A 50 26.169 32.846 7.571 1.00 25.00 H new ATOM 0 HD22 LEU A 50 26.876 34.477 7.668 1.00 25.00 H new ATOM 0 HD23 LEU A 50 27.307 33.399 6.319 1.00 25.00 H new ATOM 758 N SER A 51 32.371 33.695 6.591 1.00 25.00 N ATOM 759 CA SER A 51 33.776 34.013 6.732 1.00 25.00 C ATOM 760 C SER A 51 34.308 34.800 5.539 1.00 25.00 C ATOM 761 O SER A 51 35.336 35.458 5.633 1.00 25.00 O ATOM 762 CB SER A 51 34.543 32.717 6.827 1.00 25.00 C ATOM 763 OG SER A 51 34.157 31.953 7.959 1.00 25.00 O ATOM 0 H SER A 51 32.186 32.714 6.380 1.00 25.00 H new ATOM 0 HA SER A 51 33.900 34.627 7.624 1.00 25.00 H new ATOM 0 HB2 SER A 51 34.380 32.132 5.922 1.00 25.00 H new ATOM 0 HB3 SER A 51 35.611 32.931 6.880 1.00 25.00 H new ATOM 0 HG SER A 51 33.422 31.353 7.714 1.00 25.00 H new ATOM 769 N GLY A 52 33.623 34.693 4.411 1.00 25.00 N ATOM 770 CA GLY A 52 34.001 35.429 3.215 1.00 25.00 C ATOM 771 C GLY A 52 34.996 34.720 2.317 1.00 25.00 C ATOM 772 O GLY A 52 35.105 35.062 1.140 1.00 25.00 O ATOM 0 H GLY A 52 32.800 34.101 4.299 1.00 25.00 H new ATOM 0 HA2 GLY A 52 33.101 35.643 2.638 1.00 25.00 H new ATOM 0 HA3 GLY A 52 34.423 36.388 3.515 1.00 25.00 H new ATOM 776 N ASP A 53 35.734 33.748 2.843 1.00 25.00 N ATOM 777 CA ASP A 53 36.733 33.058 2.025 1.00 25.00 C ATOM 778 C ASP A 53 36.085 32.250 0.925 1.00 25.00 C ATOM 779 O ASP A 53 35.295 31.338 1.168 1.00 25.00 O ATOM 780 CB ASP A 53 37.677 32.174 2.825 1.00 25.00 C ATOM 781 CG ASP A 53 39.074 32.199 2.258 1.00 25.00 C ATOM 782 OD1 ASP A 53 39.192 32.252 1.006 1.00 25.00 O ATOM 783 OD2 ASP A 53 40.045 32.178 3.033 1.00 25.00 O ATOM 0 H ASP A 53 35.665 33.424 3.808 1.00 25.00 H new ATOM 0 HA ASP A 53 37.337 33.852 1.586 1.00 25.00 H new ATOM 0 HB2 ASP A 53 37.699 32.508 3.862 1.00 25.00 H new ATOM 0 HB3 ASP A 53 37.303 31.150 2.828 1.00 25.00 H new ATOM 788 N LEU A 54 36.408 32.587 -0.308 1.00 25.00 N ATOM 789 CA LEU A 54 35.851 31.860 -1.429 1.00 25.00 C ATOM 790 C LEU A 54 36.392 30.448 -1.445 1.00 25.00 C ATOM 791 O LEU A 54 35.674 29.525 -1.781 1.00 25.00 O ATOM 792 CB LEU A 54 36.182 32.553 -2.741 1.00 25.00 C ATOM 793 CG LEU A 54 35.506 32.012 -4.009 1.00 25.00 C ATOM 794 CD1 LEU A 54 36.312 30.949 -4.732 1.00 25.00 C ATOM 795 CD2 LEU A 54 34.037 31.537 -3.778 1.00 25.00 C ATOM 0 H LEU A 54 37.042 33.346 -0.556 1.00 25.00 H new ATOM 0 HA LEU A 54 34.767 31.833 -1.317 1.00 25.00 H new ATOM 0 HB2 LEU A 54 35.921 33.607 -2.642 1.00 25.00 H new ATOM 0 HB3 LEU A 54 37.261 32.504 -2.886 1.00 25.00 H new ATOM 0 HG LEU A 54 35.466 32.878 -4.669 1.00 25.00 H new ATOM 0 HD11 LEU A 54 35.767 30.618 -5.616 1.00 25.00 H new ATOM 0 HD12 LEU A 54 37.274 31.364 -5.033 1.00 25.00 H new ATOM 0 HD13 LEU A 54 36.474 30.101 -4.067 1.00 25.00 H new ATOM 0 HD21 LEU A 54 33.622 31.168 -4.716 1.00 25.00 H new ATOM 0 HD22 LEU A 54 34.025 30.738 -3.036 1.00 25.00 H new ATOM 0 HD23 LEU A 54 33.436 32.373 -3.420 1.00 25.00 H new ATOM 807 N GLU A 55 37.639 30.266 -1.053 1.00 25.00 N ATOM 808 CA GLU A 55 38.203 28.919 -1.026 1.00 25.00 C ATOM 809 C GLU A 55 37.382 27.998 -0.128 1.00 25.00 C ATOM 810 O GLU A 55 37.006 26.907 -0.533 1.00 25.00 O ATOM 811 CB GLU A 55 39.666 28.919 -0.672 1.00 25.00 C ATOM 812 CG GLU A 55 40.003 29.042 0.749 1.00 25.00 C ATOM 813 CD GLU A 55 40.005 27.711 1.526 1.00 25.00 C ATOM 814 OE1 GLU A 55 39.824 27.755 2.760 1.00 25.00 O ATOM 815 OE2 GLU A 55 40.126 26.621 0.914 1.00 25.00 O ATOM 0 H GLU A 55 38.271 31.009 -0.755 1.00 25.00 H new ATOM 0 HA GLU A 55 38.143 28.518 -2.038 1.00 25.00 H new ATOM 0 HB2 GLU A 55 40.106 27.995 -1.046 1.00 25.00 H new ATOM 0 HB3 GLU A 55 40.145 29.739 -1.207 1.00 25.00 H new ATOM 0 HG2 GLU A 55 40.988 29.500 0.837 1.00 25.00 H new ATOM 0 HG3 GLU A 55 39.292 29.721 1.220 1.00 25.00 H new ATOM 822 N LYS A 56 37.040 28.462 1.066 1.00 25.00 N ATOM 823 CA LYS A 56 36.264 27.643 1.989 1.00 25.00 C ATOM 824 C LYS A 56 34.852 27.509 1.468 1.00 25.00 C ATOM 825 O LYS A 56 34.284 26.434 1.532 1.00 25.00 O ATOM 826 CB LYS A 56 36.336 28.163 3.446 1.00 25.00 C ATOM 827 CG LYS A 56 35.561 29.353 3.799 1.00 25.00 C ATOM 828 CD LYS A 56 36.065 29.916 5.137 1.00 25.00 C ATOM 829 CE LYS A 56 35.635 29.074 6.358 1.00 25.00 C ATOM 830 NZ LYS A 56 36.086 29.675 7.659 1.00 25.00 N ATOM 0 H LYS A 56 37.283 29.389 1.416 1.00 25.00 H new ATOM 0 HA LYS A 56 36.702 26.646 2.035 1.00 25.00 H new ATOM 0 HB2 LYS A 56 36.019 27.353 4.104 1.00 25.00 H new ATOM 0 HB3 LYS A 56 37.382 28.368 3.674 1.00 25.00 H new ATOM 0 HG2 LYS A 56 35.655 30.106 3.017 1.00 25.00 H new ATOM 0 HG3 LYS A 56 34.503 29.102 3.874 1.00 25.00 H new ATOM 0 HD2 LYS A 56 37.153 29.975 5.111 1.00 25.00 H new ATOM 0 HD3 LYS A 56 35.693 30.934 5.258 1.00 25.00 H new ATOM 0 HE2 LYS A 56 34.549 28.976 6.364 1.00 25.00 H new ATOM 0 HE3 LYS A 56 36.045 28.068 6.264 1.00 25.00 H new ATOM 0 HZ1 LYS A 56 36.036 28.957 8.409 1.00 25.00 H new ATOM 0 HZ2 LYS A 56 37.066 30.010 7.565 1.00 25.00 H new ATOM 0 HZ3 LYS A 56 35.469 30.475 7.904 1.00 25.00 H new ATOM 844 N PHE A 57 34.304 28.559 0.880 1.00 25.00 N ATOM 845 CA PHE A 57 32.959 28.472 0.324 1.00 25.00 C ATOM 846 C PHE A 57 32.888 27.445 -0.800 1.00 25.00 C ATOM 847 O PHE A 57 32.042 26.576 -0.781 1.00 25.00 O ATOM 848 CB PHE A 57 32.484 29.832 -0.175 1.00 25.00 C ATOM 849 CG PHE A 57 31.063 29.819 -0.646 1.00 25.00 C ATOM 850 CD1 PHE A 57 30.012 29.931 0.280 1.00 25.00 C ATOM 851 CD2 PHE A 57 30.759 29.680 -2.011 1.00 25.00 C ATOM 852 CE1 PHE A 57 28.666 29.908 -0.149 1.00 25.00 C ATOM 853 CE2 PHE A 57 29.417 29.643 -2.449 1.00 25.00 C ATOM 854 CZ PHE A 57 28.374 29.757 -1.516 1.00 25.00 C ATOM 0 H PHE A 57 34.757 29.467 0.775 1.00 25.00 H new ATOM 0 HA PHE A 57 32.297 28.146 1.126 1.00 25.00 H new ATOM 0 HB2 PHE A 57 32.589 30.564 0.626 1.00 25.00 H new ATOM 0 HB3 PHE A 57 33.128 30.159 -0.991 1.00 25.00 H new ATOM 0 HD1 PHE A 57 30.236 30.036 1.331 1.00 25.00 H new ATOM 0 HD2 PHE A 57 31.559 29.601 -2.732 1.00 25.00 H new ATOM 0 HE1 PHE A 57 27.866 30.006 0.569 1.00 25.00 H new ATOM 0 HE2 PHE A 57 29.193 29.527 -3.499 1.00 25.00 H new ATOM 0 HZ PHE A 57 27.347 29.729 -1.849 1.00 25.00 H new ATOM 864 N SER A 58 33.801 27.521 -1.755 1.00 25.00 N ATOM 865 CA SER A 58 33.822 26.605 -2.890 1.00 25.00 C ATOM 866 C SER A 58 34.148 25.181 -2.489 1.00 25.00 C ATOM 867 O SER A 58 33.575 24.231 -3.005 1.00 25.00 O ATOM 868 CB SER A 58 34.875 27.080 -3.899 1.00 25.00 C ATOM 869 OG SER A 58 34.918 26.222 -5.025 1.00 25.00 O ATOM 0 H SER A 58 34.547 28.216 -1.768 1.00 25.00 H new ATOM 0 HA SER A 58 32.822 26.608 -3.324 1.00 25.00 H new ATOM 0 HB2 SER A 58 34.645 28.096 -4.219 1.00 25.00 H new ATOM 0 HB3 SER A 58 35.855 27.110 -3.422 1.00 25.00 H new ATOM 0 HG SER A 58 35.595 26.544 -5.656 1.00 25.00 H new ATOM 875 N ARG A 59 35.065 25.021 -1.553 1.00 25.00 N ATOM 876 CA ARG A 59 35.467 23.690 -1.120 1.00 25.00 C ATOM 877 C ARG A 59 34.294 23.002 -0.433 1.00 25.00 C ATOM 878 O ARG A 59 33.988 21.848 -0.711 1.00 25.00 O ATOM 879 CB ARG A 59 36.646 23.826 -0.170 1.00 25.00 C ATOM 880 CG ARG A 59 37.252 22.517 0.255 1.00 25.00 C ATOM 881 CD ARG A 59 37.712 22.584 1.686 1.00 25.00 C ATOM 882 NE ARG A 59 38.685 23.670 1.931 1.00 25.00 N ATOM 883 CZ ARG A 59 39.397 23.822 3.043 1.00 25.00 C ATOM 884 NH1 ARG A 59 39.317 22.979 4.044 1.00 25.00 N ATOM 885 NH2 ARG A 59 40.195 24.836 3.151 1.00 25.00 N ATOM 0 H ARG A 59 35.544 25.787 -1.080 1.00 25.00 H new ATOM 0 HA ARG A 59 35.764 23.083 -1.976 1.00 25.00 H new ATOM 0 HB2 ARG A 59 37.416 24.431 -0.649 1.00 25.00 H new ATOM 0 HB3 ARG A 59 36.321 24.368 0.718 1.00 25.00 H new ATOM 0 HG2 ARG A 59 36.520 21.717 0.140 1.00 25.00 H new ATOM 0 HG3 ARG A 59 38.095 22.273 -0.392 1.00 25.00 H new ATOM 0 HD2 ARG A 59 36.847 22.726 2.333 1.00 25.00 H new ATOM 0 HD3 ARG A 59 38.163 21.631 1.962 1.00 25.00 H new ATOM 0 HE ARG A 59 38.820 24.356 1.189 1.00 25.00 H new ATOM 0 HH11 ARG A 59 38.693 22.174 3.985 1.00 25.00 H new ATOM 0 HH12 ARG A 59 39.879 23.128 4.882 1.00 25.00 H new ATOM 0 HH21 ARG A 59 40.272 25.508 2.387 1.00 25.00 H new ATOM 0 HH22 ARG A 59 40.746 24.963 4.000 1.00 25.00 H new ATOM 899 N VAL A 60 33.617 23.729 0.438 1.00 25.00 N ATOM 900 CA VAL A 60 32.442 23.199 1.118 1.00 25.00 C ATOM 901 C VAL A 60 31.326 22.987 0.100 1.00 25.00 C ATOM 902 O VAL A 60 30.558 22.050 0.226 1.00 25.00 O ATOM 903 CB VAL A 60 31.993 24.102 2.291 1.00 25.00 C ATOM 904 CG1 VAL A 60 30.731 23.546 2.941 1.00 25.00 C ATOM 905 CG2 VAL A 60 33.109 24.175 3.355 1.00 25.00 C ATOM 0 H VAL A 60 33.858 24.687 0.693 1.00 25.00 H new ATOM 0 HA VAL A 60 32.698 22.238 1.564 1.00 25.00 H new ATOM 0 HB VAL A 60 31.788 25.097 1.896 1.00 25.00 H new ATOM 0 HG11 VAL A 60 30.430 24.194 3.764 1.00 25.00 H new ATOM 0 HG12 VAL A 60 29.931 23.502 2.202 1.00 25.00 H new ATOM 0 HG13 VAL A 60 30.929 22.544 3.322 1.00 25.00 H new ATOM 0 HG21 VAL A 60 32.786 24.813 4.178 1.00 25.00 H new ATOM 0 HG22 VAL A 60 33.318 23.174 3.732 1.00 25.00 H new ATOM 0 HG23 VAL A 60 34.012 24.590 2.907 1.00 25.00 H new ATOM 915 N LEU A 61 31.237 23.843 -0.912 1.00 25.00 N ATOM 916 CA LEU A 61 30.228 23.685 -1.962 1.00 25.00 C ATOM 917 C LEU A 61 30.300 22.287 -2.580 1.00 25.00 C ATOM 918 O LEU A 61 29.275 21.648 -2.757 1.00 25.00 O ATOM 919 CB LEU A 61 30.419 24.739 -3.063 1.00 25.00 C ATOM 920 CG LEU A 61 29.191 25.024 -3.935 1.00 25.00 C ATOM 921 CD1 LEU A 61 28.348 26.087 -3.261 1.00 25.00 C ATOM 922 CD2 LEU A 61 29.583 25.522 -5.323 1.00 25.00 C ATOM 0 H LEU A 61 31.847 24.652 -1.031 1.00 25.00 H new ATOM 0 HA LEU A 61 29.249 23.821 -1.502 1.00 25.00 H new ATOM 0 HB2 LEU A 61 30.734 25.672 -2.596 1.00 25.00 H new ATOM 0 HB3 LEU A 61 31.234 24.416 -3.711 1.00 25.00 H new ATOM 0 HG LEU A 61 28.636 24.093 -4.050 1.00 25.00 H new ATOM 0 HD11 LEU A 61 27.471 26.298 -3.873 1.00 25.00 H new ATOM 0 HD12 LEU A 61 28.030 25.732 -2.281 1.00 25.00 H new ATOM 0 HD13 LEU A 61 28.936 26.997 -3.144 1.00 25.00 H new ATOM 0 HD21 LEU A 61 28.684 25.712 -5.909 1.00 25.00 H new ATOM 0 HD22 LEU A 61 30.157 26.444 -5.230 1.00 25.00 H new ATOM 0 HD23 LEU A 61 30.189 24.766 -5.823 1.00 25.00 H new ATOM 934 N VAL A 62 31.501 21.789 -2.859 1.00 25.00 N ATOM 935 CA VAL A 62 31.648 20.432 -3.412 1.00 25.00 C ATOM 936 C VAL A 62 31.226 19.376 -2.398 1.00 25.00 C ATOM 937 O VAL A 62 30.504 18.439 -2.729 1.00 25.00 O ATOM 938 CB VAL A 62 33.113 20.106 -3.822 1.00 25.00 C ATOM 939 CG1 VAL A 62 33.185 18.697 -4.472 1.00 25.00 C ATOM 940 CG2 VAL A 62 33.652 21.158 -4.793 1.00 25.00 C ATOM 0 H VAL A 62 32.378 22.290 -2.717 1.00 25.00 H new ATOM 0 HA VAL A 62 31.007 20.411 -4.294 1.00 25.00 H new ATOM 0 HB VAL A 62 33.730 20.117 -2.924 1.00 25.00 H new ATOM 0 HG11 VAL A 62 34.215 18.479 -4.755 1.00 25.00 H new ATOM 0 HG12 VAL A 62 32.839 17.949 -3.759 1.00 25.00 H new ATOM 0 HG13 VAL A 62 32.552 18.673 -5.359 1.00 25.00 H new ATOM 0 HG21 VAL A 62 34.678 20.910 -5.066 1.00 25.00 H new ATOM 0 HG22 VAL A 62 33.032 21.177 -5.690 1.00 25.00 H new ATOM 0 HG23 VAL A 62 33.631 22.138 -4.316 1.00 25.00 H new ATOM 950 N GLU A 63 31.660 19.529 -1.156 1.00 25.00 N ATOM 951 CA GLU A 63 31.312 18.571 -0.104 1.00 25.00 C ATOM 952 C GLU A 63 29.798 18.526 0.055 1.00 25.00 C ATOM 953 O GLU A 63 29.196 17.465 0.224 1.00 25.00 O ATOM 954 CB GLU A 63 31.974 18.969 1.219 1.00 25.00 C ATOM 955 CG GLU A 63 33.492 18.844 1.196 1.00 25.00 C ATOM 956 CD GLU A 63 33.946 17.439 0.833 1.00 25.00 C ATOM 957 OE1 GLU A 63 34.697 17.289 -0.153 1.00 25.00 O ATOM 958 OE2 GLU A 63 33.520 16.481 1.511 1.00 25.00 O ATOM 0 H GLU A 63 32.251 20.301 -0.848 1.00 25.00 H new ATOM 0 HA GLU A 63 31.675 17.582 -0.383 1.00 25.00 H new ATOM 0 HB2 GLU A 63 31.705 19.998 1.456 1.00 25.00 H new ATOM 0 HB3 GLU A 63 31.577 18.343 2.018 1.00 25.00 H new ATOM 0 HG2 GLU A 63 33.903 19.554 0.478 1.00 25.00 H new ATOM 0 HG3 GLU A 63 33.892 19.112 2.174 1.00 25.00 H new ATOM 965 N GLN A 64 29.170 19.683 -0.071 1.00 25.00 N ATOM 966 CA GLN A 64 27.727 19.755 -0.032 1.00 25.00 C ATOM 967 C GLN A 64 27.129 19.110 -1.257 1.00 25.00 C ATOM 968 O GLN A 64 26.210 18.356 -1.112 1.00 25.00 O ATOM 969 CB GLN A 64 27.239 21.197 0.088 1.00 25.00 C ATOM 970 CG GLN A 64 27.306 21.718 1.506 1.00 25.00 C ATOM 971 CD GLN A 64 26.426 20.919 2.447 1.00 25.00 C ATOM 972 OE1 GLN A 64 25.215 20.796 2.241 1.00 25.00 O ATOM 973 NE2 GLN A 64 27.020 20.364 3.470 1.00 25.00 N ATOM 0 H GLN A 64 29.638 20.580 -0.201 1.00 25.00 H new ATOM 0 HA GLN A 64 27.398 19.211 0.854 1.00 25.00 H new ATOM 0 HB2 GLN A 64 27.841 21.835 -0.558 1.00 25.00 H new ATOM 0 HB3 GLN A 64 26.211 21.260 -0.270 1.00 25.00 H new ATOM 0 HG2 GLN A 64 28.337 21.683 1.857 1.00 25.00 H new ATOM 0 HG3 GLN A 64 26.999 22.764 1.523 1.00 25.00 H new ATOM 0 HE21 GLN A 64 28.023 20.489 3.607 1.00 25.00 H new ATOM 0 HE22 GLN A 64 26.481 19.806 4.132 1.00 25.00 H new ATOM 982 N GLN A 65 27.642 19.358 -2.450 1.00 25.00 N ATOM 983 CA GLN A 65 27.075 18.741 -3.655 1.00 25.00 C ATOM 984 C GLN A 65 27.098 17.213 -3.550 1.00 25.00 C ATOM 985 O GLN A 65 26.116 16.554 -3.892 1.00 25.00 O ATOM 986 CB GLN A 65 27.844 19.177 -4.906 1.00 25.00 C ATOM 987 CG GLN A 65 27.531 20.600 -5.364 1.00 25.00 C ATOM 988 CD GLN A 65 28.452 21.062 -6.472 1.00 25.00 C ATOM 989 OE1 GLN A 65 29.020 20.262 -7.194 1.00 25.00 O ATOM 990 NE2 GLN A 65 28.610 22.351 -6.601 1.00 25.00 N ATOM 0 H GLN A 65 28.439 19.972 -2.618 1.00 25.00 H new ATOM 0 HA GLN A 65 26.041 19.076 -3.738 1.00 25.00 H new ATOM 0 HB2 GLN A 65 28.913 19.097 -4.709 1.00 25.00 H new ATOM 0 HB3 GLN A 65 27.617 18.487 -5.718 1.00 25.00 H new ATOM 0 HG2 GLN A 65 26.498 20.649 -5.709 1.00 25.00 H new ATOM 0 HG3 GLN A 65 27.617 21.279 -4.516 1.00 25.00 H new ATOM 0 HE21 GLN A 65 28.117 22.990 -5.977 1.00 25.00 H new ATOM 0 HE22 GLN A 65 29.226 22.719 -7.326 1.00 25.00 H new ATOM 999 N GLN A 66 28.182 16.658 -3.024 1.00 25.00 N ATOM 1000 CA GLN A 66 28.279 15.207 -2.856 1.00 25.00 C ATOM 1001 C GLN A 66 27.189 14.701 -1.896 1.00 25.00 C ATOM 1002 O GLN A 66 26.598 13.642 -2.096 1.00 25.00 O ATOM 1003 CB GLN A 66 29.649 14.817 -2.291 1.00 25.00 C ATOM 1004 CG GLN A 66 30.818 15.073 -3.229 1.00 25.00 C ATOM 1005 CD GLN A 66 32.134 14.686 -2.594 1.00 25.00 C ATOM 1006 OE1 GLN A 66 32.511 13.523 -2.587 1.00 25.00 O ATOM 1007 NE2 GLN A 66 32.823 15.647 -2.042 1.00 25.00 N ATOM 0 H GLN A 66 29.000 17.180 -2.708 1.00 25.00 H new ATOM 0 HA GLN A 66 28.146 14.751 -3.837 1.00 25.00 H new ATOM 0 HB2 GLN A 66 29.816 15.368 -1.365 1.00 25.00 H new ATOM 0 HB3 GLN A 66 29.633 13.758 -2.033 1.00 25.00 H new ATOM 0 HG2 GLN A 66 30.677 14.507 -4.150 1.00 25.00 H new ATOM 0 HG3 GLN A 66 30.841 16.128 -3.503 1.00 25.00 H new ATOM 0 HE21 GLN A 66 32.474 16.605 -2.069 1.00 25.00 H new ATOM 0 HE22 GLN A 66 33.710 15.440 -1.584 1.00 25.00 H new ATOM 1016 N ASP A 67 26.939 15.465 -0.844 1.00 25.00 N ATOM 1017 CA ASP A 67 25.956 15.096 0.177 1.00 25.00 C ATOM 1018 C ASP A 67 24.513 15.362 -0.278 1.00 25.00 C ATOM 1019 O ASP A 67 23.587 14.616 0.040 1.00 25.00 O ATOM 1020 CB ASP A 67 26.245 15.907 1.438 1.00 25.00 C ATOM 1021 CG ASP A 67 25.506 15.390 2.654 1.00 25.00 C ATOM 1022 OD1 ASP A 67 25.276 16.195 3.584 1.00 25.00 O ATOM 1023 OD2 ASP A 67 25.097 14.210 2.671 1.00 25.00 O ATOM 0 H ASP A 67 27.406 16.355 -0.669 1.00 25.00 H new ATOM 0 HA ASP A 67 26.044 14.026 0.364 1.00 25.00 H new ATOM 0 HB2 ASP A 67 27.317 15.891 1.636 1.00 25.00 H new ATOM 0 HB3 ASP A 67 25.968 16.947 1.266 1.00 25.00 H new ATOM 1028 N ARG A 68 24.322 16.442 -1.017 1.00 25.00 N ATOM 1029 CA ARG A 68 23.000 16.835 -1.515 1.00 25.00 C ATOM 1030 C ARG A 68 22.514 15.801 -2.499 1.00 25.00 C ATOM 1031 O ARG A 68 21.361 15.424 -2.458 1.00 25.00 O ATOM 1032 CB ARG A 68 23.040 18.211 -2.200 1.00 25.00 C ATOM 1033 CG ARG A 68 23.285 19.387 -1.254 1.00 25.00 C ATOM 1034 CD ARG A 68 22.099 19.680 -0.386 1.00 25.00 C ATOM 1035 NE ARG A 68 22.546 20.248 0.900 1.00 25.00 N ATOM 1036 CZ ARG A 68 21.757 20.730 1.850 1.00 25.00 C ATOM 1037 NH1 ARG A 68 20.454 20.773 1.723 1.00 25.00 N ATOM 1038 NH2 ARG A 68 22.298 21.173 2.948 1.00 25.00 N ATOM 0 H ARG A 68 25.073 17.075 -1.292 1.00 25.00 H new ATOM 0 HA ARG A 68 22.321 16.901 -0.665 1.00 25.00 H new ATOM 0 HB2 ARG A 68 23.823 18.202 -2.958 1.00 25.00 H new ATOM 0 HB3 ARG A 68 22.095 18.371 -2.720 1.00 25.00 H new ATOM 0 HG2 ARG A 68 24.148 19.169 -0.624 1.00 25.00 H new ATOM 0 HG3 ARG A 68 23.532 20.274 -1.838 1.00 25.00 H new ATOM 0 HD2 ARG A 68 21.432 20.379 -0.890 1.00 25.00 H new ATOM 0 HD3 ARG A 68 21.530 18.767 -0.212 1.00 25.00 H new ATOM 0 HE ARG A 68 23.551 20.272 1.074 1.00 25.00 H new ATOM 0 HH11 ARG A 68 20.013 20.428 0.870 1.00 25.00 H new ATOM 0 HH12 ARG A 68 19.880 21.151 2.477 1.00 25.00 H new ATOM 0 HH21 ARG A 68 23.311 21.145 3.065 1.00 25.00 H new ATOM 0 HH22 ARG A 68 21.709 21.548 3.692 1.00 25.00 H new ATOM 1052 N ALA A 69 23.428 15.254 -3.285 1.00 25.00 N ATOM 1053 CA ALA A 69 23.105 14.189 -4.234 1.00 25.00 C ATOM 1054 C ALA A 69 22.423 12.991 -3.545 1.00 25.00 C ATOM 1055 O ALA A 69 21.580 12.311 -4.137 1.00 25.00 O ATOM 1056 CB ALA A 69 24.384 13.734 -4.953 1.00 25.00 C ATOM 0 H ALA A 69 24.410 15.530 -3.287 1.00 25.00 H new ATOM 0 HA ALA A 69 22.398 14.589 -4.961 1.00 25.00 H new ATOM 0 HB1 ALA A 69 24.141 12.940 -5.660 1.00 25.00 H new ATOM 0 HB2 ALA A 69 24.819 14.577 -5.489 1.00 25.00 H new ATOM 0 HB3 ALA A 69 25.100 13.361 -4.221 1.00 25.00 H new ATOM 1062 N ARG A 70 22.765 12.751 -2.286 1.00 25.00 N ATOM 1063 CA ARG A 70 22.163 11.654 -1.521 1.00 25.00 C ATOM 1064 C ARG A 70 20.732 11.985 -1.103 1.00 25.00 C ATOM 1065 O ARG A 70 19.884 11.107 -1.019 1.00 25.00 O ATOM 1066 CB ARG A 70 23.029 11.350 -0.292 1.00 25.00 C ATOM 1067 CG ARG A 70 24.488 11.123 -0.673 1.00 25.00 C ATOM 1068 CD ARG A 70 25.309 10.482 0.435 1.00 25.00 C ATOM 1069 NE ARG A 70 25.559 11.379 1.579 1.00 25.00 N ATOM 1070 CZ ARG A 70 26.368 11.105 2.597 1.00 25.00 C ATOM 1071 NH1 ARG A 70 27.027 9.974 2.687 1.00 25.00 N ATOM 1072 NH2 ARG A 70 26.517 11.981 3.544 1.00 25.00 N ATOM 0 H ARG A 70 23.454 13.297 -1.769 1.00 25.00 H new ATOM 0 HA ARG A 70 22.119 10.771 -2.158 1.00 25.00 H new ATOM 0 HB2 ARG A 70 22.962 12.177 0.414 1.00 25.00 H new ATOM 0 HB3 ARG A 70 22.643 10.466 0.215 1.00 25.00 H new ATOM 0 HG2 ARG A 70 24.530 10.490 -1.559 1.00 25.00 H new ATOM 0 HG3 ARG A 70 24.938 12.078 -0.942 1.00 25.00 H new ATOM 0 HD2 ARG A 70 24.792 9.590 0.789 1.00 25.00 H new ATOM 0 HD3 ARG A 70 26.264 10.155 0.025 1.00 25.00 H new ATOM 0 HE ARG A 70 25.075 12.277 1.589 1.00 25.00 H new ATOM 0 HH11 ARG A 70 26.928 9.267 1.959 1.00 25.00 H new ATOM 0 HH12 ARG A 70 27.638 9.802 3.485 1.00 25.00 H new ATOM 0 HH21 ARG A 70 26.016 12.868 3.501 1.00 25.00 H new ATOM 0 HH22 ARG A 70 27.135 11.782 4.330 1.00 25.00 H new ATOM 1086 N ARG A 71 20.460 13.264 -0.875 1.00 25.00 N ATOM 1087 CA ARG A 71 19.111 13.730 -0.518 1.00 25.00 C ATOM 1088 C ARG A 71 18.252 13.873 -1.750 1.00 25.00 C ATOM 1089 O ARG A 71 17.048 13.714 -1.692 1.00 25.00 O ATOM 1090 CB ARG A 71 19.169 15.100 0.141 1.00 25.00 C ATOM 1091 CG ARG A 71 19.918 15.132 1.434 1.00 25.00 C ATOM 1092 CD ARG A 71 20.012 16.559 1.897 1.00 25.00 C ATOM 1093 NE ARG A 71 20.750 16.652 3.167 1.00 25.00 N ATOM 1094 CZ ARG A 71 22.066 16.779 3.278 1.00 25.00 C ATOM 1095 NH1 ARG A 71 22.850 16.878 2.242 1.00 25.00 N ATOM 1096 NH2 ARG A 71 22.611 16.797 4.458 1.00 25.00 N ATOM 0 H ARG A 71 21.156 14.007 -0.930 1.00 25.00 H new ATOM 0 HA ARG A 71 18.691 12.991 0.164 1.00 25.00 H new ATOM 0 HB2 ARG A 71 19.633 15.803 -0.551 1.00 25.00 H new ATOM 0 HB3 ARG A 71 18.151 15.449 0.316 1.00 25.00 H new ATOM 0 HG2 ARG A 71 19.409 14.524 2.182 1.00 25.00 H new ATOM 0 HG3 ARG A 71 20.914 14.709 1.305 1.00 25.00 H new ATOM 0 HD2 ARG A 71 20.511 17.160 1.137 1.00 25.00 H new ATOM 0 HD3 ARG A 71 19.011 16.971 2.023 1.00 25.00 H new ATOM 0 HE ARG A 71 20.207 16.616 4.030 1.00 25.00 H new ATOM 0 HH11 ARG A 71 22.457 16.859 1.301 1.00 25.00 H new ATOM 0 HH12 ARG A 71 23.857 16.974 2.372 1.00 25.00 H new ATOM 0 HH21 ARG A 71 22.028 16.714 5.291 1.00 25.00 H new ATOM 0 HH22 ARG A 71 23.622 16.894 4.551 1.00 25.00 H new ATOM 1110 N GLU A 72 18.891 14.193 -2.861 1.00 25.00 N ATOM 1111 CA GLU A 72 18.212 14.384 -4.145 1.00 25.00 C ATOM 1112 C GLU A 72 17.349 13.194 -4.529 1.00 25.00 C ATOM 1113 O GLU A 72 16.299 13.348 -5.139 1.00 25.00 O ATOM 1114 CB GLU A 72 19.230 14.659 -5.246 1.00 25.00 C ATOM 1115 CG GLU A 72 19.209 16.091 -5.735 1.00 25.00 C ATOM 1116 CD GLU A 72 19.732 17.071 -4.693 1.00 25.00 C ATOM 1117 OE1 GLU A 72 20.945 17.348 -4.687 1.00 25.00 O ATOM 1118 OE2 GLU A 72 18.922 17.560 -3.866 1.00 25.00 O ATOM 0 H GLU A 72 19.901 14.330 -2.906 1.00 25.00 H new ATOM 0 HA GLU A 72 17.552 15.244 -4.030 1.00 25.00 H new ATOM 0 HB2 GLU A 72 20.228 14.423 -4.876 1.00 25.00 H new ATOM 0 HB3 GLU A 72 19.036 13.992 -6.086 1.00 25.00 H new ATOM 0 HG2 GLU A 72 19.812 16.171 -6.640 1.00 25.00 H new ATOM 0 HG3 GLU A 72 18.189 16.364 -6.006 1.00 25.00 H new ATOM 1125 N GLN A 73 17.764 12.012 -4.104 1.00 25.00 N ATOM 1126 CA GLN A 73 16.997 10.791 -4.340 1.00 25.00 C ATOM 1127 C GLN A 73 15.579 10.899 -3.740 1.00 25.00 C ATOM 1128 O GLN A 73 14.606 10.474 -4.344 1.00 25.00 O ATOM 1129 CB GLN A 73 17.745 9.596 -3.735 1.00 25.00 C ATOM 1130 CG GLN A 73 19.232 9.513 -4.149 1.00 25.00 C ATOM 1131 CD GLN A 73 19.428 9.511 -5.651 1.00 25.00 C ATOM 1132 OE1 GLN A 73 18.868 8.693 -6.361 1.00 25.00 O ATOM 1133 NE2 GLN A 73 20.233 10.420 -6.136 1.00 25.00 N ATOM 0 H GLN A 73 18.633 11.868 -3.590 1.00 25.00 H new ATOM 0 HA GLN A 73 16.890 10.647 -5.415 1.00 25.00 H new ATOM 0 HB2 GLN A 73 17.683 9.654 -2.648 1.00 25.00 H new ATOM 0 HB3 GLN A 73 17.243 8.676 -4.034 1.00 25.00 H new ATOM 0 HG2 GLN A 73 19.771 10.357 -3.719 1.00 25.00 H new ATOM 0 HG3 GLN A 73 19.670 8.608 -3.730 1.00 25.00 H new ATOM 0 HE21 GLN A 73 20.684 11.088 -5.511 1.00 25.00 H new ATOM 0 HE22 GLN A 73 20.410 10.461 -7.140 1.00 25.00 H new ATOM 1142 N GLU A 74 15.471 11.481 -2.553 1.00 25.00 N ATOM 1143 CA GLU A 74 14.167 11.798 -1.948 1.00 25.00 C ATOM 1144 C GLU A 74 13.510 13.007 -2.597 1.00 25.00 C ATOM 1145 O GLU A 74 12.286 13.092 -2.680 1.00 25.00 O ATOM 1146 CB GLU A 74 14.343 12.097 -0.450 1.00 25.00 C ATOM 1147 CG GLU A 74 14.707 10.891 0.405 1.00 25.00 C ATOM 1148 CD GLU A 74 13.484 10.074 0.774 1.00 25.00 C ATOM 1149 OE1 GLU A 74 12.673 10.551 1.596 1.00 25.00 O ATOM 1150 OE2 GLU A 74 13.276 8.997 0.186 1.00 25.00 O ATOM 0 H GLU A 74 16.272 11.748 -1.980 1.00 25.00 H new ATOM 0 HA GLU A 74 13.528 10.928 -2.102 1.00 25.00 H new ATOM 0 HB2 GLU A 74 15.119 12.854 -0.334 1.00 25.00 H new ATOM 0 HB3 GLU A 74 13.417 12.528 -0.069 1.00 25.00 H new ATOM 0 HG2 GLU A 74 15.415 10.262 -0.135 1.00 25.00 H new ATOM 0 HG3 GLU A 74 15.208 11.227 1.313 1.00 25.00 H new ATOM 1157 N ARG A 75 14.317 13.981 -2.990 1.00 25.00 N ATOM 1158 CA ARG A 75 13.802 15.268 -3.480 1.00 25.00 C ATOM 1159 C ARG A 75 12.980 15.175 -4.745 1.00 25.00 C ATOM 1160 O ARG A 75 12.094 15.977 -4.928 1.00 25.00 O ATOM 1161 CB ARG A 75 14.942 16.249 -3.723 1.00 25.00 C ATOM 1162 CG ARG A 75 15.660 16.677 -2.443 1.00 25.00 C ATOM 1163 CD ARG A 75 15.641 18.184 -2.279 1.00 25.00 C ATOM 1164 NE ARG A 75 16.533 18.860 -3.233 1.00 25.00 N ATOM 1165 CZ ARG A 75 16.422 20.122 -3.634 1.00 25.00 C ATOM 1166 NH1 ARG A 75 15.460 20.909 -3.225 1.00 25.00 N ATOM 1167 NH2 ARG A 75 17.306 20.603 -4.454 1.00 25.00 N ATOM 0 H ARG A 75 15.335 13.912 -2.982 1.00 25.00 H new ATOM 0 HA ARG A 75 13.140 15.618 -2.688 1.00 25.00 H new ATOM 0 HB2 ARG A 75 15.664 15.794 -4.401 1.00 25.00 H new ATOM 0 HB3 ARG A 75 14.549 17.134 -4.223 1.00 25.00 H new ATOM 0 HG2 ARG A 75 15.183 16.209 -1.582 1.00 25.00 H new ATOM 0 HG3 ARG A 75 16.691 16.324 -2.467 1.00 25.00 H new ATOM 0 HD2 ARG A 75 14.623 18.549 -2.415 1.00 25.00 H new ATOM 0 HD3 ARG A 75 15.938 18.440 -1.262 1.00 25.00 H new ATOM 0 HE ARG A 75 17.303 18.314 -3.620 1.00 25.00 H new ATOM 0 HH11 ARG A 75 14.758 20.560 -2.573 1.00 25.00 H new ATOM 0 HH12 ARG A 75 15.412 21.872 -3.558 1.00 25.00 H new ATOM 0 HH21 ARG A 75 18.072 20.014 -4.781 1.00 25.00 H new ATOM 0 HH22 ARG A 75 17.235 21.570 -4.771 1.00 25.00 H new ATOM 1181 N ILE A 76 13.226 14.185 -5.587 1.00 25.00 N ATOM 1182 CA ILE A 76 12.409 13.997 -6.802 1.00 25.00 C ATOM 1183 C ILE A 76 10.937 13.644 -6.473 1.00 25.00 C ATOM 1184 O ILE A 76 10.050 13.794 -7.289 1.00 25.00 O ATOM 1185 CB ILE A 76 13.005 12.915 -7.753 1.00 25.00 C ATOM 1186 CG1 ILE A 76 12.960 11.524 -7.092 1.00 25.00 C ATOM 1187 CG2 ILE A 76 14.458 13.307 -8.145 1.00 25.00 C ATOM 1188 CD1 ILE A 76 13.432 10.375 -7.991 1.00 25.00 C ATOM 0 H ILE A 76 13.972 13.500 -5.465 1.00 25.00 H new ATOM 0 HA ILE A 76 12.427 14.958 -7.316 1.00 25.00 H new ATOM 0 HB ILE A 76 12.402 12.865 -8.660 1.00 25.00 H new ATOM 0 HG12 ILE A 76 13.578 11.543 -6.194 1.00 25.00 H new ATOM 0 HG13 ILE A 76 11.938 11.321 -6.772 1.00 25.00 H new ATOM 0 HG21 ILE A 76 14.873 12.549 -8.810 1.00 25.00 H new ATOM 0 HG22 ILE A 76 14.450 14.271 -8.654 1.00 25.00 H new ATOM 0 HG23 ILE A 76 15.071 13.376 -7.246 1.00 25.00 H new ATOM 0 HD11 ILE A 76 13.366 9.434 -7.444 1.00 25.00 H new ATOM 0 HD12 ILE A 76 12.800 10.324 -8.878 1.00 25.00 H new ATOM 0 HD13 ILE A 76 14.465 10.549 -8.291 1.00 25.00 H new ATOM 1200 N ARG A 77 10.721 13.185 -5.237 1.00 25.00 N ATOM 1201 CA ARG A 77 9.366 12.889 -4.724 1.00 25.00 C ATOM 1202 C ARG A 77 8.622 14.185 -4.348 1.00 25.00 C ATOM 1203 O ARG A 77 7.432 14.173 -4.013 1.00 25.00 O ATOM 1204 CB ARG A 77 9.416 11.936 -3.569 1.00 25.00 C ATOM 1205 CG ARG A 77 8.162 11.073 -3.440 1.00 25.00 C ATOM 1206 CD ARG A 77 8.310 9.964 -2.435 1.00 25.00 C ATOM 1207 NE ARG A 77 8.679 10.493 -1.118 1.00 25.00 N ATOM 1208 CZ ARG A 77 9.831 10.270 -0.496 1.00 25.00 C ATOM 1209 NH1 ARG A 77 10.767 9.507 -0.997 1.00 25.00 N ATOM 1210 NH2 ARG A 77 10.041 10.828 0.660 1.00 25.00 N ATOM 0 H ARG A 77 11.467 13.007 -4.564 1.00 25.00 H new ATOM 0 HA ARG A 77 8.807 12.404 -5.524 1.00 25.00 H new ATOM 0 HB2 ARG A 77 10.285 11.287 -3.680 1.00 25.00 H new ATOM 0 HB3 ARG A 77 9.556 12.501 -2.647 1.00 25.00 H new ATOM 0 HG2 ARG A 77 7.321 11.705 -3.154 1.00 25.00 H new ATOM 0 HG3 ARG A 77 7.922 10.644 -4.413 1.00 25.00 H new ATOM 0 HD2 ARG A 77 7.374 9.410 -2.359 1.00 25.00 H new ATOM 0 HD3 ARG A 77 9.070 9.260 -2.774 1.00 25.00 H new ATOM 0 HE ARG A 77 7.995 11.080 -0.641 1.00 25.00 H new ATOM 0 HH11 ARG A 77 10.627 9.055 -1.901 1.00 25.00 H new ATOM 0 HH12 ARG A 77 11.637 9.364 -0.484 1.00 25.00 H new ATOM 0 HH21 ARG A 77 9.326 11.426 1.075 1.00 25.00 H new ATOM 0 HH22 ARG A 77 10.920 10.667 1.152 1.00 25.00 H new ATOM 1224 N LEU A 78 9.364 15.288 -4.332 1.00 25.00 N ATOM 1225 CA LEU A 78 8.849 16.610 -3.999 1.00 25.00 C ATOM 1226 C LEU A 78 9.076 17.466 -5.256 1.00 25.00 C ATOM 1227 O LEU A 78 9.783 17.063 -6.166 1.00 25.00 O ATOM 1228 CB LEU A 78 9.627 17.163 -2.797 1.00 25.00 C ATOM 1229 CG LEU A 78 9.116 18.444 -2.125 1.00 25.00 C ATOM 1230 CD1 LEU A 78 7.721 18.250 -1.523 1.00 25.00 C ATOM 1231 CD2 LEU A 78 10.105 18.848 -1.045 1.00 25.00 C ATOM 0 H LEU A 78 10.359 15.287 -4.555 1.00 25.00 H new ATOM 0 HA LEU A 78 7.794 16.600 -3.724 1.00 25.00 H new ATOM 0 HB2 LEU A 78 9.664 16.382 -2.038 1.00 25.00 H new ATOM 0 HB3 LEU A 78 10.652 17.343 -3.120 1.00 25.00 H new ATOM 0 HG LEU A 78 9.033 19.229 -2.877 1.00 25.00 H new ATOM 0 HD11 LEU A 78 7.394 19.179 -1.056 1.00 25.00 H new ATOM 0 HD12 LEU A 78 7.020 17.973 -2.311 1.00 25.00 H new ATOM 0 HD13 LEU A 78 7.755 17.460 -0.773 1.00 25.00 H new ATOM 0 HD21 LEU A 78 9.758 19.758 -0.556 1.00 25.00 H new ATOM 0 HD22 LEU A 78 10.186 18.048 -0.309 1.00 25.00 H new ATOM 0 HD23 LEU A 78 11.081 19.028 -1.495 1.00 25.00 H new ATOM 1243 N PHE A 79 8.459 18.632 -5.306 1.00 25.00 N ATOM 1244 CA PHE A 79 8.527 19.492 -6.482 1.00 25.00 C ATOM 1245 C PHE A 79 9.887 20.128 -6.667 1.00 25.00 C ATOM 1246 O PHE A 79 10.315 20.392 -7.769 1.00 25.00 O ATOM 1247 CB PHE A 79 7.456 20.580 -6.369 1.00 25.00 C ATOM 1248 CG PHE A 79 6.041 20.042 -6.390 1.00 25.00 C ATOM 1249 CD1 PHE A 79 5.534 19.273 -5.311 1.00 25.00 C ATOM 1250 CD2 PHE A 79 5.204 20.312 -7.486 1.00 25.00 C ATOM 1251 CE1 PHE A 79 4.206 18.782 -5.337 1.00 25.00 C ATOM 1252 CE2 PHE A 79 3.872 19.823 -7.520 1.00 25.00 C ATOM 1253 CZ PHE A 79 3.372 19.064 -6.441 1.00 25.00 C ATOM 0 H PHE A 79 7.900 19.011 -4.542 1.00 25.00 H new ATOM 0 HA PHE A 79 8.351 18.867 -7.357 1.00 25.00 H new ATOM 0 HB2 PHE A 79 7.611 21.136 -5.444 1.00 25.00 H new ATOM 0 HB3 PHE A 79 7.579 21.286 -7.190 1.00 25.00 H new ATOM 0 HD1 PHE A 79 6.167 19.060 -4.462 1.00 25.00 H new ATOM 0 HD2 PHE A 79 5.579 20.898 -8.312 1.00 25.00 H new ATOM 0 HE1 PHE A 79 3.831 18.192 -4.513 1.00 25.00 H new ATOM 0 HE2 PHE A 79 3.241 20.032 -8.372 1.00 25.00 H new ATOM 0 HZ PHE A 79 2.355 18.700 -6.459 1.00 25.00 H new ATOM 1263 N SER A 80 10.544 20.347 -5.544 1.00 25.00 N ATOM 1264 CA SER A 80 11.883 20.958 -5.492 1.00 25.00 C ATOM 1265 C SER A 80 11.985 22.217 -6.367 1.00 25.00 C ATOM 1266 O SER A 80 12.924 22.386 -7.136 1.00 25.00 O ATOM 1267 CB SER A 80 12.931 19.925 -5.909 1.00 25.00 C ATOM 1268 OG SER A 80 12.822 18.779 -5.076 1.00 25.00 O ATOM 0 H SER A 80 10.170 20.108 -4.626 1.00 25.00 H new ATOM 0 HA SER A 80 12.067 21.275 -4.466 1.00 25.00 H new ATOM 0 HB2 SER A 80 12.786 19.645 -6.952 1.00 25.00 H new ATOM 0 HB3 SER A 80 13.931 20.352 -5.829 1.00 25.00 H new ATOM 0 HG SER A 80 12.470 18.028 -5.598 1.00 25.00 H new ATOM 1274 N ALA A 81 10.996 23.094 -6.217 1.00 25.00 N ATOM 1275 CA ALA A 81 10.889 24.347 -6.970 1.00 25.00 C ATOM 1276 C ALA A 81 11.799 25.406 -6.347 1.00 25.00 C ATOM 1277 O ALA A 81 11.349 26.478 -5.930 1.00 25.00 O ATOM 1278 CB ALA A 81 9.424 24.829 -6.973 1.00 25.00 C ATOM 0 H ALA A 81 10.231 22.954 -5.557 1.00 25.00 H new ATOM 0 HA ALA A 81 11.205 24.179 -8.000 1.00 25.00 H new ATOM 0 HB1 ALA A 81 9.349 25.761 -7.534 1.00 25.00 H new ATOM 0 HB2 ALA A 81 8.793 24.073 -7.440 1.00 25.00 H new ATOM 0 HB3 ALA A 81 9.093 24.995 -5.948 1.00 25.00 H new ATOM 1284 N ASP A 82 13.061 25.048 -6.229 1.00 25.00 N ATOM 1285 CA ASP A 82 14.080 25.889 -5.618 1.00 25.00 C ATOM 1286 C ASP A 82 14.216 27.175 -6.460 1.00 25.00 C ATOM 1287 O ASP A 82 14.446 27.109 -7.670 1.00 25.00 O ATOM 1288 CB ASP A 82 15.405 25.126 -5.577 1.00 25.00 C ATOM 1289 CG ASP A 82 15.423 24.010 -4.524 1.00 25.00 C ATOM 1290 OD1 ASP A 82 14.400 23.764 -3.839 1.00 25.00 O ATOM 1291 OD2 ASP A 82 16.475 23.347 -4.395 1.00 25.00 O ATOM 0 H ASP A 82 13.417 24.151 -6.559 1.00 25.00 H new ATOM 0 HA ASP A 82 13.803 26.153 -4.597 1.00 25.00 H new ATOM 0 HB2 ASP A 82 15.600 24.694 -6.559 1.00 25.00 H new ATOM 0 HB3 ASP A 82 16.215 25.826 -5.370 1.00 25.00 H new ATOM 1296 N PRO A 83 13.967 28.353 -5.857 1.00 25.00 N ATOM 1297 CA PRO A 83 13.912 29.584 -6.654 1.00 25.00 C ATOM 1298 C PRO A 83 15.249 30.324 -6.807 1.00 25.00 C ATOM 1299 O PRO A 83 16.275 29.897 -6.295 1.00 25.00 O ATOM 1300 CB PRO A 83 12.938 30.434 -5.839 1.00 25.00 C ATOM 1301 CG PRO A 83 13.312 30.113 -4.436 1.00 25.00 C ATOM 1302 CD PRO A 83 13.621 28.627 -4.445 1.00 25.00 C ATOM 0 HA PRO A 83 13.626 29.374 -7.685 1.00 25.00 H new ATOM 0 HB2 PRO A 83 13.051 31.497 -6.054 1.00 25.00 H new ATOM 0 HB3 PRO A 83 11.901 30.174 -6.050 1.00 25.00 H new ATOM 0 HG2 PRO A 83 14.176 30.694 -4.115 1.00 25.00 H new ATOM 0 HG3 PRO A 83 12.499 30.343 -3.748 1.00 25.00 H new ATOM 0 HD2 PRO A 83 14.446 28.385 -3.776 1.00 25.00 H new ATOM 0 HD3 PRO A 83 12.764 28.037 -4.120 1.00 25.00 H new ATOM 1310 N PHE A 84 15.164 31.500 -7.432 1.00 25.00 N ATOM 1311 CA PHE A 84 16.250 32.496 -7.506 1.00 25.00 C ATOM 1312 C PHE A 84 17.419 32.145 -8.434 1.00 25.00 C ATOM 1313 O PHE A 84 18.487 32.752 -8.356 1.00 25.00 O ATOM 1314 CB PHE A 84 16.754 32.858 -6.095 1.00 25.00 C ATOM 1315 CG PHE A 84 16.894 34.340 -5.863 1.00 25.00 C ATOM 1316 CD1 PHE A 84 18.119 34.987 -6.090 1.00 25.00 C ATOM 1317 CD2 PHE A 84 15.799 35.097 -5.403 1.00 25.00 C ATOM 1318 CE1 PHE A 84 18.267 36.377 -5.852 1.00 25.00 C ATOM 1319 CE2 PHE A 84 15.926 36.492 -5.170 1.00 25.00 C ATOM 1320 CZ PHE A 84 17.167 37.129 -5.391 1.00 25.00 C ATOM 0 H PHE A 84 14.318 31.800 -7.916 1.00 25.00 H new ATOM 0 HA PHE A 84 15.790 33.366 -7.975 1.00 25.00 H new ATOM 0 HB2 PHE A 84 16.066 32.447 -5.357 1.00 25.00 H new ATOM 0 HB3 PHE A 84 17.720 32.381 -5.930 1.00 25.00 H new ATOM 0 HD1 PHE A 84 18.962 34.417 -6.452 1.00 25.00 H new ATOM 0 HD2 PHE A 84 14.851 34.611 -5.225 1.00 25.00 H new ATOM 0 HE1 PHE A 84 19.219 36.858 -6.023 1.00 25.00 H new ATOM 0 HE2 PHE A 84 15.077 37.064 -4.825 1.00 25.00 H new ATOM 0 HZ PHE A 84 17.273 38.188 -5.208 1.00 25.00 H new ATOM 1330 N ASP A 85 17.166 31.289 -9.414 1.00 25.00 N ATOM 1331 CA ASP A 85 18.120 31.050 -10.496 1.00 25.00 C ATOM 1332 C ASP A 85 17.824 32.099 -11.552 1.00 25.00 C ATOM 1333 O ASP A 85 17.325 31.807 -12.631 1.00 25.00 O ATOM 1334 CB ASP A 85 17.964 29.660 -11.093 1.00 25.00 C ATOM 1335 CG ASP A 85 18.570 28.587 -10.224 1.00 25.00 C ATOM 1336 OD1 ASP A 85 17.980 27.492 -10.116 1.00 25.00 O ATOM 1337 OD2 ASP A 85 19.695 28.797 -9.725 1.00 25.00 O ATOM 0 H ASP A 85 16.306 30.745 -9.485 1.00 25.00 H new ATOM 0 HA ASP A 85 19.142 31.114 -10.121 1.00 25.00 H new ATOM 0 HB2 ASP A 85 16.905 29.448 -11.241 1.00 25.00 H new ATOM 0 HB3 ASP A 85 18.434 29.635 -12.076 1.00 25.00 H new ATOM 1342 N LEU A 86 18.028 33.344 -11.171 1.00 25.00 N ATOM 1343 CA LEU A 86 17.672 34.472 -12.010 1.00 25.00 C ATOM 1344 C LEU A 86 18.607 34.565 -13.207 1.00 25.00 C ATOM 1345 O LEU A 86 18.203 34.979 -14.289 1.00 25.00 O ATOM 1346 CB LEU A 86 17.743 35.758 -11.185 1.00 25.00 C ATOM 1347 CG LEU A 86 16.812 35.844 -9.961 1.00 25.00 C ATOM 1348 CD1 LEU A 86 17.089 37.142 -9.209 1.00 25.00 C ATOM 1349 CD2 LEU A 86 15.331 35.782 -10.353 1.00 25.00 C ATOM 0 H LEU A 86 18.443 33.602 -10.276 1.00 25.00 H new ATOM 0 HA LEU A 86 16.657 34.333 -12.381 1.00 25.00 H new ATOM 0 HB2 LEU A 86 18.770 35.887 -10.842 1.00 25.00 H new ATOM 0 HB3 LEU A 86 17.519 36.598 -11.843 1.00 25.00 H new ATOM 0 HG LEU A 86 17.017 34.983 -9.325 1.00 25.00 H new ATOM 0 HD11 LEU A 86 16.432 37.207 -8.342 1.00 25.00 H new ATOM 0 HD12 LEU A 86 18.128 37.157 -8.879 1.00 25.00 H new ATOM 0 HD13 LEU A 86 16.905 37.991 -9.868 1.00 25.00 H new ATOM 0 HD21 LEU A 86 14.714 35.846 -9.457 1.00 25.00 H new ATOM 0 HD22 LEU A 86 15.095 36.614 -11.016 1.00 25.00 H new ATOM 0 HD23 LEU A 86 15.129 34.841 -10.865 1.00 25.00 H new ATOM 1361 N GLU A 87 19.866 34.212 -12.998 1.00 25.00 N ATOM 1362 CA GLU A 87 20.838 34.169 -14.093 1.00 25.00 C ATOM 1363 C GLU A 87 20.676 32.869 -14.865 1.00 25.00 C ATOM 1364 O GLU A 87 20.673 32.850 -16.094 1.00 25.00 O ATOM 1365 CB GLU A 87 22.276 34.251 -13.577 1.00 25.00 C ATOM 1366 CG GLU A 87 22.656 35.590 -12.986 1.00 25.00 C ATOM 1367 CD GLU A 87 24.137 35.646 -12.659 1.00 25.00 C ATOM 1368 OE1 GLU A 87 24.953 35.347 -13.561 1.00 25.00 O ATOM 1369 OE2 GLU A 87 24.493 35.964 -11.505 1.00 25.00 O ATOM 0 H GLU A 87 20.243 33.951 -12.087 1.00 25.00 H new ATOM 0 HA GLU A 87 20.649 35.029 -14.736 1.00 25.00 H new ATOM 0 HB2 GLU A 87 22.421 33.480 -12.820 1.00 25.00 H new ATOM 0 HB3 GLU A 87 22.956 34.024 -14.398 1.00 25.00 H new ATOM 0 HG2 GLU A 87 22.406 36.385 -13.689 1.00 25.00 H new ATOM 0 HG3 GLU A 87 22.074 35.769 -12.082 1.00 25.00 H new ATOM 1376 N ALA A 88 20.634 31.783 -14.096 1.00 25.00 N ATOM 1377 CA ALA A 88 20.594 30.405 -14.598 1.00 25.00 C ATOM 1378 C ALA A 88 21.723 30.092 -15.615 1.00 25.00 C ATOM 1379 O ALA A 88 21.611 29.172 -16.426 1.00 25.00 O ATOM 1380 CB ALA A 88 19.202 30.096 -15.175 1.00 25.00 C ATOM 0 H ALA A 88 20.627 31.835 -13.077 1.00 25.00 H new ATOM 0 HA ALA A 88 20.779 29.745 -13.751 1.00 25.00 H new ATOM 0 HB1 ALA A 88 19.181 29.071 -15.545 1.00 25.00 H new ATOM 0 HB2 ALA A 88 18.450 30.215 -14.395 1.00 25.00 H new ATOM 0 HB3 ALA A 88 18.987 30.782 -15.994 1.00 25.00 H new ATOM 1386 N GLN A 89 22.815 30.847 -15.538 1.00 25.00 N ATOM 1387 CA GLN A 89 23.973 30.645 -16.411 1.00 25.00 C ATOM 1388 C GLN A 89 24.801 29.467 -15.900 1.00 25.00 C ATOM 1389 O GLN A 89 24.623 29.030 -14.772 1.00 25.00 O ATOM 1390 CB GLN A 89 24.843 31.909 -16.454 1.00 25.00 C ATOM 1391 CG GLN A 89 24.145 33.109 -17.085 1.00 25.00 C ATOM 1392 CD GLN A 89 25.108 34.238 -17.397 1.00 25.00 C ATOM 1393 OE1 GLN A 89 25.529 34.399 -18.533 1.00 25.00 O ATOM 1394 NE2 GLN A 89 25.470 35.007 -16.404 1.00 25.00 N ATOM 0 H GLN A 89 22.925 31.613 -14.873 1.00 25.00 H new ATOM 0 HA GLN A 89 23.618 30.432 -17.419 1.00 25.00 H new ATOM 0 HB2 GLN A 89 25.145 32.167 -15.439 1.00 25.00 H new ATOM 0 HB3 GLN A 89 25.754 31.694 -17.012 1.00 25.00 H new ATOM 0 HG2 GLN A 89 23.647 32.795 -18.003 1.00 25.00 H new ATOM 0 HG3 GLN A 89 23.370 33.472 -16.410 1.00 25.00 H new ATOM 0 HE21 GLN A 89 25.097 34.842 -15.469 1.00 25.00 H new ATOM 0 HE22 GLN A 89 26.125 35.772 -16.564 1.00 25.00 H new ATOM 1403 N ALA A 90 25.711 28.969 -16.728 1.00 25.00 N ATOM 1404 CA ALA A 90 26.547 27.826 -16.370 1.00 25.00 C ATOM 1405 C ALA A 90 28.017 28.105 -16.698 1.00 25.00 C ATOM 1406 O ALA A 90 28.319 28.965 -17.531 1.00 25.00 O ATOM 1407 CB ALA A 90 26.058 26.576 -17.126 1.00 25.00 C ATOM 0 H ALA A 90 25.891 29.342 -17.660 1.00 25.00 H new ATOM 0 HA ALA A 90 26.468 27.653 -15.297 1.00 25.00 H new ATOM 0 HB1 ALA A 90 26.681 25.723 -16.859 1.00 25.00 H new ATOM 0 HB2 ALA A 90 25.023 26.368 -16.854 1.00 25.00 H new ATOM 0 HB3 ALA A 90 26.123 26.752 -18.200 1.00 25.00 H new ATOM 1413 N LYS A 91 28.898 27.325 -16.072 1.00 25.00 N ATOM 1414 CA LYS A 91 30.352 27.384 -16.250 1.00 25.00 C ATOM 1415 C LYS A 91 30.978 28.758 -15.901 1.00 25.00 C ATOM 1416 O LYS A 91 30.299 29.685 -15.475 1.00 25.00 O ATOM 1417 CB LYS A 91 30.679 26.940 -17.683 1.00 25.00 C ATOM 1418 CG LYS A 91 32.007 26.205 -17.842 1.00 25.00 C ATOM 1419 CD LYS A 91 32.885 26.938 -18.827 1.00 25.00 C ATOM 1420 CE LYS A 91 34.315 26.382 -18.825 1.00 25.00 C ATOM 1421 NZ LYS A 91 35.304 27.386 -19.367 1.00 25.00 N ATOM 0 H LYS A 91 28.611 26.610 -15.404 1.00 25.00 H new ATOM 0 HA LYS A 91 30.810 26.703 -15.533 1.00 25.00 H new ATOM 0 HB2 LYS A 91 29.878 26.293 -18.039 1.00 25.00 H new ATOM 0 HB3 LYS A 91 30.688 27.819 -18.327 1.00 25.00 H new ATOM 0 HG2 LYS A 91 32.510 26.132 -16.878 1.00 25.00 H new ATOM 0 HG3 LYS A 91 31.830 25.186 -18.187 1.00 25.00 H new ATOM 0 HD2 LYS A 91 32.461 26.853 -19.828 1.00 25.00 H new ATOM 0 HD3 LYS A 91 32.905 27.999 -18.579 1.00 25.00 H new ATOM 0 HE2 LYS A 91 34.597 26.105 -17.809 1.00 25.00 H new ATOM 0 HE3 LYS A 91 34.353 25.473 -19.425 1.00 25.00 H new ATOM 0 HZ1 LYS A 91 36.257 26.970 -19.366 1.00 25.00 H new ATOM 0 HZ2 LYS A 91 35.039 27.644 -20.339 1.00 25.00 H new ATOM 0 HZ3 LYS A 91 35.298 28.237 -18.769 1.00 25.00 H new ATOM 1435 N ILE A 92 32.296 28.845 -16.046 1.00 25.00 N ATOM 1436 CA ILE A 92 33.065 30.060 -15.791 1.00 25.00 C ATOM 1437 C ILE A 92 33.948 30.221 -17.026 1.00 25.00 C ATOM 1438 O ILE A 92 34.713 29.314 -17.360 1.00 25.00 O ATOM 1439 CB ILE A 92 33.971 29.923 -14.519 1.00 25.00 C ATOM 1440 CG1 ILE A 92 33.106 29.644 -13.270 1.00 25.00 C ATOM 1441 CG2 ILE A 92 34.814 31.215 -14.315 1.00 25.00 C ATOM 1442 CD1 ILE A 92 33.898 29.247 -12.013 1.00 25.00 C ATOM 0 H ILE A 92 32.871 28.059 -16.350 1.00 25.00 H new ATOM 0 HA ILE A 92 32.407 30.910 -15.611 1.00 25.00 H new ATOM 0 HB ILE A 92 34.650 29.083 -14.665 1.00 25.00 H new ATOM 0 HG12 ILE A 92 32.518 30.534 -13.046 1.00 25.00 H new ATOM 0 HG13 ILE A 92 32.400 28.847 -13.505 1.00 25.00 H new ATOM 0 HG21 ILE A 92 35.438 31.106 -13.428 1.00 25.00 H new ATOM 0 HG22 ILE A 92 35.447 31.378 -15.187 1.00 25.00 H new ATOM 0 HG23 ILE A 92 34.147 32.068 -14.187 1.00 25.00 H new ATOM 0 HD11 ILE A 92 33.207 29.071 -11.188 1.00 25.00 H new ATOM 0 HD12 ILE A 92 34.465 28.337 -12.212 1.00 25.00 H new ATOM 0 HD13 ILE A 92 34.584 30.051 -11.746 1.00 25.00 H new ATOM 1454 N GLU A 93 33.790 31.315 -17.748 1.00 25.00 N ATOM 1455 CA GLU A 93 34.563 31.545 -18.972 1.00 25.00 C ATOM 1456 C GLU A 93 35.948 32.101 -18.628 1.00 25.00 C ATOM 1457 O GLU A 93 36.143 32.640 -17.541 1.00 25.00 O ATOM 1458 CB GLU A 93 33.798 32.491 -19.917 1.00 25.00 C ATOM 1459 CG GLU A 93 34.042 34.007 -19.710 1.00 25.00 C ATOM 1460 CD GLU A 93 35.299 34.512 -20.433 1.00 25.00 C ATOM 1461 OE1 GLU A 93 35.532 34.079 -21.583 1.00 25.00 O ATOM 1462 OE2 GLU A 93 36.055 35.320 -19.851 1.00 25.00 O ATOM 0 H GLU A 93 33.136 32.062 -17.515 1.00 25.00 H new ATOM 0 HA GLU A 93 34.702 30.595 -19.489 1.00 25.00 H new ATOM 0 HB2 GLU A 93 34.063 32.238 -20.944 1.00 25.00 H new ATOM 0 HB3 GLU A 93 32.731 32.297 -19.806 1.00 25.00 H new ATOM 0 HG2 GLU A 93 33.175 34.562 -20.068 1.00 25.00 H new ATOM 0 HG3 GLU A 93 34.134 34.213 -18.644 1.00 25.00 H new ATOM 1469 N GLU A 94 36.889 31.979 -19.557 1.00 25.00 N ATOM 1470 CA GLU A 94 38.219 32.565 -19.407 1.00 25.00 C ATOM 1471 C GLU A 94 38.757 32.964 -20.775 1.00 25.00 C ATOM 1472 O GLU A 94 38.883 32.126 -21.667 1.00 25.00 O ATOM 1473 CB GLU A 94 39.223 31.574 -18.818 1.00 25.00 C ATOM 1474 CG GLU A 94 39.072 31.276 -17.337 1.00 25.00 C ATOM 1475 CD GLU A 94 40.193 30.381 -16.831 1.00 25.00 C ATOM 1476 OE1 GLU A 94 41.065 30.877 -16.085 1.00 25.00 O ATOM 1477 OE2 GLU A 94 40.219 29.185 -17.206 1.00 25.00 O ATOM 0 H GLU A 94 36.754 31.474 -20.433 1.00 25.00 H new ATOM 0 HA GLU A 94 38.111 33.420 -18.739 1.00 25.00 H new ATOM 0 HB2 GLU A 94 39.143 30.636 -19.367 1.00 25.00 H new ATOM 0 HB3 GLU A 94 40.228 31.959 -18.990 1.00 25.00 H new ATOM 0 HG2 GLU A 94 39.069 32.210 -16.775 1.00 25.00 H new ATOM 0 HG3 GLU A 94 38.111 30.794 -17.158 1.00 25.00 H new ATOM 1484 N ASP A 95 39.158 34.219 -20.904 1.00 25.00 N ATOM 1485 CA ASP A 95 39.794 34.720 -22.132 1.00 25.00 C ATOM 1486 C ASP A 95 41.241 35.094 -21.808 1.00 25.00 C ATOM 1487 O ASP A 95 41.772 36.111 -22.249 1.00 25.00 O ATOM 1488 CB ASP A 95 39.031 35.920 -22.709 1.00 25.00 C ATOM 1489 CG ASP A 95 39.377 36.171 -24.175 1.00 25.00 C ATOM 1490 OD1 ASP A 95 39.647 37.332 -24.565 1.00 25.00 O ATOM 1491 OD2 ASP A 95 39.417 35.191 -24.949 1.00 25.00 O ATOM 0 H ASP A 95 39.057 34.922 -20.171 1.00 25.00 H new ATOM 0 HA ASP A 95 39.775 33.941 -22.894 1.00 25.00 H new ATOM 0 HB2 ASP A 95 37.959 35.747 -22.615 1.00 25.00 H new ATOM 0 HB3 ASP A 95 39.262 36.811 -22.125 1.00 25.00 H new ATOM 1496 N ILE A 96 41.872 34.254 -20.999 1.00 25.00 N ATOM 1497 CA ILE A 96 43.241 34.474 -20.497 1.00 25.00 C ATOM 1498 C ILE A 96 44.352 34.281 -21.548 1.00 25.00 C ATOM 1499 O ILE A 96 45.514 34.059 -21.223 1.00 25.00 O ATOM 1500 CB ILE A 96 43.517 33.542 -19.274 1.00 25.00 C ATOM 1501 CG1 ILE A 96 43.359 32.059 -19.682 1.00 25.00 C ATOM 1502 CG2 ILE A 96 42.552 33.907 -18.110 1.00 25.00 C ATOM 1503 CD1 ILE A 96 43.843 31.056 -18.625 1.00 25.00 C ATOM 0 H ILE A 96 41.451 33.388 -20.663 1.00 25.00 H new ATOM 0 HA ILE A 96 43.278 35.524 -20.208 1.00 25.00 H new ATOM 0 HB ILE A 96 44.542 33.688 -18.934 1.00 25.00 H new ATOM 0 HG12 ILE A 96 42.308 31.864 -19.897 1.00 25.00 H new ATOM 0 HG13 ILE A 96 43.910 31.888 -20.607 1.00 25.00 H new ATOM 0 HG21 ILE A 96 42.747 33.255 -17.258 1.00 25.00 H new ATOM 0 HG22 ILE A 96 42.711 34.945 -17.817 1.00 25.00 H new ATOM 0 HG23 ILE A 96 41.521 33.777 -18.438 1.00 25.00 H new ATOM 0 HD11 ILE A 96 43.696 30.040 -18.993 1.00 25.00 H new ATOM 0 HD12 ILE A 96 44.902 31.220 -18.426 1.00 25.00 H new ATOM 0 HD13 ILE A 96 43.275 31.195 -17.705 1.00 25.00 H new ATOM 1515 N ARG A 97 43.991 34.435 -22.812 1.00 25.00 N ATOM 1516 CA ARG A 97 44.933 34.315 -23.937 1.00 25.00 C ATOM 1517 C ARG A 97 45.707 35.599 -24.179 1.00 25.00 C ATOM 1518 O ARG A 97 46.477 35.733 -25.125 1.00 25.00 O ATOM 1519 CB ARG A 97 44.160 33.953 -25.209 1.00 25.00 C ATOM 1520 CG ARG A 97 43.174 35.048 -25.604 1.00 25.00 C ATOM 1521 CD ARG A 97 42.352 34.708 -26.816 1.00 25.00 C ATOM 1522 NE ARG A 97 41.274 35.697 -26.912 1.00 25.00 N ATOM 1523 CZ ARG A 97 41.306 36.830 -27.596 1.00 25.00 C ATOM 1524 NH1 ARG A 97 42.316 37.168 -28.363 1.00 25.00 N ATOM 1525 NH2 ARG A 97 40.299 37.643 -27.491 1.00 25.00 N ATOM 0 H ARG A 97 43.035 34.648 -23.098 1.00 25.00 H new ATOM 0 HA ARG A 97 45.650 33.535 -23.682 1.00 25.00 H new ATOM 0 HB2 ARG A 97 44.862 33.785 -26.025 1.00 25.00 H new ATOM 0 HB3 ARG A 97 43.622 33.018 -25.053 1.00 25.00 H new ATOM 0 HG2 ARG A 97 42.506 35.244 -24.765 1.00 25.00 H new ATOM 0 HG3 ARG A 97 43.724 35.969 -25.795 1.00 25.00 H new ATOM 0 HD2 ARG A 97 42.969 34.726 -27.714 1.00 25.00 H new ATOM 0 HD3 ARG A 97 41.942 33.702 -26.731 1.00 25.00 H new ATOM 0 HE ARG A 97 40.415 35.492 -26.402 1.00 25.00 H new ATOM 0 HH11 ARG A 97 43.120 36.547 -28.450 1.00 25.00 H new ATOM 0 HH12 ARG A 97 42.297 38.052 -28.872 1.00 25.00 H new ATOM 0 HH21 ARG A 97 39.509 37.402 -26.892 1.00 25.00 H new ATOM 0 HH22 ARG A 97 40.298 38.523 -28.007 1.00 25.00 H new ATOM 1539 N GLN A 98 45.440 36.552 -23.318 1.00 25.00 N ATOM 1540 CA GLN A 98 46.015 37.896 -23.385 1.00 25.00 C ATOM 1541 C GLN A 98 47.390 37.950 -22.721 1.00 25.00 C ATOM 1542 O GLN A 98 47.612 37.707 -21.556 1.00 25.00 O ATOM 1543 CB GLN A 98 45.056 38.941 -22.773 1.00 25.00 C ATOM 1544 CG GLN A 98 44.327 39.749 -23.870 1.00 25.00 C ATOM 1545 CD GLN A 98 43.344 38.918 -24.665 1.00 25.00 C ATOM 1546 OE1 GLN A 98 43.495 38.651 -25.835 1.00 25.00 O ATOM 1547 NE2 GLN A 98 42.265 38.523 -24.015 1.00 25.00 N ATOM 1548 OXT GLN A 98 48.339 38.301 -23.521 1.00 25.00 O ATOM 0 H GLN A 98 44.805 36.423 -22.530 1.00 25.00 H new ATOM 0 HA GLN A 98 46.152 38.144 -24.438 1.00 25.00 H new ATOM 0 HB2 GLN A 98 44.323 38.439 -22.142 1.00 25.00 H new ATOM 0 HB3 GLN A 98 45.617 39.620 -22.131 1.00 25.00 H new ATOM 0 HG2 GLN A 98 43.798 40.583 -23.408 1.00 25.00 H new ATOM 0 HG3 GLN A 98 45.065 40.176 -24.549 1.00 25.00 H new ATOM 0 HE21 GLN A 98 42.150 38.755 -23.028 1.00 25.00 H new ATOM 0 HE22 GLN A 98 41.546 37.986 -24.499 1.00 25.00 H new TER 1558 GLN A 98