USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 525 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 41 THR OG1 : rot 122:sc= 0.192 USER MOD Set 1.2: A 48 TYR OH : rot -16:sc= -1.71! USER MOD Single : A 1 THR N :NH3+ 167:sc= 0.00228 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= -0.717 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 HIS : no HD1:sc= -0.484 K(o=-0.48,f=-1.6) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 151:sc= -0.113 (180deg=-0.868) USER MOD Single : A 14 ASN : amide:sc= -2.37 X(o=-2.4,f=-2.7!) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 93:sc= 1.24 USER MOD Single : A 21 GLN : amide:sc= 0.0376 X(o=0.038,f=0) USER MOD Single : A 25 ASN : amide:sc= -0.0594 K(o=-0.059,f=-1.6!) USER MOD Single : A 29 HIS : no HD1:sc= -0.315 X(o=-0.31,f=-0.31) USER MOD Single : A 30 SER OG : rot -51:sc= 1.22 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.169 K(o=-0.17,f=-5!) USER MOD Single : A 33 ASN : amide:sc=-0.00653 X(o=-0.0065,f=-0.012) USER MOD Single : A 39 SER OG : rot 97:sc= 1.24 USER MOD Single : A 40 SER OG : rot 83:sc= 0.193 USER MOD Single : A 42 ASN : amide:sc= -0.845 K(o=-0.85,f=-5.3!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.787 K(o=-0.79,f=-5.6!) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ -154:sc= -0.177 (180deg=-1.11) USER MOD Single : A 52 ASN : amide:sc= 0.477 X(o=0.48,f=0) USER MOD Single : A 58 LYS NZ :NH3+ -142:sc= 0 (180deg=-0.21) USER MOD Single : A 63 ASN :FLIP amide:sc= 0.569 F(o=-0.87,f=0.57) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -3.405 -4.440 0.182 1.00 0.00 N ATOM 2 CA THR A 1 -1.972 -4.242 0.539 1.00 0.00 C ATOM 3 C THR A 1 -1.869 -3.147 1.600 1.00 0.00 C ATOM 4 O THR A 1 -2.794 -2.353 1.773 1.00 0.00 O ATOM 5 CB THR A 1 -1.190 -3.856 -0.726 1.00 0.00 C ATOM 6 OG1 THR A 1 -0.046 -4.690 -0.845 1.00 0.00 O ATOM 7 CG2 THR A 1 -0.749 -2.390 -0.659 1.00 0.00 C ATOM 0 H1 THR A 1 -3.471 -5.014 -0.682 1.00 0.00 H new ATOM 0 H2 THR A 1 -3.892 -4.928 0.960 1.00 0.00 H new ATOM 0 H3 THR A 1 -3.853 -3.516 0.019 1.00 0.00 H new ATOM 0 HA THR A 1 -1.548 -5.161 0.945 1.00 0.00 H new ATOM 0 HB THR A 1 -1.837 -3.987 -1.593 1.00 0.00 H new ATOM 0 HG1 THR A 1 0.454 -4.447 -1.652 1.00 0.00 H new ATOM 0 HG21 THR A 1 -0.197 -2.135 -1.563 1.00 0.00 H new ATOM 0 HG22 THR A 1 -1.627 -1.749 -0.577 1.00 0.00 H new ATOM 0 HG23 THR A 1 -0.109 -2.242 0.211 1.00 0.00 H new ATOM 17 N PRO A 2 -0.771 -3.091 2.310 1.00 0.00 N ATOM 18 CA PRO A 2 -0.555 -2.069 3.375 1.00 0.00 C ATOM 19 C PRO A 2 -0.266 -0.686 2.797 1.00 0.00 C ATOM 20 O PRO A 2 0.249 -0.562 1.686 1.00 0.00 O ATOM 21 CB PRO A 2 0.651 -2.604 4.147 1.00 0.00 C ATOM 22 CG PRO A 2 1.409 -3.437 3.168 1.00 0.00 C ATOM 23 CD PRO A 2 0.386 -3.992 2.176 1.00 0.00 C ATOM 0 HA PRO A 2 -1.439 -1.932 3.998 1.00 0.00 H new ATOM 0 HB2 PRO A 2 1.266 -1.789 4.529 1.00 0.00 H new ATOM 0 HB3 PRO A 2 0.336 -3.196 5.006 1.00 0.00 H new ATOM 0 HG2 PRO A 2 2.162 -2.840 2.654 1.00 0.00 H new ATOM 0 HG3 PRO A 2 1.935 -4.246 3.674 1.00 0.00 H new ATOM 0 HD2 PRO A 2 0.776 -3.991 1.158 1.00 0.00 H new ATOM 0 HD3 PRO A 2 0.119 -5.022 2.413 1.00 0.00 H new ATOM 31 N ILE A 3 -0.602 0.350 3.559 1.00 0.00 N ATOM 32 CA ILE A 3 -0.374 1.719 3.113 1.00 0.00 C ATOM 33 C ILE A 3 1.118 1.985 2.940 1.00 0.00 C ATOM 34 O ILE A 3 1.936 1.528 3.739 1.00 0.00 O ATOM 35 CB ILE A 3 -0.956 2.703 4.130 1.00 0.00 C ATOM 36 CG1 ILE A 3 -0.867 4.126 3.573 1.00 0.00 C ATOM 37 CG2 ILE A 3 -0.161 2.617 5.434 1.00 0.00 C ATOM 38 CD1 ILE A 3 -1.864 4.292 2.424 1.00 0.00 C ATOM 0 H ILE A 3 -1.030 0.269 4.481 1.00 0.00 H new ATOM 0 HA ILE A 3 -0.869 1.855 2.152 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.999 2.452 4.322 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.080 4.849 4.360 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.145 4.327 3.221 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.575 3.318 6.159 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.223 1.604 5.832 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.882 2.868 5.241 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.799 5.306 2.029 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.630 3.579 1.633 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -2.874 4.110 2.790 1.00 0.00 H new ATOM 50 N GLU A 4 1.464 2.728 1.894 1.00 0.00 N ATOM 51 CA GLU A 4 2.862 3.048 1.628 1.00 0.00 C ATOM 52 C GLU A 4 3.467 3.818 2.797 1.00 0.00 C ATOM 53 O GLU A 4 2.806 4.658 3.408 1.00 0.00 O ATOM 54 CB GLU A 4 2.972 3.885 0.352 1.00 0.00 C ATOM 55 CG GLU A 4 2.280 5.233 0.563 1.00 0.00 C ATOM 56 CD GLU A 4 2.313 6.044 -0.729 1.00 0.00 C ATOM 57 OE1 GLU A 4 2.863 5.551 -1.700 1.00 0.00 O ATOM 58 OE2 GLU A 4 1.787 7.145 -0.727 1.00 0.00 O ATOM 0 H GLU A 4 0.803 3.117 1.222 1.00 0.00 H new ATOM 0 HA GLU A 4 3.411 2.115 1.499 1.00 0.00 H new ATOM 0 HB2 GLU A 4 4.020 4.039 0.095 1.00 0.00 H new ATOM 0 HB3 GLU A 4 2.513 3.356 -0.483 1.00 0.00 H new ATOM 0 HG2 GLU A 4 1.248 5.076 0.877 1.00 0.00 H new ATOM 0 HG3 GLU A 4 2.776 5.785 1.361 1.00 0.00 H new ATOM 65 N SER A 5 4.726 3.526 3.103 1.00 0.00 N ATOM 66 CA SER A 5 5.411 4.197 4.202 1.00 0.00 C ATOM 67 C SER A 5 5.730 5.642 3.832 1.00 0.00 C ATOM 68 O SER A 5 5.745 6.003 2.655 1.00 0.00 O ATOM 69 CB SER A 5 6.705 3.457 4.540 1.00 0.00 C ATOM 70 OG SER A 5 7.632 3.623 3.474 1.00 0.00 O ATOM 0 H SER A 5 5.290 2.834 2.610 1.00 0.00 H new ATOM 0 HA SER A 5 4.754 4.193 5.071 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.127 3.843 5.468 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.501 2.398 4.699 1.00 0.00 H new ATOM 0 HG SER A 5 8.464 3.151 3.688 1.00 0.00 H new ATOM 76 N HIS A 6 5.983 6.465 4.845 1.00 0.00 N ATOM 77 CA HIS A 6 6.301 7.870 4.614 1.00 0.00 C ATOM 78 C HIS A 6 7.607 8.006 3.835 1.00 0.00 C ATOM 79 O HIS A 6 7.838 9.012 3.165 1.00 0.00 O ATOM 80 CB HIS A 6 6.424 8.603 5.951 1.00 0.00 C ATOM 81 CG HIS A 6 7.627 8.091 6.695 1.00 0.00 C ATOM 82 ND1 HIS A 6 8.900 8.593 6.477 1.00 0.00 N ATOM 83 CD2 HIS A 6 7.766 7.121 7.657 1.00 0.00 C ATOM 84 CE1 HIS A 6 9.742 7.931 7.291 1.00 0.00 C ATOM 85 NE2 HIS A 6 9.102 7.022 8.032 1.00 0.00 N ATOM 0 H HIS A 6 5.974 6.186 5.826 1.00 0.00 H new ATOM 0 HA HIS A 6 5.496 8.313 4.028 1.00 0.00 H new ATOM 0 HB2 HIS A 6 6.517 9.676 5.782 1.00 0.00 H new ATOM 0 HB3 HIS A 6 5.523 8.451 6.546 1.00 0.00 H new ATOM 0 HD2 HIS A 6 6.961 6.526 8.061 1.00 0.00 H new ATOM 0 HE1 HIS A 6 10.806 8.112 7.340 1.00 0.00 H new ATOM 0 HE2 HIS A 6 9.506 6.391 8.724 1.00 0.00 H new ATOM 94 N GLN A 7 8.457 6.988 3.928 1.00 0.00 N ATOM 95 CA GLN A 7 9.736 7.008 3.227 1.00 0.00 C ATOM 96 C GLN A 7 9.523 6.934 1.719 1.00 0.00 C ATOM 97 O GLN A 7 8.671 6.187 1.238 1.00 0.00 O ATOM 98 CB GLN A 7 10.599 5.829 3.682 1.00 0.00 C ATOM 99 CG GLN A 7 11.957 5.891 2.981 1.00 0.00 C ATOM 100 CD GLN A 7 12.867 4.787 3.509 1.00 0.00 C ATOM 101 OE1 GLN A 7 13.045 4.654 4.719 1.00 0.00 O ATOM 102 NE2 GLN A 7 13.456 3.981 2.667 1.00 0.00 N ATOM 0 H GLN A 7 8.286 6.146 4.477 1.00 0.00 H new ATOM 0 HA GLN A 7 10.244 7.943 3.464 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.734 5.859 4.763 1.00 0.00 H new ATOM 0 HB3 GLN A 7 10.100 4.888 3.449 1.00 0.00 H new ATOM 0 HG2 GLN A 7 11.825 5.781 1.905 1.00 0.00 H new ATOM 0 HG3 GLN A 7 12.418 6.865 3.148 1.00 0.00 H new ATOM 0 HE21 GLN A 7 13.307 4.093 1.664 1.00 0.00 H new ATOM 0 HE22 GLN A 7 14.065 3.239 3.012 1.00 0.00 H new ATOM 111 N VAL A 8 10.304 7.713 0.977 1.00 0.00 N ATOM 112 CA VAL A 8 10.193 7.728 -0.477 1.00 0.00 C ATOM 113 C VAL A 8 11.558 7.506 -1.121 1.00 0.00 C ATOM 114 O VAL A 8 12.573 8.000 -0.631 1.00 0.00 O ATOM 115 CB VAL A 8 9.618 9.066 -0.943 1.00 0.00 C ATOM 116 CG1 VAL A 8 10.540 10.202 -0.498 1.00 0.00 C ATOM 117 CG2 VAL A 8 9.508 9.068 -2.469 1.00 0.00 C ATOM 0 H VAL A 8 11.016 8.338 1.355 1.00 0.00 H new ATOM 0 HA VAL A 8 9.526 6.921 -0.780 1.00 0.00 H new ATOM 0 HB VAL A 8 8.630 9.209 -0.505 1.00 0.00 H new ATOM 0 HG11 VAL A 8 10.129 11.155 -0.831 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.620 10.201 0.589 1.00 0.00 H new ATOM 0 HG13 VAL A 8 11.529 10.061 -0.935 1.00 0.00 H new ATOM 0 HG21 VAL A 8 9.098 10.021 -2.803 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.497 8.925 -2.905 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.851 8.259 -2.787 1.00 0.00 H new ATOM 127 N GLU A 9 11.574 6.758 -2.220 1.00 0.00 N ATOM 128 CA GLU A 9 12.821 6.476 -2.922 1.00 0.00 C ATOM 129 C GLU A 9 12.617 6.559 -4.431 1.00 0.00 C ATOM 130 O GLU A 9 12.519 5.538 -5.112 1.00 0.00 O ATOM 131 CB GLU A 9 13.343 5.082 -2.549 1.00 0.00 C ATOM 132 CG GLU A 9 12.183 4.176 -2.120 1.00 0.00 C ATOM 133 CD GLU A 9 11.133 4.104 -3.225 1.00 0.00 C ATOM 134 OE1 GLU A 9 11.401 3.466 -4.230 1.00 0.00 O ATOM 135 OE2 GLU A 9 10.075 4.686 -3.049 1.00 0.00 O ATOM 0 H GLU A 9 10.745 6.339 -2.641 1.00 0.00 H new ATOM 0 HA GLU A 9 13.555 7.224 -2.622 1.00 0.00 H new ATOM 0 HB2 GLU A 9 13.862 4.641 -3.400 1.00 0.00 H new ATOM 0 HB3 GLU A 9 14.069 5.163 -1.740 1.00 0.00 H new ATOM 0 HG2 GLU A 9 12.556 3.176 -1.897 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.732 4.559 -1.205 1.00 0.00 H new ATOM 142 N LYS A 10 12.557 7.782 -4.948 1.00 0.00 N ATOM 143 CA LYS A 10 12.365 7.989 -6.379 1.00 0.00 C ATOM 144 C LYS A 10 13.566 7.458 -7.159 1.00 0.00 C ATOM 145 O LYS A 10 14.618 7.181 -6.584 1.00 0.00 O ATOM 146 CB LYS A 10 12.130 9.488 -6.662 1.00 0.00 C ATOM 147 CG LYS A 10 13.398 10.189 -7.190 1.00 0.00 C ATOM 148 CD LYS A 10 14.510 10.161 -6.132 1.00 0.00 C ATOM 149 CE LYS A 10 15.832 9.765 -6.792 1.00 0.00 C ATOM 150 NZ LYS A 10 16.758 9.220 -5.760 1.00 0.00 N ATOM 0 H LYS A 10 12.638 8.640 -4.402 1.00 0.00 H new ATOM 0 HA LYS A 10 11.486 7.436 -6.709 1.00 0.00 H new ATOM 0 HB2 LYS A 10 11.327 9.596 -7.391 1.00 0.00 H new ATOM 0 HB3 LYS A 10 11.799 9.981 -5.748 1.00 0.00 H new ATOM 0 HG2 LYS A 10 13.741 9.696 -8.099 1.00 0.00 H new ATOM 0 HG3 LYS A 10 13.166 11.221 -7.455 1.00 0.00 H new ATOM 0 HD2 LYS A 10 14.605 11.140 -5.662 1.00 0.00 H new ATOM 0 HD3 LYS A 10 14.258 9.452 -5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 10 15.655 9.020 -7.567 1.00 0.00 H new ATOM 0 HE3 LYS A 10 16.281 10.631 -7.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 17.657 8.951 -6.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 16.936 9.945 -5.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 16.329 8.384 -5.315 1.00 0.00 H new ATOM 164 N ARG A 11 13.399 7.318 -8.470 1.00 0.00 N ATOM 165 CA ARG A 11 14.477 6.818 -9.317 1.00 0.00 C ATOM 166 C ARG A 11 14.572 7.631 -10.605 1.00 0.00 C ATOM 167 O ARG A 11 13.685 8.426 -10.917 1.00 0.00 O ATOM 168 CB ARG A 11 14.269 5.330 -9.652 1.00 0.00 C ATOM 169 CG ARG A 11 12.779 5.008 -9.865 1.00 0.00 C ATOM 170 CD ARG A 11 12.274 5.683 -11.142 1.00 0.00 C ATOM 171 NE ARG A 11 11.525 6.893 -10.816 1.00 0.00 N ATOM 172 CZ ARG A 11 10.326 6.840 -10.232 1.00 0.00 C ATOM 173 NH1 ARG A 11 9.778 5.690 -9.930 1.00 0.00 N ATOM 174 NH2 ARG A 11 9.692 7.948 -9.960 1.00 0.00 N ATOM 0 H ARG A 11 12.536 7.541 -8.966 1.00 0.00 H new ATOM 0 HA ARG A 11 15.410 6.923 -8.764 1.00 0.00 H new ATOM 0 HB2 ARG A 11 14.830 5.075 -10.551 1.00 0.00 H new ATOM 0 HB3 ARG A 11 14.665 4.714 -8.844 1.00 0.00 H new ATOM 0 HG2 ARG A 11 12.638 3.929 -9.934 1.00 0.00 H new ATOM 0 HG3 ARG A 11 12.198 5.351 -9.009 1.00 0.00 H new ATOM 0 HD2 ARG A 11 13.117 5.932 -11.787 1.00 0.00 H new ATOM 0 HD3 ARG A 11 11.639 4.994 -11.699 1.00 0.00 H new ATOM 0 HE ARG A 11 11.928 7.803 -11.040 1.00 0.00 H new ATOM 0 HH11 ARG A 11 10.268 4.821 -10.141 1.00 0.00 H new ATOM 0 HH12 ARG A 11 8.861 5.663 -9.484 1.00 0.00 H new ATOM 0 HH21 ARG A 11 10.113 8.847 -10.194 1.00 0.00 H new ATOM 0 HH22 ARG A 11 8.775 7.915 -9.514 1.00 0.00 H new ATOM 188 N LYS A 12 15.657 7.430 -11.346 1.00 0.00 N ATOM 189 CA LYS A 12 15.863 8.152 -12.596 1.00 0.00 C ATOM 190 C LYS A 12 14.744 7.848 -13.587 1.00 0.00 C ATOM 191 O LYS A 12 14.222 6.734 -13.627 1.00 0.00 O ATOM 192 CB LYS A 12 17.211 7.763 -13.207 1.00 0.00 C ATOM 193 CG LYS A 12 17.110 6.367 -13.826 1.00 0.00 C ATOM 194 CD LYS A 12 18.509 5.871 -14.201 1.00 0.00 C ATOM 195 CE LYS A 12 19.208 5.321 -12.956 1.00 0.00 C ATOM 196 NZ LYS A 12 18.503 4.093 -12.493 1.00 0.00 N ATOM 0 H LYS A 12 16.403 6.777 -11.105 1.00 0.00 H new ATOM 0 HA LYS A 12 15.856 9.220 -12.380 1.00 0.00 H new ATOM 0 HB2 LYS A 12 17.500 8.489 -13.967 1.00 0.00 H new ATOM 0 HB3 LYS A 12 17.987 7.777 -12.441 1.00 0.00 H new ATOM 0 HG2 LYS A 12 16.645 5.678 -13.121 1.00 0.00 H new ATOM 0 HG3 LYS A 12 16.474 6.395 -14.710 1.00 0.00 H new ATOM 0 HD2 LYS A 12 18.439 5.096 -14.964 1.00 0.00 H new ATOM 0 HD3 LYS A 12 19.093 6.686 -14.628 1.00 0.00 H new ATOM 0 HE2 LYS A 12 20.250 5.092 -13.182 1.00 0.00 H new ATOM 0 HE3 LYS A 12 19.211 6.072 -12.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 19.179 3.464 -12.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 17.746 4.356 -11.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 18.091 3.600 -13.311 1.00 0.00 H new ATOM 210 N CYS A 13 14.382 8.847 -14.386 1.00 0.00 N ATOM 211 CA CYS A 13 13.323 8.677 -15.375 1.00 0.00 C ATOM 212 C CYS A 13 13.781 7.750 -16.498 1.00 0.00 C ATOM 213 O CYS A 13 14.246 8.206 -17.543 1.00 0.00 O ATOM 214 CB CYS A 13 12.929 10.037 -15.957 1.00 0.00 C ATOM 215 SG CYS A 13 11.319 10.535 -15.297 1.00 0.00 S ATOM 0 H CYS A 13 14.803 9.776 -14.369 1.00 0.00 H new ATOM 0 HA CYS A 13 12.459 8.230 -14.883 1.00 0.00 H new ATOM 0 HB2 CYS A 13 13.683 10.783 -15.707 1.00 0.00 H new ATOM 0 HB3 CYS A 13 12.886 9.980 -17.045 1.00 0.00 H new ATOM 220 N ASN A 14 13.645 6.447 -16.277 1.00 0.00 N ATOM 221 CA ASN A 14 14.048 5.469 -17.282 1.00 0.00 C ATOM 222 C ASN A 14 12.823 4.811 -17.913 1.00 0.00 C ATOM 223 O ASN A 14 12.806 4.538 -19.113 1.00 0.00 O ATOM 224 CB ASN A 14 14.944 4.400 -16.652 1.00 0.00 C ATOM 225 CG ASN A 14 14.229 3.746 -15.474 1.00 0.00 C ATOM 226 OD1 ASN A 14 13.329 2.929 -15.669 1.00 0.00 O ATOM 227 ND2 ASN A 14 14.577 4.059 -14.256 1.00 0.00 N ATOM 0 H ASN A 14 13.263 6.046 -15.420 1.00 0.00 H new ATOM 0 HA ASN A 14 14.606 5.989 -18.060 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.202 3.646 -17.396 1.00 0.00 H new ATOM 0 HB3 ASN A 14 15.879 4.849 -16.316 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.103 3.626 -13.463 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.323 4.736 -14.097 1.00 0.00 H new ATOM 234 N THR A 15 11.800 4.557 -17.099 1.00 0.00 N ATOM 235 CA THR A 15 10.581 3.930 -17.596 1.00 0.00 C ATOM 236 C THR A 15 10.081 4.656 -18.843 1.00 0.00 C ATOM 237 O THR A 15 10.318 5.852 -19.013 1.00 0.00 O ATOM 238 CB THR A 15 9.500 3.943 -16.509 1.00 0.00 C ATOM 239 OG1 THR A 15 8.382 3.185 -16.950 1.00 0.00 O ATOM 240 CG2 THR A 15 9.056 5.381 -16.218 1.00 0.00 C ATOM 0 H THR A 15 11.792 4.774 -16.102 1.00 0.00 H new ATOM 0 HA THR A 15 10.803 2.896 -17.860 1.00 0.00 H new ATOM 0 HB THR A 15 9.908 3.507 -15.597 1.00 0.00 H new ATOM 0 HG1 THR A 15 7.690 3.190 -16.257 1.00 0.00 H new ATOM 0 HG21 THR A 15 8.288 5.375 -15.444 1.00 0.00 H new ATOM 0 HG22 THR A 15 9.911 5.964 -15.876 1.00 0.00 H new ATOM 0 HG23 THR A 15 8.652 5.828 -17.126 1.00 0.00 H new ATOM 248 N ALA A 16 9.403 3.920 -19.717 1.00 0.00 N ATOM 249 CA ALA A 16 8.886 4.495 -20.956 1.00 0.00 C ATOM 250 C ALA A 16 7.763 5.496 -20.689 1.00 0.00 C ATOM 251 O ALA A 16 7.406 6.280 -21.566 1.00 0.00 O ATOM 252 CB ALA A 16 8.364 3.379 -21.863 1.00 0.00 C ATOM 0 H ALA A 16 9.199 2.928 -19.593 1.00 0.00 H new ATOM 0 HA ALA A 16 9.704 5.025 -21.443 1.00 0.00 H new ATOM 0 HB1 ALA A 16 7.979 3.811 -22.787 1.00 0.00 H new ATOM 0 HB2 ALA A 16 9.176 2.690 -22.096 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.565 2.840 -21.354 1.00 0.00 H new ATOM 258 N THR A 17 7.206 5.468 -19.482 1.00 0.00 N ATOM 259 CA THR A 17 6.122 6.383 -19.136 1.00 0.00 C ATOM 260 C THR A 17 6.630 7.819 -19.035 1.00 0.00 C ATOM 261 O THR A 17 5.960 8.756 -19.468 1.00 0.00 O ATOM 262 CB THR A 17 5.494 5.966 -17.804 1.00 0.00 C ATOM 263 OG1 THR A 17 4.972 4.650 -17.920 1.00 0.00 O ATOM 264 CG2 THR A 17 4.365 6.934 -17.446 1.00 0.00 C ATOM 0 H THR A 17 7.482 4.831 -18.735 1.00 0.00 H new ATOM 0 HA THR A 17 5.372 6.336 -19.925 1.00 0.00 H new ATOM 0 HB THR A 17 6.252 5.989 -17.021 1.00 0.00 H new ATOM 0 HG1 THR A 17 4.571 4.381 -17.067 1.00 0.00 H new ATOM 0 HG21 THR A 17 3.918 6.637 -16.497 1.00 0.00 H new ATOM 0 HG22 THR A 17 4.766 7.944 -17.358 1.00 0.00 H new ATOM 0 HG23 THR A 17 3.606 6.912 -18.228 1.00 0.00 H new ATOM 272 N CYS A 18 7.813 7.985 -18.453 1.00 0.00 N ATOM 273 CA CYS A 18 8.397 9.311 -18.290 1.00 0.00 C ATOM 274 C CYS A 18 8.703 9.940 -19.647 1.00 0.00 C ATOM 275 O CYS A 18 8.344 11.088 -19.904 1.00 0.00 O ATOM 276 CB CYS A 18 9.683 9.213 -17.468 1.00 0.00 C ATOM 277 SG CYS A 18 10.194 10.868 -16.942 1.00 0.00 S ATOM 0 H CYS A 18 8.383 7.222 -18.088 1.00 0.00 H new ATOM 0 HA CYS A 18 7.677 9.942 -17.769 1.00 0.00 H new ATOM 0 HB2 CYS A 18 9.523 8.577 -16.597 1.00 0.00 H new ATOM 0 HB3 CYS A 18 10.471 8.749 -18.061 1.00 0.00 H new ATOM 282 N ALA A 19 9.372 9.182 -20.509 1.00 0.00 N ATOM 283 CA ALA A 19 9.723 9.680 -21.834 1.00 0.00 C ATOM 284 C ALA A 19 8.471 9.947 -22.665 1.00 0.00 C ATOM 285 O ALA A 19 8.396 10.937 -23.390 1.00 0.00 O ATOM 286 CB ALA A 19 10.608 8.663 -22.556 1.00 0.00 C ATOM 0 H ALA A 19 9.680 8.229 -20.317 1.00 0.00 H new ATOM 0 HA ALA A 19 10.266 10.617 -21.712 1.00 0.00 H new ATOM 0 HB1 ALA A 19 10.866 9.042 -23.545 1.00 0.00 H new ATOM 0 HB2 ALA A 19 11.519 8.501 -21.981 1.00 0.00 H new ATOM 0 HB3 ALA A 19 10.070 7.720 -22.658 1.00 0.00 H new ATOM 292 N THR A 20 7.496 9.053 -22.565 1.00 0.00 N ATOM 293 CA THR A 20 6.258 9.199 -23.324 1.00 0.00 C ATOM 294 C THR A 20 5.683 10.607 -23.179 1.00 0.00 C ATOM 295 O THR A 20 5.082 11.138 -24.114 1.00 0.00 O ATOM 296 CB THR A 20 5.227 8.172 -22.850 1.00 0.00 C ATOM 297 OG1 THR A 20 5.592 6.880 -23.320 1.00 0.00 O ATOM 298 CG2 THR A 20 3.846 8.542 -23.395 1.00 0.00 C ATOM 0 H THR A 20 7.536 8.225 -21.971 1.00 0.00 H new ATOM 0 HA THR A 20 6.487 9.028 -24.376 1.00 0.00 H new ATOM 0 HB THR A 20 5.197 8.167 -21.760 1.00 0.00 H new ATOM 0 HG1 THR A 20 6.131 6.425 -22.640 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.113 7.810 -23.057 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.565 9.531 -23.033 1.00 0.00 H new ATOM 0 HG23 THR A 20 3.875 8.549 -24.485 1.00 0.00 H new ATOM 306 N GLN A 21 5.854 11.202 -22.005 1.00 0.00 N ATOM 307 CA GLN A 21 5.327 12.542 -21.760 1.00 0.00 C ATOM 308 C GLN A 21 6.241 13.621 -22.343 1.00 0.00 C ATOM 309 O GLN A 21 5.784 14.720 -22.657 1.00 0.00 O ATOM 310 CB GLN A 21 5.151 12.767 -20.254 1.00 0.00 C ATOM 311 CG GLN A 21 6.346 13.544 -19.695 1.00 0.00 C ATOM 312 CD GLN A 21 6.341 13.479 -18.171 1.00 0.00 C ATOM 313 OE1 GLN A 21 5.672 14.279 -17.517 1.00 0.00 O ATOM 314 NE2 GLN A 21 7.052 12.569 -17.564 1.00 0.00 N ATOM 0 H GLN A 21 6.347 10.786 -21.215 1.00 0.00 H new ATOM 0 HA GLN A 21 4.360 12.617 -22.257 1.00 0.00 H new ATOM 0 HB2 GLN A 21 4.229 13.318 -20.066 1.00 0.00 H new ATOM 0 HB3 GLN A 21 5.060 11.808 -19.743 1.00 0.00 H new ATOM 0 HG2 GLN A 21 7.275 13.127 -20.082 1.00 0.00 H new ATOM 0 HG3 GLN A 21 6.301 14.582 -20.023 1.00 0.00 H new ATOM 0 HE21 GLN A 21 7.605 11.907 -18.108 1.00 0.00 H new ATOM 0 HE22 GLN A 21 7.054 12.519 -16.545 1.00 0.00 H new ATOM 323 N ARG A 22 7.530 13.317 -22.473 1.00 0.00 N ATOM 324 CA ARG A 22 8.474 14.297 -23.005 1.00 0.00 C ATOM 325 C ARG A 22 8.301 14.472 -24.514 1.00 0.00 C ATOM 326 O ARG A 22 8.627 15.525 -25.063 1.00 0.00 O ATOM 327 CB ARG A 22 9.920 13.892 -22.655 1.00 0.00 C ATOM 328 CG ARG A 22 10.559 13.051 -23.771 1.00 0.00 C ATOM 329 CD ARG A 22 11.286 13.968 -24.758 1.00 0.00 C ATOM 330 NE ARG A 22 12.728 13.762 -24.670 1.00 0.00 N ATOM 331 CZ ARG A 22 13.325 12.716 -25.245 1.00 0.00 C ATOM 332 NH1 ARG A 22 12.628 11.831 -25.912 1.00 0.00 N ATOM 333 NH2 ARG A 22 14.618 12.573 -25.140 1.00 0.00 N ATOM 0 H ARG A 22 7.940 12.417 -22.223 1.00 0.00 H new ATOM 0 HA ARG A 22 8.264 15.260 -22.540 1.00 0.00 H new ATOM 0 HB2 ARG A 22 10.518 14.787 -22.486 1.00 0.00 H new ATOM 0 HB3 ARG A 22 9.924 13.325 -21.724 1.00 0.00 H new ATOM 0 HG2 ARG A 22 11.259 12.334 -23.343 1.00 0.00 H new ATOM 0 HG3 ARG A 22 9.792 12.477 -24.291 1.00 0.00 H new ATOM 0 HD2 ARG A 22 10.944 13.766 -25.773 1.00 0.00 H new ATOM 0 HD3 ARG A 22 11.046 15.009 -24.542 1.00 0.00 H new ATOM 0 HE ARG A 22 13.295 14.436 -24.155 1.00 0.00 H new ATOM 0 HH11 ARG A 22 11.617 11.937 -25.997 1.00 0.00 H new ATOM 0 HH12 ARG A 22 13.096 11.036 -26.347 1.00 0.00 H new ATOM 0 HH21 ARG A 22 15.166 13.259 -24.621 1.00 0.00 H new ATOM 0 HH22 ARG A 22 15.080 11.776 -25.577 1.00 0.00 H new ATOM 347 N LEU A 23 7.786 13.444 -25.183 1.00 0.00 N ATOM 348 CA LEU A 23 7.583 13.525 -26.625 1.00 0.00 C ATOM 349 C LEU A 23 6.252 14.202 -26.942 1.00 0.00 C ATOM 350 O LEU A 23 6.089 14.796 -28.008 1.00 0.00 O ATOM 351 CB LEU A 23 7.651 12.130 -27.267 1.00 0.00 C ATOM 352 CG LEU A 23 6.337 11.370 -27.062 1.00 0.00 C ATOM 353 CD1 LEU A 23 5.460 11.504 -28.312 1.00 0.00 C ATOM 354 CD2 LEU A 23 6.647 9.890 -26.822 1.00 0.00 C ATOM 0 H LEU A 23 7.506 12.560 -24.758 1.00 0.00 H new ATOM 0 HA LEU A 23 8.385 14.130 -27.048 1.00 0.00 H new ATOM 0 HB2 LEU A 23 7.858 12.225 -28.333 1.00 0.00 H new ATOM 0 HB3 LEU A 23 8.475 11.564 -26.831 1.00 0.00 H new ATOM 0 HG LEU A 23 5.808 11.785 -26.204 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.527 10.962 -28.161 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.243 12.557 -28.493 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.986 11.089 -29.172 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.716 9.342 -26.675 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.174 9.484 -27.685 1.00 0.00 H new ATOM 0 HD23 LEU A 23 7.272 9.788 -25.934 1.00 0.00 H new ATOM 366 N ALA A 24 5.303 14.109 -26.015 1.00 0.00 N ATOM 367 CA ALA A 24 3.995 14.719 -26.219 1.00 0.00 C ATOM 368 C ALA A 24 4.132 16.226 -26.403 1.00 0.00 C ATOM 369 O ALA A 24 3.612 16.794 -27.363 1.00 0.00 O ATOM 370 CB ALA A 24 3.090 14.429 -25.021 1.00 0.00 C ATOM 0 H ALA A 24 5.414 13.623 -25.125 1.00 0.00 H new ATOM 0 HA ALA A 24 3.552 14.292 -27.119 1.00 0.00 H new ATOM 0 HB1 ALA A 24 2.115 14.889 -25.182 1.00 0.00 H new ATOM 0 HB2 ALA A 24 2.969 13.352 -24.909 1.00 0.00 H new ATOM 0 HB3 ALA A 24 3.540 14.840 -24.117 1.00 0.00 H new ATOM 376 N ASN A 25 4.836 16.869 -25.476 1.00 0.00 N ATOM 377 CA ASN A 25 5.035 18.311 -25.547 1.00 0.00 C ATOM 378 C ASN A 25 5.848 18.682 -26.783 1.00 0.00 C ATOM 379 O ASN A 25 5.564 19.677 -27.449 1.00 0.00 O ATOM 380 CB ASN A 25 5.761 18.797 -24.291 1.00 0.00 C ATOM 381 CG ASN A 25 4.830 18.715 -23.086 1.00 0.00 C ATOM 382 OD1 ASN A 25 3.609 18.742 -23.241 1.00 0.00 O ATOM 383 ND2 ASN A 25 5.337 18.613 -21.888 1.00 0.00 N ATOM 0 H ASN A 25 5.275 16.418 -24.673 1.00 0.00 H new ATOM 0 HA ASN A 25 4.059 18.791 -25.613 1.00 0.00 H new ATOM 0 HB2 ASN A 25 6.649 18.190 -24.117 1.00 0.00 H new ATOM 0 HB3 ASN A 25 6.099 19.824 -24.431 1.00 0.00 H new ATOM 0 HD21 ASN A 25 4.721 18.555 -21.077 1.00 0.00 H new ATOM 0 HD22 ASN A 25 6.349 18.591 -21.763 1.00 0.00 H new ATOM 390 N PHE A 26 6.862 17.876 -27.081 1.00 0.00 N ATOM 391 CA PHE A 26 7.711 18.131 -28.239 1.00 0.00 C ATOM 392 C PHE A 26 6.906 18.024 -29.530 1.00 0.00 C ATOM 393 O PHE A 26 7.133 18.775 -30.479 1.00 0.00 O ATOM 394 CB PHE A 26 8.870 17.131 -28.270 1.00 0.00 C ATOM 395 CG PHE A 26 9.774 17.443 -29.438 1.00 0.00 C ATOM 396 CD1 PHE A 26 10.701 18.488 -29.345 1.00 0.00 C ATOM 397 CD2 PHE A 26 9.685 16.688 -30.613 1.00 0.00 C ATOM 398 CE1 PHE A 26 11.539 18.778 -30.429 1.00 0.00 C ATOM 399 CE2 PHE A 26 10.523 16.978 -31.697 1.00 0.00 C ATOM 400 CZ PHE A 26 11.451 18.023 -31.604 1.00 0.00 C ATOM 0 H PHE A 26 7.114 17.048 -26.542 1.00 0.00 H new ATOM 0 HA PHE A 26 8.109 19.143 -28.157 1.00 0.00 H new ATOM 0 HB2 PHE A 26 9.432 17.181 -27.338 1.00 0.00 H new ATOM 0 HB3 PHE A 26 8.485 16.115 -28.356 1.00 0.00 H new ATOM 0 HD1 PHE A 26 10.770 19.070 -28.438 1.00 0.00 H new ATOM 0 HD2 PHE A 26 8.970 15.882 -30.684 1.00 0.00 H new ATOM 0 HE1 PHE A 26 12.254 19.585 -30.358 1.00 0.00 H new ATOM 0 HE2 PHE A 26 10.454 16.396 -32.604 1.00 0.00 H new ATOM 0 HZ PHE A 26 12.099 18.246 -32.439 1.00 0.00 H new ATOM 410 N LEU A 27 5.966 17.084 -29.560 1.00 0.00 N ATOM 411 CA LEU A 27 5.133 16.884 -30.739 1.00 0.00 C ATOM 412 C LEU A 27 4.424 18.185 -31.109 1.00 0.00 C ATOM 413 O LEU A 27 4.636 18.735 -32.190 1.00 0.00 O ATOM 414 CB LEU A 27 4.104 15.775 -30.439 1.00 0.00 C ATOM 415 CG LEU A 27 3.107 15.559 -31.601 1.00 0.00 C ATOM 416 CD1 LEU A 27 1.906 16.510 -31.466 1.00 0.00 C ATOM 417 CD2 LEU A 27 3.790 15.771 -32.961 1.00 0.00 C ATOM 0 H LEU A 27 5.763 16.452 -28.785 1.00 0.00 H new ATOM 0 HA LEU A 27 5.754 16.584 -31.583 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.630 14.842 -30.238 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.552 16.031 -29.535 1.00 0.00 H new ATOM 0 HG LEU A 27 2.753 14.530 -31.548 1.00 0.00 H new ATOM 0 HD11 LEU A 27 1.215 16.343 -32.293 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.395 16.319 -30.522 1.00 0.00 H new ATOM 0 HD13 LEU A 27 2.255 17.542 -31.487 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.066 15.613 -33.760 1.00 0.00 H new ATOM 0 HD22 LEU A 27 4.178 16.788 -33.019 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.611 15.063 -33.070 1.00 0.00 H new ATOM 429 N VAL A 28 3.579 18.671 -30.204 1.00 0.00 N ATOM 430 CA VAL A 28 2.838 19.903 -30.449 1.00 0.00 C ATOM 431 C VAL A 28 3.773 21.109 -30.517 1.00 0.00 C ATOM 432 O VAL A 28 3.407 22.158 -31.046 1.00 0.00 O ATOM 433 CB VAL A 28 1.807 20.121 -29.339 1.00 0.00 C ATOM 434 CG1 VAL A 28 0.860 18.921 -29.276 1.00 0.00 C ATOM 435 CG2 VAL A 28 2.525 20.274 -27.995 1.00 0.00 C ATOM 0 H VAL A 28 3.392 18.234 -29.301 1.00 0.00 H new ATOM 0 HA VAL A 28 2.333 19.804 -31.410 1.00 0.00 H new ATOM 0 HB VAL A 28 1.235 21.024 -29.550 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.126 19.078 -28.485 1.00 0.00 H new ATOM 0 HG12 VAL A 28 0.346 18.812 -30.231 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.432 18.017 -29.067 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.790 20.429 -27.205 1.00 0.00 H new ATOM 0 HG22 VAL A 28 3.099 19.372 -27.784 1.00 0.00 H new ATOM 0 HG23 VAL A 28 3.198 21.130 -28.037 1.00 0.00 H new ATOM 445 N HIS A 29 4.979 20.958 -29.974 1.00 0.00 N ATOM 446 CA HIS A 29 5.947 22.049 -29.977 1.00 0.00 C ATOM 447 C HIS A 29 6.738 22.086 -31.283 1.00 0.00 C ATOM 448 O HIS A 29 7.422 23.069 -31.570 1.00 0.00 O ATOM 449 CB HIS A 29 6.909 21.900 -28.797 1.00 0.00 C ATOM 450 CG HIS A 29 7.853 23.071 -28.768 1.00 0.00 C ATOM 451 ND1 HIS A 29 7.436 24.347 -28.425 1.00 0.00 N ATOM 452 CD2 HIS A 29 9.195 23.174 -29.037 1.00 0.00 C ATOM 453 CE1 HIS A 29 8.509 25.157 -28.495 1.00 0.00 C ATOM 454 NE2 HIS A 29 9.607 24.492 -28.864 1.00 0.00 N ATOM 0 H HIS A 29 5.306 20.099 -29.531 1.00 0.00 H new ATOM 0 HA HIS A 29 5.396 22.985 -29.884 1.00 0.00 H new ATOM 0 HB2 HIS A 29 6.350 21.847 -27.863 1.00 0.00 H new ATOM 0 HB3 HIS A 29 7.470 20.970 -28.886 1.00 0.00 H new ATOM 0 HD2 HIS A 29 9.834 22.357 -29.337 1.00 0.00 H new ATOM 0 HE1 HIS A 29 8.485 26.215 -28.279 1.00 0.00 H new ATOM 0 HE2 HIS A 29 10.546 24.869 -28.992 1.00 0.00 H new ATOM 463 N SER A 30 6.647 21.019 -32.075 1.00 0.00 N ATOM 464 CA SER A 30 7.367 20.958 -33.344 1.00 0.00 C ATOM 465 C SER A 30 6.566 21.617 -34.468 1.00 0.00 C ATOM 466 O SER A 30 6.820 21.367 -35.645 1.00 0.00 O ATOM 467 CB SER A 30 7.647 19.501 -33.709 1.00 0.00 C ATOM 468 OG SER A 30 8.355 19.453 -34.941 1.00 0.00 O ATOM 0 H SER A 30 6.087 20.193 -31.863 1.00 0.00 H new ATOM 0 HA SER A 30 8.306 21.500 -33.226 1.00 0.00 H new ATOM 0 HB2 SER A 30 8.230 19.023 -32.922 1.00 0.00 H new ATOM 0 HB3 SER A 30 6.711 18.949 -33.792 1.00 0.00 H new ATOM 0 HG SER A 30 7.884 19.992 -35.610 1.00 0.00 H new ATOM 474 N SER A 31 5.598 22.453 -34.106 1.00 0.00 N ATOM 475 CA SER A 31 4.776 23.131 -35.101 1.00 0.00 C ATOM 476 C SER A 31 5.636 24.010 -36.006 1.00 0.00 C ATOM 477 O SER A 31 5.382 24.124 -37.205 1.00 0.00 O ATOM 478 CB SER A 31 3.728 23.997 -34.402 1.00 0.00 C ATOM 479 OG SER A 31 2.933 24.654 -35.381 1.00 0.00 O ATOM 0 H SER A 31 5.365 22.676 -33.138 1.00 0.00 H new ATOM 0 HA SER A 31 4.283 22.375 -35.712 1.00 0.00 H new ATOM 0 HB2 SER A 31 3.099 23.380 -33.760 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.215 24.731 -33.760 1.00 0.00 H new ATOM 0 HG SER A 31 2.259 25.209 -34.936 1.00 0.00 H new ATOM 485 N ASN A 32 6.648 24.637 -35.416 1.00 0.00 N ATOM 486 CA ASN A 32 7.540 25.518 -36.166 1.00 0.00 C ATOM 487 C ASN A 32 8.614 24.721 -36.902 1.00 0.00 C ATOM 488 O ASN A 32 8.833 24.915 -38.097 1.00 0.00 O ATOM 489 CB ASN A 32 8.207 26.513 -35.216 1.00 0.00 C ATOM 490 CG ASN A 32 8.820 25.774 -34.031 1.00 0.00 C ATOM 491 OD1 ASN A 32 8.102 25.153 -33.247 1.00 0.00 O ATOM 492 ND2 ASN A 32 10.112 25.803 -33.853 1.00 0.00 N ATOM 0 H ASN A 32 6.872 24.553 -34.424 1.00 0.00 H new ATOM 0 HA ASN A 32 6.942 26.054 -36.903 1.00 0.00 H new ATOM 0 HB2 ASN A 32 8.979 27.072 -35.745 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.474 27.238 -34.863 1.00 0.00 H new ATOM 0 HD21 ASN A 32 10.529 25.311 -33.063 1.00 0.00 H new ATOM 0 HD22 ASN A 32 10.705 26.318 -34.504 1.00 0.00 H new ATOM 499 N ASN A 33 9.285 23.831 -36.180 1.00 0.00 N ATOM 500 CA ASN A 33 10.340 23.017 -36.775 1.00 0.00 C ATOM 501 C ASN A 33 9.803 22.183 -37.933 1.00 0.00 C ATOM 502 O ASN A 33 10.443 22.085 -38.980 1.00 0.00 O ATOM 503 CB ASN A 33 10.945 22.093 -35.715 1.00 0.00 C ATOM 504 CG ASN A 33 11.771 22.906 -34.725 1.00 0.00 C ATOM 505 OD1 ASN A 33 11.413 23.008 -33.552 1.00 0.00 O ATOM 506 ND2 ASN A 33 12.863 23.495 -35.130 1.00 0.00 N ATOM 0 H ASN A 33 9.120 23.655 -35.189 1.00 0.00 H new ATOM 0 HA ASN A 33 11.109 23.687 -37.160 1.00 0.00 H new ATOM 0 HB2 ASN A 33 10.152 21.561 -35.189 1.00 0.00 H new ATOM 0 HB3 ASN A 33 11.572 21.340 -36.192 1.00 0.00 H new ATOM 0 HD21 ASN A 33 13.421 24.041 -34.474 1.00 0.00 H new ATOM 0 HD22 ASN A 33 13.158 23.409 -36.103 1.00 0.00 H new ATOM 513 N PHE A 34 8.639 21.572 -37.734 1.00 0.00 N ATOM 514 CA PHE A 34 8.031 20.731 -38.762 1.00 0.00 C ATOM 515 C PHE A 34 8.085 21.398 -40.134 1.00 0.00 C ATOM 516 O PHE A 34 8.611 20.827 -41.089 1.00 0.00 O ATOM 517 CB PHE A 34 6.572 20.446 -38.398 1.00 0.00 C ATOM 518 CG PHE A 34 5.950 19.566 -39.456 1.00 0.00 C ATOM 519 CD1 PHE A 34 6.477 18.293 -39.706 1.00 0.00 C ATOM 520 CD2 PHE A 34 4.846 20.023 -40.186 1.00 0.00 C ATOM 521 CE1 PHE A 34 5.900 17.477 -40.687 1.00 0.00 C ATOM 522 CE2 PHE A 34 4.269 19.206 -41.167 1.00 0.00 C ATOM 523 CZ PHE A 34 4.796 17.934 -41.417 1.00 0.00 C ATOM 0 H PHE A 34 8.098 21.643 -36.872 1.00 0.00 H new ATOM 0 HA PHE A 34 8.596 19.800 -38.810 1.00 0.00 H new ATOM 0 HB2 PHE A 34 6.518 19.957 -37.425 1.00 0.00 H new ATOM 0 HB3 PHE A 34 6.018 21.381 -38.316 1.00 0.00 H new ATOM 0 HD1 PHE A 34 7.328 17.941 -39.142 1.00 0.00 H new ATOM 0 HD2 PHE A 34 4.439 21.005 -39.993 1.00 0.00 H new ATOM 0 HE1 PHE A 34 6.307 16.495 -40.880 1.00 0.00 H new ATOM 0 HE2 PHE A 34 3.417 19.558 -41.730 1.00 0.00 H new ATOM 0 HZ PHE A 34 4.351 17.304 -42.173 1.00 0.00 H new ATOM 533 N GLY A 35 7.533 22.603 -40.230 1.00 0.00 N ATOM 534 CA GLY A 35 7.525 23.320 -41.500 1.00 0.00 C ATOM 535 C GLY A 35 8.945 23.635 -41.959 1.00 0.00 C ATOM 536 O GLY A 35 9.226 23.693 -43.155 1.00 0.00 O ATOM 0 H GLY A 35 7.091 23.098 -39.455 1.00 0.00 H new ATOM 0 HA2 GLY A 35 7.019 22.721 -42.257 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.959 24.246 -41.396 1.00 0.00 H new ATOM 540 N ALA A 36 9.833 23.840 -40.992 1.00 0.00 N ATOM 541 CA ALA A 36 11.226 24.151 -41.294 1.00 0.00 C ATOM 542 C ALA A 36 11.898 22.979 -42.005 1.00 0.00 C ATOM 543 O ALA A 36 12.640 23.171 -42.968 1.00 0.00 O ATOM 544 CB ALA A 36 11.983 24.475 -40.005 1.00 0.00 C ATOM 0 H ALA A 36 9.615 23.797 -39.997 1.00 0.00 H new ATOM 0 HA ALA A 36 11.248 25.019 -41.953 1.00 0.00 H new ATOM 0 HB1 ALA A 36 13.022 24.706 -40.241 1.00 0.00 H new ATOM 0 HB2 ALA A 36 11.522 25.335 -39.519 1.00 0.00 H new ATOM 0 HB3 ALA A 36 11.945 23.616 -39.335 1.00 0.00 H new ATOM 550 N ILE A 37 11.634 21.768 -41.527 1.00 0.00 N ATOM 551 CA ILE A 37 12.221 20.577 -42.133 1.00 0.00 C ATOM 552 C ILE A 37 11.614 20.317 -43.508 1.00 0.00 C ATOM 553 O ILE A 37 12.330 20.013 -44.462 1.00 0.00 O ATOM 554 CB ILE A 37 11.999 19.362 -41.229 1.00 0.00 C ATOM 555 CG1 ILE A 37 13.049 19.359 -40.114 1.00 0.00 C ATOM 556 CG2 ILE A 37 12.126 18.077 -42.052 1.00 0.00 C ATOM 557 CD1 ILE A 37 12.541 20.181 -38.927 1.00 0.00 C ATOM 0 H ILE A 37 11.024 21.585 -40.730 1.00 0.00 H new ATOM 0 HA ILE A 37 13.291 20.745 -42.251 1.00 0.00 H new ATOM 0 HB ILE A 37 11.002 19.414 -40.792 1.00 0.00 H new ATOM 0 HG12 ILE A 37 13.256 18.336 -39.799 1.00 0.00 H new ATOM 0 HG13 ILE A 37 13.987 19.775 -40.483 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.967 17.214 -41.406 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.379 18.078 -42.846 1.00 0.00 H new ATOM 0 HG23 ILE A 37 13.122 18.023 -42.491 1.00 0.00 H new ATOM 0 HD11 ILE A 37 13.290 20.177 -38.135 1.00 0.00 H new ATOM 0 HD12 ILE A 37 12.356 21.206 -39.247 1.00 0.00 H new ATOM 0 HD13 ILE A 37 11.615 19.745 -38.553 1.00 0.00 H new ATOM 569 N LEU A 38 10.295 20.439 -43.609 1.00 0.00 N ATOM 570 CA LEU A 38 9.620 20.215 -44.882 1.00 0.00 C ATOM 571 C LEU A 38 10.130 21.209 -45.920 1.00 0.00 C ATOM 572 O LEU A 38 10.514 20.835 -47.029 1.00 0.00 O ATOM 573 CB LEU A 38 8.107 20.382 -44.704 1.00 0.00 C ATOM 574 CG LEU A 38 7.394 20.158 -46.041 1.00 0.00 C ATOM 575 CD1 LEU A 38 7.610 18.716 -46.505 1.00 0.00 C ATOM 576 CD2 LEU A 38 5.895 20.414 -45.863 1.00 0.00 C ATOM 0 H LEU A 38 9.679 20.688 -42.836 1.00 0.00 H new ATOM 0 HA LEU A 38 9.830 19.202 -45.224 1.00 0.00 H new ATOM 0 HB2 LEU A 38 7.739 19.672 -43.963 1.00 0.00 H new ATOM 0 HB3 LEU A 38 7.885 21.380 -44.327 1.00 0.00 H new ATOM 0 HG LEU A 38 7.799 20.842 -46.787 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.101 18.560 -47.456 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.677 18.530 -46.629 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.206 18.030 -45.761 1.00 0.00 H new ATOM 0 HD21 LEU A 38 5.384 20.256 -46.812 1.00 0.00 H new ATOM 0 HD22 LEU A 38 5.495 19.728 -45.116 1.00 0.00 H new ATOM 0 HD23 LEU A 38 5.738 21.441 -45.533 1.00 0.00 H new ATOM 588 N SER A 39 10.124 22.482 -45.540 1.00 0.00 N ATOM 589 CA SER A 39 10.581 23.548 -46.424 1.00 0.00 C ATOM 590 C SER A 39 11.935 23.198 -47.033 1.00 0.00 C ATOM 591 O SER A 39 12.259 23.629 -48.140 1.00 0.00 O ATOM 592 CB SER A 39 10.697 24.856 -45.642 1.00 0.00 C ATOM 593 OG SER A 39 9.414 25.229 -45.157 1.00 0.00 O ATOM 0 H SER A 39 9.807 22.801 -44.624 1.00 0.00 H new ATOM 0 HA SER A 39 9.854 23.665 -47.228 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.392 24.736 -44.811 1.00 0.00 H new ATOM 0 HB3 SER A 39 11.099 25.641 -46.282 1.00 0.00 H new ATOM 0 HG SER A 39 9.315 24.930 -44.229 1.00 0.00 H new ATOM 599 N SER A 40 12.722 22.417 -46.300 1.00 0.00 N ATOM 600 CA SER A 40 14.042 22.015 -46.773 1.00 0.00 C ATOM 601 C SER A 40 13.963 20.700 -47.543 1.00 0.00 C ATOM 602 O SER A 40 14.867 19.870 -47.463 1.00 0.00 O ATOM 603 CB SER A 40 14.994 21.857 -45.588 1.00 0.00 C ATOM 604 OG SER A 40 15.106 23.099 -44.906 1.00 0.00 O ATOM 0 H SER A 40 12.471 22.052 -45.381 1.00 0.00 H new ATOM 0 HA SER A 40 14.417 22.790 -47.442 1.00 0.00 H new ATOM 0 HB2 SER A 40 14.624 21.089 -44.909 1.00 0.00 H new ATOM 0 HB3 SER A 40 15.974 21.530 -45.935 1.00 0.00 H new ATOM 0 HG SER A 40 14.352 23.202 -44.288 1.00 0.00 H new ATOM 610 N THR A 41 12.876 20.516 -48.285 1.00 0.00 N ATOM 611 CA THR A 41 12.689 19.296 -49.063 1.00 0.00 C ATOM 612 C THR A 41 13.861 19.073 -50.017 1.00 0.00 C ATOM 613 O THR A 41 14.103 17.951 -50.462 1.00 0.00 O ATOM 614 CB THR A 41 11.388 19.382 -49.864 1.00 0.00 C ATOM 615 OG1 THR A 41 11.097 18.111 -50.428 1.00 0.00 O ATOM 616 CG2 THR A 41 11.540 20.416 -50.980 1.00 0.00 C ATOM 0 H THR A 41 12.115 21.191 -48.364 1.00 0.00 H new ATOM 0 HA THR A 41 12.638 18.456 -48.371 1.00 0.00 H new ATOM 0 HB THR A 41 10.574 19.682 -49.204 1.00 0.00 H new ATOM 0 HG1 THR A 41 10.217 17.810 -50.120 1.00 0.00 H new ATOM 0 HG21 THR A 41 10.612 20.476 -51.549 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.762 21.390 -50.545 1.00 0.00 H new ATOM 0 HG23 THR A 41 12.354 20.120 -51.642 1.00 0.00 H new ATOM 624 N ASN A 42 14.584 20.145 -50.332 1.00 0.00 N ATOM 625 CA ASN A 42 15.725 20.044 -51.237 1.00 0.00 C ATOM 626 C ASN A 42 16.984 19.589 -50.496 1.00 0.00 C ATOM 627 O ASN A 42 18.081 19.617 -51.054 1.00 0.00 O ATOM 628 CB ASN A 42 15.983 21.399 -51.899 1.00 0.00 C ATOM 629 CG ASN A 42 16.463 22.405 -50.859 1.00 0.00 C ATOM 630 OD1 ASN A 42 16.400 22.137 -49.659 1.00 0.00 O ATOM 631 ND2 ASN A 42 16.943 23.554 -51.250 1.00 0.00 N ATOM 0 H ASN A 42 14.403 21.084 -49.978 1.00 0.00 H new ATOM 0 HA ASN A 42 15.487 19.300 -51.997 1.00 0.00 H new ATOM 0 HB2 ASN A 42 16.730 21.292 -52.686 1.00 0.00 H new ATOM 0 HB3 ASN A 42 15.071 21.761 -52.373 1.00 0.00 H new ATOM 0 HD21 ASN A 42 17.267 24.232 -50.561 1.00 0.00 H new ATOM 0 HD22 ASN A 42 16.994 23.773 -52.245 1.00 0.00 H new ATOM 638 N VAL A 43 16.825 19.168 -49.243 1.00 0.00 N ATOM 639 CA VAL A 43 17.961 18.710 -48.452 1.00 0.00 C ATOM 640 C VAL A 43 18.252 17.236 -48.729 1.00 0.00 C ATOM 641 O VAL A 43 19.361 16.758 -48.492 1.00 0.00 O ATOM 642 CB VAL A 43 17.672 18.903 -46.963 1.00 0.00 C ATOM 643 CG1 VAL A 43 16.674 17.843 -46.493 1.00 0.00 C ATOM 644 CG2 VAL A 43 18.973 18.765 -46.169 1.00 0.00 C ATOM 0 H VAL A 43 15.928 19.135 -48.758 1.00 0.00 H new ATOM 0 HA VAL A 43 18.834 19.299 -48.733 1.00 0.00 H new ATOM 0 HB VAL A 43 17.250 19.895 -46.802 1.00 0.00 H new ATOM 0 HG11 VAL A 43 16.469 17.982 -45.431 1.00 0.00 H new ATOM 0 HG12 VAL A 43 15.747 17.941 -47.058 1.00 0.00 H new ATOM 0 HG13 VAL A 43 17.094 16.850 -46.655 1.00 0.00 H new ATOM 0 HG21 VAL A 43 18.768 18.903 -45.107 1.00 0.00 H new ATOM 0 HG22 VAL A 43 19.395 17.773 -46.332 1.00 0.00 H new ATOM 0 HG23 VAL A 43 19.684 19.521 -46.502 1.00 0.00 H new ATOM 654 N GLY A 44 17.248 16.520 -49.231 1.00 0.00 N ATOM 655 CA GLY A 44 17.410 15.102 -49.533 1.00 0.00 C ATOM 656 C GLY A 44 16.285 14.276 -48.912 1.00 0.00 C ATOM 657 O GLY A 44 16.437 13.075 -48.688 1.00 0.00 O ATOM 0 H GLY A 44 16.322 16.895 -49.435 1.00 0.00 H new ATOM 0 HA2 GLY A 44 17.419 14.956 -50.613 1.00 0.00 H new ATOM 0 HA3 GLY A 44 18.372 14.754 -49.156 1.00 0.00 H new ATOM 661 N SER A 45 15.157 14.926 -48.638 1.00 0.00 N ATOM 662 CA SER A 45 14.015 14.241 -48.046 1.00 0.00 C ATOM 663 C SER A 45 12.772 14.434 -48.910 1.00 0.00 C ATOM 664 O SER A 45 11.656 14.523 -48.399 1.00 0.00 O ATOM 665 CB SER A 45 13.751 14.784 -46.641 1.00 0.00 C ATOM 666 OG SER A 45 13.452 16.171 -46.722 1.00 0.00 O ATOM 0 H SER A 45 15.011 15.920 -48.816 1.00 0.00 H new ATOM 0 HA SER A 45 14.243 13.177 -47.986 1.00 0.00 H new ATOM 0 HB2 SER A 45 12.921 14.248 -46.181 1.00 0.00 H new ATOM 0 HB3 SER A 45 14.623 14.625 -46.007 1.00 0.00 H new ATOM 0 HG SER A 45 13.281 16.522 -45.823 1.00 0.00 H new ATOM 672 N ASN A 46 12.977 14.501 -50.221 1.00 0.00 N ATOM 673 CA ASN A 46 11.870 14.688 -51.152 1.00 0.00 C ATOM 674 C ASN A 46 11.336 13.342 -51.635 1.00 0.00 C ATOM 675 O ASN A 46 10.786 13.240 -52.732 1.00 0.00 O ATOM 676 CB ASN A 46 12.332 15.518 -52.352 1.00 0.00 C ATOM 677 CG ASN A 46 13.456 14.795 -53.086 1.00 0.00 C ATOM 678 OD1 ASN A 46 13.836 13.687 -52.707 1.00 0.00 O ATOM 679 ND2 ASN A 46 14.016 15.360 -54.122 1.00 0.00 N ATOM 0 H ASN A 46 13.894 14.429 -50.661 1.00 0.00 H new ATOM 0 HA ASN A 46 11.070 15.214 -50.632 1.00 0.00 H new ATOM 0 HB2 ASN A 46 11.496 15.689 -53.030 1.00 0.00 H new ATOM 0 HB3 ASN A 46 12.676 16.496 -52.017 1.00 0.00 H new ATOM 0 HD21 ASN A 46 14.769 14.883 -54.618 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.700 16.278 -54.435 1.00 0.00 H new ATOM 686 N THR A 47 11.505 12.312 -50.812 1.00 0.00 N ATOM 687 CA THR A 47 11.037 10.977 -51.168 1.00 0.00 C ATOM 688 C THR A 47 9.614 10.748 -50.664 1.00 0.00 C ATOM 689 O THR A 47 9.215 9.614 -50.398 1.00 0.00 O ATOM 690 CB THR A 47 11.966 9.920 -50.566 1.00 0.00 C ATOM 691 OG1 THR A 47 13.304 10.395 -50.597 1.00 0.00 O ATOM 692 CG2 THR A 47 11.861 8.626 -51.374 1.00 0.00 C ATOM 0 H THR A 47 11.959 12.375 -49.901 1.00 0.00 H new ATOM 0 HA THR A 47 11.042 10.893 -52.255 1.00 0.00 H new ATOM 0 HB THR A 47 11.675 9.724 -49.534 1.00 0.00 H new ATOM 0 HG1 THR A 47 13.900 9.720 -50.210 1.00 0.00 H new ATOM 0 HG21 THR A 47 12.523 7.874 -50.944 1.00 0.00 H new ATOM 0 HG22 THR A 47 10.834 8.263 -51.347 1.00 0.00 H new ATOM 0 HG23 THR A 47 12.151 8.817 -52.407 1.00 0.00 H new ATOM 700 N TYR A 48 8.851 11.830 -50.536 1.00 0.00 N ATOM 701 CA TYR A 48 7.475 11.730 -50.064 1.00 0.00 C ATOM 702 C TYR A 48 6.519 12.399 -51.048 1.00 0.00 C ATOM 703 O TYR A 48 5.436 12.844 -50.670 1.00 0.00 O ATOM 704 CB TYR A 48 7.345 12.393 -48.690 1.00 0.00 C ATOM 705 CG TYR A 48 7.569 13.881 -48.823 1.00 0.00 C ATOM 706 CD1 TYR A 48 6.475 14.753 -48.861 1.00 0.00 C ATOM 707 CD2 TYR A 48 8.871 14.387 -48.911 1.00 0.00 C ATOM 708 CE1 TYR A 48 6.683 16.132 -48.986 1.00 0.00 C ATOM 709 CE2 TYR A 48 9.079 15.765 -49.036 1.00 0.00 C ATOM 710 CZ TYR A 48 7.986 16.638 -49.073 1.00 0.00 C ATOM 711 OH TYR A 48 8.191 17.997 -49.197 1.00 0.00 O ATOM 0 H TYR A 48 9.160 12.778 -50.751 1.00 0.00 H new ATOM 0 HA TYR A 48 7.214 10.675 -49.984 1.00 0.00 H new ATOM 0 HB2 TYR A 48 6.356 12.200 -48.274 1.00 0.00 H new ATOM 0 HB3 TYR A 48 8.071 11.966 -47.999 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.470 14.362 -48.794 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.715 13.714 -48.882 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.839 16.805 -49.015 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.084 16.155 -49.104 1.00 0.00 H new ATOM 0 HH TYR A 48 7.354 18.431 -49.463 1.00 0.00 H new ATOM 721 N GLY A 49 6.928 12.465 -52.311 1.00 0.00 N ATOM 722 CA GLY A 49 6.099 13.083 -53.340 1.00 0.00 C ATOM 723 C GLY A 49 4.672 12.548 -53.288 1.00 0.00 C ATOM 724 O GLY A 49 4.447 11.340 -53.373 1.00 0.00 O ATOM 0 H GLY A 49 7.821 12.102 -52.645 1.00 0.00 H new ATOM 0 HA2 GLY A 49 6.091 14.164 -53.204 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.528 12.889 -54.323 1.00 0.00 H new ATOM 728 N LYS A 50 3.712 13.456 -53.148 1.00 0.00 N ATOM 729 CA LYS A 50 2.307 13.070 -53.085 1.00 0.00 C ATOM 730 C LYS A 50 1.851 12.475 -54.414 1.00 0.00 C ATOM 731 O LYS A 50 1.051 11.539 -54.444 1.00 0.00 O ATOM 732 CB LYS A 50 1.446 14.288 -52.747 1.00 0.00 C ATOM 733 CG LYS A 50 1.707 14.712 -51.300 1.00 0.00 C ATOM 734 CD LYS A 50 0.717 15.808 -50.899 1.00 0.00 C ATOM 735 CE LYS A 50 1.057 17.103 -51.639 1.00 0.00 C ATOM 736 NZ LYS A 50 2.445 17.523 -51.293 1.00 0.00 N ATOM 0 H LYS A 50 3.880 14.460 -53.076 1.00 0.00 H new ATOM 0 HA LYS A 50 2.193 12.316 -52.306 1.00 0.00 H new ATOM 0 HB2 LYS A 50 1.677 15.109 -53.425 1.00 0.00 H new ATOM 0 HB3 LYS A 50 0.391 14.050 -52.883 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.604 13.854 -50.635 1.00 0.00 H new ATOM 0 HG3 LYS A 50 2.729 15.076 -51.196 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -0.300 15.498 -51.137 1.00 0.00 H new ATOM 0 HD3 LYS A 50 0.757 15.972 -49.822 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.968 16.954 -52.715 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.350 17.887 -51.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.534 18.553 -51.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.651 17.264 -50.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 3.120 17.046 -51.924 1.00 0.00 H new ATOM 750 N ARG A 51 2.363 13.025 -55.509 1.00 0.00 N ATOM 751 CA ARG A 51 2.000 12.543 -56.838 1.00 0.00 C ATOM 752 C ARG A 51 2.441 11.094 -57.035 1.00 0.00 C ATOM 753 O ARG A 51 1.939 10.401 -57.919 1.00 0.00 O ATOM 754 CB ARG A 51 2.643 13.431 -57.909 1.00 0.00 C ATOM 755 CG ARG A 51 4.161 13.221 -57.916 1.00 0.00 C ATOM 756 CD ARG A 51 4.810 14.172 -58.927 1.00 0.00 C ATOM 757 NE ARG A 51 4.809 15.543 -58.414 1.00 0.00 N ATOM 758 CZ ARG A 51 3.844 16.420 -58.712 1.00 0.00 C ATOM 759 NH1 ARG A 51 2.829 16.083 -59.468 1.00 0.00 N ATOM 760 NH2 ARG A 51 3.916 17.635 -58.241 1.00 0.00 N ATOM 0 H ARG A 51 3.026 13.800 -55.505 1.00 0.00 H new ATOM 0 HA ARG A 51 0.915 12.587 -56.932 1.00 0.00 H new ATOM 0 HB2 ARG A 51 2.229 13.192 -58.889 1.00 0.00 H new ATOM 0 HB3 ARG A 51 2.413 14.478 -57.712 1.00 0.00 H new ATOM 0 HG2 ARG A 51 4.567 13.401 -56.921 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.394 12.188 -58.173 1.00 0.00 H new ATOM 0 HD2 ARG A 51 5.833 13.854 -59.130 1.00 0.00 H new ATOM 0 HD3 ARG A 51 4.270 14.131 -59.873 1.00 0.00 H new ATOM 0 HE ARG A 51 5.573 15.841 -57.807 1.00 0.00 H new ATOM 0 HH11 ARG A 51 2.764 15.136 -59.842 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.104 16.767 -59.683 1.00 0.00 H new ATOM 0 HH21 ARG A 51 4.703 17.908 -57.652 1.00 0.00 H new ATOM 0 HH22 ARG A 51 3.186 18.312 -58.462 1.00 0.00 H new ATOM 774 N ASN A 52 3.381 10.640 -56.211 1.00 0.00 N ATOM 775 CA ASN A 52 3.872 9.271 -56.316 1.00 0.00 C ATOM 776 C ASN A 52 2.842 8.287 -55.772 1.00 0.00 C ATOM 777 O ASN A 52 2.769 7.141 -56.216 1.00 0.00 O ATOM 778 CB ASN A 52 5.183 9.123 -55.542 1.00 0.00 C ATOM 779 CG ASN A 52 6.079 8.094 -56.224 1.00 0.00 C ATOM 780 OD1 ASN A 52 7.278 8.323 -56.383 1.00 0.00 O ATOM 781 ND2 ASN A 52 5.565 6.968 -56.638 1.00 0.00 N ATOM 0 H ASN A 52 3.814 11.193 -55.471 1.00 0.00 H new ATOM 0 HA ASN A 52 4.047 9.049 -57.369 1.00 0.00 H new ATOM 0 HB2 ASN A 52 5.694 10.084 -55.489 1.00 0.00 H new ATOM 0 HB3 ASN A 52 4.977 8.815 -54.517 1.00 0.00 H new ATOM 0 HD21 ASN A 52 6.157 6.275 -57.095 1.00 0.00 H new ATOM 0 HD22 ASN A 52 4.571 6.782 -56.505 1.00 0.00 H new ATOM 788 N ALA A 53 2.051 8.739 -54.805 1.00 0.00 N ATOM 789 CA ALA A 53 1.031 7.889 -54.202 1.00 0.00 C ATOM 790 C ALA A 53 0.044 7.388 -55.253 1.00 0.00 C ATOM 791 O ALA A 53 -0.361 6.226 -55.230 1.00 0.00 O ATOM 792 CB ALA A 53 0.276 8.670 -53.126 1.00 0.00 C ATOM 0 H ALA A 53 2.096 9.684 -54.424 1.00 0.00 H new ATOM 0 HA ALA A 53 1.527 7.028 -53.754 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -0.485 8.030 -52.679 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.975 8.996 -52.356 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.201 9.541 -53.576 1.00 0.00 H new ATOM 798 N VAL A 54 -0.347 8.269 -56.168 1.00 0.00 N ATOM 799 CA VAL A 54 -1.295 7.892 -57.212 1.00 0.00 C ATOM 800 C VAL A 54 -0.638 6.967 -58.235 1.00 0.00 C ATOM 801 O VAL A 54 -1.307 6.128 -58.838 1.00 0.00 O ATOM 802 CB VAL A 54 -1.843 9.142 -57.908 1.00 0.00 C ATOM 803 CG1 VAL A 54 -0.981 9.485 -59.126 1.00 0.00 C ATOM 804 CG2 VAL A 54 -3.282 8.879 -58.361 1.00 0.00 C ATOM 0 H VAL A 54 -0.028 9.237 -56.209 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.121 7.356 -56.744 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.822 9.979 -57.210 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.378 10.375 -59.614 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.043 9.674 -58.805 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -0.993 8.651 -59.827 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.675 9.766 -58.857 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.297 8.039 -59.055 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.899 8.644 -57.494 1.00 0.00 H new ATOM 814 N GLU A 55 0.668 7.120 -58.430 1.00 0.00 N ATOM 815 CA GLU A 55 1.382 6.282 -59.388 1.00 0.00 C ATOM 816 C GLU A 55 1.282 4.811 -58.994 1.00 0.00 C ATOM 817 O GLU A 55 0.898 3.968 -59.805 1.00 0.00 O ATOM 818 CB GLU A 55 2.853 6.697 -59.450 1.00 0.00 C ATOM 819 CG GLU A 55 2.971 8.059 -60.138 1.00 0.00 C ATOM 820 CD GLU A 55 2.580 7.935 -61.607 1.00 0.00 C ATOM 821 OE1 GLU A 55 2.679 6.841 -62.136 1.00 0.00 O ATOM 822 OE2 GLU A 55 2.189 8.938 -62.182 1.00 0.00 O ATOM 0 H GLU A 55 1.247 7.806 -57.945 1.00 0.00 H new ATOM 0 HA GLU A 55 0.925 6.415 -60.369 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.270 6.748 -58.444 1.00 0.00 H new ATOM 0 HB3 GLU A 55 3.430 5.951 -59.996 1.00 0.00 H new ATOM 0 HG2 GLU A 55 2.326 8.784 -59.641 1.00 0.00 H new ATOM 0 HG3 GLU A 55 3.992 8.431 -60.055 1.00 0.00 H new ATOM 829 N VAL A 56 1.629 4.509 -57.747 1.00 0.00 N ATOM 830 CA VAL A 56 1.570 3.133 -57.265 1.00 0.00 C ATOM 831 C VAL A 56 0.121 2.677 -57.122 1.00 0.00 C ATOM 832 O VAL A 56 -0.212 1.536 -57.444 1.00 0.00 O ATOM 833 CB VAL A 56 2.296 3.007 -55.921 1.00 0.00 C ATOM 834 CG1 VAL A 56 1.624 3.900 -54.877 1.00 0.00 C ATOM 835 CG2 VAL A 56 2.244 1.551 -55.451 1.00 0.00 C ATOM 0 H VAL A 56 1.951 5.189 -57.059 1.00 0.00 H new ATOM 0 HA VAL A 56 2.066 2.493 -57.994 1.00 0.00 H new ATOM 0 HB VAL A 56 3.333 3.319 -56.045 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.147 3.804 -53.925 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.661 4.938 -55.208 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.585 3.596 -54.753 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.760 1.459 -54.495 1.00 0.00 H new ATOM 0 HG22 VAL A 56 1.205 1.243 -55.334 1.00 0.00 H new ATOM 0 HG23 VAL A 56 2.730 0.913 -56.189 1.00 0.00 H new ATOM 845 N LEU A 57 -0.738 3.569 -56.640 1.00 0.00 N ATOM 846 CA LEU A 57 -2.149 3.241 -56.464 1.00 0.00 C ATOM 847 C LEU A 57 -2.749 2.704 -57.760 1.00 0.00 C ATOM 848 O LEU A 57 -3.453 1.695 -57.753 1.00 0.00 O ATOM 849 CB LEU A 57 -2.926 4.484 -56.022 1.00 0.00 C ATOM 850 CG LEU A 57 -3.336 4.335 -54.556 1.00 0.00 C ATOM 851 CD1 LEU A 57 -2.151 4.682 -53.652 1.00 0.00 C ATOM 852 CD2 LEU A 57 -4.501 5.282 -54.255 1.00 0.00 C ATOM 0 H LEU A 57 -0.485 4.518 -56.366 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.224 2.470 -55.697 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.311 5.375 -56.150 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -3.810 4.614 -56.646 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.643 3.306 -54.369 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.446 4.575 -52.608 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.321 4.008 -53.865 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.841 5.710 -53.838 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.795 5.177 -53.211 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -4.192 6.310 -54.444 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.347 5.034 -54.896 1.00 0.00 H new ATOM 864 N LYS A 58 -2.472 3.380 -58.871 1.00 0.00 N ATOM 865 CA LYS A 58 -3.003 2.945 -60.158 1.00 0.00 C ATOM 866 C LYS A 58 -2.388 1.609 -60.562 1.00 0.00 C ATOM 867 O LYS A 58 -3.072 0.736 -61.097 1.00 0.00 O ATOM 868 CB LYS A 58 -2.715 3.996 -61.233 1.00 0.00 C ATOM 869 CG LYS A 58 -3.582 5.234 -60.990 1.00 0.00 C ATOM 870 CD LYS A 58 -5.021 4.946 -61.425 1.00 0.00 C ATOM 871 CE LYS A 58 -5.832 6.242 -61.396 1.00 0.00 C ATOM 872 NZ LYS A 58 -5.955 6.720 -59.989 1.00 0.00 N ATOM 0 H LYS A 58 -1.892 4.218 -58.907 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.082 2.822 -60.062 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.660 4.270 -61.214 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.920 3.585 -62.221 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.558 5.506 -59.935 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.186 6.083 -61.547 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.031 4.521 -62.429 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -5.472 4.208 -60.762 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.346 7.002 -62.008 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.821 6.074 -61.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.904 7.119 -59.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.808 5.923 -59.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.239 7.452 -59.807 1.00 0.00 H new ATOM 886 N ARG A 59 -1.095 1.456 -60.296 1.00 0.00 N ATOM 887 CA ARG A 59 -0.396 0.220 -60.629 1.00 0.00 C ATOM 888 C ARG A 59 -0.931 -0.939 -59.792 1.00 0.00 C ATOM 889 O ARG A 59 -0.836 -2.100 -60.189 1.00 0.00 O ATOM 890 CB ARG A 59 1.105 0.384 -60.378 1.00 0.00 C ATOM 891 CG ARG A 59 1.861 -0.780 -61.021 1.00 0.00 C ATOM 892 CD ARG A 59 2.244 -1.798 -59.945 1.00 0.00 C ATOM 893 NE ARG A 59 2.933 -2.935 -60.548 1.00 0.00 N ATOM 894 CZ ARG A 59 3.347 -3.972 -59.818 1.00 0.00 C ATOM 895 NH1 ARG A 59 3.149 -4.004 -58.524 1.00 0.00 N ATOM 896 NH2 ARG A 59 3.957 -4.968 -60.401 1.00 0.00 N ATOM 0 H ARG A 59 -0.513 2.167 -59.854 1.00 0.00 H new ATOM 0 HA ARG A 59 -0.565 0.001 -61.683 1.00 0.00 H new ATOM 0 HB2 ARG A 59 1.452 1.330 -60.793 1.00 0.00 H new ATOM 0 HB3 ARG A 59 1.304 0.413 -59.307 1.00 0.00 H new ATOM 0 HG2 ARG A 59 1.240 -1.255 -61.781 1.00 0.00 H new ATOM 0 HG3 ARG A 59 2.756 -0.413 -61.524 1.00 0.00 H new ATOM 0 HD2 ARG A 59 2.887 -1.327 -59.201 1.00 0.00 H new ATOM 0 HD3 ARG A 59 1.350 -2.140 -59.423 1.00 0.00 H new ATOM 0 HE ARG A 59 3.102 -2.937 -61.554 1.00 0.00 H new ATOM 0 HH11 ARG A 59 2.673 -3.230 -58.062 1.00 0.00 H new ATOM 0 HH12 ARG A 59 3.471 -4.803 -57.978 1.00 0.00 H new ATOM 0 HH21 ARG A 59 4.114 -4.950 -61.409 1.00 0.00 H new ATOM 0 HH22 ARG A 59 4.276 -5.764 -59.849 1.00 0.00 H new ATOM 910 N GLU A 60 -1.492 -0.613 -58.631 1.00 0.00 N ATOM 911 CA GLU A 60 -2.039 -1.631 -57.741 1.00 0.00 C ATOM 912 C GLU A 60 -3.569 -1.614 -57.783 1.00 0.00 C ATOM 913 O GLU A 60 -4.205 -0.966 -56.952 1.00 0.00 O ATOM 914 CB GLU A 60 -1.572 -1.365 -56.308 1.00 0.00 C ATOM 915 CG GLU A 60 -0.061 -1.585 -56.212 1.00 0.00 C ATOM 916 CD GLU A 60 0.259 -3.070 -56.351 1.00 0.00 C ATOM 917 OE1 GLU A 60 -0.658 -3.866 -56.239 1.00 0.00 O ATOM 918 OE2 GLU A 60 1.417 -3.388 -56.565 1.00 0.00 O ATOM 0 H GLU A 60 -1.579 0.343 -58.286 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.686 -2.608 -58.071 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -1.820 -0.344 -56.017 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -2.091 -2.029 -55.616 1.00 0.00 H new ATOM 0 HG2 GLU A 60 0.448 -1.020 -56.993 1.00 0.00 H new ATOM 0 HG3 GLU A 60 0.309 -1.212 -55.257 1.00 0.00 H new ATOM 925 N PRO A 61 -4.175 -2.302 -58.724 1.00 0.00 N ATOM 926 CA PRO A 61 -5.664 -2.344 -58.848 1.00 0.00 C ATOM 927 C PRO A 61 -6.338 -2.994 -57.639 1.00 0.00 C ATOM 928 O PRO A 61 -7.562 -2.964 -57.515 1.00 0.00 O ATOM 929 CB PRO A 61 -5.915 -3.161 -60.120 1.00 0.00 C ATOM 930 CG PRO A 61 -4.662 -3.934 -60.359 1.00 0.00 C ATOM 931 CD PRO A 61 -3.521 -3.109 -59.769 1.00 0.00 C ATOM 0 HA PRO A 61 -6.087 -1.340 -58.895 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -6.768 -3.828 -59.995 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -6.140 -2.510 -60.965 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -4.716 -4.915 -59.886 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -4.508 -4.102 -61.425 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -2.740 -3.746 -59.353 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -3.050 -2.480 -60.524 1.00 0.00 H new ATOM 939 N LEU A 62 -5.541 -3.573 -56.746 1.00 0.00 N ATOM 940 CA LEU A 62 -6.090 -4.211 -55.556 1.00 0.00 C ATOM 941 C LEU A 62 -6.876 -3.198 -54.729 1.00 0.00 C ATOM 942 O LEU A 62 -7.960 -3.500 -54.230 1.00 0.00 O ATOM 943 CB LEU A 62 -4.963 -4.805 -54.710 1.00 0.00 C ATOM 944 CG LEU A 62 -5.561 -5.605 -53.552 1.00 0.00 C ATOM 945 CD1 LEU A 62 -4.798 -6.922 -53.392 1.00 0.00 C ATOM 946 CD2 LEU A 62 -5.450 -4.792 -52.260 1.00 0.00 C ATOM 0 H LEU A 62 -4.525 -3.613 -56.822 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.761 -5.011 -55.869 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.334 -5.449 -55.324 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -4.325 -4.009 -54.325 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.610 -5.816 -53.761 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.225 -7.492 -52.566 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.876 -7.502 -54.312 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.749 -6.712 -53.184 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -5.876 -5.361 -51.434 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -4.401 -4.581 -52.052 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.994 -3.854 -52.372 1.00 0.00 H new ATOM 958 N ASN A 63 -6.328 -1.994 -54.591 1.00 0.00 N ATOM 959 CA ASN A 63 -6.996 -0.947 -53.824 1.00 0.00 C ATOM 960 C ASN A 63 -8.116 -0.298 -54.641 1.00 0.00 C ATOM 961 O ASN A 63 -8.915 0.470 -54.105 1.00 0.00 O ATOM 962 CB ASN A 63 -5.984 0.122 -53.408 1.00 0.00 C ATOM 963 CG ASN A 63 -5.800 1.133 -54.535 1.00 0.00 C ATOM 964 OD1 ASN A 63 -6.452 2.263 -54.498 1.00 0.00 O flip ATOM 965 ND2 ASN A 63 -5.042 0.888 -55.473 1.00 0.00 N flip ATOM 0 H ASN A 63 -5.432 -1.721 -54.996 1.00 0.00 H new ATOM 0 HA ASN A 63 -7.433 -1.404 -52.936 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -6.328 0.629 -52.506 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -5.029 -0.344 -53.167 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -4.533 0.004 -55.500 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -4.922 1.569 -56.223 1.00 0.00 H new ATOM 972 N TYR A 64 -8.172 -0.606 -55.936 1.00 0.00 N ATOM 973 CA TYR A 64 -9.202 -0.040 -56.801 1.00 0.00 C ATOM 974 C TYR A 64 -10.549 -0.701 -56.532 1.00 0.00 C ATOM 975 O TYR A 64 -11.587 -0.039 -56.531 1.00 0.00 O ATOM 976 CB TYR A 64 -8.819 -0.243 -58.268 1.00 0.00 C ATOM 977 CG TYR A 64 -9.818 0.464 -59.153 1.00 0.00 C ATOM 978 CD1 TYR A 64 -9.745 1.852 -59.321 1.00 0.00 C ATOM 979 CD2 TYR A 64 -10.816 -0.269 -59.805 1.00 0.00 C ATOM 980 CE1 TYR A 64 -10.670 2.507 -60.141 1.00 0.00 C ATOM 981 CE2 TYR A 64 -11.742 0.387 -60.625 1.00 0.00 C ATOM 982 CZ TYR A 64 -11.669 1.775 -60.794 1.00 0.00 C ATOM 983 OH TYR A 64 -12.582 2.420 -61.602 1.00 0.00 O ATOM 0 H TYR A 64 -7.523 -1.238 -56.404 1.00 0.00 H new ATOM 0 HA TYR A 64 -9.283 1.026 -56.589 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -7.817 0.146 -58.450 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -8.796 -1.307 -58.505 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -8.975 2.417 -58.818 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -10.872 -1.340 -59.676 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -10.613 3.578 -60.270 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -12.513 -0.178 -61.128 1.00 0.00 H new ATOM 0 HH TYR A 64 -13.206 1.765 -61.979 1.00 0.00 H new ATOM 993 N LEU A 65 -10.526 -2.010 -56.303 1.00 0.00 N ATOM 994 CA LEU A 65 -11.753 -2.749 -56.033 1.00 0.00 C ATOM 995 C LEU A 65 -12.279 -2.412 -54.637 1.00 0.00 C ATOM 996 O LEU A 65 -11.525 -1.947 -53.783 1.00 0.00 O ATOM 997 CB LEU A 65 -11.484 -4.253 -56.133 1.00 0.00 C ATOM 998 CG LEU A 65 -11.121 -4.616 -57.575 1.00 0.00 C ATOM 999 CD1 LEU A 65 -10.603 -6.055 -57.623 1.00 0.00 C ATOM 1000 CD2 LEU A 65 -12.363 -4.492 -58.463 1.00 0.00 C ATOM 0 H LEU A 65 -9.678 -2.577 -56.299 1.00 0.00 H new ATOM 0 HA LEU A 65 -12.503 -2.465 -56.771 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -10.672 -4.533 -55.462 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -12.365 -4.812 -55.818 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.348 -3.938 -57.936 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.344 -6.314 -58.650 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -9.719 -6.145 -56.992 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.377 -6.732 -57.262 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -12.104 -4.751 -59.490 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -13.137 -5.170 -58.103 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -12.733 -3.467 -58.430 1.00 0.00 H new ATOM 1012 N PRO A 66 -13.547 -2.633 -54.389 1.00 0.00 N ATOM 1013 CA PRO A 66 -14.164 -2.339 -53.061 1.00 0.00 C ATOM 1014 C PRO A 66 -13.390 -2.985 -51.914 1.00 0.00 C ATOM 1015 O PRO A 66 -12.963 -4.135 -52.012 1.00 0.00 O ATOM 1016 CB PRO A 66 -15.572 -2.931 -53.169 1.00 0.00 C ATOM 1017 CG PRO A 66 -15.870 -2.980 -54.629 1.00 0.00 C ATOM 1018 CD PRO A 66 -14.531 -3.183 -55.336 1.00 0.00 C ATOM 0 HA PRO A 66 -14.164 -1.272 -52.840 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -15.615 -3.926 -52.726 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -16.299 -2.315 -52.640 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -16.557 -3.794 -54.858 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -16.348 -2.057 -54.959 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -14.343 -4.237 -55.541 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -14.501 -2.661 -56.293 1.00 0.00 H new ATOM 1026 N LEU A 67 -13.215 -2.236 -50.830 1.00 0.00 N ATOM 1027 CA LEU A 67 -12.491 -2.746 -49.671 1.00 0.00 C ATOM 1028 C LEU A 67 -12.879 -1.972 -48.414 1.00 0.00 C ATOM 1029 O LEU A 67 -13.853 -1.240 -48.470 1.00 0.00 O ATOM 1030 CB LEU A 67 -10.984 -2.626 -49.902 1.00 0.00 C ATOM 1031 CG LEU A 67 -10.391 -4.015 -50.144 1.00 0.00 C ATOM 1032 CD1 LEU A 67 -8.977 -3.876 -50.709 1.00 0.00 C ATOM 1033 CD2 LEU A 67 -10.337 -4.782 -48.821 1.00 0.00 C ATOM 0 H LEU A 67 -13.561 -1.282 -50.730 1.00 0.00 H new ATOM 0 HA LEU A 67 -12.754 -3.795 -49.534 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -10.787 -1.981 -50.758 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -10.509 -2.162 -49.038 1.00 0.00 H new ATOM 0 HG LEU A 67 -11.014 -4.557 -50.855 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -8.555 -4.866 -50.881 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -9.014 -3.328 -51.651 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.353 -3.334 -49.998 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -9.915 -5.772 -48.992 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.713 -4.239 -48.111 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -11.344 -4.882 -48.417 1.00 0.00 H new TER 1045 LEU A 67