USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1027 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 60 GLN : amide:sc= -3.93! C(o=-3.8!,f=-13!) USER MOD Set 1.2: A 108 THR OG1 : rot 48:sc= 0.163 USER MOD Set 2.1: A 48 ASN : amide:sc= -0.719 K(o=-0.41,f=-5.6!) USER MOD Set 2.2: A 50 SER OG : rot -42:sc= 0.937 USER MOD Set 2.3: A 111 HIS : no HD1:sc= -0.628 K(o=-0.41,f=-1.9!) USER MOD Set 3.1: A 17 LYS NZ :NH3+ 146:sc= -0.493 (180deg=-2.14!) USER MOD Set 3.2: A 27 ASN : amide:sc=-0.00126 X(o=-0.49,f=-0.51) USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.0959 (180deg=0) USER MOD Single : A 2 SER OG : rot 47:sc= 0.562 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0677 K(o=-0.068,f=-1.1!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.00532 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 HIS : no HD1:sc= -0.0717 X(o=-0.072,f=0) USER MOD Single : A 59 CYS SG : rot 140:sc= -0.595 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.0606 X(o=-0.061,f=0) USER MOD Single : A 70 GLN : amide:sc= -0.0448 K(o=-0.045,f=-1.8!) USER MOD Single : A 72 GLN : amide:sc= 0.00765 K(o=0.0076,f=-1.4) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -1.03! C(o=-1!,f=-6.3!) USER MOD Single : A 78 THR OG1 : rot -21:sc= 0.529 USER MOD Single : A 88 THR OG1 : rot 42:sc= 0.112 USER MOD Single : A 89 GLN : amide:sc= -3.82! C(o=-3.8!,f=-11!) USER MOD Single : A 95 ASN : amide:sc= -1.8! C(o=-1.8!,f=-1.1!) USER MOD Single : A 97 ASN : amide:sc= -0.0188 X(o=-0.019,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 TYR OH : rot 165:sc= 0 USER MOD Single : A 113 HIS : no HD1:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 114 GLN : amide:sc= -0.756 K(o=-0.76,f=-1.8!) USER MOD Single : A 115 SER OG : rot 33:sc= 0.879 USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 ASN : amide:sc= -1.37! K(o=-1.4!,f=-0.68) USER MOD Single : A 124 ASN : amide:sc= -1.83 K(o=-1.8,f=-8.4!) USER MOD Single : A 129 SER OG : rot -98:sc= 0.278 USER MOD Single : A 131 GLN : amide:sc= 0.137 X(o=0.14,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.613 -32.905 -4.071 1.00 0.00 N ATOM 2 CA GLY A 1 -14.428 -33.428 -3.415 1.00 0.00 C ATOM 3 C GLY A 1 -14.484 -33.273 -1.908 1.00 0.00 C ATOM 4 O GLY A 1 -15.426 -32.689 -1.372 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.083 -33.668 -4.599 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.266 -32.525 -3.356 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.340 -32.147 -4.728 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.314 -34.483 -3.665 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.547 -32.913 -3.798 1.00 0.00 H new ATOM 8 N SER A 2 -13.474 -33.798 -1.223 1.00 0.00 N ATOM 9 CA SER A 2 -13.414 -33.720 0.232 1.00 0.00 C ATOM 10 C SER A 2 -12.323 -32.753 0.680 1.00 0.00 C ATOM 11 O SER A 2 -11.181 -33.150 0.909 1.00 0.00 O ATOM 12 CB SER A 2 -13.159 -35.106 0.828 1.00 0.00 C ATOM 13 OG SER A 2 -11.983 -35.684 0.289 1.00 0.00 O ATOM 0 H SER A 2 -12.685 -34.282 -1.652 1.00 0.00 H new ATOM 0 HA SER A 2 -14.374 -33.349 0.591 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.066 -35.028 1.911 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.012 -35.754 0.627 1.00 0.00 H new ATOM 0 HG SER A 2 -11.260 -35.023 0.298 1.00 0.00 H new ATOM 19 N SER A 3 -12.684 -31.479 0.803 1.00 0.00 N ATOM 20 CA SER A 3 -11.736 -30.453 1.220 1.00 0.00 C ATOM 21 C SER A 3 -12.220 -29.747 2.483 1.00 0.00 C ATOM 22 O SER A 3 -12.940 -28.752 2.415 1.00 0.00 O ATOM 23 CB SER A 3 -11.532 -29.432 0.099 1.00 0.00 C ATOM 24 OG SER A 3 -10.475 -29.823 -0.760 1.00 0.00 O ATOM 0 H SER A 3 -13.626 -31.133 0.620 1.00 0.00 H new ATOM 0 HA SER A 3 -10.785 -30.939 1.438 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.453 -29.329 -0.475 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.313 -28.454 0.528 1.00 0.00 H new ATOM 0 HG SER A 3 -10.366 -29.155 -1.469 1.00 0.00 H new ATOM 30 N GLY A 4 -11.818 -30.271 3.637 1.00 0.00 N ATOM 31 CA GLY A 4 -12.220 -29.681 4.901 1.00 0.00 C ATOM 32 C GLY A 4 -11.350 -28.502 5.292 1.00 0.00 C ATOM 33 O GLY A 4 -10.207 -28.391 4.848 1.00 0.00 O ATOM 0 H GLY A 4 -11.221 -31.094 3.719 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.258 -29.356 4.833 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.174 -30.438 5.683 1.00 0.00 H new ATOM 37 N SER A 5 -11.892 -27.619 6.124 1.00 0.00 N ATOM 38 CA SER A 5 -11.160 -26.440 6.571 1.00 0.00 C ATOM 39 C SER A 5 -10.655 -26.623 7.999 1.00 0.00 C ATOM 40 O SER A 5 -9.463 -26.481 8.271 1.00 0.00 O ATOM 41 CB SER A 5 -12.050 -25.199 6.487 1.00 0.00 C ATOM 42 OG SER A 5 -11.277 -24.012 6.531 1.00 0.00 O ATOM 0 H SER A 5 -12.836 -27.698 6.502 1.00 0.00 H new ATOM 0 HA SER A 5 -10.300 -26.306 5.915 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.629 -25.225 5.564 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.763 -25.203 7.311 1.00 0.00 H new ATOM 0 HG SER A 5 -11.869 -23.233 6.474 1.00 0.00 H new ATOM 48 N SER A 6 -11.572 -26.938 8.908 1.00 0.00 N ATOM 49 CA SER A 6 -11.222 -27.136 10.310 1.00 0.00 C ATOM 50 C SER A 6 -9.918 -27.916 10.439 1.00 0.00 C ATOM 51 O SER A 6 -9.771 -29.000 9.876 1.00 0.00 O ATOM 52 CB SER A 6 -12.346 -27.876 11.038 1.00 0.00 C ATOM 53 OG SER A 6 -12.024 -28.076 12.404 1.00 0.00 O ATOM 0 H SER A 6 -12.563 -27.062 8.699 1.00 0.00 H new ATOM 0 HA SER A 6 -11.086 -26.156 10.767 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.272 -27.306 10.959 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.522 -28.839 10.558 1.00 0.00 H new ATOM 0 HG SER A 6 -12.759 -28.549 12.847 1.00 0.00 H new ATOM 59 N GLY A 7 -8.971 -27.356 11.186 1.00 0.00 N ATOM 60 CA GLY A 7 -7.691 -28.011 11.376 1.00 0.00 C ATOM 61 C GLY A 7 -6.740 -27.192 12.227 1.00 0.00 C ATOM 62 O GLY A 7 -7.153 -26.321 12.993 1.00 0.00 O ATOM 0 H GLY A 7 -9.068 -26.460 11.663 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.849 -28.982 11.846 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.234 -28.198 10.404 1.00 0.00 H new ATOM 66 N PRO A 8 -5.435 -27.470 12.098 1.00 0.00 N ATOM 67 CA PRO A 8 -4.396 -26.764 12.854 1.00 0.00 C ATOM 68 C PRO A 8 -4.232 -25.317 12.401 1.00 0.00 C ATOM 69 O PRO A 8 -4.447 -24.978 11.238 1.00 0.00 O ATOM 70 CB PRO A 8 -3.129 -27.566 12.550 1.00 0.00 C ATOM 71 CG PRO A 8 -3.395 -28.212 11.234 1.00 0.00 C ATOM 72 CD PRO A 8 -4.872 -28.496 11.203 1.00 0.00 C ATOM 0 HA PRO A 8 -4.634 -26.704 13.916 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -2.253 -26.919 12.503 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.936 -28.309 13.324 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.106 -27.557 10.412 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.819 -29.131 11.127 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.276 -28.415 10.194 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -5.095 -29.503 11.555 1.00 0.00 H new ATOM 80 N PRO A 9 -3.843 -24.443 13.341 1.00 0.00 N ATOM 81 CA PRO A 9 -3.641 -23.018 13.062 1.00 0.00 C ATOM 82 C PRO A 9 -2.420 -22.767 12.183 1.00 0.00 C ATOM 83 O PRO A 9 -1.277 -22.977 12.592 1.00 0.00 O ATOM 84 CB PRO A 9 -3.434 -22.410 14.451 1.00 0.00 C ATOM 85 CG PRO A 9 -2.917 -23.533 15.283 1.00 0.00 C ATOM 86 CD PRO A 9 -3.569 -24.778 14.749 1.00 0.00 C ATOM 0 HA PRO A 9 -4.479 -22.587 12.514 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -2.726 -21.582 14.419 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -4.367 -22.016 14.854 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -1.831 -23.601 15.215 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -3.162 -23.385 16.335 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -2.913 -25.644 14.836 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -4.484 -25.016 15.291 1.00 0.00 H new ATOM 94 N PRO A 10 -2.664 -22.307 10.947 1.00 0.00 N ATOM 95 CA PRO A 10 -1.596 -22.017 9.986 1.00 0.00 C ATOM 96 C PRO A 10 -0.774 -20.796 10.383 1.00 0.00 C ATOM 97 O PRO A 10 -0.940 -20.253 11.475 1.00 0.00 O ATOM 98 CB PRO A 10 -2.355 -21.749 8.683 1.00 0.00 C ATOM 99 CG PRO A 10 -3.705 -21.295 9.118 1.00 0.00 C ATOM 100 CD PRO A 10 -4.001 -22.035 10.393 1.00 0.00 C ATOM 0 HA PRO A 10 -0.877 -22.833 9.917 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -1.856 -20.988 8.083 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -2.418 -22.648 8.070 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -3.721 -20.217 9.280 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -4.454 -21.514 8.357 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -4.604 -21.436 11.075 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -4.553 -22.956 10.204 1.00 0.00 H new ATOM 108 N ALA A 11 0.113 -20.369 9.491 1.00 0.00 N ATOM 109 CA ALA A 11 0.960 -19.211 9.748 1.00 0.00 C ATOM 110 C ALA A 11 0.729 -18.120 8.708 1.00 0.00 C ATOM 111 O ALA A 11 1.278 -18.155 7.606 1.00 0.00 O ATOM 112 CB ALA A 11 2.424 -19.622 9.770 1.00 0.00 C ATOM 0 H ALA A 11 0.264 -20.808 8.583 1.00 0.00 H new ATOM 0 HA ALA A 11 0.694 -18.807 10.725 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.045 -18.747 9.963 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.583 -20.360 10.556 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.695 -20.054 8.807 1.00 0.00 H new ATOM 118 N PRO A 12 -0.102 -17.129 9.062 1.00 0.00 N ATOM 119 CA PRO A 12 -0.424 -16.010 8.172 1.00 0.00 C ATOM 120 C PRO A 12 0.762 -15.074 7.965 1.00 0.00 C ATOM 121 O PRO A 12 1.900 -15.419 8.286 1.00 0.00 O ATOM 122 CB PRO A 12 -1.555 -15.286 8.907 1.00 0.00 C ATOM 123 CG PRO A 12 -1.355 -15.631 10.342 1.00 0.00 C ATOM 124 CD PRO A 12 -0.791 -17.024 10.359 1.00 0.00 C ATOM 0 HA PRO A 12 -0.696 -16.349 7.172 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -1.505 -14.209 8.748 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -2.532 -15.615 8.553 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -0.673 -14.928 10.821 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -2.297 -15.585 10.889 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -0.103 -17.169 11.192 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.576 -17.774 10.459 1.00 0.00 H new ATOM 132 N ILE A 13 0.489 -13.889 7.429 1.00 0.00 N ATOM 133 CA ILE A 13 1.534 -12.903 7.182 1.00 0.00 C ATOM 134 C ILE A 13 1.499 -11.792 8.226 1.00 0.00 C ATOM 135 O ILE A 13 0.511 -11.073 8.371 1.00 0.00 O ATOM 136 CB ILE A 13 1.399 -12.280 5.780 1.00 0.00 C ATOM 137 CG1 ILE A 13 1.232 -13.375 4.725 1.00 0.00 C ATOM 138 CG2 ILE A 13 2.611 -11.415 5.467 1.00 0.00 C ATOM 139 CD1 ILE A 13 -0.210 -13.753 4.469 1.00 0.00 C ATOM 0 H ILE A 13 -0.447 -13.588 7.157 1.00 0.00 H new ATOM 0 HA ILE A 13 2.487 -13.429 7.247 1.00 0.00 H new ATOM 0 HB ILE A 13 0.511 -11.648 5.763 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.683 -13.040 3.791 1.00 0.00 H new ATOM 0 HG13 ILE A 13 1.780 -14.262 5.043 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.502 -10.981 4.473 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.688 -10.616 6.205 1.00 0.00 H new ATOM 0 HG23 ILE A 13 3.513 -12.027 5.499 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.252 -14.534 3.710 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.660 -14.119 5.392 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.759 -12.878 4.120 1.00 0.00 H new ATOM 151 N PRO A 14 2.605 -11.646 8.971 1.00 0.00 N ATOM 152 CA PRO A 14 2.727 -10.623 10.013 1.00 0.00 C ATOM 153 C PRO A 14 2.812 -9.214 9.436 1.00 0.00 C ATOM 154 O PRO A 14 3.156 -9.032 8.268 1.00 0.00 O ATOM 155 CB PRO A 14 4.035 -10.990 10.720 1.00 0.00 C ATOM 156 CG PRO A 14 4.824 -11.730 9.695 1.00 0.00 C ATOM 157 CD PRO A 14 3.821 -12.468 8.853 1.00 0.00 C ATOM 0 HA PRO A 14 1.859 -10.609 10.672 1.00 0.00 H new ATOM 0 HB2 PRO A 14 4.564 -10.100 11.061 1.00 0.00 H new ATOM 0 HB3 PRO A 14 3.850 -11.607 11.599 1.00 0.00 H new ATOM 0 HG2 PRO A 14 5.414 -11.044 9.087 1.00 0.00 H new ATOM 0 HG3 PRO A 14 5.523 -12.422 10.165 1.00 0.00 H new ATOM 0 HD2 PRO A 14 4.150 -12.552 7.817 1.00 0.00 H new ATOM 0 HD3 PRO A 14 3.658 -13.482 9.219 1.00 0.00 H new ATOM 165 N ASP A 15 2.497 -8.221 10.260 1.00 0.00 N ATOM 166 CA ASP A 15 2.540 -6.828 9.831 1.00 0.00 C ATOM 167 C ASP A 15 3.888 -6.495 9.200 1.00 0.00 C ATOM 168 O ASP A 15 4.917 -7.061 9.572 1.00 0.00 O ATOM 169 CB ASP A 15 2.274 -5.899 11.016 1.00 0.00 C ATOM 170 CG ASP A 15 0.831 -5.950 11.480 1.00 0.00 C ATOM 171 OD1 ASP A 15 -0.069 -5.980 10.614 1.00 0.00 O ATOM 172 OD2 ASP A 15 0.601 -5.959 12.707 1.00 0.00 O ATOM 0 H ASP A 15 2.209 -8.355 11.229 1.00 0.00 H new ATOM 0 HA ASP A 15 1.762 -6.680 9.082 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.928 -6.174 11.843 1.00 0.00 H new ATOM 0 HB3 ASP A 15 2.527 -4.876 10.736 1.00 0.00 H new ATOM 177 N LEU A 16 3.875 -5.574 8.243 1.00 0.00 N ATOM 178 CA LEU A 16 5.097 -5.165 7.558 1.00 0.00 C ATOM 179 C LEU A 16 5.125 -3.654 7.350 1.00 0.00 C ATOM 180 O LEU A 16 4.334 -3.108 6.581 1.00 0.00 O ATOM 181 CB LEU A 16 5.213 -5.879 6.211 1.00 0.00 C ATOM 182 CG LEU A 16 6.591 -5.841 5.547 1.00 0.00 C ATOM 183 CD1 LEU A 16 6.993 -4.408 5.236 1.00 0.00 C ATOM 184 CD2 LEU A 16 7.630 -6.507 6.437 1.00 0.00 C ATOM 0 H LEU A 16 3.032 -5.096 7.924 1.00 0.00 H new ATOM 0 HA LEU A 16 5.945 -5.443 8.184 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.927 -6.922 6.349 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.489 -5.438 5.525 1.00 0.00 H new ATOM 0 HG LEU A 16 6.537 -6.394 4.609 1.00 0.00 H new ATOM 0 HD11 LEU A 16 7.976 -4.400 4.764 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.262 -3.964 4.560 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.030 -3.832 6.160 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.604 -6.471 5.949 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.682 -5.982 7.391 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.349 -7.546 6.610 1.00 0.00 H new ATOM 196 N LYS A 17 6.043 -2.984 8.038 1.00 0.00 N ATOM 197 CA LYS A 17 6.178 -1.537 7.927 1.00 0.00 C ATOM 198 C LYS A 17 6.852 -1.152 6.614 1.00 0.00 C ATOM 199 O LYS A 17 7.784 -1.819 6.165 1.00 0.00 O ATOM 200 CB LYS A 17 6.984 -0.987 9.106 1.00 0.00 C ATOM 201 CG LYS A 17 6.697 0.473 9.411 1.00 0.00 C ATOM 202 CD LYS A 17 5.572 0.622 10.421 1.00 0.00 C ATOM 203 CE LYS A 17 5.734 1.885 11.253 1.00 0.00 C ATOM 204 NZ LYS A 17 4.420 2.430 11.695 1.00 0.00 N ATOM 0 H LYS A 17 6.705 -3.421 8.679 1.00 0.00 H new ATOM 0 HA LYS A 17 5.179 -1.102 7.943 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.769 -1.584 9.992 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.047 -1.103 8.894 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.599 0.949 9.797 1.00 0.00 H new ATOM 0 HG3 LYS A 17 6.431 0.992 8.490 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.615 0.648 9.900 1.00 0.00 H new ATOM 0 HD3 LYS A 17 5.554 -0.248 11.078 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.350 1.668 12.126 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.262 2.639 10.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.522 2.861 12.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.097 3.150 11.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 3.722 1.660 11.741 1.00 0.00 H new ATOM 218 N VAL A 18 6.376 -0.072 6.003 1.00 0.00 N ATOM 219 CA VAL A 18 6.934 0.402 4.743 1.00 0.00 C ATOM 220 C VAL A 18 7.391 1.852 4.856 1.00 0.00 C ATOM 221 O VAL A 18 8.260 2.301 4.107 1.00 0.00 O ATOM 222 CB VAL A 18 5.912 0.285 3.597 1.00 0.00 C ATOM 223 CG1 VAL A 18 5.382 -1.137 3.496 1.00 0.00 C ATOM 224 CG2 VAL A 18 4.773 1.274 3.796 1.00 0.00 C ATOM 0 H VAL A 18 5.605 0.491 6.361 1.00 0.00 H new ATOM 0 HA VAL A 18 7.793 -0.231 4.519 1.00 0.00 H new ATOM 0 HB VAL A 18 6.414 0.527 2.660 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.661 -1.200 2.681 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.209 -1.821 3.303 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.896 -1.411 4.432 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.060 1.178 2.977 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.271 1.065 4.741 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.171 2.289 3.813 1.00 0.00 H new ATOM 234 N PHE A 19 6.801 2.582 5.797 1.00 0.00 N ATOM 235 CA PHE A 19 7.147 3.982 6.008 1.00 0.00 C ATOM 236 C PHE A 19 6.966 4.372 7.472 1.00 0.00 C ATOM 237 O PHE A 19 6.006 3.958 8.121 1.00 0.00 O ATOM 238 CB PHE A 19 6.286 4.882 5.119 1.00 0.00 C ATOM 239 CG PHE A 19 6.850 6.262 4.936 1.00 0.00 C ATOM 240 CD1 PHE A 19 7.946 6.473 4.116 1.00 0.00 C ATOM 241 CD2 PHE A 19 6.285 7.347 5.586 1.00 0.00 C ATOM 242 CE1 PHE A 19 8.468 7.741 3.945 1.00 0.00 C ATOM 243 CE2 PHE A 19 6.803 8.618 5.419 1.00 0.00 C ATOM 244 CZ PHE A 19 7.896 8.815 4.599 1.00 0.00 C ATOM 0 H PHE A 19 6.081 2.227 6.426 1.00 0.00 H new ATOM 0 HA PHE A 19 8.195 4.115 5.741 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.173 4.412 4.142 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.289 4.960 5.553 1.00 0.00 H new ATOM 0 HD1 PHE A 19 8.398 5.636 3.604 1.00 0.00 H new ATOM 0 HD2 PHE A 19 5.431 7.199 6.230 1.00 0.00 H new ATOM 0 HE1 PHE A 19 9.322 7.892 3.301 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.353 9.456 5.930 1.00 0.00 H new ATOM 0 HZ PHE A 19 8.303 9.807 4.469 1.00 0.00 H new ATOM 254 N GLU A 20 7.897 5.172 7.985 1.00 0.00 N ATOM 255 CA GLU A 20 7.841 5.616 9.372 1.00 0.00 C ATOM 256 C GLU A 20 8.297 7.067 9.497 1.00 0.00 C ATOM 257 O GLU A 20 9.477 7.375 9.328 1.00 0.00 O ATOM 258 CB GLU A 20 8.712 4.719 10.254 1.00 0.00 C ATOM 259 CG GLU A 20 8.580 5.012 11.739 1.00 0.00 C ATOM 260 CD GLU A 20 9.303 3.995 12.601 1.00 0.00 C ATOM 261 OE1 GLU A 20 9.283 2.797 12.250 1.00 0.00 O ATOM 262 OE2 GLU A 20 9.891 4.399 13.626 1.00 0.00 O ATOM 0 H GLU A 20 8.698 5.525 7.461 1.00 0.00 H new ATOM 0 HA GLU A 20 6.806 5.548 9.707 1.00 0.00 H new ATOM 0 HB2 GLU A 20 8.446 3.678 10.073 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.755 4.838 9.960 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.977 6.006 11.946 1.00 0.00 H new ATOM 0 HG3 GLU A 20 7.524 5.027 12.010 1.00 0.00 H new ATOM 269 N ARG A 21 7.353 7.954 9.794 1.00 0.00 N ATOM 270 CA ARG A 21 7.656 9.373 9.940 1.00 0.00 C ATOM 271 C ARG A 21 7.426 9.833 11.377 1.00 0.00 C ATOM 272 O ARG A 21 6.584 9.284 12.087 1.00 0.00 O ATOM 273 CB ARG A 21 6.795 10.201 8.984 1.00 0.00 C ATOM 274 CG ARG A 21 7.183 11.670 8.933 1.00 0.00 C ATOM 275 CD ARG A 21 6.894 12.275 7.568 1.00 0.00 C ATOM 276 NE ARG A 21 7.896 11.894 6.577 1.00 0.00 N ATOM 277 CZ ARG A 21 9.077 12.492 6.458 1.00 0.00 C ATOM 278 NH1 ARG A 21 9.400 13.493 7.265 1.00 0.00 N ATOM 279 NH2 ARG A 21 9.936 12.087 5.532 1.00 0.00 N ATOM 0 H ARG A 21 6.372 7.715 9.938 1.00 0.00 H new ATOM 0 HA ARG A 21 8.707 9.522 9.693 1.00 0.00 H new ATOM 0 HB2 ARG A 21 6.871 9.779 7.982 1.00 0.00 H new ATOM 0 HB3 ARG A 21 5.751 10.120 9.286 1.00 0.00 H new ATOM 0 HG2 ARG A 21 6.635 12.219 9.699 1.00 0.00 H new ATOM 0 HG3 ARG A 21 8.243 11.776 9.162 1.00 0.00 H new ATOM 0 HD2 ARG A 21 5.909 11.953 7.230 1.00 0.00 H new ATOM 0 HD3 ARG A 21 6.862 13.361 7.652 1.00 0.00 H new ATOM 0 HE ARG A 21 7.678 11.127 5.941 1.00 0.00 H new ATOM 0 HH11 ARG A 21 8.742 13.805 7.979 1.00 0.00 H new ATOM 0 HH12 ARG A 21 10.307 13.951 7.172 1.00 0.00 H new ATOM 0 HH21 ARG A 21 9.690 11.316 4.911 1.00 0.00 H new ATOM 0 HH22 ARG A 21 10.842 12.546 5.441 1.00 0.00 H new ATOM 293 N GLU A 22 8.182 10.842 11.797 1.00 0.00 N ATOM 294 CA GLU A 22 8.061 11.374 13.149 1.00 0.00 C ATOM 295 C GLU A 22 6.600 11.646 13.499 1.00 0.00 C ATOM 296 O GLU A 22 6.241 11.754 14.670 1.00 0.00 O ATOM 297 CB GLU A 22 8.878 12.660 13.291 1.00 0.00 C ATOM 298 CG GLU A 22 8.435 13.769 12.351 1.00 0.00 C ATOM 299 CD GLU A 22 8.759 13.469 10.900 1.00 0.00 C ATOM 300 OE1 GLU A 22 9.777 12.791 10.648 1.00 0.00 O ATOM 301 OE2 GLU A 22 7.995 13.911 10.018 1.00 0.00 O ATOM 0 H GLU A 22 8.884 11.307 11.221 1.00 0.00 H new ATOM 0 HA GLU A 22 8.450 10.627 13.841 1.00 0.00 H new ATOM 0 HB2 GLU A 22 8.805 13.015 14.319 1.00 0.00 H new ATOM 0 HB3 GLU A 22 9.928 12.436 13.105 1.00 0.00 H new ATOM 0 HG2 GLU A 22 7.361 13.921 12.455 1.00 0.00 H new ATOM 0 HG3 GLU A 22 8.919 14.701 12.642 1.00 0.00 H new ATOM 308 N GLY A 23 5.763 11.757 12.472 1.00 0.00 N ATOM 309 CA GLY A 23 4.352 12.017 12.690 1.00 0.00 C ATOM 310 C GLY A 23 3.462 11.033 11.956 1.00 0.00 C ATOM 311 O GLY A 23 2.514 10.496 12.529 1.00 0.00 O ATOM 0 H GLY A 23 6.037 11.672 11.493 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.138 11.970 13.758 1.00 0.00 H new ATOM 0 HA3 GLY A 23 4.117 13.030 12.362 1.00 0.00 H new ATOM 315 N VAL A 24 3.766 10.797 10.684 1.00 0.00 N ATOM 316 CA VAL A 24 2.986 9.872 9.870 1.00 0.00 C ATOM 317 C VAL A 24 3.543 8.456 9.962 1.00 0.00 C ATOM 318 O VAL A 24 4.749 8.262 10.104 1.00 0.00 O ATOM 319 CB VAL A 24 2.960 10.308 8.393 1.00 0.00 C ATOM 320 CG1 VAL A 24 2.177 9.309 7.555 1.00 0.00 C ATOM 321 CG2 VAL A 24 2.372 11.705 8.260 1.00 0.00 C ATOM 0 H VAL A 24 4.547 11.234 10.195 1.00 0.00 H new ATOM 0 HA VAL A 24 1.969 9.885 10.262 1.00 0.00 H new ATOM 0 HB VAL A 24 3.984 10.333 8.022 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.169 9.634 6.515 1.00 0.00 H new ATOM 0 HG12 VAL A 24 2.647 8.328 7.626 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.153 9.248 7.924 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.361 11.997 7.210 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.353 11.710 8.648 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.979 12.411 8.827 1.00 0.00 H new ATOM 331 N GLN A 25 2.655 7.470 9.878 1.00 0.00 N ATOM 332 CA GLN A 25 3.059 6.071 9.952 1.00 0.00 C ATOM 333 C GLN A 25 2.296 5.231 8.933 1.00 0.00 C ATOM 334 O GLN A 25 1.065 5.235 8.906 1.00 0.00 O ATOM 335 CB GLN A 25 2.824 5.524 11.360 1.00 0.00 C ATOM 336 CG GLN A 25 4.011 5.710 12.291 1.00 0.00 C ATOM 337 CD GLN A 25 3.611 5.713 13.754 1.00 0.00 C ATOM 338 OE1 GLN A 25 2.589 5.139 14.131 1.00 0.00 O ATOM 339 NE2 GLN A 25 4.417 6.361 14.587 1.00 0.00 N ATOM 0 H GLN A 25 1.652 7.614 9.759 1.00 0.00 H new ATOM 0 HA GLN A 25 4.123 6.013 9.721 1.00 0.00 H new ATOM 0 HB2 GLN A 25 1.953 6.018 11.792 1.00 0.00 H new ATOM 0 HB3 GLN A 25 2.588 4.462 11.293 1.00 0.00 H new ATOM 0 HG2 GLN A 25 4.733 4.912 12.117 1.00 0.00 H new ATOM 0 HG3 GLN A 25 4.511 6.649 12.053 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.254 6.823 14.231 1.00 0.00 H new ATOM 0 HE22 GLN A 25 4.199 6.397 15.583 1.00 0.00 H new ATOM 348 N LEU A 26 3.035 4.511 8.096 1.00 0.00 N ATOM 349 CA LEU A 26 2.428 3.664 7.074 1.00 0.00 C ATOM 350 C LEU A 26 2.694 2.190 7.360 1.00 0.00 C ATOM 351 O LEU A 26 3.820 1.801 7.667 1.00 0.00 O ATOM 352 CB LEU A 26 2.969 4.033 5.691 1.00 0.00 C ATOM 353 CG LEU A 26 2.021 3.798 4.515 1.00 0.00 C ATOM 354 CD1 LEU A 26 0.805 4.705 4.620 1.00 0.00 C ATOM 355 CD2 LEU A 26 2.743 4.021 3.195 1.00 0.00 C ATOM 0 H LEU A 26 4.055 4.496 8.105 1.00 0.00 H new ATOM 0 HA LEU A 26 1.351 3.830 7.092 1.00 0.00 H new ATOM 0 HB2 LEU A 26 3.249 5.087 5.702 1.00 0.00 H new ATOM 0 HB3 LEU A 26 3.881 3.463 5.516 1.00 0.00 H new ATOM 0 HG LEU A 26 1.680 2.763 4.549 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.142 4.524 3.774 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.274 4.496 5.549 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.126 5.747 4.612 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.053 3.849 2.369 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.113 5.045 3.151 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.581 3.329 3.117 1.00 0.00 H new ATOM 367 N ASN A 27 1.650 1.374 7.254 1.00 0.00 N ATOM 368 CA ASN A 27 1.771 -0.058 7.499 1.00 0.00 C ATOM 369 C ASN A 27 1.329 -0.859 6.278 1.00 0.00 C ATOM 370 O ASN A 27 0.680 -0.328 5.376 1.00 0.00 O ATOM 371 CB ASN A 27 0.937 -0.461 8.717 1.00 0.00 C ATOM 372 CG ASN A 27 1.568 -0.017 10.023 1.00 0.00 C ATOM 373 OD1 ASN A 27 2.204 -0.809 10.718 1.00 0.00 O ATOM 374 ND2 ASN A 27 1.394 1.255 10.361 1.00 0.00 N ATOM 0 H ASN A 27 0.711 1.680 7.000 1.00 0.00 H new ATOM 0 HA ASN A 27 2.820 -0.280 7.696 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.059 -0.026 8.632 1.00 0.00 H new ATOM 0 HB3 ASN A 27 0.813 -1.544 8.726 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.795 1.612 11.228 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.859 1.876 9.753 1.00 0.00 H new ATOM 381 N LEU A 28 1.683 -2.139 6.257 1.00 0.00 N ATOM 382 CA LEU A 28 1.322 -3.014 5.147 1.00 0.00 C ATOM 383 C LEU A 28 0.552 -4.233 5.644 1.00 0.00 C ATOM 384 O LEU A 28 0.934 -4.863 6.630 1.00 0.00 O ATOM 385 CB LEU A 28 2.577 -3.462 4.396 1.00 0.00 C ATOM 386 CG LEU A 28 2.398 -3.759 2.907 1.00 0.00 C ATOM 387 CD1 LEU A 28 3.749 -3.879 2.220 1.00 0.00 C ATOM 388 CD2 LEU A 28 1.583 -5.029 2.711 1.00 0.00 C ATOM 0 H LEU A 28 2.219 -2.594 6.996 1.00 0.00 H new ATOM 0 HA LEU A 28 0.680 -2.453 4.468 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.336 -2.687 4.503 1.00 0.00 H new ATOM 0 HB3 LEU A 28 2.966 -4.358 4.880 1.00 0.00 H new ATOM 0 HG LEU A 28 1.856 -2.929 2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.601 -4.091 1.161 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.298 -2.944 2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.318 -4.689 2.676 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.465 -5.225 1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 28 2.098 -5.868 3.180 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.601 -4.905 3.168 1.00 0.00 H new ATOM 400 N SER A 29 -0.535 -4.562 4.952 1.00 0.00 N ATOM 401 CA SER A 29 -1.360 -5.706 5.324 1.00 0.00 C ATOM 402 C SER A 29 -1.530 -6.659 4.145 1.00 0.00 C ATOM 403 O SER A 29 -1.881 -6.243 3.040 1.00 0.00 O ATOM 404 CB SER A 29 -2.731 -5.234 5.814 1.00 0.00 C ATOM 405 OG SER A 29 -3.410 -6.269 6.504 1.00 0.00 O ATOM 0 H SER A 29 -0.864 -4.053 4.132 1.00 0.00 H new ATOM 0 HA SER A 29 -0.857 -6.239 6.131 1.00 0.00 H new ATOM 0 HB2 SER A 29 -2.609 -4.373 6.472 1.00 0.00 H new ATOM 0 HB3 SER A 29 -3.330 -4.904 4.965 1.00 0.00 H new ATOM 0 HG SER A 29 -4.282 -5.942 6.808 1.00 0.00 H new ATOM 411 N PHE A 30 -1.279 -7.941 4.388 1.00 0.00 N ATOM 412 CA PHE A 30 -1.402 -8.955 3.347 1.00 0.00 C ATOM 413 C PHE A 30 -2.595 -9.868 3.616 1.00 0.00 C ATOM 414 O PHE A 30 -2.809 -10.311 4.745 1.00 0.00 O ATOM 415 CB PHE A 30 -0.120 -9.785 3.260 1.00 0.00 C ATOM 416 CG PHE A 30 1.132 -8.955 3.244 1.00 0.00 C ATOM 417 CD1 PHE A 30 1.698 -8.509 4.427 1.00 0.00 C ATOM 418 CD2 PHE A 30 1.741 -8.620 2.045 1.00 0.00 C ATOM 419 CE1 PHE A 30 2.850 -7.746 4.416 1.00 0.00 C ATOM 420 CE2 PHE A 30 2.893 -7.857 2.028 1.00 0.00 C ATOM 421 CZ PHE A 30 3.448 -7.418 3.214 1.00 0.00 C ATOM 0 H PHE A 30 -0.989 -8.303 5.297 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.563 -8.447 2.396 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -0.082 -10.469 4.107 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.153 -10.396 2.358 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.233 -8.761 5.369 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.311 -8.959 1.114 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.283 -7.406 5.346 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.359 -7.604 1.087 1.00 0.00 H new ATOM 0 HZ PHE A 30 4.347 -6.820 3.202 1.00 0.00 H new ATOM 431 N ILE A 31 -3.369 -10.143 2.572 1.00 0.00 N ATOM 432 CA ILE A 31 -4.540 -11.003 2.694 1.00 0.00 C ATOM 433 C ILE A 31 -4.593 -12.024 1.563 1.00 0.00 C ATOM 434 O ILE A 31 -4.543 -11.664 0.386 1.00 0.00 O ATOM 435 CB ILE A 31 -5.843 -10.182 2.693 1.00 0.00 C ATOM 436 CG1 ILE A 31 -6.031 -9.479 4.038 1.00 0.00 C ATOM 437 CG2 ILE A 31 -7.033 -11.080 2.388 1.00 0.00 C ATOM 438 CD1 ILE A 31 -5.412 -8.099 4.090 1.00 0.00 C ATOM 0 H ILE A 31 -3.207 -9.783 1.632 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.450 -11.526 3.646 1.00 0.00 H new ATOM 0 HB ILE A 31 -5.776 -9.422 1.915 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.097 -9.399 4.251 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -5.594 -10.094 4.825 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -7.947 -10.486 2.391 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -6.901 -11.539 1.408 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -7.105 -11.859 3.147 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.584 -7.660 5.073 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.340 -8.174 3.909 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.866 -7.468 3.326 1.00 0.00 H new ATOM 450 N ARG A 32 -4.697 -13.298 1.927 1.00 0.00 N ATOM 451 CA ARG A 32 -4.758 -14.371 0.942 1.00 0.00 C ATOM 452 C ARG A 32 -6.038 -15.186 1.106 1.00 0.00 C ATOM 453 O ARG A 32 -6.170 -16.003 2.017 1.00 0.00 O ATOM 454 CB ARG A 32 -3.538 -15.284 1.076 1.00 0.00 C ATOM 455 CG ARG A 32 -2.289 -14.733 0.409 1.00 0.00 C ATOM 456 CD ARG A 32 -1.156 -15.748 0.423 1.00 0.00 C ATOM 457 NE ARG A 32 -1.560 -17.027 -0.154 1.00 0.00 N ATOM 458 CZ ARG A 32 -0.759 -18.084 -0.232 1.00 0.00 C ATOM 459 NH1 ARG A 32 0.483 -18.014 0.228 1.00 0.00 N ATOM 460 NH2 ARG A 32 -1.199 -19.214 -0.770 1.00 0.00 N ATOM 0 H ARG A 32 -4.741 -13.612 2.896 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.759 -13.921 -0.051 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.332 -15.448 2.134 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.773 -16.256 0.642 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.517 -14.455 -0.620 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -1.972 -13.825 0.922 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -0.307 -15.351 -0.134 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -0.821 -15.903 1.448 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.509 -17.114 -0.517 1.00 0.00 H new ATOM 0 HH11 ARG A 32 0.825 -17.147 0.643 1.00 0.00 H new ATOM 0 HH12 ARG A 32 1.096 -18.827 0.167 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -2.154 -19.272 -1.125 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.583 -20.025 -0.829 1.00 0.00 H new ATOM 474 N PRO A 33 -7.003 -14.960 0.202 1.00 0.00 N ATOM 475 CA PRO A 33 -8.289 -15.663 0.225 1.00 0.00 C ATOM 476 C PRO A 33 -8.151 -17.136 -0.146 1.00 0.00 C ATOM 477 O PRO A 33 -7.270 -17.528 -0.912 1.00 0.00 O ATOM 478 CB PRO A 33 -9.117 -14.922 -0.827 1.00 0.00 C ATOM 479 CG PRO A 33 -8.112 -14.334 -1.756 1.00 0.00 C ATOM 480 CD PRO A 33 -6.913 -14.000 -0.911 1.00 0.00 C ATOM 0 HA PRO A 33 -8.737 -15.661 1.219 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.790 -15.601 -1.351 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -9.735 -14.148 -0.371 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -7.850 -15.039 -2.544 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.506 -13.443 -2.244 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.983 -14.117 -1.468 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.945 -12.970 -0.557 1.00 0.00 H new ATOM 488 N PRO A 34 -9.041 -17.973 0.407 1.00 0.00 N ATOM 489 CA PRO A 34 -9.040 -19.415 0.147 1.00 0.00 C ATOM 490 C PRO A 34 -9.466 -19.748 -1.278 1.00 0.00 C ATOM 491 O PRO A 34 -8.900 -20.637 -1.913 1.00 0.00 O ATOM 492 CB PRO A 34 -10.060 -19.958 1.151 1.00 0.00 C ATOM 493 CG PRO A 34 -10.970 -18.810 1.423 1.00 0.00 C ATOM 494 CD PRO A 34 -10.119 -17.575 1.328 1.00 0.00 C ATOM 0 HA PRO A 34 -8.045 -19.847 0.254 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.606 -20.808 0.741 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -9.573 -20.302 2.063 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -11.785 -18.779 0.700 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -11.423 -18.897 2.411 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -10.684 -16.726 0.942 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -9.727 -17.281 2.302 1.00 0.00 H new ATOM 502 N GLU A 35 -10.467 -19.028 -1.775 1.00 0.00 N ATOM 503 CA GLU A 35 -10.968 -19.248 -3.127 1.00 0.00 C ATOM 504 C GLU A 35 -9.868 -19.022 -4.159 1.00 0.00 C ATOM 505 O GLU A 35 -9.746 -19.772 -5.127 1.00 0.00 O ATOM 506 CB GLU A 35 -12.151 -18.321 -3.414 1.00 0.00 C ATOM 507 CG GLU A 35 -11.771 -16.850 -3.469 1.00 0.00 C ATOM 508 CD GLU A 35 -12.960 -15.933 -3.259 1.00 0.00 C ATOM 509 OE1 GLU A 35 -14.076 -16.301 -3.680 1.00 0.00 O ATOM 510 OE2 GLU A 35 -12.774 -14.846 -2.672 1.00 0.00 O ATOM 0 H GLU A 35 -10.947 -18.288 -1.262 1.00 0.00 H new ATOM 0 HA GLU A 35 -11.302 -20.283 -3.199 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -12.604 -18.607 -4.363 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -12.909 -18.463 -2.644 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -11.019 -16.644 -2.707 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -11.315 -16.632 -4.435 1.00 0.00 H new ATOM 517 N ASN A 36 -9.069 -17.981 -3.945 1.00 0.00 N ATOM 518 CA ASN A 36 -7.979 -17.654 -4.857 1.00 0.00 C ATOM 519 C ASN A 36 -6.656 -17.539 -4.105 1.00 0.00 C ATOM 520 O ASN A 36 -6.297 -16.479 -3.591 1.00 0.00 O ATOM 521 CB ASN A 36 -8.276 -16.346 -5.593 1.00 0.00 C ATOM 522 CG ASN A 36 -9.054 -16.568 -6.875 1.00 0.00 C ATOM 523 OD1 ASN A 36 -9.535 -17.670 -7.140 1.00 0.00 O ATOM 524 ND2 ASN A 36 -9.181 -15.518 -7.679 1.00 0.00 N ATOM 0 H ASN A 36 -9.156 -17.350 -3.148 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.894 -18.461 -5.585 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -8.842 -15.684 -4.938 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.338 -15.841 -5.823 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -9.694 -15.606 -8.556 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -8.766 -14.623 -7.419 1.00 0.00 H new ATOM 531 N PRO A 37 -5.914 -18.654 -4.039 1.00 0.00 N ATOM 532 CA PRO A 37 -4.619 -18.703 -3.353 1.00 0.00 C ATOM 533 C PRO A 37 -3.543 -17.913 -4.089 1.00 0.00 C ATOM 534 O PRO A 37 -2.570 -17.461 -3.486 1.00 0.00 O ATOM 535 CB PRO A 37 -4.277 -20.195 -3.348 1.00 0.00 C ATOM 536 CG PRO A 37 -5.016 -20.757 -4.513 1.00 0.00 C ATOM 537 CD PRO A 37 -6.281 -19.952 -4.629 1.00 0.00 C ATOM 0 HA PRO A 37 -4.667 -18.259 -2.359 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.203 -20.355 -3.446 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.587 -20.669 -2.417 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -4.422 -20.684 -5.424 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -5.238 -21.813 -4.361 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -6.597 -19.847 -5.667 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -7.106 -20.419 -4.091 1.00 0.00 H new ATOM 545 N ALA A 38 -3.724 -17.749 -5.395 1.00 0.00 N ATOM 546 CA ALA A 38 -2.770 -17.010 -6.213 1.00 0.00 C ATOM 547 C ALA A 38 -3.055 -15.513 -6.172 1.00 0.00 C ATOM 548 O ALA A 38 -2.313 -14.713 -6.745 1.00 0.00 O ATOM 549 CB ALA A 38 -2.800 -17.517 -7.647 1.00 0.00 C ATOM 0 H ALA A 38 -4.523 -18.118 -5.910 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.774 -17.174 -5.803 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -2.083 -16.956 -8.246 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -2.539 -18.575 -7.664 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -3.800 -17.384 -8.059 1.00 0.00 H new ATOM 555 N LEU A 39 -4.135 -15.139 -5.494 1.00 0.00 N ATOM 556 CA LEU A 39 -4.519 -13.737 -5.380 1.00 0.00 C ATOM 557 C LEU A 39 -4.013 -13.138 -4.071 1.00 0.00 C ATOM 558 O LEU A 39 -4.337 -13.625 -2.987 1.00 0.00 O ATOM 559 CB LEU A 39 -6.040 -13.596 -5.463 1.00 0.00 C ATOM 560 CG LEU A 39 -6.599 -12.196 -5.210 1.00 0.00 C ATOM 561 CD1 LEU A 39 -6.335 -11.291 -6.403 1.00 0.00 C ATOM 562 CD2 LEU A 39 -8.089 -12.263 -4.909 1.00 0.00 C ATOM 0 H LEU A 39 -4.760 -15.788 -5.015 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.064 -13.193 -6.208 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.361 -13.920 -6.453 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.488 -14.280 -4.742 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.091 -11.775 -4.342 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.740 -10.299 -6.204 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -5.261 -11.217 -6.573 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.814 -11.708 -7.289 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.470 -11.257 -4.731 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -8.612 -12.705 -5.757 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -8.254 -12.875 -4.022 1.00 0.00 H new ATOM 574 N LEU A 40 -3.218 -12.079 -4.180 1.00 0.00 N ATOM 575 CA LEU A 40 -2.668 -11.412 -3.005 1.00 0.00 C ATOM 576 C LEU A 40 -3.325 -10.052 -2.794 1.00 0.00 C ATOM 577 O LEU A 40 -3.045 -9.096 -3.518 1.00 0.00 O ATOM 578 CB LEU A 40 -1.155 -11.243 -3.151 1.00 0.00 C ATOM 579 CG LEU A 40 -0.444 -10.535 -1.998 1.00 0.00 C ATOM 580 CD1 LEU A 40 -0.449 -11.407 -0.752 1.00 0.00 C ATOM 581 CD2 LEU A 40 0.981 -10.173 -2.391 1.00 0.00 C ATOM 0 H LEU A 40 -2.940 -11.664 -5.069 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.875 -12.034 -2.134 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.710 -12.230 -3.274 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.959 -10.688 -4.068 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.983 -9.614 -1.775 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.062 -10.887 0.058 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.478 -11.616 -0.458 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.066 -12.345 -0.962 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.472 -9.670 -1.558 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.531 -11.080 -2.642 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.963 -9.509 -3.256 1.00 0.00 H new ATOM 593 N LEU A 41 -4.199 -9.971 -1.796 1.00 0.00 N ATOM 594 CA LEU A 41 -4.895 -8.726 -1.488 1.00 0.00 C ATOM 595 C LEU A 41 -4.136 -7.925 -0.435 1.00 0.00 C ATOM 596 O LEU A 41 -4.135 -8.277 0.745 1.00 0.00 O ATOM 597 CB LEU A 41 -6.314 -9.021 -0.997 1.00 0.00 C ATOM 598 CG LEU A 41 -7.160 -9.925 -1.894 1.00 0.00 C ATOM 599 CD1 LEU A 41 -8.382 -10.429 -1.143 1.00 0.00 C ATOM 600 CD2 LEU A 41 -7.576 -9.184 -3.157 1.00 0.00 C ATOM 0 H LEU A 41 -4.442 -10.752 -1.187 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.949 -8.132 -2.400 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.248 -9.481 -0.011 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -6.838 -8.073 -0.872 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.556 -10.785 -2.183 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -8.972 -11.071 -1.797 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.063 -10.997 -0.269 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.988 -9.581 -0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.177 -9.842 -3.784 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.162 -8.305 -2.887 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -6.687 -8.873 -3.706 1.00 0.00 H new ATOM 612 N ILE A 42 -3.494 -6.846 -0.869 1.00 0.00 N ATOM 613 CA ILE A 42 -2.735 -5.993 0.037 1.00 0.00 C ATOM 614 C ILE A 42 -3.554 -4.781 0.467 1.00 0.00 C ATOM 615 O ILE A 42 -4.451 -4.337 -0.251 1.00 0.00 O ATOM 616 CB ILE A 42 -1.424 -5.510 -0.611 1.00 0.00 C ATOM 617 CG1 ILE A 42 -0.405 -6.649 -0.663 1.00 0.00 C ATOM 618 CG2 ILE A 42 -0.861 -4.322 0.157 1.00 0.00 C ATOM 619 CD1 ILE A 42 0.903 -6.261 -1.316 1.00 0.00 C ATOM 0 H ILE A 42 -3.484 -6.542 -1.842 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.497 -6.596 0.913 1.00 0.00 H new ATOM 0 HB ILE A 42 -1.636 -5.191 -1.632 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -0.207 -6.995 0.352 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.838 -7.489 -1.207 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.066 -3.991 -0.312 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.584 -3.506 0.147 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.661 -4.617 1.187 1.00 0.00 H new ATOM 0 HD11 ILE A 42 1.577 -7.118 -1.318 1.00 0.00 H new ATOM 0 HD12 ILE A 42 0.717 -5.943 -2.342 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.359 -5.442 -0.760 1.00 0.00 H new ATOM 631 N THR A 43 -3.239 -4.247 1.643 1.00 0.00 N ATOM 632 CA THR A 43 -3.944 -3.085 2.168 1.00 0.00 C ATOM 633 C THR A 43 -2.981 -2.116 2.844 1.00 0.00 C ATOM 634 O THR A 43 -2.063 -2.531 3.552 1.00 0.00 O ATOM 635 CB THR A 43 -5.032 -3.498 3.178 1.00 0.00 C ATOM 636 OG1 THR A 43 -5.602 -4.755 2.797 1.00 0.00 O ATOM 637 CG2 THR A 43 -6.125 -2.443 3.257 1.00 0.00 C ATOM 0 H THR A 43 -2.500 -4.601 2.250 1.00 0.00 H new ATOM 0 HA THR A 43 -4.415 -2.591 1.318 1.00 0.00 H new ATOM 0 HB THR A 43 -4.568 -3.592 4.160 1.00 0.00 H new ATOM 0 HG1 THR A 43 -6.291 -5.011 3.445 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.882 -2.756 3.976 1.00 0.00 H new ATOM 0 HG22 THR A 43 -5.693 -1.494 3.575 1.00 0.00 H new ATOM 0 HG23 THR A 43 -6.585 -2.321 2.276 1.00 0.00 H new ATOM 645 N ILE A 44 -3.197 -0.824 2.623 1.00 0.00 N ATOM 646 CA ILE A 44 -2.348 0.204 3.213 1.00 0.00 C ATOM 647 C ILE A 44 -3.044 0.885 4.386 1.00 0.00 C ATOM 648 O ILE A 44 -4.269 1.009 4.410 1.00 0.00 O ATOM 649 CB ILE A 44 -1.952 1.271 2.175 1.00 0.00 C ATOM 650 CG1 ILE A 44 -1.866 0.650 0.780 1.00 0.00 C ATOM 651 CG2 ILE A 44 -0.628 1.916 2.557 1.00 0.00 C ATOM 652 CD1 ILE A 44 -1.313 1.592 -0.267 1.00 0.00 C ATOM 0 H ILE A 44 -3.952 -0.464 2.040 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.447 -0.296 3.569 1.00 0.00 H new ATOM 0 HB ILE A 44 -2.720 2.045 2.160 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.238 -0.240 0.825 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -2.860 0.323 0.475 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.362 2.668 1.814 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -0.722 2.389 3.534 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.150 1.154 2.597 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -1.280 1.085 -1.231 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -1.954 2.471 -0.340 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.306 1.899 0.016 1.00 0.00 H new ATOM 664 N THR A 45 -2.254 1.327 5.360 1.00 0.00 N ATOM 665 CA THR A 45 -2.793 1.997 6.537 1.00 0.00 C ATOM 666 C THR A 45 -2.000 3.257 6.864 1.00 0.00 C ATOM 667 O THR A 45 -0.936 3.190 7.478 1.00 0.00 O ATOM 668 CB THR A 45 -2.787 1.066 7.765 1.00 0.00 C ATOM 669 OG1 THR A 45 -3.699 -0.019 7.561 1.00 0.00 O ATOM 670 CG2 THR A 45 -3.172 1.829 9.023 1.00 0.00 C ATOM 0 H THR A 45 -1.238 1.233 5.357 1.00 0.00 H new ATOM 0 HA THR A 45 -3.822 2.270 6.302 1.00 0.00 H new ATOM 0 HB THR A 45 -1.778 0.673 7.892 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.688 -0.607 8.345 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.161 1.152 9.877 1.00 0.00 H new ATOM 0 HG22 THR A 45 -2.459 2.637 9.191 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.172 2.246 8.904 1.00 0.00 H new ATOM 678 N ALA A 46 -2.527 4.405 6.452 1.00 0.00 N ATOM 679 CA ALA A 46 -1.869 5.681 6.704 1.00 0.00 C ATOM 680 C ALA A 46 -2.447 6.362 7.940 1.00 0.00 C ATOM 681 O ALA A 46 -3.588 6.827 7.929 1.00 0.00 O ATOM 682 CB ALA A 46 -1.996 6.590 5.490 1.00 0.00 C ATOM 0 H ALA A 46 -3.408 4.478 5.942 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.813 5.486 6.889 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.500 7.539 5.693 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.529 6.113 4.628 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.050 6.769 5.278 1.00 0.00 H new ATOM 688 N THR A 47 -1.654 6.418 9.005 1.00 0.00 N ATOM 689 CA THR A 47 -2.088 7.040 10.250 1.00 0.00 C ATOM 690 C THR A 47 -1.425 8.399 10.445 1.00 0.00 C ATOM 691 O THR A 47 -0.239 8.567 10.167 1.00 0.00 O ATOM 692 CB THR A 47 -1.771 6.148 11.464 1.00 0.00 C ATOM 693 OG1 THR A 47 -0.523 5.475 11.266 1.00 0.00 O ATOM 694 CG2 THR A 47 -2.875 5.125 11.687 1.00 0.00 C ATOM 0 H THR A 47 -0.707 6.040 9.030 1.00 0.00 H new ATOM 0 HA THR A 47 -3.168 7.172 10.178 1.00 0.00 H new ATOM 0 HB THR A 47 -1.703 6.785 12.346 1.00 0.00 H new ATOM 0 HG1 THR A 47 -0.328 4.911 12.044 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.629 4.506 12.550 1.00 0.00 H new ATOM 0 HG22 THR A 47 -3.818 5.641 11.868 1.00 0.00 H new ATOM 0 HG23 THR A 47 -2.970 4.494 10.803 1.00 0.00 H new ATOM 702 N ASN A 48 -2.200 9.366 10.926 1.00 0.00 N ATOM 703 CA ASN A 48 -1.687 10.712 11.158 1.00 0.00 C ATOM 704 C ASN A 48 -1.967 11.160 12.589 1.00 0.00 C ATOM 705 O ASN A 48 -3.107 11.119 13.053 1.00 0.00 O ATOM 706 CB ASN A 48 -2.315 11.697 10.171 1.00 0.00 C ATOM 707 CG ASN A 48 -1.784 13.107 10.344 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.929 13.360 11.193 1.00 0.00 O ATOM 709 ND2 ASN A 48 -2.290 14.033 9.538 1.00 0.00 N ATOM 0 H ASN A 48 -3.185 9.243 11.163 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.608 10.695 11.005 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -2.120 11.361 9.153 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.397 11.700 10.304 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -1.971 14.999 9.608 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -2.997 13.778 8.849 1.00 0.00 H new ATOM 716 N PHE A 49 -0.919 11.590 13.285 1.00 0.00 N ATOM 717 CA PHE A 49 -1.052 12.047 14.663 1.00 0.00 C ATOM 718 C PHE A 49 -0.520 13.469 14.819 1.00 0.00 C ATOM 719 O PHE A 49 -0.900 14.187 15.743 1.00 0.00 O ATOM 720 CB PHE A 49 -0.304 11.105 15.609 1.00 0.00 C ATOM 721 CG PHE A 49 -1.032 9.817 15.871 1.00 0.00 C ATOM 722 CD1 PHE A 49 -1.977 9.732 16.880 1.00 0.00 C ATOM 723 CD2 PHE A 49 -0.771 8.691 15.107 1.00 0.00 C ATOM 724 CE1 PHE A 49 -2.647 8.548 17.124 1.00 0.00 C ATOM 725 CE2 PHE A 49 -1.438 7.504 15.345 1.00 0.00 C ATOM 726 CZ PHE A 49 -2.378 7.433 16.355 1.00 0.00 C ATOM 0 H PHE A 49 0.031 11.631 12.917 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.111 12.044 14.919 1.00 0.00 H new ATOM 0 HB2 PHE A 49 0.675 10.880 15.186 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -0.132 11.615 16.557 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -2.193 10.601 17.483 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.037 8.741 14.316 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.380 8.495 17.915 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -1.225 6.633 14.742 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.901 6.507 16.543 1.00 0.00 H new ATOM 736 N SER A 50 0.361 13.867 13.907 1.00 0.00 N ATOM 737 CA SER A 50 0.949 15.201 13.945 1.00 0.00 C ATOM 738 C SER A 50 -0.132 16.267 14.099 1.00 0.00 C ATOM 739 O SER A 50 -1.324 15.972 14.024 1.00 0.00 O ATOM 740 CB SER A 50 1.759 15.460 12.673 1.00 0.00 C ATOM 741 OG SER A 50 0.968 15.261 11.515 1.00 0.00 O ATOM 0 H SER A 50 0.683 13.285 13.133 1.00 0.00 H new ATOM 0 HA SER A 50 1.613 15.254 14.808 1.00 0.00 H new ATOM 0 HB2 SER A 50 2.143 16.480 12.684 1.00 0.00 H new ATOM 0 HB3 SER A 50 2.622 14.795 12.646 1.00 0.00 H new ATOM 0 HG SER A 50 0.418 14.458 11.629 1.00 0.00 H new ATOM 747 N GLU A 51 0.296 17.507 14.315 1.00 0.00 N ATOM 748 CA GLU A 51 -0.635 18.617 14.481 1.00 0.00 C ATOM 749 C GLU A 51 -1.205 19.055 13.135 1.00 0.00 C ATOM 750 O GLU A 51 -2.266 19.674 13.069 1.00 0.00 O ATOM 751 CB GLU A 51 0.060 19.798 15.162 1.00 0.00 C ATOM 752 CG GLU A 51 1.415 20.135 14.561 1.00 0.00 C ATOM 753 CD GLU A 51 1.988 21.430 15.104 1.00 0.00 C ATOM 754 OE1 GLU A 51 2.411 21.446 16.279 1.00 0.00 O ATOM 755 OE2 GLU A 51 2.013 22.427 14.353 1.00 0.00 O ATOM 0 H GLU A 51 1.280 17.768 14.379 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.457 18.277 15.111 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.585 20.674 15.098 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.187 19.573 16.221 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.111 19.321 14.764 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.319 20.210 13.478 1.00 0.00 H new ATOM 762 N GLY A 52 -0.490 18.729 12.062 1.00 0.00 N ATOM 763 CA GLY A 52 -0.939 19.097 10.732 1.00 0.00 C ATOM 764 C GLY A 52 -1.779 18.015 10.084 1.00 0.00 C ATOM 765 O GLY A 52 -1.406 16.842 10.091 1.00 0.00 O ATOM 0 H GLY A 52 0.392 18.217 12.090 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.520 20.018 10.790 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.073 19.305 10.104 1.00 0.00 H new ATOM 769 N ASP A 53 -2.918 18.409 9.523 1.00 0.00 N ATOM 770 CA ASP A 53 -3.815 17.464 8.868 1.00 0.00 C ATOM 771 C ASP A 53 -3.385 17.218 7.425 1.00 0.00 C ATOM 772 O ASP A 53 -2.667 18.024 6.834 1.00 0.00 O ATOM 773 CB ASP A 53 -5.252 17.983 8.904 1.00 0.00 C ATOM 774 CG ASP A 53 -5.663 18.457 10.285 1.00 0.00 C ATOM 775 OD1 ASP A 53 -5.332 19.607 10.641 1.00 0.00 O ATOM 776 OD2 ASP A 53 -6.316 17.677 11.009 1.00 0.00 O ATOM 0 H ASP A 53 -3.241 19.376 9.509 1.00 0.00 H new ATOM 0 HA ASP A 53 -3.765 16.519 9.409 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.356 18.805 8.195 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.929 17.193 8.578 1.00 0.00 H new ATOM 781 N VAL A 54 -3.829 16.098 6.864 1.00 0.00 N ATOM 782 CA VAL A 54 -3.491 15.745 5.490 1.00 0.00 C ATOM 783 C VAL A 54 -4.743 15.626 4.629 1.00 0.00 C ATOM 784 O VAL A 54 -5.797 15.198 5.101 1.00 0.00 O ATOM 785 CB VAL A 54 -2.710 14.419 5.427 1.00 0.00 C ATOM 786 CG1 VAL A 54 -2.308 14.104 3.994 1.00 0.00 C ATOM 787 CG2 VAL A 54 -1.488 14.477 6.332 1.00 0.00 C ATOM 0 H VAL A 54 -4.424 15.419 7.340 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.863 16.547 5.103 1.00 0.00 H new ATOM 0 HB VAL A 54 -3.359 13.618 5.782 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.757 13.164 3.969 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.202 14.018 3.376 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.677 14.905 3.609 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.948 13.532 6.275 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -0.835 15.288 6.010 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -1.805 14.653 7.360 1.00 0.00 H new ATOM 797 N THR A 55 -4.622 16.008 3.361 1.00 0.00 N ATOM 798 CA THR A 55 -5.744 15.945 2.433 1.00 0.00 C ATOM 799 C THR A 55 -5.287 15.504 1.047 1.00 0.00 C ATOM 800 O THR A 55 -4.097 15.294 0.813 1.00 0.00 O ATOM 801 CB THR A 55 -6.455 17.307 2.318 1.00 0.00 C ATOM 802 OG1 THR A 55 -5.496 18.340 2.066 1.00 0.00 O ATOM 803 CG2 THR A 55 -7.227 17.624 3.589 1.00 0.00 C ATOM 0 H THR A 55 -3.758 16.364 2.954 1.00 0.00 H new ATOM 0 HA THR A 55 -6.444 15.211 2.832 1.00 0.00 H new ATOM 0 HB THR A 55 -7.160 17.255 1.488 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.956 19.202 1.992 1.00 0.00 H new ATOM 0 HG21 THR A 55 -7.720 18.590 3.484 1.00 0.00 H new ATOM 0 HG22 THR A 55 -7.976 16.851 3.762 1.00 0.00 H new ATOM 0 HG23 THR A 55 -6.539 17.658 4.434 1.00 0.00 H new ATOM 811 N HIS A 56 -6.240 15.366 0.131 1.00 0.00 N ATOM 812 CA HIS A 56 -5.935 14.950 -1.233 1.00 0.00 C ATOM 813 C HIS A 56 -4.793 13.938 -1.250 1.00 0.00 C ATOM 814 O HIS A 56 -3.859 14.055 -2.043 1.00 0.00 O ATOM 815 CB HIS A 56 -5.570 16.164 -2.088 1.00 0.00 C ATOM 816 CG HIS A 56 -5.899 15.995 -3.540 1.00 0.00 C ATOM 817 ND1 HIS A 56 -4.981 16.196 -4.548 1.00 0.00 N ATOM 818 CD2 HIS A 56 -7.054 15.639 -4.150 1.00 0.00 C ATOM 819 CE1 HIS A 56 -5.557 15.973 -5.716 1.00 0.00 C ATOM 820 NE2 HIS A 56 -6.815 15.634 -5.502 1.00 0.00 N ATOM 0 H HIS A 56 -7.230 15.536 0.309 1.00 0.00 H new ATOM 0 HA HIS A 56 -6.823 14.475 -1.650 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -6.095 17.039 -1.705 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -4.503 16.362 -1.986 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -7.989 15.403 -3.664 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.080 16.054 -6.682 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -7.498 15.405 -6.224 1.00 0.00 H new ATOM 828 N PHE A 57 -4.875 12.946 -0.370 1.00 0.00 N ATOM 829 CA PHE A 57 -3.848 11.915 -0.283 1.00 0.00 C ATOM 830 C PHE A 57 -3.931 10.962 -1.472 1.00 0.00 C ATOM 831 O PHE A 57 -4.964 10.334 -1.706 1.00 0.00 O ATOM 832 CB PHE A 57 -3.991 11.132 1.024 1.00 0.00 C ATOM 833 CG PHE A 57 -3.089 9.933 1.106 1.00 0.00 C ATOM 834 CD1 PHE A 57 -1.837 9.950 0.514 1.00 0.00 C ATOM 835 CD2 PHE A 57 -3.494 8.790 1.776 1.00 0.00 C ATOM 836 CE1 PHE A 57 -1.005 8.849 0.588 1.00 0.00 C ATOM 837 CE2 PHE A 57 -2.666 7.686 1.854 1.00 0.00 C ATOM 838 CZ PHE A 57 -1.421 7.715 1.258 1.00 0.00 C ATOM 0 H PHE A 57 -5.642 12.834 0.293 1.00 0.00 H new ATOM 0 HA PHE A 57 -2.874 12.405 -0.300 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -3.777 11.796 1.861 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -5.026 10.807 1.132 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -1.507 10.834 -0.012 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -4.468 8.761 2.243 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -0.031 8.875 0.123 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -2.993 6.802 2.381 1.00 0.00 H new ATOM 0 HZ PHE A 57 -0.773 6.853 1.316 1.00 0.00 H new ATOM 848 N ILE A 58 -2.837 10.860 -2.219 1.00 0.00 N ATOM 849 CA ILE A 58 -2.786 9.985 -3.383 1.00 0.00 C ATOM 850 C ILE A 58 -1.631 8.994 -3.275 1.00 0.00 C ATOM 851 O ILE A 58 -0.463 9.385 -3.276 1.00 0.00 O ATOM 852 CB ILE A 58 -2.637 10.790 -4.687 1.00 0.00 C ATOM 853 CG1 ILE A 58 -3.860 11.684 -4.902 1.00 0.00 C ATOM 854 CG2 ILE A 58 -2.445 9.852 -5.869 1.00 0.00 C ATOM 855 CD1 ILE A 58 -3.763 12.553 -6.137 1.00 0.00 C ATOM 0 H ILE A 58 -1.974 11.373 -2.039 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.729 9.439 -3.409 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.755 11.426 -4.606 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -4.749 11.058 -4.977 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.992 12.322 -4.028 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -2.341 10.436 -6.784 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -1.547 9.254 -5.716 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.309 9.193 -5.955 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.664 13.160 -6.227 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -2.893 13.205 -6.056 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.662 11.921 -7.019 1.00 0.00 H new ATOM 867 N CYS A 59 -1.965 7.712 -3.184 1.00 0.00 N ATOM 868 CA CYS A 59 -0.956 6.664 -3.077 1.00 0.00 C ATOM 869 C CYS A 59 -0.909 5.823 -4.349 1.00 0.00 C ATOM 870 O CYS A 59 -1.864 5.118 -4.672 1.00 0.00 O ATOM 871 CB CYS A 59 -1.244 5.771 -1.870 1.00 0.00 C ATOM 872 SG CYS A 59 -0.205 4.294 -1.780 1.00 0.00 S ATOM 0 H CYS A 59 -2.927 7.373 -3.182 1.00 0.00 H new ATOM 0 HA CYS A 59 0.015 7.141 -2.943 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -1.108 6.354 -0.959 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -2.290 5.465 -1.899 1.00 0.00 H new ATOM 0 HG CYS A 59 0.143 4.082 -0.545 1.00 0.00 H new ATOM 878 N GLN A 60 0.208 5.905 -5.065 1.00 0.00 N ATOM 879 CA GLN A 60 0.378 5.152 -6.302 1.00 0.00 C ATOM 880 C GLN A 60 1.342 3.987 -6.103 1.00 0.00 C ATOM 881 O GLN A 60 2.198 4.022 -5.220 1.00 0.00 O ATOM 882 CB GLN A 60 0.890 6.069 -7.415 1.00 0.00 C ATOM 883 CG GLN A 60 0.173 7.408 -7.479 1.00 0.00 C ATOM 884 CD GLN A 60 0.806 8.452 -6.580 1.00 0.00 C ATOM 885 OE1 GLN A 60 0.981 8.233 -5.381 1.00 0.00 O ATOM 886 NE2 GLN A 60 1.154 9.597 -7.157 1.00 0.00 N ATOM 0 H GLN A 60 1.008 6.485 -4.810 1.00 0.00 H new ATOM 0 HA GLN A 60 -0.593 4.750 -6.589 1.00 0.00 H new ATOM 0 HB2 GLN A 60 1.956 6.244 -7.269 1.00 0.00 H new ATOM 0 HB3 GLN A 60 0.779 5.561 -8.373 1.00 0.00 H new ATOM 0 HG2 GLN A 60 0.177 7.769 -8.507 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.870 7.272 -7.193 1.00 0.00 H new ATOM 0 HE21 GLN A 60 0.991 9.736 -8.154 1.00 0.00 H new ATOM 0 HE22 GLN A 60 1.585 10.337 -6.603 1.00 0.00 H new ATOM 895 N ALA A 61 1.195 2.956 -6.929 1.00 0.00 N ATOM 896 CA ALA A 61 2.053 1.781 -6.844 1.00 0.00 C ATOM 897 C ALA A 61 2.458 1.296 -8.232 1.00 0.00 C ATOM 898 O ALA A 61 1.954 1.785 -9.242 1.00 0.00 O ATOM 899 CB ALA A 61 1.352 0.669 -6.078 1.00 0.00 C ATOM 0 H ALA A 61 0.490 2.911 -7.664 1.00 0.00 H new ATOM 0 HA ALA A 61 2.959 2.061 -6.307 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.005 -0.202 -6.023 1.00 0.00 H new ATOM 0 HB2 ALA A 61 1.119 1.012 -5.070 1.00 0.00 H new ATOM 0 HB3 ALA A 61 0.429 0.399 -6.592 1.00 0.00 H new ATOM 905 N ALA A 62 3.373 0.333 -8.273 1.00 0.00 N ATOM 906 CA ALA A 62 3.844 -0.219 -9.537 1.00 0.00 C ATOM 907 C ALA A 62 4.317 -1.659 -9.365 1.00 0.00 C ATOM 908 O ALA A 62 5.185 -1.944 -8.540 1.00 0.00 O ATOM 909 CB ALA A 62 4.964 0.642 -10.104 1.00 0.00 C ATOM 0 H ALA A 62 3.803 -0.081 -7.446 1.00 0.00 H new ATOM 0 HA ALA A 62 3.010 -0.219 -10.238 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.306 0.218 -11.048 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.595 1.654 -10.273 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.794 0.671 -9.398 1.00 0.00 H new ATOM 915 N VAL A 63 3.739 -2.564 -10.149 1.00 0.00 N ATOM 916 CA VAL A 63 4.101 -3.975 -10.084 1.00 0.00 C ATOM 917 C VAL A 63 4.624 -4.470 -11.427 1.00 0.00 C ATOM 918 O VAL A 63 4.253 -3.969 -12.489 1.00 0.00 O ATOM 919 CB VAL A 63 2.901 -4.843 -9.661 1.00 0.00 C ATOM 920 CG1 VAL A 63 2.295 -4.322 -8.367 1.00 0.00 C ATOM 921 CG2 VAL A 63 1.859 -4.887 -10.768 1.00 0.00 C ATOM 0 H VAL A 63 3.018 -2.345 -10.837 1.00 0.00 H new ATOM 0 HA VAL A 63 4.888 -4.066 -9.335 1.00 0.00 H new ATOM 0 HB VAL A 63 3.254 -5.859 -9.485 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.449 -4.948 -8.084 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.046 -4.348 -7.577 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.956 -3.296 -8.511 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.018 -5.505 -10.452 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.508 -3.877 -10.978 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.303 -5.311 -11.669 1.00 0.00 H new ATOM 931 N PRO A 64 5.507 -5.479 -11.383 1.00 0.00 N ATOM 932 CA PRO A 64 6.101 -6.065 -12.588 1.00 0.00 C ATOM 933 C PRO A 64 5.087 -6.859 -13.405 1.00 0.00 C ATOM 934 O PRO A 64 4.059 -7.295 -12.886 1.00 0.00 O ATOM 935 CB PRO A 64 7.185 -6.993 -12.034 1.00 0.00 C ATOM 936 CG PRO A 64 6.724 -7.337 -10.660 1.00 0.00 C ATOM 937 CD PRO A 64 5.995 -6.124 -10.152 1.00 0.00 C ATOM 0 HA PRO A 64 6.481 -5.302 -13.268 1.00 0.00 H new ATOM 0 HB2 PRO A 64 7.294 -7.886 -12.650 1.00 0.00 H new ATOM 0 HB3 PRO A 64 8.156 -6.499 -12.013 1.00 0.00 H new ATOM 0 HG2 PRO A 64 6.069 -8.208 -10.675 1.00 0.00 H new ATOM 0 HG3 PRO A 64 7.568 -7.584 -10.016 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.174 -6.397 -9.489 1.00 0.00 H new ATOM 0 HD3 PRO A 64 6.655 -5.465 -9.588 1.00 0.00 H new ATOM 945 N LYS A 65 5.383 -7.045 -14.687 1.00 0.00 N ATOM 946 CA LYS A 65 4.499 -7.788 -15.577 1.00 0.00 C ATOM 947 C LYS A 65 4.046 -9.093 -14.929 1.00 0.00 C ATOM 948 O LYS A 65 2.855 -9.402 -14.900 1.00 0.00 O ATOM 949 CB LYS A 65 5.206 -8.083 -16.902 1.00 0.00 C ATOM 950 CG LYS A 65 4.254 -8.422 -18.037 1.00 0.00 C ATOM 951 CD LYS A 65 3.837 -9.882 -17.998 1.00 0.00 C ATOM 952 CE LYS A 65 2.615 -10.136 -18.867 1.00 0.00 C ATOM 953 NZ LYS A 65 1.347 -9.910 -18.121 1.00 0.00 N ATOM 0 H LYS A 65 6.229 -6.691 -15.133 1.00 0.00 H new ATOM 0 HA LYS A 65 3.619 -7.174 -15.770 1.00 0.00 H new ATOM 0 HB2 LYS A 65 5.803 -7.217 -17.186 1.00 0.00 H new ATOM 0 HB3 LYS A 65 5.897 -8.913 -16.758 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.369 -7.788 -17.973 1.00 0.00 H new ATOM 0 HG3 LYS A 65 4.733 -8.205 -18.992 1.00 0.00 H new ATOM 0 HD2 LYS A 65 4.663 -10.507 -18.338 1.00 0.00 H new ATOM 0 HD3 LYS A 65 3.620 -10.172 -16.970 1.00 0.00 H new ATOM 0 HE2 LYS A 65 2.646 -9.481 -19.737 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.640 -11.160 -19.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 0.538 -10.094 -18.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.305 -10.553 -17.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 1.311 -8.925 -17.788 1.00 0.00 H new ATOM 967 N SER A 66 5.004 -9.853 -14.408 1.00 0.00 N ATOM 968 CA SER A 66 4.703 -11.126 -13.762 1.00 0.00 C ATOM 969 C SER A 66 3.443 -11.017 -12.909 1.00 0.00 C ATOM 970 O SER A 66 2.560 -11.874 -12.972 1.00 0.00 O ATOM 971 CB SER A 66 5.882 -11.574 -12.897 1.00 0.00 C ATOM 972 OG SER A 66 6.888 -12.188 -13.683 1.00 0.00 O ATOM 0 H SER A 66 5.995 -9.610 -14.420 1.00 0.00 H new ATOM 0 HA SER A 66 4.530 -11.869 -14.540 1.00 0.00 H new ATOM 0 HB2 SER A 66 6.300 -10.714 -12.373 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.534 -12.273 -12.136 1.00 0.00 H new ATOM 0 HG SER A 66 7.631 -12.464 -13.106 1.00 0.00 H new ATOM 978 N LEU A 67 3.366 -9.958 -12.111 1.00 0.00 N ATOM 979 CA LEU A 67 2.215 -9.735 -11.243 1.00 0.00 C ATOM 980 C LEU A 67 1.288 -8.675 -11.830 1.00 0.00 C ATOM 981 O LEU A 67 1.618 -8.032 -12.826 1.00 0.00 O ATOM 982 CB LEU A 67 2.677 -9.310 -9.848 1.00 0.00 C ATOM 983 CG LEU A 67 3.942 -9.991 -9.324 1.00 0.00 C ATOM 984 CD1 LEU A 67 4.507 -9.226 -8.137 1.00 0.00 C ATOM 985 CD2 LEU A 67 3.651 -11.435 -8.941 1.00 0.00 C ATOM 0 H LEU A 67 4.087 -9.240 -12.047 1.00 0.00 H new ATOM 0 HA LEU A 67 1.663 -10.672 -11.165 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.844 -8.233 -9.855 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.867 -9.502 -9.144 1.00 0.00 H new ATOM 0 HG LEU A 67 4.688 -9.990 -10.119 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.407 -9.725 -7.777 1.00 0.00 H new ATOM 0 HD12 LEU A 67 4.754 -8.209 -8.443 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.766 -9.194 -7.338 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.563 -11.904 -8.570 1.00 0.00 H new ATOM 0 HD22 LEU A 67 2.888 -11.458 -8.162 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.293 -11.978 -9.816 1.00 0.00 H new ATOM 997 N GLN A 68 0.130 -8.497 -11.203 1.00 0.00 N ATOM 998 CA GLN A 68 -0.844 -7.513 -11.663 1.00 0.00 C ATOM 999 C GLN A 68 -1.205 -6.542 -10.544 1.00 0.00 C ATOM 1000 O GLN A 68 -0.991 -6.828 -9.365 1.00 0.00 O ATOM 1001 CB GLN A 68 -2.104 -8.212 -12.174 1.00 0.00 C ATOM 1002 CG GLN A 68 -2.838 -7.432 -13.253 1.00 0.00 C ATOM 1003 CD GLN A 68 -4.113 -8.116 -13.704 1.00 0.00 C ATOM 1004 OE1 GLN A 68 -5.191 -7.522 -13.685 1.00 0.00 O ATOM 1005 NE2 GLN A 68 -3.996 -9.374 -14.115 1.00 0.00 N ATOM 0 H GLN A 68 -0.157 -9.020 -10.376 1.00 0.00 H new ATOM 0 HA GLN A 68 -0.395 -6.948 -12.480 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.832 -9.192 -12.567 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.780 -8.381 -11.336 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -3.078 -6.437 -12.877 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.179 -7.298 -14.111 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -3.083 -9.828 -14.114 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -4.820 -9.886 -14.431 1.00 0.00 H new ATOM 1014 N LEU A 69 -1.752 -5.391 -10.921 1.00 0.00 N ATOM 1015 CA LEU A 69 -2.143 -4.376 -9.949 1.00 0.00 C ATOM 1016 C LEU A 69 -3.475 -3.739 -10.333 1.00 0.00 C ATOM 1017 O LEU A 69 -3.724 -3.459 -11.505 1.00 0.00 O ATOM 1018 CB LEU A 69 -1.062 -3.299 -9.844 1.00 0.00 C ATOM 1019 CG LEU A 69 -1.250 -2.265 -8.733 1.00 0.00 C ATOM 1020 CD1 LEU A 69 -1.013 -2.896 -7.370 1.00 0.00 C ATOM 1021 CD2 LEU A 69 -0.319 -1.080 -8.945 1.00 0.00 C ATOM 0 H LEU A 69 -1.935 -5.138 -11.892 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.259 -4.862 -8.980 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -0.101 -3.791 -9.696 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -1.008 -2.773 -10.797 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.278 -1.904 -8.768 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.151 -2.145 -6.592 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -1.721 -3.710 -7.218 1.00 0.00 H new ATOM 0 HD13 LEU A 69 0.004 -3.286 -7.321 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.466 -0.354 -8.145 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.715 -1.424 -8.937 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.538 -0.612 -9.905 1.00 0.00 H new ATOM 1033 N GLN A 70 -4.326 -3.512 -9.337 1.00 0.00 N ATOM 1034 CA GLN A 70 -5.631 -2.907 -9.571 1.00 0.00 C ATOM 1035 C GLN A 70 -5.979 -1.918 -8.463 1.00 0.00 C ATOM 1036 O GLN A 70 -6.154 -2.302 -7.306 1.00 0.00 O ATOM 1037 CB GLN A 70 -6.709 -3.988 -9.662 1.00 0.00 C ATOM 1038 CG GLN A 70 -8.104 -3.438 -9.915 1.00 0.00 C ATOM 1039 CD GLN A 70 -8.353 -3.130 -11.378 1.00 0.00 C ATOM 1040 OE1 GLN A 70 -7.551 -3.482 -12.244 1.00 0.00 O ATOM 1041 NE2 GLN A 70 -9.469 -2.469 -11.663 1.00 0.00 N ATOM 0 H GLN A 70 -4.135 -3.738 -8.361 1.00 0.00 H new ATOM 0 HA GLN A 70 -5.588 -2.366 -10.516 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.450 -4.681 -10.463 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -6.716 -4.561 -8.735 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.843 -4.160 -9.569 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -8.245 -2.531 -9.327 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -10.106 -2.197 -10.914 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -9.689 -2.234 -12.631 1.00 0.00 H new ATOM 1050 N LEU A 71 -6.078 -0.643 -8.825 1.00 0.00 N ATOM 1051 CA LEU A 71 -6.405 0.402 -7.861 1.00 0.00 C ATOM 1052 C LEU A 71 -7.892 0.382 -7.519 1.00 0.00 C ATOM 1053 O LEU A 71 -8.733 0.727 -8.348 1.00 0.00 O ATOM 1054 CB LEU A 71 -6.017 1.774 -8.416 1.00 0.00 C ATOM 1055 CG LEU A 71 -5.817 2.883 -7.383 1.00 0.00 C ATOM 1056 CD1 LEU A 71 -4.817 3.911 -7.890 1.00 0.00 C ATOM 1057 CD2 LEU A 71 -7.145 3.548 -7.052 1.00 0.00 C ATOM 0 H LEU A 71 -5.937 -0.308 -9.778 1.00 0.00 H new ATOM 0 HA LEU A 71 -5.839 0.211 -6.949 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.095 1.665 -8.986 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.789 2.092 -9.116 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.418 2.437 -6.472 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -4.688 4.693 -7.141 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.859 3.425 -8.077 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.187 4.353 -8.815 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.984 4.335 -6.315 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.571 3.980 -7.957 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.832 2.806 -6.646 1.00 0.00 H new ATOM 1069 N GLN A 72 -8.206 -0.023 -6.293 1.00 0.00 N ATOM 1070 CA GLN A 72 -9.590 -0.086 -5.841 1.00 0.00 C ATOM 1071 C GLN A 72 -10.050 1.264 -5.302 1.00 0.00 C ATOM 1072 O GLN A 72 -9.232 2.118 -4.961 1.00 0.00 O ATOM 1073 CB GLN A 72 -9.749 -1.160 -4.763 1.00 0.00 C ATOM 1074 CG GLN A 72 -11.183 -1.348 -4.297 1.00 0.00 C ATOM 1075 CD GLN A 72 -12.097 -1.837 -5.404 1.00 0.00 C ATOM 1076 OE1 GLN A 72 -13.073 -1.174 -5.757 1.00 0.00 O ATOM 1077 NE2 GLN A 72 -11.784 -3.002 -5.958 1.00 0.00 N ATOM 0 H GLN A 72 -7.521 -0.312 -5.595 1.00 0.00 H new ATOM 0 HA GLN A 72 -10.213 -0.345 -6.697 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -9.374 -2.108 -5.149 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -9.129 -0.897 -3.906 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -11.203 -2.061 -3.473 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -11.562 -0.402 -3.909 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -10.966 -3.517 -5.634 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -12.362 -3.382 -6.708 1.00 0.00 H new ATOM 1086 N ALA A 73 -11.363 1.451 -5.229 1.00 0.00 N ATOM 1087 CA ALA A 73 -11.931 2.697 -4.730 1.00 0.00 C ATOM 1088 C ALA A 73 -11.547 2.931 -3.273 1.00 0.00 C ATOM 1089 O ALA A 73 -11.807 2.106 -2.397 1.00 0.00 O ATOM 1090 CB ALA A 73 -13.445 2.686 -4.883 1.00 0.00 C ATOM 0 H ALA A 73 -12.054 0.755 -5.509 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.523 3.516 -5.322 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.856 3.623 -4.506 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.703 2.574 -5.936 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.862 1.853 -4.317 1.00 0.00 H new ATOM 1096 N PRO A 74 -10.913 4.082 -3.005 1.00 0.00 N ATOM 1097 CA PRO A 74 -10.479 4.451 -1.654 1.00 0.00 C ATOM 1098 C PRO A 74 -11.653 4.770 -0.735 1.00 0.00 C ATOM 1099 O PRO A 74 -12.808 4.517 -1.077 1.00 0.00 O ATOM 1100 CB PRO A 74 -9.625 5.700 -1.884 1.00 0.00 C ATOM 1101 CG PRO A 74 -10.138 6.280 -3.157 1.00 0.00 C ATOM 1102 CD PRO A 74 -10.571 5.113 -4.000 1.00 0.00 C ATOM 0 HA PRO A 74 -9.945 3.638 -1.161 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -9.725 6.405 -1.059 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -8.567 5.448 -1.962 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -10.972 6.956 -2.969 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -9.365 6.860 -3.661 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -11.426 5.366 -4.627 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.774 4.781 -4.666 1.00 0.00 H new ATOM 1110 N SER A 75 -11.350 5.328 0.433 1.00 0.00 N ATOM 1111 CA SER A 75 -12.380 5.679 1.403 1.00 0.00 C ATOM 1112 C SER A 75 -12.582 7.191 1.458 1.00 0.00 C ATOM 1113 O SER A 75 -13.711 7.675 1.527 1.00 0.00 O ATOM 1114 CB SER A 75 -12.006 5.152 2.789 1.00 0.00 C ATOM 1115 OG SER A 75 -13.089 5.284 3.694 1.00 0.00 O ATOM 0 H SER A 75 -10.399 5.547 0.730 1.00 0.00 H new ATOM 0 HA SER A 75 -13.315 5.216 1.087 1.00 0.00 H new ATOM 0 HB2 SER A 75 -11.714 4.104 2.717 1.00 0.00 H new ATOM 0 HB3 SER A 75 -11.142 5.698 3.168 1.00 0.00 H new ATOM 0 HG SER A 75 -12.825 4.939 4.572 1.00 0.00 H new ATOM 1121 N GLY A 76 -11.478 7.930 1.427 1.00 0.00 N ATOM 1122 CA GLY A 76 -11.554 9.379 1.475 1.00 0.00 C ATOM 1123 C GLY A 76 -10.185 10.031 1.495 1.00 0.00 C ATOM 1124 O GLY A 76 -9.343 9.694 2.326 1.00 0.00 O ATOM 0 H GLY A 76 -10.532 7.552 1.370 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.112 9.739 0.611 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.110 9.681 2.362 1.00 0.00 H new ATOM 1128 N ASN A 77 -9.963 10.966 0.577 1.00 0.00 N ATOM 1129 CA ASN A 77 -8.686 11.665 0.492 1.00 0.00 C ATOM 1130 C ASN A 77 -8.563 12.709 1.597 1.00 0.00 C ATOM 1131 O ASN A 77 -8.371 13.895 1.328 1.00 0.00 O ATOM 1132 CB ASN A 77 -8.538 12.334 -0.876 1.00 0.00 C ATOM 1133 CG ASN A 77 -8.836 11.384 -2.020 1.00 0.00 C ATOM 1134 OD1 ASN A 77 -9.682 10.498 -1.901 1.00 0.00 O ATOM 1135 ND2 ASN A 77 -8.139 11.565 -3.136 1.00 0.00 N ATOM 0 H ASN A 77 -10.650 11.257 -0.118 1.00 0.00 H new ATOM 0 HA ASN A 77 -7.889 10.932 0.619 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -9.211 13.190 -0.933 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -7.523 12.718 -0.982 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.295 10.956 -3.939 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.447 12.313 -3.190 1.00 0.00 H new ATOM 1142 N THR A 78 -8.673 12.260 2.843 1.00 0.00 N ATOM 1143 CA THR A 78 -8.575 13.154 3.990 1.00 0.00 C ATOM 1144 C THR A 78 -8.245 12.382 5.262 1.00 0.00 C ATOM 1145 O THR A 78 -8.948 11.441 5.630 1.00 0.00 O ATOM 1146 CB THR A 78 -9.883 13.939 4.204 1.00 0.00 C ATOM 1147 OG1 THR A 78 -10.268 14.590 2.988 1.00 0.00 O ATOM 1148 CG2 THR A 78 -9.719 14.973 5.308 1.00 0.00 C ATOM 0 H THR A 78 -8.830 11.281 3.084 1.00 0.00 H new ATOM 0 HA THR A 78 -7.770 13.856 3.775 1.00 0.00 H new ATOM 0 HB THR A 78 -10.660 13.234 4.500 1.00 0.00 H new ATOM 0 HG1 THR A 78 -9.486 14.682 2.405 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.655 15.515 5.441 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.454 14.472 6.239 1.00 0.00 H new ATOM 0 HG23 THR A 78 -8.930 15.674 5.036 1.00 0.00 H new ATOM 1156 N VAL A 79 -7.170 12.787 5.932 1.00 0.00 N ATOM 1157 CA VAL A 79 -6.748 12.134 7.166 1.00 0.00 C ATOM 1158 C VAL A 79 -6.618 13.140 8.303 1.00 0.00 C ATOM 1159 O VAL A 79 -5.933 14.158 8.190 1.00 0.00 O ATOM 1160 CB VAL A 79 -5.403 11.405 6.983 1.00 0.00 C ATOM 1161 CG1 VAL A 79 -5.096 10.540 8.195 1.00 0.00 C ATOM 1162 CG2 VAL A 79 -5.419 10.570 5.712 1.00 0.00 C ATOM 0 H VAL A 79 -6.576 13.564 5.641 1.00 0.00 H new ATOM 0 HA VAL A 79 -7.517 11.404 7.417 1.00 0.00 H new ATOM 0 HB VAL A 79 -4.614 12.151 6.890 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -4.142 10.033 8.048 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -5.040 11.167 9.085 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -5.885 9.799 8.322 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -4.461 10.062 5.598 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.217 9.830 5.773 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.590 11.219 4.853 1.00 0.00 H new ATOM 1172 N PRO A 80 -7.289 12.852 9.428 1.00 0.00 N ATOM 1173 CA PRO A 80 -7.263 13.719 10.610 1.00 0.00 C ATOM 1174 C PRO A 80 -5.905 13.714 11.303 1.00 0.00 C ATOM 1175 O PRO A 80 -5.190 12.713 11.281 1.00 0.00 O ATOM 1176 CB PRO A 80 -8.331 13.109 11.521 1.00 0.00 C ATOM 1177 CG PRO A 80 -8.407 11.679 11.110 1.00 0.00 C ATOM 1178 CD PRO A 80 -8.124 11.657 9.633 1.00 0.00 C ATOM 0 HA PRO A 80 -7.447 14.762 10.354 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -8.057 13.205 12.572 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -9.291 13.609 11.395 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -7.680 11.077 11.656 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -9.391 11.263 11.325 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -7.602 10.747 9.337 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -9.042 11.703 9.047 1.00 0.00 H new ATOM 1186 N ALA A 81 -5.556 14.840 11.918 1.00 0.00 N ATOM 1187 CA ALA A 81 -4.284 14.964 12.620 1.00 0.00 C ATOM 1188 C ALA A 81 -4.441 14.641 14.102 1.00 0.00 C ATOM 1189 O ALA A 81 -3.516 14.835 14.891 1.00 0.00 O ATOM 1190 CB ALA A 81 -3.716 16.364 12.440 1.00 0.00 C ATOM 0 H ALA A 81 -6.136 15.679 11.944 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.588 14.244 12.190 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -2.766 16.442 12.969 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -3.557 16.559 11.379 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.417 17.095 12.842 1.00 0.00 H new ATOM 1196 N ARG A 82 -5.618 14.149 14.474 1.00 0.00 N ATOM 1197 CA ARG A 82 -5.897 13.802 15.862 1.00 0.00 C ATOM 1198 C ARG A 82 -6.086 12.296 16.019 1.00 0.00 C ATOM 1199 O ARG A 82 -6.948 11.842 16.770 1.00 0.00 O ATOM 1200 CB ARG A 82 -7.145 14.537 16.354 1.00 0.00 C ATOM 1201 CG ARG A 82 -7.008 16.050 16.335 1.00 0.00 C ATOM 1202 CD ARG A 82 -7.219 16.611 14.937 1.00 0.00 C ATOM 1203 NE ARG A 82 -7.378 18.063 14.949 1.00 0.00 N ATOM 1204 CZ ARG A 82 -8.534 18.673 15.185 1.00 0.00 C ATOM 1205 NH1 ARG A 82 -9.626 17.961 15.429 1.00 0.00 N ATOM 1206 NH2 ARG A 82 -8.600 19.998 15.178 1.00 0.00 N ATOM 0 H ARG A 82 -6.394 13.982 13.833 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.042 14.109 16.465 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -7.994 14.250 15.733 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.370 14.214 17.370 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -7.734 16.491 17.018 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -6.019 16.331 16.696 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.370 16.344 14.307 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -8.102 16.153 14.492 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.557 18.640 14.766 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -9.580 16.942 15.436 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -10.512 18.432 15.610 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.762 20.549 14.991 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -9.488 20.465 15.359 1.00 0.00 H new ATOM 1220 N GLY A 83 -5.273 11.525 15.302 1.00 0.00 N ATOM 1221 CA GLY A 83 -5.367 10.078 15.375 1.00 0.00 C ATOM 1222 C GLY A 83 -6.773 9.575 15.116 1.00 0.00 C ATOM 1223 O GLY A 83 -7.235 8.641 15.770 1.00 0.00 O ATOM 0 H GLY A 83 -4.552 11.876 14.672 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.686 9.636 14.648 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.041 9.745 16.360 1.00 0.00 H new ATOM 1227 N GLY A 84 -7.456 10.197 14.160 1.00 0.00 N ATOM 1228 CA GLY A 84 -8.812 9.794 13.835 1.00 0.00 C ATOM 1229 C GLY A 84 -8.867 8.439 13.159 1.00 0.00 C ATOM 1230 O GLY A 84 -8.446 7.433 13.731 1.00 0.00 O ATOM 0 H GLY A 84 -7.095 10.973 13.605 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.408 9.766 14.747 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.263 10.541 13.182 1.00 0.00 H new ATOM 1234 N LEU A 85 -9.389 8.410 11.937 1.00 0.00 N ATOM 1235 CA LEU A 85 -9.500 7.167 11.182 1.00 0.00 C ATOM 1236 C LEU A 85 -8.656 7.224 9.913 1.00 0.00 C ATOM 1237 O LEU A 85 -8.876 8.051 9.028 1.00 0.00 O ATOM 1238 CB LEU A 85 -10.961 6.893 10.824 1.00 0.00 C ATOM 1239 CG LEU A 85 -11.955 6.929 11.985 1.00 0.00 C ATOM 1240 CD1 LEU A 85 -12.395 8.357 12.267 1.00 0.00 C ATOM 1241 CD2 LEU A 85 -13.159 6.048 11.685 1.00 0.00 C ATOM 0 H LEU A 85 -9.742 9.233 11.448 1.00 0.00 H new ATOM 0 HA LEU A 85 -9.128 6.356 11.808 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.275 7.625 10.080 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.021 5.913 10.351 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.459 6.541 12.874 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -13.102 8.363 13.096 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.526 8.961 12.527 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.873 8.772 11.380 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.856 6.086 12.523 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -13.656 6.406 10.783 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -12.829 5.020 11.534 1.00 0.00 H new ATOM 1253 N PRO A 86 -7.666 6.323 9.819 1.00 0.00 N ATOM 1254 CA PRO A 86 -6.770 6.249 8.661 1.00 0.00 C ATOM 1255 C PRO A 86 -7.481 5.744 7.410 1.00 0.00 C ATOM 1256 O PRO A 86 -8.649 5.357 7.462 1.00 0.00 O ATOM 1257 CB PRO A 86 -5.697 5.252 9.105 1.00 0.00 C ATOM 1258 CG PRO A 86 -6.368 4.407 10.133 1.00 0.00 C ATOM 1259 CD PRO A 86 -7.345 5.308 10.836 1.00 0.00 C ATOM 0 HA PRO A 86 -6.375 7.228 8.388 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.344 4.651 8.267 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -4.828 5.764 9.519 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.879 3.562 9.671 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -5.642 3.996 10.834 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.234 4.765 11.156 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -6.908 5.757 11.728 1.00 0.00 H new ATOM 1267 N ILE A 87 -6.770 5.749 6.288 1.00 0.00 N ATOM 1268 CA ILE A 87 -7.333 5.289 5.024 1.00 0.00 C ATOM 1269 C ILE A 87 -6.834 3.891 4.676 1.00 0.00 C ATOM 1270 O ILE A 87 -5.761 3.475 5.114 1.00 0.00 O ATOM 1271 CB ILE A 87 -6.985 6.248 3.871 1.00 0.00 C ATOM 1272 CG1 ILE A 87 -7.479 7.661 4.186 1.00 0.00 C ATOM 1273 CG2 ILE A 87 -7.588 5.748 2.566 1.00 0.00 C ATOM 1274 CD1 ILE A 87 -6.646 8.750 3.548 1.00 0.00 C ATOM 0 H ILE A 87 -5.803 6.067 6.228 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.415 5.264 5.151 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.901 6.280 3.759 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.511 7.760 3.849 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -7.482 7.803 5.267 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.333 6.436 1.760 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.191 4.759 2.337 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.672 5.690 2.665 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.055 9.724 3.815 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.618 8.678 3.904 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.663 8.634 2.464 1.00 0.00 H new ATOM 1286 N THR A 88 -7.620 3.168 3.884 1.00 0.00 N ATOM 1287 CA THR A 88 -7.258 1.816 3.476 1.00 0.00 C ATOM 1288 C THR A 88 -7.640 1.560 2.023 1.00 0.00 C ATOM 1289 O THR A 88 -8.793 1.743 1.633 1.00 0.00 O ATOM 1290 CB THR A 88 -7.938 0.760 4.367 1.00 0.00 C ATOM 1291 OG1 THR A 88 -9.343 1.023 4.454 1.00 0.00 O ATOM 1292 CG2 THR A 88 -7.330 0.756 5.762 1.00 0.00 C ATOM 0 H THR A 88 -8.511 3.496 3.512 1.00 0.00 H new ATOM 0 HA THR A 88 -6.177 1.731 3.585 1.00 0.00 H new ATOM 0 HB THR A 88 -7.780 -0.220 3.916 1.00 0.00 H new ATOM 0 HG1 THR A 88 -9.685 1.271 3.570 1.00 0.00 H new ATOM 0 HG21 THR A 88 -7.826 0.002 6.373 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.267 0.526 5.695 1.00 0.00 H new ATOM 0 HG23 THR A 88 -7.461 1.737 6.219 1.00 0.00 H new ATOM 1300 N GLN A 89 -6.665 1.135 1.226 1.00 0.00 N ATOM 1301 CA GLN A 89 -6.900 0.854 -0.186 1.00 0.00 C ATOM 1302 C GLN A 89 -6.588 -0.603 -0.510 1.00 0.00 C ATOM 1303 O GLN A 89 -5.585 -1.151 -0.050 1.00 0.00 O ATOM 1304 CB GLN A 89 -6.049 1.777 -1.060 1.00 0.00 C ATOM 1305 CG GLN A 89 -6.347 1.652 -2.546 1.00 0.00 C ATOM 1306 CD GLN A 89 -7.532 2.494 -2.976 1.00 0.00 C ATOM 1307 OE1 GLN A 89 -8.665 2.251 -2.560 1.00 0.00 O ATOM 1308 NE2 GLN A 89 -7.276 3.493 -3.813 1.00 0.00 N ATOM 0 H GLN A 89 -5.705 0.978 1.533 1.00 0.00 H new ATOM 0 HA GLN A 89 -7.954 1.036 -0.396 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -6.212 2.809 -0.751 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -4.995 1.556 -0.889 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -5.467 1.952 -3.116 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -6.542 0.607 -2.787 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -6.322 3.659 -4.133 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -8.034 4.095 -4.136 1.00 0.00 H new ATOM 1317 N LEU A 90 -7.453 -1.226 -1.303 1.00 0.00 N ATOM 1318 CA LEU A 90 -7.270 -2.620 -1.689 1.00 0.00 C ATOM 1319 C LEU A 90 -6.593 -2.724 -3.052 1.00 0.00 C ATOM 1320 O LEU A 90 -6.837 -1.909 -3.942 1.00 0.00 O ATOM 1321 CB LEU A 90 -8.618 -3.342 -1.720 1.00 0.00 C ATOM 1322 CG LEU A 90 -8.669 -4.635 -2.535 1.00 0.00 C ATOM 1323 CD1 LEU A 90 -7.990 -5.768 -1.781 1.00 0.00 C ATOM 1324 CD2 LEU A 90 -10.108 -5.000 -2.868 1.00 0.00 C ATOM 0 H LEU A 90 -8.288 -0.787 -1.691 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.627 -3.095 -0.948 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -8.908 -3.571 -0.695 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -9.366 -2.656 -2.118 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.131 -4.474 -3.469 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.036 -6.680 -2.376 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.948 -5.508 -1.595 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -8.499 -5.929 -0.831 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -10.124 -5.923 -3.448 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -10.670 -5.142 -1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -10.562 -4.198 -3.450 1.00 0.00 H new ATOM 1336 N PHE A 91 -5.743 -3.734 -3.209 1.00 0.00 N ATOM 1337 CA PHE A 91 -5.031 -3.945 -4.464 1.00 0.00 C ATOM 1338 C PHE A 91 -5.014 -5.425 -4.837 1.00 0.00 C ATOM 1339 O PHE A 91 -4.446 -6.249 -4.121 1.00 0.00 O ATOM 1340 CB PHE A 91 -3.599 -3.418 -4.358 1.00 0.00 C ATOM 1341 CG PHE A 91 -3.522 -1.944 -4.078 1.00 0.00 C ATOM 1342 CD1 PHE A 91 -3.551 -1.470 -2.777 1.00 0.00 C ATOM 1343 CD2 PHE A 91 -3.420 -1.032 -5.117 1.00 0.00 C ATOM 1344 CE1 PHE A 91 -3.481 -0.114 -2.517 1.00 0.00 C ATOM 1345 CE2 PHE A 91 -3.350 0.324 -4.863 1.00 0.00 C ATOM 1346 CZ PHE A 91 -3.379 0.784 -3.561 1.00 0.00 C ATOM 0 H PHE A 91 -5.531 -4.419 -2.483 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.555 -3.397 -5.247 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -3.079 -3.958 -3.566 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -3.072 -3.631 -5.288 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -3.629 -2.168 -1.956 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.395 -1.386 -6.137 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -3.506 0.243 -1.498 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.273 1.024 -5.682 1.00 0.00 H new ATOM 0 HZ PHE A 91 -3.322 1.844 -3.360 1.00 0.00 H new ATOM 1356 N ARG A 92 -5.641 -5.753 -5.962 1.00 0.00 N ATOM 1357 CA ARG A 92 -5.700 -7.132 -6.429 1.00 0.00 C ATOM 1358 C ARG A 92 -4.460 -7.483 -7.247 1.00 0.00 C ATOM 1359 O ARG A 92 -4.278 -6.988 -8.360 1.00 0.00 O ATOM 1360 CB ARG A 92 -6.958 -7.355 -7.270 1.00 0.00 C ATOM 1361 CG ARG A 92 -8.202 -7.633 -6.443 1.00 0.00 C ATOM 1362 CD ARG A 92 -9.338 -8.160 -7.306 1.00 0.00 C ATOM 1363 NE ARG A 92 -9.853 -7.141 -8.216 1.00 0.00 N ATOM 1364 CZ ARG A 92 -11.000 -7.256 -8.875 1.00 0.00 C ATOM 1365 NH1 ARG A 92 -11.748 -8.341 -8.727 1.00 0.00 N ATOM 1366 NH2 ARG A 92 -11.401 -6.285 -9.686 1.00 0.00 N ATOM 0 H ARG A 92 -6.115 -5.082 -6.567 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.735 -7.783 -5.556 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.132 -6.474 -7.888 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -6.788 -8.192 -7.948 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -7.968 -8.359 -5.664 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.519 -6.719 -5.941 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.988 -9.017 -7.882 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -10.145 -8.515 -6.665 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.301 -6.294 -8.353 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.443 -9.090 -8.106 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -12.629 -8.426 -9.235 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -10.828 -5.449 -9.804 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.282 -6.374 -10.192 1.00 0.00 H new ATOM 1380 N ILE A 93 -3.610 -8.337 -6.687 1.00 0.00 N ATOM 1381 CA ILE A 93 -2.388 -8.753 -7.364 1.00 0.00 C ATOM 1382 C ILE A 93 -2.395 -10.254 -7.636 1.00 0.00 C ATOM 1383 O ILE A 93 -2.913 -11.038 -6.840 1.00 0.00 O ATOM 1384 CB ILE A 93 -1.138 -8.398 -6.538 1.00 0.00 C ATOM 1385 CG1 ILE A 93 -1.018 -6.881 -6.381 1.00 0.00 C ATOM 1386 CG2 ILE A 93 0.110 -8.968 -7.195 1.00 0.00 C ATOM 1387 CD1 ILE A 93 -0.273 -6.459 -5.134 1.00 0.00 C ATOM 0 H ILE A 93 -3.745 -8.754 -5.766 1.00 0.00 H new ATOM 0 HA ILE A 93 -2.352 -8.214 -8.311 1.00 0.00 H new ATOM 0 HB ILE A 93 -1.238 -8.840 -5.547 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -0.509 -6.473 -7.254 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -2.017 -6.446 -6.362 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.985 -8.709 -6.600 1.00 0.00 H new ATOM 0 HG22 ILE A 93 0.024 -10.053 -7.260 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.216 -8.552 -8.197 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.227 -5.371 -5.089 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -0.793 -6.837 -4.254 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.738 -6.864 -5.160 1.00 0.00 H new ATOM 1399 N LEU A 94 -1.814 -10.647 -8.764 1.00 0.00 N ATOM 1400 CA LEU A 94 -1.750 -12.055 -9.141 1.00 0.00 C ATOM 1401 C LEU A 94 -0.313 -12.565 -9.100 1.00 0.00 C ATOM 1402 O LEU A 94 0.573 -12.008 -9.747 1.00 0.00 O ATOM 1403 CB LEU A 94 -2.334 -12.256 -10.540 1.00 0.00 C ATOM 1404 CG LEU A 94 -3.832 -12.557 -10.605 1.00 0.00 C ATOM 1405 CD1 LEU A 94 -4.106 -13.992 -10.180 1.00 0.00 C ATOM 1406 CD2 LEU A 94 -4.611 -11.583 -9.734 1.00 0.00 C ATOM 0 H LEU A 94 -1.381 -10.011 -9.433 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.339 -12.625 -8.423 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.138 -11.358 -11.126 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.798 -13.074 -11.022 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.163 -12.435 -11.636 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.177 -14.189 -10.232 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.579 -14.676 -10.845 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -3.759 -14.141 -9.157 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.675 -11.813 -9.793 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.277 -11.672 -8.700 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.440 -10.565 -10.084 1.00 0.00 H new ATOM 1418 N ASN A 95 -0.090 -13.630 -8.336 1.00 0.00 N ATOM 1419 CA ASN A 95 1.240 -14.216 -8.211 1.00 0.00 C ATOM 1420 C ASN A 95 1.218 -15.696 -8.581 1.00 0.00 C ATOM 1421 O ASN A 95 1.807 -16.540 -7.904 1.00 0.00 O ATOM 1422 CB ASN A 95 1.765 -14.043 -6.785 1.00 0.00 C ATOM 1423 CG ASN A 95 3.097 -14.736 -6.571 1.00 0.00 C ATOM 1424 OD1 ASN A 95 3.267 -15.498 -5.619 1.00 0.00 O ATOM 1425 ND2 ASN A 95 4.049 -14.474 -7.459 1.00 0.00 N ATOM 0 H ASN A 95 -0.813 -14.104 -7.795 1.00 0.00 H new ATOM 0 HA ASN A 95 1.905 -13.696 -8.901 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.872 -12.980 -6.567 1.00 0.00 H new ATOM 0 HB3 ASN A 95 1.034 -14.441 -6.081 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.966 -14.911 -7.368 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.863 -13.836 -8.233 1.00 0.00 H new ATOM 1432 N PRO A 96 0.522 -16.021 -9.681 1.00 0.00 N ATOM 1433 CA PRO A 96 0.408 -17.400 -10.167 1.00 0.00 C ATOM 1434 C PRO A 96 1.725 -17.930 -10.723 1.00 0.00 C ATOM 1435 O PRO A 96 1.947 -19.139 -10.772 1.00 0.00 O ATOM 1436 CB PRO A 96 -0.640 -17.298 -11.278 1.00 0.00 C ATOM 1437 CG PRO A 96 -0.560 -15.886 -11.746 1.00 0.00 C ATOM 1438 CD PRO A 96 -0.205 -15.068 -10.536 1.00 0.00 C ATOM 0 HA PRO A 96 0.138 -18.093 -9.370 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -0.428 -17.996 -12.088 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.636 -17.536 -10.905 1.00 0.00 H new ATOM 0 HG2 PRO A 96 0.193 -15.776 -12.526 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -1.510 -15.562 -12.171 1.00 0.00 H new ATOM 0 HD2 PRO A 96 0.414 -14.210 -10.798 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -1.094 -14.679 -10.039 1.00 0.00 H new ATOM 1446 N ASN A 97 2.595 -17.017 -11.142 1.00 0.00 N ATOM 1447 CA ASN A 97 3.891 -17.393 -11.695 1.00 0.00 C ATOM 1448 C ASN A 97 4.854 -17.813 -10.589 1.00 0.00 C ATOM 1449 O ASN A 97 6.013 -18.138 -10.849 1.00 0.00 O ATOM 1450 CB ASN A 97 4.486 -16.230 -12.491 1.00 0.00 C ATOM 1451 CG ASN A 97 3.998 -16.201 -13.926 1.00 0.00 C ATOM 1452 OD1 ASN A 97 4.745 -16.510 -14.854 1.00 0.00 O ATOM 1453 ND2 ASN A 97 2.737 -15.828 -14.114 1.00 0.00 N ATOM 0 H ASN A 97 2.426 -16.012 -11.109 1.00 0.00 H new ATOM 0 HA ASN A 97 3.741 -18.242 -12.362 1.00 0.00 H new ATOM 0 HB2 ASN A 97 4.228 -15.290 -12.003 1.00 0.00 H new ATOM 0 HB3 ASN A 97 5.573 -16.306 -12.482 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.352 -15.789 -15.058 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.154 -15.580 -13.315 1.00 0.00 H new ATOM 1460 N LYS A 98 4.366 -17.804 -9.353 1.00 0.00 N ATOM 1461 CA LYS A 98 5.181 -18.185 -8.205 1.00 0.00 C ATOM 1462 C LYS A 98 6.494 -17.409 -8.189 1.00 0.00 C ATOM 1463 O LYS A 98 7.516 -17.908 -7.719 1.00 0.00 O ATOM 1464 CB LYS A 98 5.466 -19.688 -8.233 1.00 0.00 C ATOM 1465 CG LYS A 98 4.306 -20.536 -7.741 1.00 0.00 C ATOM 1466 CD LYS A 98 4.656 -22.015 -7.741 1.00 0.00 C ATOM 1467 CE LYS A 98 5.536 -22.379 -6.556 1.00 0.00 C ATOM 1468 NZ LYS A 98 5.382 -23.808 -6.168 1.00 0.00 N ATOM 0 H LYS A 98 3.409 -17.537 -9.120 1.00 0.00 H new ATOM 0 HA LYS A 98 4.625 -17.943 -7.299 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.714 -19.983 -9.252 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.342 -19.895 -7.619 1.00 0.00 H new ATOM 0 HG2 LYS A 98 4.030 -20.227 -6.733 1.00 0.00 H new ATOM 0 HG3 LYS A 98 3.436 -20.367 -8.376 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.741 -22.607 -7.711 1.00 0.00 H new ATOM 0 HD3 LYS A 98 5.170 -22.269 -8.668 1.00 0.00 H new ATOM 0 HE2 LYS A 98 6.579 -22.181 -6.804 1.00 0.00 H new ATOM 0 HE3 LYS A 98 5.283 -21.743 -5.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.999 -24.016 -5.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 4.392 -23.992 -5.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 5.647 -24.416 -6.969 1.00 0.00 H new ATOM 1482 N ALA A 99 6.459 -16.184 -8.703 1.00 0.00 N ATOM 1483 CA ALA A 99 7.645 -15.337 -8.744 1.00 0.00 C ATOM 1484 C ALA A 99 7.576 -14.244 -7.683 1.00 0.00 C ATOM 1485 O ALA A 99 6.855 -13.255 -7.822 1.00 0.00 O ATOM 1486 CB ALA A 99 7.809 -14.725 -10.127 1.00 0.00 C ATOM 0 H ALA A 99 5.621 -15.756 -9.097 1.00 0.00 H new ATOM 0 HA ALA A 99 8.514 -15.960 -8.530 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.698 -14.095 -10.143 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.913 -15.519 -10.866 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.933 -14.122 -10.364 1.00 0.00 H new ATOM 1492 N PRO A 100 8.341 -14.423 -6.597 1.00 0.00 N ATOM 1493 CA PRO A 100 8.384 -13.461 -5.491 1.00 0.00 C ATOM 1494 C PRO A 100 9.072 -12.158 -5.882 1.00 0.00 C ATOM 1495 O PRO A 100 10.296 -12.043 -5.806 1.00 0.00 O ATOM 1496 CB PRO A 100 9.193 -14.192 -4.416 1.00 0.00 C ATOM 1497 CG PRO A 100 10.039 -15.158 -5.171 1.00 0.00 C ATOM 1498 CD PRO A 100 9.225 -15.577 -6.364 1.00 0.00 C ATOM 0 HA PRO A 100 7.385 -13.168 -5.167 1.00 0.00 H new ATOM 0 HB2 PRO A 100 9.804 -13.497 -3.839 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.540 -14.705 -3.710 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.977 -14.696 -5.481 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.296 -16.018 -4.553 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.856 -15.781 -7.229 1.00 0.00 H new ATOM 0 HD3 PRO A 100 8.656 -16.485 -6.163 1.00 0.00 H new ATOM 1506 N LEU A 101 8.279 -11.178 -6.301 1.00 0.00 N ATOM 1507 CA LEU A 101 8.813 -9.881 -6.704 1.00 0.00 C ATOM 1508 C LEU A 101 8.562 -8.831 -5.627 1.00 0.00 C ATOM 1509 O LEU A 101 8.047 -9.140 -4.552 1.00 0.00 O ATOM 1510 CB LEU A 101 8.181 -9.436 -8.024 1.00 0.00 C ATOM 1511 CG LEU A 101 8.922 -9.851 -9.296 1.00 0.00 C ATOM 1512 CD1 LEU A 101 10.186 -9.025 -9.472 1.00 0.00 C ATOM 1513 CD2 LEU A 101 9.253 -11.336 -9.260 1.00 0.00 C ATOM 0 H LEU A 101 7.264 -11.256 -6.371 1.00 0.00 H new ATOM 0 HA LEU A 101 9.889 -9.985 -6.840 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.168 -9.835 -8.071 1.00 0.00 H new ATOM 0 HB3 LEU A 101 8.096 -8.349 -8.015 1.00 0.00 H new ATOM 0 HG LEU A 101 8.270 -9.665 -10.150 1.00 0.00 H new ATOM 0 HD11 LEU A 101 10.699 -9.335 -10.382 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.924 -7.970 -9.545 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.843 -9.178 -8.615 1.00 0.00 H new ATOM 0 HD21 LEU A 101 9.780 -11.614 -10.173 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.885 -11.547 -8.398 1.00 0.00 H new ATOM 0 HD23 LEU A 101 8.331 -11.913 -9.184 1.00 0.00 H new ATOM 1525 N ARG A 102 8.927 -7.588 -5.924 1.00 0.00 N ATOM 1526 CA ARG A 102 8.741 -6.491 -4.981 1.00 0.00 C ATOM 1527 C ARG A 102 7.585 -5.594 -5.413 1.00 0.00 C ATOM 1528 O ARG A 102 6.991 -5.796 -6.473 1.00 0.00 O ATOM 1529 CB ARG A 102 10.024 -5.667 -4.865 1.00 0.00 C ATOM 1530 CG ARG A 102 10.485 -5.067 -6.184 1.00 0.00 C ATOM 1531 CD ARG A 102 11.947 -4.653 -6.127 1.00 0.00 C ATOM 1532 NE ARG A 102 12.329 -3.837 -7.276 1.00 0.00 N ATOM 1533 CZ ARG A 102 13.491 -3.200 -7.371 1.00 0.00 C ATOM 1534 NH1 ARG A 102 14.380 -3.286 -6.391 1.00 0.00 N ATOM 1535 NH2 ARG A 102 13.767 -2.476 -8.448 1.00 0.00 N ATOM 0 H ARG A 102 9.353 -7.315 -6.810 1.00 0.00 H new ATOM 0 HA ARG A 102 8.503 -6.918 -4.007 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.866 -4.863 -4.146 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.817 -6.300 -4.467 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.342 -5.793 -6.985 1.00 0.00 H new ATOM 0 HG3 ARG A 102 9.870 -4.200 -6.426 1.00 0.00 H new ATOM 0 HD2 ARG A 102 12.130 -4.095 -5.209 1.00 0.00 H new ATOM 0 HD3 ARG A 102 12.575 -5.543 -6.090 1.00 0.00 H new ATOM 0 HE ARG A 102 11.668 -3.751 -8.048 1.00 0.00 H new ATOM 0 HH11 ARG A 102 14.173 -3.842 -5.562 1.00 0.00 H new ATOM 0 HH12 ARG A 102 15.271 -2.796 -6.467 1.00 0.00 H new ATOM 0 HH21 ARG A 102 13.087 -2.408 -9.205 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.660 -1.988 -8.519 1.00 0.00 H new ATOM 1549 N LEU A 103 7.270 -4.604 -4.585 1.00 0.00 N ATOM 1550 CA LEU A 103 6.184 -3.675 -4.881 1.00 0.00 C ATOM 1551 C LEU A 103 6.631 -2.232 -4.673 1.00 0.00 C ATOM 1552 O LEU A 103 7.128 -1.871 -3.606 1.00 0.00 O ATOM 1553 CB LEU A 103 4.973 -3.979 -3.997 1.00 0.00 C ATOM 1554 CG LEU A 103 4.022 -2.810 -3.738 1.00 0.00 C ATOM 1555 CD1 LEU A 103 3.212 -2.495 -4.986 1.00 0.00 C ATOM 1556 CD2 LEU A 103 3.101 -3.121 -2.567 1.00 0.00 C ATOM 0 H LEU A 103 7.751 -4.424 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 103 5.904 -3.802 -5.927 1.00 0.00 H new ATOM 0 HB2 LEU A 103 4.406 -4.788 -4.458 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.333 -4.349 -3.037 1.00 0.00 H new ATOM 0 HG LEU A 103 4.616 -1.932 -3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.541 -1.661 -4.783 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.886 -2.229 -5.800 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.628 -3.370 -5.271 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.431 -2.278 -2.397 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.514 -4.011 -2.792 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.697 -3.297 -1.672 1.00 0.00 H new ATOM 1568 N LYS A 104 6.449 -1.408 -5.700 1.00 0.00 N ATOM 1569 CA LYS A 104 6.829 -0.002 -5.630 1.00 0.00 C ATOM 1570 C LYS A 104 5.697 0.840 -5.052 1.00 0.00 C ATOM 1571 O LYS A 104 4.549 0.738 -5.487 1.00 0.00 O ATOM 1572 CB LYS A 104 7.205 0.515 -7.021 1.00 0.00 C ATOM 1573 CG LYS A 104 7.652 1.966 -7.030 1.00 0.00 C ATOM 1574 CD LYS A 104 7.881 2.471 -8.444 1.00 0.00 C ATOM 1575 CE LYS A 104 8.792 3.689 -8.461 1.00 0.00 C ATOM 1576 NZ LYS A 104 8.023 4.958 -8.338 1.00 0.00 N ATOM 0 H LYS A 104 6.040 -1.690 -6.591 1.00 0.00 H new ATOM 0 HA LYS A 104 7.693 0.083 -4.971 1.00 0.00 H new ATOM 0 HB2 LYS A 104 8.005 -0.105 -7.426 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.348 0.404 -7.685 1.00 0.00 H new ATOM 0 HG2 LYS A 104 6.898 2.583 -6.540 1.00 0.00 H new ATOM 0 HG3 LYS A 104 8.571 2.068 -6.453 1.00 0.00 H new ATOM 0 HD2 LYS A 104 8.321 1.678 -9.048 1.00 0.00 H new ATOM 0 HD3 LYS A 104 6.924 2.725 -8.900 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.509 3.618 -7.643 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.366 3.700 -9.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.679 5.765 -8.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.357 5.038 -9.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 7.495 4.959 -7.442 1.00 0.00 H new ATOM 1590 N LEU A 105 6.026 1.672 -4.070 1.00 0.00 N ATOM 1591 CA LEU A 105 5.036 2.534 -3.433 1.00 0.00 C ATOM 1592 C LEU A 105 5.415 4.003 -3.586 1.00 0.00 C ATOM 1593 O LEU A 105 6.572 4.380 -3.396 1.00 0.00 O ATOM 1594 CB LEU A 105 4.903 2.181 -1.951 1.00 0.00 C ATOM 1595 CG LEU A 105 3.920 1.059 -1.613 1.00 0.00 C ATOM 1596 CD1 LEU A 105 4.041 0.666 -0.149 1.00 0.00 C ATOM 1597 CD2 LEU A 105 2.495 1.484 -1.937 1.00 0.00 C ATOM 0 H LEU A 105 6.971 1.768 -3.697 1.00 0.00 H new ATOM 0 HA LEU A 105 4.077 2.372 -3.926 1.00 0.00 H new ATOM 0 HB2 LEU A 105 5.887 1.900 -1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.600 3.078 -1.410 1.00 0.00 H new ATOM 0 HG LEU A 105 4.167 0.190 -2.222 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.334 -0.133 0.073 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.055 0.320 0.052 1.00 0.00 H new ATOM 0 HD13 LEU A 105 3.821 1.529 0.479 1.00 0.00 H new ATOM 0 HD21 LEU A 105 1.809 0.674 -1.690 1.00 0.00 H new ATOM 0 HD22 LEU A 105 2.237 2.368 -1.354 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.417 1.715 -2.999 1.00 0.00 H new ATOM 1609 N ARG A 106 4.432 4.830 -3.928 1.00 0.00 N ATOM 1610 CA ARG A 106 4.662 6.259 -4.105 1.00 0.00 C ATOM 1611 C ARG A 106 3.639 7.075 -3.320 1.00 0.00 C ATOM 1612 O ARG A 106 2.431 6.909 -3.493 1.00 0.00 O ATOM 1613 CB ARG A 106 4.594 6.628 -5.588 1.00 0.00 C ATOM 1614 CG ARG A 106 4.366 8.110 -5.837 1.00 0.00 C ATOM 1615 CD ARG A 106 4.882 8.531 -7.204 1.00 0.00 C ATOM 1616 NE ARG A 106 4.135 9.662 -7.747 1.00 0.00 N ATOM 1617 CZ ARG A 106 4.582 10.434 -8.730 1.00 0.00 C ATOM 1618 NH1 ARG A 106 5.768 10.199 -9.276 1.00 0.00 N ATOM 1619 NH2 ARG A 106 3.843 11.445 -9.170 1.00 0.00 N ATOM 0 H ARG A 106 3.469 4.535 -4.088 1.00 0.00 H new ATOM 0 HA ARG A 106 5.657 6.492 -3.725 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.523 6.326 -6.072 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.790 6.061 -6.058 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.301 8.333 -5.764 1.00 0.00 H new ATOM 0 HG3 ARG A 106 4.867 8.691 -5.063 1.00 0.00 H new ATOM 0 HD2 ARG A 106 5.936 8.796 -7.127 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.815 7.688 -7.892 1.00 0.00 H new ATOM 0 HE ARG A 106 3.219 9.870 -7.349 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.339 9.423 -8.941 1.00 0.00 H new ATOM 0 HH12 ARG A 106 6.109 10.794 -10.031 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.931 11.629 -8.753 1.00 0.00 H new ATOM 0 HH22 ARG A 106 4.187 12.038 -9.925 1.00 0.00 H new ATOM 1633 N LEU A 107 4.131 7.956 -2.456 1.00 0.00 N ATOM 1634 CA LEU A 107 3.261 8.799 -1.643 1.00 0.00 C ATOM 1635 C LEU A 107 3.407 10.267 -2.031 1.00 0.00 C ATOM 1636 O LEU A 107 4.519 10.780 -2.155 1.00 0.00 O ATOM 1637 CB LEU A 107 3.584 8.617 -0.159 1.00 0.00 C ATOM 1638 CG LEU A 107 3.659 7.174 0.340 1.00 0.00 C ATOM 1639 CD1 LEU A 107 3.953 7.140 1.832 1.00 0.00 C ATOM 1640 CD2 LEU A 107 2.365 6.435 0.032 1.00 0.00 C ATOM 0 H LEU A 107 5.128 8.105 -2.300 1.00 0.00 H new ATOM 0 HA LEU A 107 2.230 8.496 -1.824 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.539 9.101 0.046 1.00 0.00 H new ATOM 0 HB3 LEU A 107 2.828 9.143 0.424 1.00 0.00 H new ATOM 0 HG LEU A 107 4.474 6.671 -0.181 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.003 6.105 2.170 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.906 7.631 2.026 1.00 0.00 H new ATOM 0 HD13 LEU A 107 3.161 7.660 2.371 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.437 5.409 0.394 1.00 0.00 H new ATOM 0 HD22 LEU A 107 1.533 6.937 0.526 1.00 0.00 H new ATOM 0 HD23 LEU A 107 2.197 6.428 -1.045 1.00 0.00 H new ATOM 1652 N THR A 108 2.275 10.939 -2.221 1.00 0.00 N ATOM 1653 CA THR A 108 2.277 12.348 -2.594 1.00 0.00 C ATOM 1654 C THR A 108 1.058 13.067 -2.028 1.00 0.00 C ATOM 1655 O THR A 108 -0.079 12.754 -2.381 1.00 0.00 O ATOM 1656 CB THR A 108 2.298 12.524 -4.124 1.00 0.00 C ATOM 1657 OG1 THR A 108 1.548 11.476 -4.748 1.00 0.00 O ATOM 1658 CG2 THR A 108 3.726 12.515 -4.649 1.00 0.00 C ATOM 0 H THR A 108 1.346 10.530 -2.123 1.00 0.00 H new ATOM 0 HA THR A 108 3.182 12.786 -2.173 1.00 0.00 H new ATOM 0 HB THR A 108 1.845 13.486 -4.364 1.00 0.00 H new ATOM 0 HG1 THR A 108 0.682 11.381 -4.299 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.716 12.641 -5.732 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.286 13.332 -4.194 1.00 0.00 H new ATOM 0 HG23 THR A 108 4.200 11.566 -4.398 1.00 0.00 H new ATOM 1666 N TYR A 109 1.302 14.033 -1.150 1.00 0.00 N ATOM 1667 CA TYR A 109 0.223 14.797 -0.534 1.00 0.00 C ATOM 1668 C TYR A 109 0.757 16.075 0.107 1.00 0.00 C ATOM 1669 O TYR A 109 1.959 16.336 0.088 1.00 0.00 O ATOM 1670 CB TYR A 109 -0.495 13.948 0.517 1.00 0.00 C ATOM 1671 CG TYR A 109 0.424 13.403 1.587 1.00 0.00 C ATOM 1672 CD1 TYR A 109 1.053 12.175 1.429 1.00 0.00 C ATOM 1673 CD2 TYR A 109 0.662 14.116 2.755 1.00 0.00 C ATOM 1674 CE1 TYR A 109 1.893 11.672 2.404 1.00 0.00 C ATOM 1675 CE2 TYR A 109 1.501 13.623 3.735 1.00 0.00 C ATOM 1676 CZ TYR A 109 2.115 12.400 3.555 1.00 0.00 C ATOM 1677 OH TYR A 109 2.950 11.904 4.529 1.00 0.00 O ATOM 0 H TYR A 109 2.237 14.306 -0.848 1.00 0.00 H new ATOM 0 HA TYR A 109 -0.485 15.072 -1.315 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -1.272 14.550 0.989 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.994 13.116 0.020 1.00 0.00 H new ATOM 0 HD1 TYR A 109 0.883 11.603 0.529 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.182 15.073 2.899 1.00 0.00 H new ATOM 0 HE1 TYR A 109 2.373 10.714 2.266 1.00 0.00 H new ATOM 0 HE2 TYR A 109 1.676 14.191 4.637 1.00 0.00 H new ATOM 0 HH TYR A 109 3.188 12.622 5.152 1.00 0.00 H new ATOM 1687 N ASP A 110 -0.147 16.866 0.673 1.00 0.00 N ATOM 1688 CA ASP A 110 0.231 18.117 1.322 1.00 0.00 C ATOM 1689 C ASP A 110 0.224 17.965 2.840 1.00 0.00 C ATOM 1690 O ASP A 110 -0.761 17.511 3.424 1.00 0.00 O ATOM 1691 CB ASP A 110 -0.719 19.240 0.905 1.00 0.00 C ATOM 1692 CG ASP A 110 -0.554 19.627 -0.552 1.00 0.00 C ATOM 1693 OD1 ASP A 110 0.584 19.551 -1.060 1.00 0.00 O ATOM 1694 OD2 ASP A 110 -1.562 20.007 -1.184 1.00 0.00 O ATOM 0 H ASP A 110 -1.147 16.664 0.696 1.00 0.00 H new ATOM 0 HA ASP A 110 1.242 18.371 1.005 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.748 18.925 1.080 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -0.542 20.114 1.532 1.00 0.00 H new ATOM 1699 N HIS A 111 1.328 18.347 3.473 1.00 0.00 N ATOM 1700 CA HIS A 111 1.449 18.254 4.924 1.00 0.00 C ATOM 1701 C HIS A 111 2.150 19.484 5.491 1.00 0.00 C ATOM 1702 O HIS A 111 3.263 19.820 5.085 1.00 0.00 O ATOM 1703 CB HIS A 111 2.218 16.990 5.312 1.00 0.00 C ATOM 1704 CG HIS A 111 1.813 16.427 6.639 1.00 0.00 C ATOM 1705 ND1 HIS A 111 2.540 15.458 7.299 1.00 0.00 N ATOM 1706 CD2 HIS A 111 0.751 16.703 7.431 1.00 0.00 C ATOM 1707 CE1 HIS A 111 1.941 15.161 8.438 1.00 0.00 C ATOM 1708 NE2 HIS A 111 0.853 15.903 8.543 1.00 0.00 N ATOM 0 H HIS A 111 2.152 18.724 3.004 1.00 0.00 H new ATOM 0 HA HIS A 111 0.445 18.204 5.345 1.00 0.00 H new ATOM 0 HB2 HIS A 111 2.067 16.232 4.543 1.00 0.00 H new ATOM 0 HB3 HIS A 111 3.284 17.215 5.332 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -0.031 17.419 7.227 1.00 0.00 H new ATOM 0 HE1 HIS A 111 2.283 14.435 9.161 1.00 0.00 H new ATOM 0 HE2 HIS A 111 0.196 15.885 9.323 1.00 0.00 H new ATOM 1716 N PHE A 112 1.491 20.154 6.431 1.00 0.00 N ATOM 1717 CA PHE A 112 2.051 21.349 7.053 1.00 0.00 C ATOM 1718 C PHE A 112 2.239 22.460 6.024 1.00 0.00 C ATOM 1719 O PHE A 112 3.188 23.240 6.103 1.00 0.00 O ATOM 1720 CB PHE A 112 3.389 21.023 7.720 1.00 0.00 C ATOM 1721 CG PHE A 112 3.248 20.486 9.115 1.00 0.00 C ATOM 1722 CD1 PHE A 112 2.805 21.301 10.144 1.00 0.00 C ATOM 1723 CD2 PHE A 112 3.559 19.165 9.397 1.00 0.00 C ATOM 1724 CE1 PHE A 112 2.676 20.809 11.429 1.00 0.00 C ATOM 1725 CE2 PHE A 112 3.431 18.667 10.680 1.00 0.00 C ATOM 1726 CZ PHE A 112 2.988 19.490 11.697 1.00 0.00 C ATOM 0 H PHE A 112 0.569 19.890 6.779 1.00 0.00 H new ATOM 0 HA PHE A 112 1.350 21.696 7.812 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.921 20.293 7.110 1.00 0.00 H new ATOM 0 HB3 PHE A 112 4.002 21.924 7.746 1.00 0.00 H new ATOM 0 HD1 PHE A 112 2.558 22.332 9.940 1.00 0.00 H new ATOM 0 HD2 PHE A 112 3.905 18.517 8.605 1.00 0.00 H new ATOM 0 HE1 PHE A 112 2.332 21.455 12.223 1.00 0.00 H new ATOM 0 HE2 PHE A 112 3.677 17.636 10.887 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.886 19.103 12.700 1.00 0.00 H new ATOM 1736 N HIS A 113 1.328 22.524 5.058 1.00 0.00 N ATOM 1737 CA HIS A 113 1.392 23.539 4.013 1.00 0.00 C ATOM 1738 C HIS A 113 2.677 23.403 3.202 1.00 0.00 C ATOM 1739 O HIS A 113 3.389 24.382 2.981 1.00 0.00 O ATOM 1740 CB HIS A 113 1.308 24.938 4.625 1.00 0.00 C ATOM 1741 CG HIS A 113 -0.046 25.272 5.172 1.00 0.00 C ATOM 1742 ND1 HIS A 113 -0.592 26.536 5.109 1.00 0.00 N ATOM 1743 CD2 HIS A 113 -0.965 24.497 5.794 1.00 0.00 C ATOM 1744 CE1 HIS A 113 -1.788 26.525 5.669 1.00 0.00 C ATOM 1745 NE2 HIS A 113 -2.039 25.299 6.093 1.00 0.00 N ATOM 0 H HIS A 113 0.537 21.885 4.977 1.00 0.00 H new ATOM 0 HA HIS A 113 0.543 23.391 3.345 1.00 0.00 H new ATOM 0 HB2 HIS A 113 2.044 25.021 5.424 1.00 0.00 H new ATOM 0 HB3 HIS A 113 1.576 25.674 3.867 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -0.871 23.444 6.014 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -2.449 27.374 5.764 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -2.891 24.997 6.565 1.00 0.00 H new ATOM 1753 N GLN A 114 2.967 22.183 2.762 1.00 0.00 N ATOM 1754 CA GLN A 114 4.167 21.919 1.976 1.00 0.00 C ATOM 1755 C GLN A 114 3.996 20.665 1.125 1.00 0.00 C ATOM 1756 O GLN A 114 3.370 19.694 1.551 1.00 0.00 O ATOM 1757 CB GLN A 114 5.380 21.765 2.896 1.00 0.00 C ATOM 1758 CG GLN A 114 5.666 20.324 3.288 1.00 0.00 C ATOM 1759 CD GLN A 114 6.508 20.218 4.545 1.00 0.00 C ATOM 1760 OE1 GLN A 114 6.515 21.124 5.379 1.00 0.00 O ATOM 1761 NE2 GLN A 114 7.222 19.108 4.687 1.00 0.00 N ATOM 0 H GLN A 114 2.388 21.362 2.936 1.00 0.00 H new ATOM 0 HA GLN A 114 4.329 22.767 1.311 1.00 0.00 H new ATOM 0 HB2 GLN A 114 6.257 22.179 2.399 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.218 22.353 3.799 1.00 0.00 H new ATOM 0 HG2 GLN A 114 4.723 19.799 3.441 1.00 0.00 H new ATOM 0 HG3 GLN A 114 6.180 19.823 2.467 1.00 0.00 H new ATOM 0 HE21 GLN A 114 7.186 18.383 3.970 1.00 0.00 H new ATOM 0 HE22 GLN A 114 7.807 18.980 5.513 1.00 0.00 H new ATOM 1770 N SER A 115 4.556 20.692 -0.080 1.00 0.00 N ATOM 1771 CA SER A 115 4.462 19.559 -0.992 1.00 0.00 C ATOM 1772 C SER A 115 5.420 18.446 -0.577 1.00 0.00 C ATOM 1773 O SER A 115 6.636 18.573 -0.717 1.00 0.00 O ATOM 1774 CB SER A 115 4.769 20.003 -2.424 1.00 0.00 C ATOM 1775 OG SER A 115 6.094 20.493 -2.533 1.00 0.00 O ATOM 0 H SER A 115 5.080 21.487 -0.447 1.00 0.00 H new ATOM 0 HA SER A 115 3.443 19.173 -0.949 1.00 0.00 H new ATOM 0 HB2 SER A 115 4.631 19.164 -3.106 1.00 0.00 H new ATOM 0 HB3 SER A 115 4.065 20.778 -2.726 1.00 0.00 H new ATOM 0 HG SER A 115 6.676 20.002 -1.916 1.00 0.00 H new ATOM 1781 N VAL A 116 4.861 17.354 -0.064 1.00 0.00 N ATOM 1782 CA VAL A 116 5.663 16.217 0.371 1.00 0.00 C ATOM 1783 C VAL A 116 5.584 15.072 -0.632 1.00 0.00 C ATOM 1784 O VAL A 116 4.500 14.573 -0.934 1.00 0.00 O ATOM 1785 CB VAL A 116 5.211 15.707 1.752 1.00 0.00 C ATOM 1786 CG1 VAL A 116 5.970 14.445 2.130 1.00 0.00 C ATOM 1787 CG2 VAL A 116 5.399 16.788 2.806 1.00 0.00 C ATOM 0 H VAL A 116 3.856 17.233 0.060 1.00 0.00 H new ATOM 0 HA VAL A 116 6.694 16.565 0.440 1.00 0.00 H new ATOM 0 HB VAL A 116 4.150 15.462 1.700 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.637 14.100 3.109 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.780 13.670 1.388 1.00 0.00 H new ATOM 0 HG13 VAL A 116 7.038 14.660 2.165 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.075 16.411 3.776 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.452 17.066 2.858 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.806 17.663 2.540 1.00 0.00 H new ATOM 1797 N GLN A 117 6.739 14.661 -1.145 1.00 0.00 N ATOM 1798 CA GLN A 117 6.800 13.574 -2.115 1.00 0.00 C ATOM 1799 C GLN A 117 7.906 12.586 -1.757 1.00 0.00 C ATOM 1800 O GLN A 117 9.087 12.866 -1.956 1.00 0.00 O ATOM 1801 CB GLN A 117 7.031 14.130 -3.521 1.00 0.00 C ATOM 1802 CG GLN A 117 7.345 13.059 -4.554 1.00 0.00 C ATOM 1803 CD GLN A 117 7.942 13.632 -5.825 1.00 0.00 C ATOM 1804 OE1 GLN A 117 7.220 14.008 -6.749 1.00 0.00 O ATOM 1805 NE2 GLN A 117 9.267 13.702 -5.878 1.00 0.00 N ATOM 0 H GLN A 117 7.645 15.064 -0.905 1.00 0.00 H new ATOM 0 HA GLN A 117 5.846 13.047 -2.093 1.00 0.00 H new ATOM 0 HB2 GLN A 117 6.143 14.678 -3.836 1.00 0.00 H new ATOM 0 HB3 GLN A 117 7.853 14.845 -3.490 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.039 12.337 -4.124 1.00 0.00 H new ATOM 0 HG3 GLN A 117 6.432 12.516 -4.798 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.827 13.379 -5.089 1.00 0.00 H new ATOM 0 HE22 GLN A 117 9.725 14.079 -6.708 1.00 0.00 H new ATOM 1814 N GLU A 118 7.513 11.431 -1.229 1.00 0.00 N ATOM 1815 CA GLU A 118 8.472 10.403 -0.843 1.00 0.00 C ATOM 1816 C GLU A 118 8.204 9.100 -1.591 1.00 0.00 C ATOM 1817 O GLU A 118 7.109 8.542 -1.512 1.00 0.00 O ATOM 1818 CB GLU A 118 8.412 10.159 0.667 1.00 0.00 C ATOM 1819 CG GLU A 118 8.863 11.351 1.494 1.00 0.00 C ATOM 1820 CD GLU A 118 10.366 11.389 1.693 1.00 0.00 C ATOM 1821 OE1 GLU A 118 10.868 10.651 2.566 1.00 0.00 O ATOM 1822 OE2 GLU A 118 11.040 12.155 0.973 1.00 0.00 O ATOM 0 H GLU A 118 6.538 11.184 -1.059 1.00 0.00 H new ATOM 0 HA GLU A 118 9.469 10.755 -1.108 1.00 0.00 H new ATOM 0 HB2 GLU A 118 7.390 9.901 0.945 1.00 0.00 H new ATOM 0 HB3 GLU A 118 9.036 9.300 0.913 1.00 0.00 H new ATOM 0 HG2 GLU A 118 8.542 12.270 1.004 1.00 0.00 H new ATOM 0 HG3 GLU A 118 8.372 11.320 2.467 1.00 0.00 H new ATOM 1829 N ILE A 119 9.210 8.623 -2.316 1.00 0.00 N ATOM 1830 CA ILE A 119 9.083 7.387 -3.077 1.00 0.00 C ATOM 1831 C ILE A 119 10.051 6.325 -2.566 1.00 0.00 C ATOM 1832 O ILE A 119 11.264 6.532 -2.549 1.00 0.00 O ATOM 1833 CB ILE A 119 9.341 7.621 -4.577 1.00 0.00 C ATOM 1834 CG1 ILE A 119 8.222 8.470 -5.183 1.00 0.00 C ATOM 1835 CG2 ILE A 119 9.459 6.291 -5.308 1.00 0.00 C ATOM 1836 CD1 ILE A 119 8.634 9.207 -6.438 1.00 0.00 C ATOM 0 H ILE A 119 10.122 9.074 -2.392 1.00 0.00 H new ATOM 0 HA ILE A 119 8.059 7.037 -2.943 1.00 0.00 H new ATOM 0 HB ILE A 119 10.282 8.160 -4.689 1.00 0.00 H new ATOM 0 HG12 ILE A 119 7.372 7.827 -5.412 1.00 0.00 H new ATOM 0 HG13 ILE A 119 7.884 9.193 -4.441 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.641 6.473 -6.367 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.287 5.719 -4.890 1.00 0.00 H new ATOM 0 HG23 ILE A 119 8.533 5.728 -5.191 1.00 0.00 H new ATOM 0 HD11 ILE A 119 7.791 9.788 -6.812 1.00 0.00 H new ATOM 0 HD12 ILE A 119 9.464 9.876 -6.211 1.00 0.00 H new ATOM 0 HD13 ILE A 119 8.944 8.488 -7.197 1.00 0.00 H new ATOM 1848 N PHE A 120 9.505 5.186 -2.150 1.00 0.00 N ATOM 1849 CA PHE A 120 10.320 4.090 -1.639 1.00 0.00 C ATOM 1850 C PHE A 120 9.815 2.748 -2.161 1.00 0.00 C ATOM 1851 O PHE A 120 8.647 2.611 -2.522 1.00 0.00 O ATOM 1852 CB PHE A 120 10.312 4.091 -0.109 1.00 0.00 C ATOM 1853 CG PHE A 120 8.931 4.112 0.483 1.00 0.00 C ATOM 1854 CD1 PHE A 120 8.165 2.958 0.527 1.00 0.00 C ATOM 1855 CD2 PHE A 120 8.400 5.285 0.994 1.00 0.00 C ATOM 1856 CE1 PHE A 120 6.895 2.974 1.072 1.00 0.00 C ATOM 1857 CE2 PHE A 120 7.131 5.306 1.540 1.00 0.00 C ATOM 1858 CZ PHE A 120 6.376 4.150 1.578 1.00 0.00 C ATOM 0 H PHE A 120 8.502 4.999 -2.157 1.00 0.00 H new ATOM 0 HA PHE A 120 11.342 4.235 -1.990 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.839 3.207 0.250 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.865 4.959 0.249 1.00 0.00 H new ATOM 0 HD1 PHE A 120 8.565 2.036 0.131 1.00 0.00 H new ATOM 0 HD2 PHE A 120 8.984 6.193 0.965 1.00 0.00 H new ATOM 0 HE1 PHE A 120 6.309 2.068 1.102 1.00 0.00 H new ATOM 0 HE2 PHE A 120 6.729 6.226 1.937 1.00 0.00 H new ATOM 0 HZ PHE A 120 5.383 4.165 2.002 1.00 0.00 H new ATOM 1868 N GLU A 121 10.706 1.762 -2.198 1.00 0.00 N ATOM 1869 CA GLU A 121 10.351 0.431 -2.677 1.00 0.00 C ATOM 1870 C GLU A 121 10.543 -0.612 -1.579 1.00 0.00 C ATOM 1871 O GLU A 121 11.658 -0.836 -1.108 1.00 0.00 O ATOM 1872 CB GLU A 121 11.195 0.062 -3.898 1.00 0.00 C ATOM 1873 CG GLU A 121 11.125 1.087 -5.018 1.00 0.00 C ATOM 1874 CD GLU A 121 11.793 2.398 -4.653 1.00 0.00 C ATOM 1875 OE1 GLU A 121 13.035 2.417 -4.527 1.00 0.00 O ATOM 1876 OE2 GLU A 121 11.072 3.405 -4.492 1.00 0.00 O ATOM 0 H GLU A 121 11.677 1.859 -1.903 1.00 0.00 H new ATOM 0 HA GLU A 121 9.299 0.445 -2.962 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.234 -0.056 -3.589 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.864 -0.904 -4.280 1.00 0.00 H new ATOM 0 HG2 GLU A 121 11.600 0.678 -5.910 1.00 0.00 H new ATOM 0 HG3 GLU A 121 10.081 1.273 -5.270 1.00 0.00 H new ATOM 1883 N VAL A 122 9.447 -1.246 -1.175 1.00 0.00 N ATOM 1884 CA VAL A 122 9.493 -2.265 -0.134 1.00 0.00 C ATOM 1885 C VAL A 122 10.317 -3.469 -0.579 1.00 0.00 C ATOM 1886 O VAL A 122 9.945 -4.177 -1.514 1.00 0.00 O ATOM 1887 CB VAL A 122 8.079 -2.739 0.251 1.00 0.00 C ATOM 1888 CG1 VAL A 122 8.138 -3.681 1.445 1.00 0.00 C ATOM 1889 CG2 VAL A 122 7.181 -1.547 0.546 1.00 0.00 C ATOM 0 H VAL A 122 8.516 -1.072 -1.553 1.00 0.00 H new ATOM 0 HA VAL A 122 9.964 -1.807 0.736 1.00 0.00 H new ATOM 0 HB VAL A 122 7.655 -3.285 -0.592 1.00 0.00 H new ATOM 0 HG11 VAL A 122 7.130 -4.005 1.703 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.746 -4.550 1.193 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.581 -3.163 2.296 1.00 0.00 H new ATOM 0 HG21 VAL A 122 6.186 -1.899 0.816 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.599 -0.972 1.372 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.114 -0.914 -0.339 1.00 0.00 H new ATOM 1899 N ASN A 123 11.438 -3.695 0.099 1.00 0.00 N ATOM 1900 CA ASN A 123 12.315 -4.813 -0.227 1.00 0.00 C ATOM 1901 C ASN A 123 12.416 -5.785 0.945 1.00 0.00 C ATOM 1902 O ASN A 123 13.316 -6.621 0.996 1.00 0.00 O ATOM 1903 CB ASN A 123 13.708 -4.304 -0.602 1.00 0.00 C ATOM 1904 CG ASN A 123 14.568 -4.022 0.614 1.00 0.00 C ATOM 1905 OD1 ASN A 123 14.592 -2.902 1.126 1.00 0.00 O ATOM 1906 ND2 ASN A 123 15.280 -5.040 1.084 1.00 0.00 N ATOM 0 H ASN A 123 11.760 -3.119 0.877 1.00 0.00 H new ATOM 0 HA ASN A 123 11.887 -5.341 -1.079 1.00 0.00 H new ATOM 0 HB2 ASN A 123 14.204 -5.043 -1.231 1.00 0.00 H new ATOM 0 HB3 ASN A 123 13.612 -3.394 -1.194 1.00 0.00 H new ATOM 0 HD21 ASN A 123 15.877 -4.911 1.901 1.00 0.00 H new ATOM 0 HD22 ASN A 123 15.230 -5.951 0.628 1.00 0.00 H new ATOM 1913 N ASN A 124 11.484 -5.667 1.885 1.00 0.00 N ATOM 1914 CA ASN A 124 11.467 -6.535 3.058 1.00 0.00 C ATOM 1915 C ASN A 124 10.155 -7.309 3.143 1.00 0.00 C ATOM 1916 O ASN A 124 9.844 -7.915 4.170 1.00 0.00 O ATOM 1917 CB ASN A 124 11.670 -5.711 4.331 1.00 0.00 C ATOM 1918 CG ASN A 124 10.744 -4.512 4.398 1.00 0.00 C ATOM 1919 OD1 ASN A 124 10.535 -3.819 3.402 1.00 0.00 O ATOM 1920 ND2 ASN A 124 10.183 -4.263 5.576 1.00 0.00 N ATOM 0 H ASN A 124 10.731 -4.980 1.858 1.00 0.00 H new ATOM 0 HA ASN A 124 12.284 -7.250 2.962 1.00 0.00 H new ATOM 0 HB2 ASN A 124 11.502 -6.345 5.202 1.00 0.00 H new ATOM 0 HB3 ASN A 124 12.704 -5.371 4.379 1.00 0.00 H new ATOM 0 HD21 ASN A 124 9.550 -3.470 5.682 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.385 -4.865 6.375 1.00 0.00 H new ATOM 1927 N LEU A 125 9.389 -7.285 2.058 1.00 0.00 N ATOM 1928 CA LEU A 125 8.109 -7.984 2.009 1.00 0.00 C ATOM 1929 C LEU A 125 8.223 -9.371 2.634 1.00 0.00 C ATOM 1930 O LEU A 125 9.264 -10.026 2.566 1.00 0.00 O ATOM 1931 CB LEU A 125 7.625 -8.101 0.563 1.00 0.00 C ATOM 1932 CG LEU A 125 7.434 -6.784 -0.189 1.00 0.00 C ATOM 1933 CD1 LEU A 125 7.548 -7.005 -1.690 1.00 0.00 C ATOM 1934 CD2 LEU A 125 6.090 -6.160 0.159 1.00 0.00 C ATOM 0 H LEU A 125 9.632 -6.789 1.200 1.00 0.00 H new ATOM 0 HA LEU A 125 7.384 -7.406 2.582 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.339 -8.712 0.010 1.00 0.00 H new ATOM 0 HB3 LEU A 125 6.677 -8.638 0.561 1.00 0.00 H new ATOM 0 HG LEU A 125 8.222 -6.096 0.118 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.409 -6.057 -2.209 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.534 -7.406 -1.925 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.783 -7.711 -2.013 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.972 -5.223 -0.386 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.288 -6.845 -0.118 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.046 -5.965 1.230 1.00 0.00 H new ATOM 1946 N PRO A 126 7.128 -9.833 3.255 1.00 0.00 N ATOM 1947 CA PRO A 126 7.079 -11.148 3.901 1.00 0.00 C ATOM 1948 C PRO A 126 7.107 -12.291 2.892 1.00 0.00 C ATOM 1949 O PRO A 126 6.555 -12.179 1.797 1.00 0.00 O ATOM 1950 CB PRO A 126 5.742 -11.127 4.647 1.00 0.00 C ATOM 1951 CG PRO A 126 4.904 -10.150 3.897 1.00 0.00 C ATOM 1952 CD PRO A 126 5.853 -9.106 3.374 1.00 0.00 C ATOM 0 HA PRO A 126 7.941 -11.317 4.546 1.00 0.00 H new ATOM 0 HB2 PRO A 126 5.281 -12.115 4.661 1.00 0.00 H new ATOM 0 HB3 PRO A 126 5.873 -10.821 5.685 1.00 0.00 H new ATOM 0 HG2 PRO A 126 4.372 -10.638 3.080 1.00 0.00 H new ATOM 0 HG3 PRO A 126 4.151 -9.703 4.546 1.00 0.00 H new ATOM 0 HD2 PRO A 126 5.525 -8.710 2.413 1.00 0.00 H new ATOM 0 HD3 PRO A 126 5.935 -8.260 4.056 1.00 0.00 H new ATOM 1960 N VAL A 127 7.753 -13.390 3.267 1.00 0.00 N ATOM 1961 CA VAL A 127 7.852 -14.554 2.395 1.00 0.00 C ATOM 1962 C VAL A 127 6.530 -15.312 2.338 1.00 0.00 C ATOM 1963 O VAL A 127 6.122 -15.788 1.280 1.00 0.00 O ATOM 1964 CB VAL A 127 8.962 -15.514 2.864 1.00 0.00 C ATOM 1965 CG1 VAL A 127 10.318 -14.827 2.814 1.00 0.00 C ATOM 1966 CG2 VAL A 127 8.665 -16.026 4.265 1.00 0.00 C ATOM 0 H VAL A 127 8.216 -13.499 4.169 1.00 0.00 H new ATOM 0 HA VAL A 127 8.099 -14.184 1.400 1.00 0.00 H new ATOM 0 HB VAL A 127 8.990 -16.369 2.188 1.00 0.00 H new ATOM 0 HG11 VAL A 127 11.090 -15.520 3.149 1.00 0.00 H new ATOM 0 HG12 VAL A 127 10.530 -14.514 1.792 1.00 0.00 H new ATOM 0 HG13 VAL A 127 10.308 -13.953 3.466 1.00 0.00 H new ATOM 0 HG21 VAL A 127 9.459 -16.703 4.581 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.609 -15.185 4.956 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.714 -16.558 4.264 1.00 0.00 H new ATOM 1976 N GLU A 128 5.866 -15.418 3.484 1.00 0.00 N ATOM 1977 CA GLU A 128 4.589 -16.118 3.564 1.00 0.00 C ATOM 1978 C GLU A 128 3.741 -15.847 2.325 1.00 0.00 C ATOM 1979 O GLU A 128 2.945 -16.688 1.908 1.00 0.00 O ATOM 1980 CB GLU A 128 3.826 -15.693 4.821 1.00 0.00 C ATOM 1981 CG GLU A 128 4.511 -16.099 6.115 1.00 0.00 C ATOM 1982 CD GLU A 128 4.404 -17.587 6.390 1.00 0.00 C ATOM 1983 OE1 GLU A 128 4.283 -18.362 5.418 1.00 0.00 O ATOM 1984 OE2 GLU A 128 4.441 -17.976 7.576 1.00 0.00 O ATOM 0 H GLU A 128 6.190 -15.029 4.369 1.00 0.00 H new ATOM 0 HA GLU A 128 4.793 -17.187 3.616 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.700 -14.610 4.811 1.00 0.00 H new ATOM 0 HB3 GLU A 128 2.828 -16.130 4.795 1.00 0.00 H new ATOM 0 HG2 GLU A 128 5.563 -15.817 6.069 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.069 -15.547 6.944 1.00 0.00 H new ATOM 1991 N SER A 129 3.918 -14.666 1.741 1.00 0.00 N ATOM 1992 CA SER A 129 3.166 -14.281 0.553 1.00 0.00 C ATOM 1993 C SER A 129 3.286 -15.344 -0.534 1.00 0.00 C ATOM 1994 O SER A 129 2.287 -15.777 -1.108 1.00 0.00 O ATOM 1995 CB SER A 129 3.664 -12.935 0.022 1.00 0.00 C ATOM 1996 OG SER A 129 4.961 -13.055 -0.537 1.00 0.00 O ATOM 0 H SER A 129 4.576 -13.960 2.071 1.00 0.00 H new ATOM 0 HA SER A 129 2.116 -14.188 0.832 1.00 0.00 H new ATOM 0 HB2 SER A 129 2.973 -12.560 -0.733 1.00 0.00 H new ATOM 0 HB3 SER A 129 3.679 -12.205 0.831 1.00 0.00 H new ATOM 0 HG SER A 129 5.629 -12.777 0.124 1.00 0.00 H new ATOM 2002 N TRP A 130 4.516 -15.761 -0.811 1.00 0.00 N ATOM 2003 CA TRP A 130 4.769 -16.775 -1.830 1.00 0.00 C ATOM 2004 C TRP A 130 4.946 -18.150 -1.197 1.00 0.00 C ATOM 2005 O TRP A 130 4.388 -19.138 -1.674 1.00 0.00 O ATOM 2006 CB TRP A 130 6.011 -16.411 -2.644 1.00 0.00 C ATOM 2007 CG TRP A 130 7.269 -16.385 -1.829 1.00 0.00 C ATOM 2008 CD1 TRP A 130 7.913 -15.280 -1.352 1.00 0.00 C ATOM 2009 CD2 TRP A 130 8.034 -17.516 -1.399 1.00 0.00 C ATOM 2010 NE1 TRP A 130 9.034 -15.655 -0.650 1.00 0.00 N ATOM 2011 CE2 TRP A 130 9.130 -17.022 -0.664 1.00 0.00 C ATOM 2012 CE3 TRP A 130 7.900 -18.897 -1.561 1.00 0.00 C ATOM 2013 CZ2 TRP A 130 10.083 -17.861 -0.094 1.00 0.00 C ATOM 2014 CZ3 TRP A 130 8.847 -19.729 -0.996 1.00 0.00 C ATOM 2015 CH2 TRP A 130 9.927 -19.210 -0.269 1.00 0.00 C ATOM 0 H TRP A 130 5.354 -15.413 -0.345 1.00 0.00 H new ATOM 0 HA TRP A 130 3.906 -16.810 -2.494 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.128 -17.129 -3.456 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.863 -15.433 -3.102 1.00 0.00 H new ATOM 0 HD1 TRP A 130 7.589 -14.261 -1.504 1.00 0.00 H new ATOM 0 HE1 TRP A 130 9.688 -15.019 -0.193 1.00 0.00 H new ATOM 0 HE3 TRP A 130 7.071 -19.307 -2.118 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 10.916 -17.462 0.466 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 8.754 -20.798 -1.117 1.00 0.00 H new ATOM 0 HH2 TRP A 130 10.650 -19.887 0.161 1.00 0.00 H new ATOM 2026 N GLN A 131 5.724 -18.206 -0.121 1.00 0.00 N ATOM 2027 CA GLN A 131 5.974 -19.462 0.576 1.00 0.00 C ATOM 2028 C GLN A 131 4.664 -20.128 0.985 1.00 0.00 C ATOM 2029 O GLN A 131 4.327 -21.210 0.502 1.00 0.00 O ATOM 2030 CB GLN A 131 6.844 -19.221 1.811 1.00 0.00 C ATOM 2031 CG GLN A 131 7.545 -20.472 2.316 1.00 0.00 C ATOM 2032 CD GLN A 131 8.508 -20.183 3.450 1.00 0.00 C ATOM 2033 OE1 GLN A 131 8.365 -20.714 4.552 1.00 0.00 O ATOM 2034 NE2 GLN A 131 9.498 -19.338 3.186 1.00 0.00 N ATOM 0 H GLN A 131 6.192 -17.397 0.287 1.00 0.00 H new ATOM 0 HA GLN A 131 6.502 -20.128 -0.107 1.00 0.00 H new ATOM 0 HB2 GLN A 131 7.593 -18.465 1.575 1.00 0.00 H new ATOM 0 HB3 GLN A 131 6.222 -18.816 2.609 1.00 0.00 H new ATOM 0 HG2 GLN A 131 6.799 -21.191 2.653 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.088 -20.937 1.493 1.00 0.00 H new ATOM 0 HE21 GLN A 131 9.579 -18.921 2.259 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.178 -19.106 3.911 1.00 0.00 H new TER 2043 GLN A 131