USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 802 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 73 ASN : amide:sc= -2.41 K(o=-2.4,f=-7.8!) USER MOD Set 1.2: A 97 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 52 SER OG : rot 180:sc=-0.00576 USER MOD Set 2.2: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 14 CYS SG : rot 180:sc= 0 USER MOD Set 3.2: A 16 GLN : amide:sc= -0.159 K(o=-0.16,f=-2.2!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 47:sc= 0.503 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 17 LYS NZ :NH3+ -148:sc= -6.97! (180deg=-10.6!) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -0.145 K(o=-0.14,f=-0.78) USER MOD Single : A 37 ASN : amide:sc= -0.0725 K(o=-0.073,f=-2.2!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 76 SER OG : rot 180:sc= 0.00678 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 HIS : no HD1:sc= -4.33! C(o=-4.3!,f=-10!) USER MOD Single : A 87 GLN : amide:sc= -2.84! C(o=-2.8!,f=-3.3!) USER MOD Single : A 91 SER OG : rot -57:sc= 1.14 USER MOD Single : A 95 THR OG1 : rot 95:sc= 0.58 USER MOD Single : A 101 CYS SG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 28:sc= 0.14 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.255 27.276 -5.709 1.00 0.00 N ATOM 2 CA GLY A 1 -8.823 27.073 -5.830 1.00 0.00 C ATOM 3 C GLY A 1 -8.253 26.265 -4.681 1.00 0.00 C ATOM 4 O GLY A 1 -8.792 25.219 -4.321 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.596 27.833 -6.518 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.736 26.354 -5.696 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.460 27.786 -4.826 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.609 26.563 -6.770 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -8.324 28.041 -5.872 1.00 0.00 H new ATOM 8 N SER A 2 -7.158 26.751 -4.104 1.00 0.00 N ATOM 9 CA SER A 2 -6.511 26.064 -2.993 1.00 0.00 C ATOM 10 C SER A 2 -7.535 25.646 -1.942 1.00 0.00 C ATOM 11 O SER A 2 -7.670 24.464 -1.627 1.00 0.00 O ATOM 12 CB SER A 2 -5.450 26.965 -2.357 1.00 0.00 C ATOM 13 OG SER A 2 -4.700 26.261 -1.383 1.00 0.00 O ATOM 0 H SER A 2 -6.701 27.618 -4.388 1.00 0.00 H new ATOM 0 HA SER A 2 -6.030 25.167 -3.383 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.782 27.346 -3.129 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.930 27.828 -1.896 1.00 0.00 H new ATOM 0 HG SER A 2 -4.028 26.858 -0.993 1.00 0.00 H new ATOM 19 N SER A 3 -8.255 26.625 -1.404 1.00 0.00 N ATOM 20 CA SER A 3 -9.265 26.361 -0.386 1.00 0.00 C ATOM 21 C SER A 3 -10.524 25.766 -1.011 1.00 0.00 C ATOM 22 O SER A 3 -11.539 26.445 -1.155 1.00 0.00 O ATOM 23 CB SER A 3 -9.613 27.648 0.364 1.00 0.00 C ATOM 24 OG SER A 3 -10.066 28.651 -0.529 1.00 0.00 O ATOM 0 H SER A 3 -8.158 27.609 -1.656 1.00 0.00 H new ATOM 0 HA SER A 3 -8.854 25.638 0.319 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.384 27.443 1.107 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.737 28.006 0.904 1.00 0.00 H new ATOM 0 HG SER A 3 -10.729 28.269 -1.141 1.00 0.00 H new ATOM 30 N GLY A 4 -10.448 24.491 -1.379 1.00 0.00 N ATOM 31 CA GLY A 4 -11.586 23.825 -1.984 1.00 0.00 C ATOM 32 C GLY A 4 -12.293 22.893 -1.020 1.00 0.00 C ATOM 33 O GLY A 4 -13.403 23.179 -0.571 1.00 0.00 O ATOM 0 H GLY A 4 -9.619 23.908 -1.269 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.292 24.574 -2.344 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.251 23.258 -2.853 1.00 0.00 H new ATOM 37 N SER A 5 -11.650 21.774 -0.701 1.00 0.00 N ATOM 38 CA SER A 5 -12.227 20.795 0.212 1.00 0.00 C ATOM 39 C SER A 5 -11.669 20.971 1.621 1.00 0.00 C ATOM 40 O SER A 5 -10.490 21.279 1.800 1.00 0.00 O ATOM 41 CB SER A 5 -11.947 19.375 -0.286 1.00 0.00 C ATOM 42 OG SER A 5 -12.618 19.122 -1.507 1.00 0.00 O ATOM 0 H SER A 5 -10.729 21.523 -1.061 1.00 0.00 H new ATOM 0 HA SER A 5 -13.305 20.956 0.244 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.874 19.239 -0.422 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.267 18.653 0.465 1.00 0.00 H new ATOM 0 HG SER A 5 -12.422 18.209 -1.805 1.00 0.00 H new ATOM 48 N SER A 6 -12.524 20.774 2.619 1.00 0.00 N ATOM 49 CA SER A 6 -12.119 20.915 4.012 1.00 0.00 C ATOM 50 C SER A 6 -11.777 19.557 4.619 1.00 0.00 C ATOM 51 O SER A 6 -12.345 19.157 5.634 1.00 0.00 O ATOM 52 CB SER A 6 -13.231 21.583 4.824 1.00 0.00 C ATOM 53 OG SER A 6 -13.502 22.887 4.341 1.00 0.00 O ATOM 0 H SER A 6 -13.502 20.516 2.488 1.00 0.00 H new ATOM 0 HA SER A 6 -11.228 21.543 4.043 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.136 20.978 4.774 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.939 21.634 5.873 1.00 0.00 H new ATOM 0 HG SER A 6 -14.217 23.292 4.875 1.00 0.00 H new ATOM 59 N GLY A 7 -10.843 18.852 3.987 1.00 0.00 N ATOM 60 CA GLY A 7 -10.441 17.547 4.477 1.00 0.00 C ATOM 61 C GLY A 7 -8.934 17.388 4.534 1.00 0.00 C ATOM 62 O GLY A 7 -8.201 17.922 3.702 1.00 0.00 O ATOM 0 H GLY A 7 -10.358 19.162 3.145 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.858 17.392 5.472 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -10.861 16.775 3.832 1.00 0.00 H new ATOM 66 N PRO A 8 -8.452 16.639 5.536 1.00 0.00 N ATOM 67 CA PRO A 8 -7.018 16.395 5.723 1.00 0.00 C ATOM 68 C PRO A 8 -6.438 15.493 4.639 1.00 0.00 C ATOM 69 O PRO A 8 -7.161 15.003 3.773 1.00 0.00 O ATOM 70 CB PRO A 8 -6.951 15.703 7.087 1.00 0.00 C ATOM 71 CG PRO A 8 -8.287 15.065 7.254 1.00 0.00 C ATOM 72 CD PRO A 8 -9.268 15.972 6.564 1.00 0.00 C ATOM 0 HA PRO A 8 -6.437 17.316 5.668 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -6.152 14.962 7.116 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -6.751 16.419 7.885 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -8.301 14.068 6.814 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -8.536 14.951 8.309 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -10.091 15.411 6.122 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -9.707 16.690 7.257 1.00 0.00 H new ATOM 80 N GLY A 9 -5.127 15.278 4.694 1.00 0.00 N ATOM 81 CA GLY A 9 -4.472 14.435 3.711 1.00 0.00 C ATOM 82 C GLY A 9 -2.960 14.523 3.787 1.00 0.00 C ATOM 83 O GLY A 9 -2.278 13.508 3.930 1.00 0.00 O ATOM 0 H GLY A 9 -4.507 15.672 5.402 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.781 13.400 3.861 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.800 14.724 2.713 1.00 0.00 H new ATOM 87 N LEU A 10 -2.435 15.739 3.688 1.00 0.00 N ATOM 88 CA LEU A 10 -0.994 15.957 3.745 1.00 0.00 C ATOM 89 C LEU A 10 -0.508 16.015 5.189 1.00 0.00 C ATOM 90 O LEU A 10 0.572 16.536 5.471 1.00 0.00 O ATOM 91 CB LEU A 10 -0.625 17.252 3.018 1.00 0.00 C ATOM 92 CG LEU A 10 -1.466 18.480 3.367 1.00 0.00 C ATOM 93 CD1 LEU A 10 -2.701 18.549 2.483 1.00 0.00 C ATOM 94 CD2 LEU A 10 -1.859 18.457 4.836 1.00 0.00 C ATOM 0 H LEU A 10 -2.986 16.589 3.568 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.505 15.118 3.251 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.420 17.479 3.230 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.701 17.077 1.945 1.00 0.00 H new ATOM 0 HG LEU A 10 -0.865 19.372 3.187 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.288 19.429 2.746 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.397 18.614 1.438 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.305 17.653 2.631 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.457 19.339 5.066 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.441 17.559 5.043 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.960 18.457 5.453 1.00 0.00 H new ATOM 106 N ARG A 11 -1.311 15.475 6.100 1.00 0.00 N ATOM 107 CA ARG A 11 -0.962 15.465 7.516 1.00 0.00 C ATOM 108 C ARG A 11 -0.152 14.220 7.867 1.00 0.00 C ATOM 109 O ARG A 11 -0.143 13.243 7.120 1.00 0.00 O ATOM 110 CB ARG A 11 -2.226 15.522 8.375 1.00 0.00 C ATOM 111 CG ARG A 11 -2.912 16.879 8.360 1.00 0.00 C ATOM 112 CD ARG A 11 -4.122 16.902 9.281 1.00 0.00 C ATOM 113 NE ARG A 11 -3.763 17.277 10.646 1.00 0.00 N ATOM 114 CZ ARG A 11 -4.509 16.990 11.707 1.00 0.00 C ATOM 115 NH1 ARG A 11 -5.648 16.327 11.561 1.00 0.00 N ATOM 116 NH2 ARG A 11 -4.115 17.366 12.917 1.00 0.00 N ATOM 0 H ARG A 11 -2.207 15.039 5.883 1.00 0.00 H new ATOM 0 HA ARG A 11 -0.352 16.345 7.720 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -2.928 14.766 8.024 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -1.969 15.266 9.403 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -2.204 17.649 8.668 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -3.223 17.120 7.343 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -4.859 17.605 8.894 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -4.592 15.919 9.287 1.00 0.00 H new ATOM 0 HE ARG A 11 -2.892 17.787 10.793 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -5.953 16.036 10.632 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -6.219 16.108 12.377 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -3.239 17.876 13.033 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -4.688 17.145 13.731 1.00 0.00 H new ATOM 130 N GLU A 12 0.528 14.266 9.009 1.00 0.00 N ATOM 131 CA GLU A 12 1.342 13.142 9.457 1.00 0.00 C ATOM 132 C GLU A 12 0.464 11.995 9.948 1.00 0.00 C ATOM 133 O GLU A 12 -0.189 12.099 10.988 1.00 0.00 O ATOM 134 CB GLU A 12 2.292 13.585 10.572 1.00 0.00 C ATOM 135 CG GLU A 12 3.406 12.590 10.854 1.00 0.00 C ATOM 136 CD GLU A 12 4.379 13.086 11.905 1.00 0.00 C ATOM 137 OE1 GLU A 12 5.182 13.990 11.592 1.00 0.00 O ATOM 138 OE2 GLU A 12 4.337 12.570 13.042 1.00 0.00 O ATOM 0 H GLU A 12 0.531 15.068 9.639 1.00 0.00 H new ATOM 0 HA GLU A 12 1.928 12.790 8.608 1.00 0.00 H new ATOM 0 HB2 GLU A 12 2.733 14.545 10.302 1.00 0.00 H new ATOM 0 HB3 GLU A 12 1.718 13.744 11.485 1.00 0.00 H new ATOM 0 HG2 GLU A 12 2.971 11.647 11.184 1.00 0.00 H new ATOM 0 HG3 GLU A 12 3.948 12.385 9.931 1.00 0.00 H new ATOM 145 N LEU A 13 0.452 10.902 9.194 1.00 0.00 N ATOM 146 CA LEU A 13 -0.347 9.735 9.551 1.00 0.00 C ATOM 147 C LEU A 13 0.545 8.581 10.000 1.00 0.00 C ATOM 148 O LEU A 13 1.744 8.565 9.718 1.00 0.00 O ATOM 149 CB LEU A 13 -1.207 9.298 8.364 1.00 0.00 C ATOM 150 CG LEU A 13 -2.438 10.156 8.074 1.00 0.00 C ATOM 151 CD1 LEU A 13 -2.860 10.012 6.620 1.00 0.00 C ATOM 152 CD2 LEU A 13 -3.583 9.777 9.003 1.00 0.00 C ATOM 0 H LEU A 13 0.986 10.799 8.331 1.00 0.00 H new ATOM 0 HA LEU A 13 -0.998 10.011 10.381 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.580 9.285 7.472 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.536 8.273 8.537 1.00 0.00 H new ATOM 0 HG LEU A 13 -2.180 11.200 8.254 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.738 10.630 6.433 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -2.045 10.333 5.971 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -3.100 8.969 6.412 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.451 10.398 8.782 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -3.840 8.728 8.855 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -3.279 9.933 10.038 1.00 0.00 H new ATOM 164 N CYS A 14 -0.048 7.619 10.697 1.00 0.00 N ATOM 165 CA CYS A 14 0.692 6.460 11.184 1.00 0.00 C ATOM 166 C CYS A 14 -0.161 5.198 11.106 1.00 0.00 C ATOM 167 O CYS A 14 -1.389 5.263 11.159 1.00 0.00 O ATOM 168 CB CYS A 14 1.153 6.691 12.624 1.00 0.00 C ATOM 169 SG CYS A 14 -0.190 7.052 13.779 1.00 0.00 S ATOM 0 H CYS A 14 -1.039 7.618 10.938 1.00 0.00 H new ATOM 0 HA CYS A 14 1.567 6.325 10.548 1.00 0.00 H new ATOM 0 HB2 CYS A 14 1.687 5.806 12.970 1.00 0.00 H new ATOM 0 HB3 CYS A 14 1.863 7.518 12.639 1.00 0.00 H new ATOM 0 HG CYS A 14 0.298 7.230 14.971 1.00 0.00 H new ATOM 175 N ILE A 15 0.499 4.052 10.980 1.00 0.00 N ATOM 176 CA ILE A 15 -0.199 2.775 10.894 1.00 0.00 C ATOM 177 C ILE A 15 0.242 1.832 12.008 1.00 0.00 C ATOM 178 O ILE A 15 1.421 1.497 12.120 1.00 0.00 O ATOM 179 CB ILE A 15 0.040 2.093 9.534 1.00 0.00 C ATOM 180 CG1 ILE A 15 -0.427 3.001 8.394 1.00 0.00 C ATOM 181 CG2 ILE A 15 -0.679 0.753 9.480 1.00 0.00 C ATOM 182 CD1 ILE A 15 -0.224 2.400 7.021 1.00 0.00 C ATOM 0 H ILE A 15 1.516 3.981 10.935 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.262 2.989 11.002 1.00 0.00 H new ATOM 0 HB ILE A 15 1.109 1.915 9.416 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -1.485 3.227 8.530 1.00 0.00 H new ATOM 0 HG13 ILE A 15 0.111 3.947 8.451 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.501 0.283 8.513 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -0.303 0.106 10.273 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -1.749 0.909 9.616 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.577 3.098 6.262 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.836 2.200 6.865 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.784 1.468 6.945 1.00 0.00 H new ATOM 194 N GLN A 16 -0.713 1.405 12.827 1.00 0.00 N ATOM 195 CA GLN A 16 -0.423 0.498 13.932 1.00 0.00 C ATOM 196 C GLN A 16 -0.623 -0.954 13.512 1.00 0.00 C ATOM 197 O GLN A 16 -1.749 -1.396 13.283 1.00 0.00 O ATOM 198 CB GLN A 16 -1.314 0.822 15.133 1.00 0.00 C ATOM 199 CG GLN A 16 -0.722 1.864 16.067 1.00 0.00 C ATOM 200 CD GLN A 16 -1.126 3.277 15.696 1.00 0.00 C ATOM 201 OE1 GLN A 16 -1.951 3.486 14.806 1.00 0.00 O ATOM 202 NE2 GLN A 16 -0.547 4.258 16.379 1.00 0.00 N ATOM 0 H GLN A 16 -1.694 1.672 12.747 1.00 0.00 H new ATOM 0 HA GLN A 16 0.621 0.634 14.216 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.280 1.176 14.773 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.499 -0.094 15.695 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.042 1.655 17.088 1.00 0.00 H new ATOM 0 HG3 GLN A 16 0.365 1.785 16.051 1.00 0.00 H new ATOM 0 HE21 GLN A 16 0.132 4.040 17.109 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.781 5.229 16.174 1.00 0.00 H new ATOM 211 N LYS A 17 0.477 -1.692 13.411 1.00 0.00 N ATOM 212 CA LYS A 17 0.424 -3.096 13.019 1.00 0.00 C ATOM 213 C LYS A 17 1.094 -3.979 14.067 1.00 0.00 C ATOM 214 O LYS A 17 1.594 -3.488 15.078 1.00 0.00 O ATOM 215 CB LYS A 17 1.102 -3.293 11.661 1.00 0.00 C ATOM 216 CG LYS A 17 2.597 -3.543 11.759 1.00 0.00 C ATOM 217 CD LYS A 17 3.318 -3.114 10.491 1.00 0.00 C ATOM 218 CE LYS A 17 3.464 -1.602 10.418 1.00 0.00 C ATOM 219 NZ LYS A 17 2.246 -0.953 9.859 1.00 0.00 N ATOM 0 H LYS A 17 1.417 -1.341 13.595 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.624 -3.387 12.941 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.634 -4.134 11.149 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.929 -2.410 11.046 1.00 0.00 H new ATOM 0 HG2 LYS A 17 3.003 -2.998 12.612 1.00 0.00 H new ATOM 0 HG3 LYS A 17 2.779 -4.602 11.941 1.00 0.00 H new ATOM 0 HD2 LYS A 17 4.304 -3.578 10.457 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.768 -3.470 9.620 1.00 0.00 H new ATOM 0 HE2 LYS A 17 3.660 -1.208 11.415 1.00 0.00 H new ATOM 0 HE3 LYS A 17 4.326 -1.350 9.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 2.519 -0.099 9.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.763 -1.615 9.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 1.605 -0.691 10.635 1.00 0.00 H new ATOM 233 N ALA A 18 1.101 -5.284 13.817 1.00 0.00 N ATOM 234 CA ALA A 18 1.712 -6.235 14.737 1.00 0.00 C ATOM 235 C ALA A 18 3.192 -5.927 14.942 1.00 0.00 C ATOM 236 O ALA A 18 3.797 -5.150 14.203 1.00 0.00 O ATOM 237 CB ALA A 18 1.534 -7.656 14.223 1.00 0.00 C ATOM 0 H ALA A 18 0.690 -5.707 12.985 1.00 0.00 H new ATOM 0 HA ALA A 18 1.211 -6.143 15.701 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.995 -8.356 14.920 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.471 -7.880 14.134 1.00 0.00 H new ATOM 0 HB3 ALA A 18 2.008 -7.752 13.246 1.00 0.00 H new ATOM 243 N PRO A 19 3.789 -6.548 15.970 1.00 0.00 N ATOM 244 CA PRO A 19 5.205 -6.355 16.296 1.00 0.00 C ATOM 245 C PRO A 19 6.130 -6.976 15.255 1.00 0.00 C ATOM 246 O PRO A 19 7.352 -6.902 15.374 1.00 0.00 O ATOM 247 CB PRO A 19 5.359 -7.067 17.642 1.00 0.00 C ATOM 248 CG PRO A 19 4.275 -8.089 17.657 1.00 0.00 C ATOM 249 CD PRO A 19 3.129 -7.487 16.892 1.00 0.00 C ATOM 0 HA PRO A 19 5.477 -5.300 16.323 1.00 0.00 H new ATOM 0 HB2 PRO A 19 6.341 -7.531 17.734 1.00 0.00 H new ATOM 0 HB3 PRO A 19 5.256 -6.369 18.473 1.00 0.00 H new ATOM 0 HG2 PRO A 19 4.608 -9.018 17.194 1.00 0.00 H new ATOM 0 HG3 PRO A 19 3.979 -8.329 18.678 1.00 0.00 H new ATOM 0 HD2 PRO A 19 2.562 -8.247 16.354 1.00 0.00 H new ATOM 0 HD3 PRO A 19 2.429 -6.976 17.553 1.00 0.00 H new ATOM 257 N GLY A 20 5.538 -7.590 14.235 1.00 0.00 N ATOM 258 CA GLY A 20 6.324 -8.215 13.188 1.00 0.00 C ATOM 259 C GLY A 20 5.502 -8.525 11.953 1.00 0.00 C ATOM 260 O GLY A 20 5.796 -9.474 11.226 1.00 0.00 O ATOM 0 H GLY A 20 4.528 -7.666 14.115 1.00 0.00 H new ATOM 0 HA2 GLY A 20 7.149 -7.557 12.916 1.00 0.00 H new ATOM 0 HA3 GLY A 20 6.764 -9.137 13.569 1.00 0.00 H new ATOM 264 N GLU A 21 4.469 -7.724 11.715 1.00 0.00 N ATOM 265 CA GLU A 21 3.601 -7.920 10.559 1.00 0.00 C ATOM 266 C GLU A 21 4.056 -7.060 9.384 1.00 0.00 C ATOM 267 O GLU A 21 4.460 -5.911 9.562 1.00 0.00 O ATOM 268 CB GLU A 21 2.152 -7.586 10.920 1.00 0.00 C ATOM 269 CG GLU A 21 1.194 -7.686 9.744 1.00 0.00 C ATOM 270 CD GLU A 21 0.999 -9.113 9.270 1.00 0.00 C ATOM 271 OE1 GLU A 21 1.418 -10.041 9.993 1.00 0.00 O ATOM 272 OE2 GLU A 21 0.427 -9.301 8.176 1.00 0.00 O ATOM 0 H GLU A 21 4.212 -6.934 12.306 1.00 0.00 H new ATOM 0 HA GLU A 21 3.662 -8.968 10.264 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.818 -8.260 11.708 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.111 -6.575 11.326 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.229 -7.267 10.030 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.572 -7.082 8.920 1.00 0.00 H new ATOM 279 N ARG A 22 3.988 -7.625 8.183 1.00 0.00 N ATOM 280 CA ARG A 22 4.394 -6.912 6.979 1.00 0.00 C ATOM 281 C ARG A 22 3.267 -6.017 6.471 1.00 0.00 C ATOM 282 O ARG A 22 2.176 -6.493 6.156 1.00 0.00 O ATOM 283 CB ARG A 22 4.805 -7.902 5.888 1.00 0.00 C ATOM 284 CG ARG A 22 3.711 -8.891 5.519 1.00 0.00 C ATOM 285 CD ARG A 22 4.291 -10.228 5.085 1.00 0.00 C ATOM 286 NE ARG A 22 3.359 -11.329 5.311 1.00 0.00 N ATOM 287 CZ ARG A 22 3.180 -11.909 6.493 1.00 0.00 C ATOM 288 NH1 ARG A 22 3.867 -11.496 7.549 1.00 0.00 N ATOM 289 NH2 ARG A 22 2.313 -12.906 6.619 1.00 0.00 N ATOM 0 H ARG A 22 3.655 -8.575 8.018 1.00 0.00 H new ATOM 0 HA ARG A 22 5.249 -6.284 7.230 1.00 0.00 H new ATOM 0 HB2 ARG A 22 5.097 -7.347 4.997 1.00 0.00 H new ATOM 0 HB3 ARG A 22 5.684 -8.453 6.222 1.00 0.00 H new ATOM 0 HG2 ARG A 22 3.051 -9.040 6.373 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.103 -8.479 4.714 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.550 -10.184 4.027 1.00 0.00 H new ATOM 0 HD3 ARG A 22 5.215 -10.417 5.632 1.00 0.00 H new ATOM 0 HE ARG A 22 2.816 -11.672 4.518 1.00 0.00 H new ATOM 0 HH11 ARG A 22 4.535 -10.731 7.455 1.00 0.00 H new ATOM 0 HH12 ARG A 22 3.727 -11.943 8.455 1.00 0.00 H new ATOM 0 HH21 ARG A 22 1.784 -13.227 5.808 1.00 0.00 H new ATOM 0 HH22 ARG A 22 2.176 -13.351 7.527 1.00 0.00 H new ATOM 303 N LEU A 23 3.539 -4.719 6.393 1.00 0.00 N ATOM 304 CA LEU A 23 2.549 -3.757 5.923 1.00 0.00 C ATOM 305 C LEU A 23 1.659 -4.372 4.847 1.00 0.00 C ATOM 306 O LEU A 23 0.434 -4.282 4.913 1.00 0.00 O ATOM 307 CB LEU A 23 3.241 -2.508 5.375 1.00 0.00 C ATOM 308 CG LEU A 23 2.503 -1.185 5.583 1.00 0.00 C ATOM 309 CD1 LEU A 23 1.050 -1.312 5.152 1.00 0.00 C ATOM 310 CD2 LEU A 23 2.594 -0.745 7.037 1.00 0.00 C ATOM 0 H LEU A 23 4.437 -4.309 6.649 1.00 0.00 H new ATOM 0 HA LEU A 23 1.923 -3.476 6.770 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.224 -2.429 5.839 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.403 -2.646 4.306 1.00 0.00 H new ATOM 0 HG LEU A 23 2.979 -0.424 4.965 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.540 -0.361 5.307 1.00 0.00 H new ATOM 0 HD12 LEU A 23 1.006 -1.580 4.096 1.00 0.00 H new ATOM 0 HD13 LEU A 23 0.561 -2.086 5.743 1.00 0.00 H new ATOM 0 HD21 LEU A 23 2.063 0.198 7.166 1.00 0.00 H new ATOM 0 HD22 LEU A 23 2.144 -1.505 7.676 1.00 0.00 H new ATOM 0 HD23 LEU A 23 3.640 -0.613 7.312 1.00 0.00 H new ATOM 322 N GLY A 24 2.286 -4.999 3.856 1.00 0.00 N ATOM 323 CA GLY A 24 1.536 -5.622 2.781 1.00 0.00 C ATOM 324 C GLY A 24 0.998 -4.611 1.788 1.00 0.00 C ATOM 325 O GLY A 24 -0.146 -4.716 1.343 1.00 0.00 O ATOM 0 H GLY A 24 3.299 -5.087 3.779 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.177 -6.333 2.260 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.706 -6.190 3.202 1.00 0.00 H new ATOM 329 N ILE A 25 1.822 -3.628 1.441 1.00 0.00 N ATOM 330 CA ILE A 25 1.422 -2.594 0.495 1.00 0.00 C ATOM 331 C ILE A 25 2.353 -2.563 -0.712 1.00 0.00 C ATOM 332 O ILE A 25 3.446 -3.128 -0.681 1.00 0.00 O ATOM 333 CB ILE A 25 1.408 -1.203 1.154 1.00 0.00 C ATOM 334 CG1 ILE A 25 2.579 -1.065 2.130 1.00 0.00 C ATOM 335 CG2 ILE A 25 0.085 -0.969 1.869 1.00 0.00 C ATOM 336 CD1 ILE A 25 3.055 0.360 2.304 1.00 0.00 C ATOM 0 H ILE A 25 2.771 -3.526 1.801 1.00 0.00 H new ATOM 0 HA ILE A 25 0.413 -2.841 0.166 1.00 0.00 H new ATOM 0 HB ILE A 25 1.517 -0.447 0.376 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.281 -1.461 3.101 1.00 0.00 H new ATOM 0 HG13 ILE A 25 3.410 -1.677 1.777 1.00 0.00 H new ATOM 0 HG21 ILE A 25 0.090 0.019 2.330 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.733 -1.030 1.151 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -0.052 -1.728 2.639 1.00 0.00 H new ATOM 0 HD11 ILE A 25 3.886 0.382 3.009 1.00 0.00 H new ATOM 0 HD12 ILE A 25 3.384 0.754 1.342 1.00 0.00 H new ATOM 0 HD13 ILE A 25 2.238 0.972 2.686 1.00 0.00 H new ATOM 348 N SER A 26 1.913 -1.897 -1.775 1.00 0.00 N ATOM 349 CA SER A 26 2.707 -1.794 -2.994 1.00 0.00 C ATOM 350 C SER A 26 2.825 -0.340 -3.443 1.00 0.00 C ATOM 351 O SER A 26 1.937 0.474 -3.189 1.00 0.00 O ATOM 352 CB SER A 26 2.080 -2.634 -4.109 1.00 0.00 C ATOM 353 OG SER A 26 3.074 -3.163 -4.968 1.00 0.00 O ATOM 0 H SER A 26 1.012 -1.421 -1.817 1.00 0.00 H new ATOM 0 HA SER A 26 3.706 -2.174 -2.781 1.00 0.00 H new ATOM 0 HB2 SER A 26 1.500 -3.448 -3.673 1.00 0.00 H new ATOM 0 HB3 SER A 26 1.386 -2.021 -4.684 1.00 0.00 H new ATOM 0 HG SER A 26 2.648 -3.697 -5.671 1.00 0.00 H new ATOM 359 N ILE A 27 3.928 -0.022 -4.112 1.00 0.00 N ATOM 360 CA ILE A 27 4.163 1.332 -4.597 1.00 0.00 C ATOM 361 C ILE A 27 4.797 1.316 -5.984 1.00 0.00 C ATOM 362 O ILE A 27 5.539 0.396 -6.329 1.00 0.00 O ATOM 363 CB ILE A 27 5.072 2.123 -3.639 1.00 0.00 C ATOM 364 CG1 ILE A 27 6.486 1.537 -3.640 1.00 0.00 C ATOM 365 CG2 ILE A 27 4.492 2.118 -2.233 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.463 2.314 -2.787 1.00 0.00 C ATOM 0 H ILE A 27 4.673 -0.684 -4.330 1.00 0.00 H new ATOM 0 HA ILE A 27 3.191 1.822 -4.650 1.00 0.00 H new ATOM 0 HB ILE A 27 5.127 3.155 -3.985 1.00 0.00 H new ATOM 0 HG12 ILE A 27 6.444 0.508 -3.284 1.00 0.00 H new ATOM 0 HG13 ILE A 27 6.856 1.505 -4.665 1.00 0.00 H new ATOM 0 HG21 ILE A 27 5.146 2.681 -1.568 1.00 0.00 H new ATOM 0 HG22 ILE A 27 3.504 2.578 -2.245 1.00 0.00 H new ATOM 0 HG23 ILE A 27 4.410 1.091 -1.877 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.444 1.841 -2.835 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.534 3.337 -3.156 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.116 2.324 -1.754 1.00 0.00 H new ATOM 378 N ARG A 28 4.501 2.342 -6.776 1.00 0.00 N ATOM 379 CA ARG A 28 5.042 2.447 -8.125 1.00 0.00 C ATOM 380 C ARG A 28 5.761 3.778 -8.321 1.00 0.00 C ATOM 381 O ARG A 28 5.178 4.844 -8.130 1.00 0.00 O ATOM 382 CB ARG A 28 3.923 2.303 -9.159 1.00 0.00 C ATOM 383 CG ARG A 28 2.919 3.445 -9.132 1.00 0.00 C ATOM 384 CD ARG A 28 1.800 3.226 -10.138 1.00 0.00 C ATOM 385 NE ARG A 28 0.666 4.114 -9.896 1.00 0.00 N ATOM 386 CZ ARG A 28 -0.435 4.119 -10.640 1.00 0.00 C ATOM 387 NH1 ARG A 28 -0.550 3.287 -11.666 1.00 0.00 N ATOM 388 NH2 ARG A 28 -1.424 4.957 -10.357 1.00 0.00 N ATOM 0 H ARG A 28 3.889 3.112 -6.506 1.00 0.00 H new ATOM 0 HA ARG A 28 5.762 1.641 -8.264 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.364 2.242 -10.154 1.00 0.00 H new ATOM 0 HB3 ARG A 28 3.398 1.364 -8.985 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.497 3.537 -8.131 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.428 4.384 -9.351 1.00 0.00 H new ATOM 0 HD2 ARG A 28 2.181 3.391 -11.146 1.00 0.00 H new ATOM 0 HD3 ARG A 28 1.466 2.190 -10.089 1.00 0.00 H new ATOM 0 HE ARG A 28 0.722 4.766 -9.113 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.208 2.641 -11.886 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.396 3.293 -12.235 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.339 5.598 -9.568 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.269 4.960 -10.928 1.00 0.00 H new ATOM 402 N GLY A 29 7.033 3.707 -8.701 1.00 0.00 N ATOM 403 CA GLY A 29 7.812 4.913 -8.915 1.00 0.00 C ATOM 404 C GLY A 29 9.300 4.680 -8.745 1.00 0.00 C ATOM 405 O GLY A 29 9.822 3.638 -9.140 1.00 0.00 O ATOM 0 H GLY A 29 7.538 2.836 -8.865 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.619 5.293 -9.918 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.485 5.682 -8.215 1.00 0.00 H new ATOM 409 N GLY A 30 9.987 5.654 -8.157 1.00 0.00 N ATOM 410 CA GLY A 30 11.418 5.531 -7.948 1.00 0.00 C ATOM 411 C GLY A 30 12.203 6.616 -8.659 1.00 0.00 C ATOM 412 O GLY A 30 11.956 6.904 -9.830 1.00 0.00 O ATOM 0 H GLY A 30 9.578 6.526 -7.821 1.00 0.00 H new ATOM 0 HA2 GLY A 30 11.631 5.573 -6.880 1.00 0.00 H new ATOM 0 HA3 GLY A 30 11.751 4.555 -8.301 1.00 0.00 H new ATOM 416 N ALA A 31 13.150 7.221 -7.950 1.00 0.00 N ATOM 417 CA ALA A 31 13.974 8.279 -8.520 1.00 0.00 C ATOM 418 C ALA A 31 14.949 7.721 -9.551 1.00 0.00 C ATOM 419 O ALA A 31 15.875 6.985 -9.208 1.00 0.00 O ATOM 420 CB ALA A 31 14.727 9.013 -7.420 1.00 0.00 C ATOM 0 H ALA A 31 13.366 6.996 -6.979 1.00 0.00 H new ATOM 0 HA ALA A 31 13.316 8.985 -9.027 1.00 0.00 H new ATOM 0 HB1 ALA A 31 15.338 9.800 -7.861 1.00 0.00 H new ATOM 0 HB2 ALA A 31 14.014 9.454 -6.723 1.00 0.00 H new ATOM 0 HB3 ALA A 31 15.368 8.311 -6.887 1.00 0.00 H new ATOM 426 N ARG A 32 14.735 8.075 -10.814 1.00 0.00 N ATOM 427 CA ARG A 32 15.595 7.607 -11.894 1.00 0.00 C ATOM 428 C ARG A 32 15.393 6.115 -12.143 1.00 0.00 C ATOM 429 O ARG A 32 16.302 5.423 -12.600 1.00 0.00 O ATOM 430 CB ARG A 32 17.063 7.886 -11.564 1.00 0.00 C ATOM 431 CG ARG A 32 17.321 9.307 -11.092 1.00 0.00 C ATOM 432 CD ARG A 32 18.720 9.457 -10.514 1.00 0.00 C ATOM 433 NE ARG A 32 19.750 9.385 -11.548 1.00 0.00 N ATOM 434 CZ ARG A 32 21.053 9.403 -11.290 1.00 0.00 C ATOM 435 NH1 ARG A 32 21.483 9.491 -10.039 1.00 0.00 N ATOM 436 NH2 ARG A 32 21.928 9.334 -12.285 1.00 0.00 N ATOM 0 H ARG A 32 13.974 8.684 -11.114 1.00 0.00 H new ATOM 0 HA ARG A 32 15.324 8.149 -12.800 1.00 0.00 H new ATOM 0 HB2 ARG A 32 17.392 7.190 -10.792 1.00 0.00 H new ATOM 0 HB3 ARG A 32 17.669 7.690 -12.449 1.00 0.00 H new ATOM 0 HG2 ARG A 32 17.195 9.997 -11.926 1.00 0.00 H new ATOM 0 HG3 ARG A 32 16.583 9.581 -10.338 1.00 0.00 H new ATOM 0 HD2 ARG A 32 18.796 10.411 -9.992 1.00 0.00 H new ATOM 0 HD3 ARG A 32 18.893 8.675 -9.775 1.00 0.00 H new ATOM 0 HE ARG A 32 19.452 9.317 -12.521 1.00 0.00 H new ATOM 0 HH11 ARG A 32 20.813 9.545 -9.272 1.00 0.00 H new ATOM 0 HH12 ARG A 32 22.484 9.505 -9.844 1.00 0.00 H new ATOM 0 HH21 ARG A 32 21.600 9.267 -13.249 1.00 0.00 H new ATOM 0 HH22 ARG A 32 22.928 9.348 -12.086 1.00 0.00 H new ATOM 450 N GLY A 33 14.195 5.626 -11.837 1.00 0.00 N ATOM 451 CA GLY A 33 13.896 4.220 -12.033 1.00 0.00 C ATOM 452 C GLY A 33 13.129 3.964 -13.316 1.00 0.00 C ATOM 453 O GLY A 33 13.710 3.941 -14.401 1.00 0.00 O ATOM 0 H GLY A 33 13.427 6.179 -11.457 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.827 3.653 -12.050 1.00 0.00 H new ATOM 0 HA3 GLY A 33 13.315 3.854 -11.187 1.00 0.00 H new ATOM 457 N HIS A 34 11.820 3.769 -13.191 1.00 0.00 N ATOM 458 CA HIS A 34 10.972 3.512 -14.350 1.00 0.00 C ATOM 459 C HIS A 34 9.773 4.455 -14.366 1.00 0.00 C ATOM 460 O HIS A 34 8.930 4.418 -13.471 1.00 0.00 O ATOM 461 CB HIS A 34 10.493 2.060 -14.346 1.00 0.00 C ATOM 462 CG HIS A 34 10.001 1.595 -13.010 1.00 0.00 C ATOM 463 ND1 HIS A 34 8.691 1.729 -12.602 1.00 0.00 N ATOM 464 CD2 HIS A 34 10.652 0.994 -11.987 1.00 0.00 C ATOM 465 CE1 HIS A 34 8.557 1.232 -11.385 1.00 0.00 C ATOM 466 NE2 HIS A 34 9.733 0.778 -10.989 1.00 0.00 N ATOM 0 H HIS A 34 11.324 3.784 -12.300 1.00 0.00 H new ATOM 0 HA HIS A 34 11.564 3.689 -15.248 1.00 0.00 H new ATOM 0 HB2 HIS A 34 9.693 1.948 -15.078 1.00 0.00 H new ATOM 0 HB3 HIS A 34 11.311 1.415 -14.667 1.00 0.00 H new ATOM 0 HD2 HIS A 34 11.700 0.733 -11.960 1.00 0.00 H new ATOM 0 HE1 HIS A 34 7.642 1.202 -10.812 1.00 0.00 H new ATOM 0 HE2 HIS A 34 9.927 0.339 -10.089 1.00 0.00 H new ATOM 475 N ALA A 35 9.705 5.300 -15.390 1.00 0.00 N ATOM 476 CA ALA A 35 8.609 6.253 -15.523 1.00 0.00 C ATOM 477 C ALA A 35 7.297 5.651 -15.032 1.00 0.00 C ATOM 478 O ALA A 35 6.886 4.582 -15.481 1.00 0.00 O ATOM 479 CB ALA A 35 8.476 6.705 -16.969 1.00 0.00 C ATOM 0 H ALA A 35 10.396 5.344 -16.139 1.00 0.00 H new ATOM 0 HA ALA A 35 8.836 7.120 -14.902 1.00 0.00 H new ATOM 0 HB1 ALA A 35 7.654 7.416 -17.054 1.00 0.00 H new ATOM 0 HB2 ALA A 35 9.403 7.182 -17.288 1.00 0.00 H new ATOM 0 HB3 ALA A 35 8.275 5.841 -17.603 1.00 0.00 H new ATOM 485 N GLY A 36 6.643 6.345 -14.105 1.00 0.00 N ATOM 486 CA GLY A 36 5.384 5.863 -13.568 1.00 0.00 C ATOM 487 C GLY A 36 4.191 6.617 -14.120 1.00 0.00 C ATOM 488 O GLY A 36 3.245 6.013 -14.624 1.00 0.00 O ATOM 0 H GLY A 36 6.963 7.232 -13.717 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.277 4.803 -13.797 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.397 5.955 -12.482 1.00 0.00 H new ATOM 492 N ASN A 37 4.234 7.942 -14.025 1.00 0.00 N ATOM 493 CA ASN A 37 3.147 8.780 -14.517 1.00 0.00 C ATOM 494 C ASN A 37 3.360 9.141 -15.984 1.00 0.00 C ATOM 495 O ASN A 37 4.415 9.635 -16.381 1.00 0.00 O ATOM 496 CB ASN A 37 3.037 10.055 -13.678 1.00 0.00 C ATOM 497 CG ASN A 37 2.563 9.777 -12.264 1.00 0.00 C ATOM 498 OD1 ASN A 37 2.611 8.640 -11.794 1.00 0.00 O ATOM 499 ND2 ASN A 37 2.103 10.817 -11.579 1.00 0.00 N ATOM 0 H ASN A 37 5.010 8.458 -13.612 1.00 0.00 H new ATOM 0 HA ASN A 37 2.219 8.215 -14.430 1.00 0.00 H new ATOM 0 HB2 ASN A 37 4.008 10.548 -13.642 1.00 0.00 H new ATOM 0 HB3 ASN A 37 2.346 10.746 -14.161 1.00 0.00 H new ATOM 0 HD21 ASN A 37 1.771 10.691 -10.623 1.00 0.00 H new ATOM 0 HD22 ASN A 37 2.082 11.742 -12.009 1.00 0.00 H new ATOM 506 N PRO A 38 2.334 8.890 -16.810 1.00 0.00 N ATOM 507 CA PRO A 38 2.383 9.181 -18.246 1.00 0.00 C ATOM 508 C PRO A 38 2.376 10.678 -18.534 1.00 0.00 C ATOM 509 O PRO A 38 3.131 11.161 -19.378 1.00 0.00 O ATOM 510 CB PRO A 38 1.109 8.526 -18.785 1.00 0.00 C ATOM 511 CG PRO A 38 0.180 8.490 -17.622 1.00 0.00 C ATOM 512 CD PRO A 38 1.045 8.302 -16.406 1.00 0.00 C ATOM 0 HA PRO A 38 3.298 8.807 -18.707 1.00 0.00 H new ATOM 0 HB2 PRO A 38 0.688 9.100 -19.610 1.00 0.00 H new ATOM 0 HB3 PRO A 38 1.309 7.523 -19.163 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -0.395 9.414 -17.553 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -0.537 7.675 -17.721 1.00 0.00 H new ATOM 0 HD2 PRO A 38 0.628 8.807 -15.535 1.00 0.00 H new ATOM 0 HD3 PRO A 38 1.148 7.249 -16.145 1.00 0.00 H new ATOM 520 N ARG A 39 1.519 11.408 -17.827 1.00 0.00 N ATOM 521 CA ARG A 39 1.413 12.851 -18.008 1.00 0.00 C ATOM 522 C ARG A 39 2.773 13.458 -18.339 1.00 0.00 C ATOM 523 O ARG A 39 3.010 13.900 -19.464 1.00 0.00 O ATOM 524 CB ARG A 39 0.844 13.504 -16.747 1.00 0.00 C ATOM 525 CG ARG A 39 -0.585 13.090 -16.439 1.00 0.00 C ATOM 526 CD ARG A 39 -1.583 13.844 -17.304 1.00 0.00 C ATOM 527 NE ARG A 39 -1.850 15.184 -16.790 1.00 0.00 N ATOM 528 CZ ARG A 39 -2.785 15.989 -17.284 1.00 0.00 C ATOM 529 NH1 ARG A 39 -3.538 15.589 -18.300 1.00 0.00 N ATOM 530 NH2 ARG A 39 -2.968 17.195 -16.763 1.00 0.00 N ATOM 0 H ARG A 39 0.888 11.024 -17.124 1.00 0.00 H new ATOM 0 HA ARG A 39 0.737 13.039 -18.842 1.00 0.00 H new ATOM 0 HB2 ARG A 39 1.478 13.249 -15.898 1.00 0.00 H new ATOM 0 HB3 ARG A 39 0.883 14.587 -16.860 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -0.697 12.018 -16.602 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -0.800 13.277 -15.387 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -1.199 13.916 -18.322 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -2.516 13.283 -17.354 1.00 0.00 H new ATOM 0 HE ARG A 39 -1.288 15.521 -16.008 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -3.400 14.662 -18.703 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -4.255 16.208 -18.678 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -2.391 17.506 -15.982 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -3.686 17.811 -17.144 1.00 0.00 H new ATOM 544 N ASP A 40 3.663 13.477 -17.353 1.00 0.00 N ATOM 545 CA ASP A 40 4.999 14.030 -17.539 1.00 0.00 C ATOM 546 C ASP A 40 6.065 12.965 -17.303 1.00 0.00 C ATOM 547 O ASP A 40 6.172 12.387 -16.221 1.00 0.00 O ATOM 548 CB ASP A 40 5.222 15.211 -16.592 1.00 0.00 C ATOM 549 CG ASP A 40 4.429 16.437 -17.000 1.00 0.00 C ATOM 550 OD1 ASP A 40 4.161 16.596 -18.209 1.00 0.00 O ATOM 551 OD2 ASP A 40 4.075 17.237 -16.109 1.00 0.00 O ATOM 0 H ASP A 40 3.483 13.116 -16.416 1.00 0.00 H new ATOM 0 HA ASP A 40 5.081 14.379 -18.568 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.941 14.920 -15.580 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.283 15.459 -16.569 1.00 0.00 H new ATOM 556 N PRO A 41 6.874 12.696 -18.339 1.00 0.00 N ATOM 557 CA PRO A 41 7.946 11.699 -18.269 1.00 0.00 C ATOM 558 C PRO A 41 9.091 12.141 -17.364 1.00 0.00 C ATOM 559 O PRO A 41 9.831 11.313 -16.833 1.00 0.00 O ATOM 560 CB PRO A 41 8.422 11.588 -19.719 1.00 0.00 C ATOM 561 CG PRO A 41 8.070 12.898 -20.335 1.00 0.00 C ATOM 562 CD PRO A 41 6.804 13.346 -19.658 1.00 0.00 C ATOM 0 HA PRO A 41 7.599 10.756 -17.847 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.495 11.402 -19.770 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.930 10.763 -20.235 1.00 0.00 H new ATOM 0 HG2 PRO A 41 8.869 13.625 -20.189 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.923 12.797 -21.410 1.00 0.00 H new ATOM 0 HD2 PRO A 41 6.758 14.431 -19.569 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.919 13.034 -20.213 1.00 0.00 H new ATOM 570 N THR A 42 9.231 13.452 -17.192 1.00 0.00 N ATOM 571 CA THR A 42 10.286 14.003 -16.352 1.00 0.00 C ATOM 572 C THR A 42 9.825 14.134 -14.905 1.00 0.00 C ATOM 573 O THR A 42 10.107 15.132 -14.241 1.00 0.00 O ATOM 574 CB THR A 42 10.744 15.384 -16.859 1.00 0.00 C ATOM 575 OG1 THR A 42 9.626 16.276 -16.929 1.00 0.00 O ATOM 576 CG2 THR A 42 11.393 15.268 -18.230 1.00 0.00 C ATOM 0 H THR A 42 8.627 14.151 -17.624 1.00 0.00 H new ATOM 0 HA THR A 42 11.125 13.309 -16.402 1.00 0.00 H new ATOM 0 HB THR A 42 11.479 15.779 -16.158 1.00 0.00 H new ATOM 0 HG1 THR A 42 9.926 17.152 -17.250 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.708 16.255 -18.568 1.00 0.00 H new ATOM 0 HG22 THR A 42 12.261 14.611 -18.167 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.675 14.854 -18.938 1.00 0.00 H new ATOM 584 N ASP A 43 9.116 13.120 -14.421 1.00 0.00 N ATOM 585 CA ASP A 43 8.617 13.121 -13.051 1.00 0.00 C ATOM 586 C ASP A 43 8.820 11.757 -12.398 1.00 0.00 C ATOM 587 O ASP A 43 8.179 10.777 -12.775 1.00 0.00 O ATOM 588 CB ASP A 43 7.134 13.497 -13.025 1.00 0.00 C ATOM 589 CG ASP A 43 6.571 13.535 -11.619 1.00 0.00 C ATOM 590 OD1 ASP A 43 7.002 14.401 -10.829 1.00 0.00 O ATOM 591 OD2 ASP A 43 5.697 12.698 -11.307 1.00 0.00 O ATOM 0 H ASP A 43 8.874 12.287 -14.957 1.00 0.00 H new ATOM 0 HA ASP A 43 9.181 13.863 -12.486 1.00 0.00 H new ATOM 0 HB2 ASP A 43 7.001 14.473 -13.493 1.00 0.00 H new ATOM 0 HB3 ASP A 43 6.570 12.779 -13.620 1.00 0.00 H new ATOM 596 N GLU A 44 9.717 11.704 -11.418 1.00 0.00 N ATOM 597 CA GLU A 44 10.005 10.460 -10.714 1.00 0.00 C ATOM 598 C GLU A 44 9.300 10.424 -9.361 1.00 0.00 C ATOM 599 O GLU A 44 9.937 10.530 -8.314 1.00 0.00 O ATOM 600 CB GLU A 44 11.514 10.296 -10.520 1.00 0.00 C ATOM 601 CG GLU A 44 12.325 10.598 -11.769 1.00 0.00 C ATOM 602 CD GLU A 44 12.217 12.048 -12.198 1.00 0.00 C ATOM 603 OE1 GLU A 44 12.344 12.936 -11.330 1.00 0.00 O ATOM 604 OE2 GLU A 44 12.004 12.295 -13.404 1.00 0.00 O ATOM 0 H GLU A 44 10.256 12.507 -11.094 1.00 0.00 H new ATOM 0 HA GLU A 44 9.632 9.635 -11.320 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.842 10.955 -9.716 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.722 9.275 -10.200 1.00 0.00 H new ATOM 0 HG2 GLU A 44 13.371 10.354 -11.586 1.00 0.00 H new ATOM 0 HG3 GLU A 44 11.986 9.956 -12.582 1.00 0.00 H new ATOM 611 N GLY A 45 7.979 10.273 -9.393 1.00 0.00 N ATOM 612 CA GLY A 45 7.209 10.227 -8.164 1.00 0.00 C ATOM 613 C GLY A 45 6.959 8.809 -7.690 1.00 0.00 C ATOM 614 O GLY A 45 7.099 7.857 -8.458 1.00 0.00 O ATOM 0 H GLY A 45 7.429 10.182 -10.247 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.738 10.779 -7.387 1.00 0.00 H new ATOM 0 HA3 GLY A 45 6.254 10.729 -8.318 1.00 0.00 H new ATOM 618 N ILE A 46 6.590 8.667 -6.421 1.00 0.00 N ATOM 619 CA ILE A 46 6.320 7.355 -5.846 1.00 0.00 C ATOM 620 C ILE A 46 4.966 7.329 -5.147 1.00 0.00 C ATOM 621 O ILE A 46 4.733 8.070 -4.192 1.00 0.00 O ATOM 622 CB ILE A 46 7.413 6.946 -4.841 1.00 0.00 C ATOM 623 CG1 ILE A 46 8.797 7.061 -5.483 1.00 0.00 C ATOM 624 CG2 ILE A 46 7.171 5.529 -4.343 1.00 0.00 C ATOM 625 CD1 ILE A 46 9.917 7.220 -4.479 1.00 0.00 C ATOM 0 H ILE A 46 6.471 9.445 -5.772 1.00 0.00 H new ATOM 0 HA ILE A 46 6.313 6.644 -6.672 1.00 0.00 H new ATOM 0 HB ILE A 46 7.372 7.623 -3.988 1.00 0.00 H new ATOM 0 HG12 ILE A 46 8.984 6.172 -6.086 1.00 0.00 H new ATOM 0 HG13 ILE A 46 8.804 7.914 -6.161 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.952 5.254 -3.634 1.00 0.00 H new ATOM 0 HG22 ILE A 46 6.199 5.477 -3.852 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.188 4.839 -5.187 1.00 0.00 H new ATOM 0 HD11 ILE A 46 10.869 7.295 -5.005 1.00 0.00 H new ATOM 0 HD12 ILE A 46 9.754 8.124 -3.892 1.00 0.00 H new ATOM 0 HD13 ILE A 46 9.936 6.355 -3.816 1.00 0.00 H new ATOM 637 N PHE A 47 4.075 6.468 -5.627 1.00 0.00 N ATOM 638 CA PHE A 47 2.742 6.343 -5.048 1.00 0.00 C ATOM 639 C PHE A 47 2.388 4.879 -4.808 1.00 0.00 C ATOM 640 O PHE A 47 3.182 3.982 -5.094 1.00 0.00 O ATOM 641 CB PHE A 47 1.701 6.988 -5.966 1.00 0.00 C ATOM 642 CG PHE A 47 2.117 8.332 -6.491 1.00 0.00 C ATOM 643 CD1 PHE A 47 3.241 8.461 -7.291 1.00 0.00 C ATOM 644 CD2 PHE A 47 1.383 9.467 -6.185 1.00 0.00 C ATOM 645 CE1 PHE A 47 3.625 9.697 -7.776 1.00 0.00 C ATOM 646 CE2 PHE A 47 1.762 10.705 -6.669 1.00 0.00 C ATOM 647 CZ PHE A 47 2.885 10.821 -7.464 1.00 0.00 C ATOM 0 H PHE A 47 4.252 5.846 -6.416 1.00 0.00 H new ATOM 0 HA PHE A 47 2.740 6.860 -4.089 1.00 0.00 H new ATOM 0 HB2 PHE A 47 1.507 6.322 -6.807 1.00 0.00 H new ATOM 0 HB3 PHE A 47 0.763 7.094 -5.421 1.00 0.00 H new ATOM 0 HD1 PHE A 47 3.824 7.586 -7.538 1.00 0.00 H new ATOM 0 HD2 PHE A 47 0.505 9.383 -5.561 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.503 9.784 -8.399 1.00 0.00 H new ATOM 0 HE2 PHE A 47 1.180 11.581 -6.425 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.184 11.788 -7.841 1.00 0.00 H new ATOM 657 N ILE A 48 1.191 4.644 -4.282 1.00 0.00 N ATOM 658 CA ILE A 48 0.731 3.289 -4.004 1.00 0.00 C ATOM 659 C ILE A 48 0.042 2.682 -5.222 1.00 0.00 C ATOM 660 O ILE A 48 -0.945 3.222 -5.722 1.00 0.00 O ATOM 661 CB ILE A 48 -0.241 3.258 -2.810 1.00 0.00 C ATOM 662 CG1 ILE A 48 0.469 3.716 -1.534 1.00 0.00 C ATOM 663 CG2 ILE A 48 -0.816 1.861 -2.631 1.00 0.00 C ATOM 664 CD1 ILE A 48 -0.478 4.125 -0.429 1.00 0.00 C ATOM 0 H ILE A 48 0.522 5.375 -4.040 1.00 0.00 H new ATOM 0 HA ILE A 48 1.615 2.700 -3.758 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.063 3.945 -3.012 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.108 2.909 -1.174 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.121 4.557 -1.772 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -1.501 1.855 -1.783 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.353 1.570 -3.534 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -0.006 1.155 -2.448 1.00 0.00 H new ATOM 0 HD11 ILE A 48 0.095 4.438 0.444 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -1.100 4.953 -0.770 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -1.113 3.280 -0.163 1.00 0.00 H new ATOM 676 N SER A 49 0.568 1.556 -5.693 1.00 0.00 N ATOM 677 CA SER A 49 0.005 0.876 -6.853 1.00 0.00 C ATOM 678 C SER A 49 -0.922 -0.256 -6.422 1.00 0.00 C ATOM 679 O SER A 49 -1.734 -0.745 -7.209 1.00 0.00 O ATOM 680 CB SER A 49 1.123 0.326 -7.740 1.00 0.00 C ATOM 681 OG SER A 49 0.662 -0.758 -8.529 1.00 0.00 O ATOM 0 H SER A 49 1.383 1.095 -5.289 1.00 0.00 H new ATOM 0 HA SER A 49 -0.577 1.601 -7.422 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.500 1.117 -8.388 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.957 -0.001 -7.119 1.00 0.00 H new ATOM 0 HG SER A 49 1.395 -1.091 -9.088 1.00 0.00 H new ATOM 687 N LYS A 50 -0.796 -0.670 -5.166 1.00 0.00 N ATOM 688 CA LYS A 50 -1.621 -1.744 -4.627 1.00 0.00 C ATOM 689 C LYS A 50 -1.523 -1.795 -3.106 1.00 0.00 C ATOM 690 O LYS A 50 -0.576 -1.273 -2.517 1.00 0.00 O ATOM 691 CB LYS A 50 -1.197 -3.089 -5.222 1.00 0.00 C ATOM 692 CG LYS A 50 -1.542 -4.279 -4.342 1.00 0.00 C ATOM 693 CD LYS A 50 -1.135 -5.590 -4.994 1.00 0.00 C ATOM 694 CE LYS A 50 -1.450 -5.594 -6.482 1.00 0.00 C ATOM 695 NZ LYS A 50 -1.426 -6.970 -7.050 1.00 0.00 N ATOM 0 H LYS A 50 -0.129 -0.277 -4.501 1.00 0.00 H new ATOM 0 HA LYS A 50 -2.657 -1.544 -4.900 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.676 -3.215 -6.193 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -0.121 -3.077 -5.397 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -1.040 -4.179 -3.380 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.614 -4.287 -4.143 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -0.068 -5.755 -4.847 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -1.655 -6.416 -4.509 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -2.432 -5.150 -6.647 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -0.726 -4.971 -7.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -1.646 -6.930 -8.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -0.482 -7.385 -6.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -2.134 -7.558 -6.566 1.00 0.00 H new ATOM 709 N VAL A 51 -2.506 -2.429 -2.474 1.00 0.00 N ATOM 710 CA VAL A 51 -2.528 -2.551 -1.022 1.00 0.00 C ATOM 711 C VAL A 51 -3.216 -3.841 -0.589 1.00 0.00 C ATOM 712 O VAL A 51 -4.412 -4.024 -0.812 1.00 0.00 O ATOM 713 CB VAL A 51 -3.247 -1.355 -0.369 1.00 0.00 C ATOM 714 CG1 VAL A 51 -3.372 -1.561 1.132 1.00 0.00 C ATOM 715 CG2 VAL A 51 -2.513 -0.059 -0.679 1.00 0.00 C ATOM 0 H VAL A 51 -3.298 -2.866 -2.946 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.490 -2.567 -0.690 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.252 -1.286 -0.786 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.882 -0.706 1.575 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.945 -2.467 1.328 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.379 -1.658 1.570 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.034 0.776 -0.210 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.496 -0.115 -0.291 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.482 0.093 -1.758 1.00 0.00 H new ATOM 725 N SER A 52 -2.451 -4.732 0.033 1.00 0.00 N ATOM 726 CA SER A 52 -2.986 -6.008 0.496 1.00 0.00 C ATOM 727 C SER A 52 -4.107 -5.792 1.507 1.00 0.00 C ATOM 728 O SER A 52 -3.999 -4.984 2.430 1.00 0.00 O ATOM 729 CB SER A 52 -1.875 -6.854 1.121 1.00 0.00 C ATOM 730 OG SER A 52 -2.166 -8.237 1.016 1.00 0.00 O ATOM 0 H SER A 52 -1.459 -4.595 0.228 1.00 0.00 H new ATOM 0 HA SER A 52 -3.394 -6.537 -0.365 1.00 0.00 H new ATOM 0 HB2 SER A 52 -0.928 -6.640 0.625 1.00 0.00 H new ATOM 0 HB3 SER A 52 -1.754 -6.583 2.170 1.00 0.00 H new ATOM 0 HG SER A 52 -1.440 -8.756 1.421 1.00 0.00 H new ATOM 736 N PRO A 53 -5.212 -6.533 1.332 1.00 0.00 N ATOM 737 CA PRO A 53 -6.375 -6.442 2.219 1.00 0.00 C ATOM 738 C PRO A 53 -6.094 -7.014 3.604 1.00 0.00 C ATOM 739 O PRO A 53 -6.799 -6.711 4.568 1.00 0.00 O ATOM 740 CB PRO A 53 -7.436 -7.279 1.500 1.00 0.00 C ATOM 741 CG PRO A 53 -6.659 -8.242 0.669 1.00 0.00 C ATOM 742 CD PRO A 53 -5.410 -7.516 0.253 1.00 0.00 C ATOM 0 HA PRO A 53 -6.674 -5.409 2.394 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -8.079 -7.798 2.210 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -8.082 -6.654 0.883 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -6.417 -9.141 1.236 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -7.234 -8.559 -0.201 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -4.561 -8.194 0.166 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -5.531 -7.031 -0.716 1.00 0.00 H new ATOM 750 N THR A 54 -5.058 -7.842 3.698 1.00 0.00 N ATOM 751 CA THR A 54 -4.684 -8.457 4.966 1.00 0.00 C ATOM 752 C THR A 54 -3.480 -7.755 5.583 1.00 0.00 C ATOM 753 O THR A 54 -2.975 -8.169 6.626 1.00 0.00 O ATOM 754 CB THR A 54 -4.358 -9.952 4.790 1.00 0.00 C ATOM 755 OG1 THR A 54 -3.091 -10.104 4.140 1.00 0.00 O ATOM 756 CG2 THR A 54 -5.438 -10.649 3.977 1.00 0.00 C ATOM 0 H THR A 54 -4.463 -8.102 2.911 1.00 0.00 H new ATOM 0 HA THR A 54 -5.541 -8.355 5.632 1.00 0.00 H new ATOM 0 HB THR A 54 -4.316 -10.411 5.778 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.890 -11.057 4.033 1.00 0.00 H new ATOM 0 HG21 THR A 54 -5.186 -11.704 3.866 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.396 -10.557 4.489 1.00 0.00 H new ATOM 0 HG23 THR A 54 -5.507 -10.187 2.992 1.00 0.00 H new ATOM 764 N GLY A 55 -3.024 -6.689 4.932 1.00 0.00 N ATOM 765 CA GLY A 55 -1.882 -5.946 5.433 1.00 0.00 C ATOM 766 C GLY A 55 -2.271 -4.923 6.481 1.00 0.00 C ATOM 767 O GLY A 55 -3.455 -4.699 6.731 1.00 0.00 O ATOM 0 H GLY A 55 -3.425 -6.327 4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.159 -6.641 5.859 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.388 -5.441 4.603 1.00 0.00 H new ATOM 771 N ALA A 56 -1.271 -4.301 7.098 1.00 0.00 N ATOM 772 CA ALA A 56 -1.515 -3.295 8.125 1.00 0.00 C ATOM 773 C ALA A 56 -2.327 -2.130 7.571 1.00 0.00 C ATOM 774 O ALA A 56 -3.212 -1.602 8.244 1.00 0.00 O ATOM 775 CB ALA A 56 -0.197 -2.797 8.699 1.00 0.00 C ATOM 0 H ALA A 56 -0.285 -4.476 6.905 1.00 0.00 H new ATOM 0 HA ALA A 56 -2.094 -3.759 8.923 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -0.394 -2.046 9.464 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.346 -3.632 9.141 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.403 -2.355 7.903 1.00 0.00 H new ATOM 781 N ALA A 57 -2.020 -1.733 6.341 1.00 0.00 N ATOM 782 CA ALA A 57 -2.722 -0.630 5.696 1.00 0.00 C ATOM 783 C ALA A 57 -4.160 -1.014 5.365 1.00 0.00 C ATOM 784 O ALA A 57 -5.106 -0.404 5.862 1.00 0.00 O ATOM 785 CB ALA A 57 -1.986 -0.200 4.436 1.00 0.00 C ATOM 0 H ALA A 57 -1.289 -2.159 5.771 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.748 0.208 6.392 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -2.522 0.624 3.965 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -0.978 0.124 4.696 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -1.930 -1.039 3.743 1.00 0.00 H new ATOM 791 N GLY A 58 -4.318 -2.030 4.522 1.00 0.00 N ATOM 792 CA GLY A 58 -5.644 -2.477 4.139 1.00 0.00 C ATOM 793 C GLY A 58 -6.611 -2.492 5.306 1.00 0.00 C ATOM 794 O GLY A 58 -7.777 -2.125 5.160 1.00 0.00 O ATOM 0 H GLY A 58 -3.551 -2.551 4.098 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -6.033 -1.824 3.358 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -5.578 -3.478 3.713 1.00 0.00 H new ATOM 798 N ARG A 59 -6.127 -2.919 6.468 1.00 0.00 N ATOM 799 CA ARG A 59 -6.957 -2.984 7.665 1.00 0.00 C ATOM 800 C ARG A 59 -7.043 -1.619 8.341 1.00 0.00 C ATOM 801 O ARG A 59 -8.002 -1.328 9.056 1.00 0.00 O ATOM 802 CB ARG A 59 -6.397 -4.016 8.645 1.00 0.00 C ATOM 803 CG ARG A 59 -5.109 -3.577 9.322 1.00 0.00 C ATOM 804 CD ARG A 59 -4.643 -4.598 10.348 1.00 0.00 C ATOM 805 NE ARG A 59 -3.901 -3.976 11.441 1.00 0.00 N ATOM 806 CZ ARG A 59 -3.613 -4.597 12.580 1.00 0.00 C ATOM 807 NH1 ARG A 59 -4.000 -5.850 12.772 1.00 0.00 N ATOM 808 NH2 ARG A 59 -2.934 -3.964 13.528 1.00 0.00 N ATOM 0 H ARG A 59 -5.164 -3.225 6.606 1.00 0.00 H new ATOM 0 HA ARG A 59 -7.960 -3.286 7.365 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -7.147 -4.223 9.409 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -6.218 -4.950 8.113 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -4.332 -3.434 8.571 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.263 -2.614 9.809 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.507 -5.127 10.751 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.013 -5.342 9.859 1.00 0.00 H new ATOM 0 HE ARG A 59 -3.587 -3.013 11.324 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -4.520 -6.340 12.044 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -3.777 -6.324 13.647 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.633 -3.000 13.383 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -2.713 -4.441 14.402 1.00 0.00 H new ATOM 822 N ASP A 60 -6.034 -0.786 8.111 1.00 0.00 N ATOM 823 CA ASP A 60 -5.995 0.549 8.697 1.00 0.00 C ATOM 824 C ASP A 60 -7.278 1.315 8.389 1.00 0.00 C ATOM 825 O ASP A 60 -8.021 1.692 9.294 1.00 0.00 O ATOM 826 CB ASP A 60 -4.785 1.324 8.173 1.00 0.00 C ATOM 827 CG ASP A 60 -4.597 2.651 8.882 1.00 0.00 C ATOM 828 OD1 ASP A 60 -4.904 2.727 10.091 1.00 0.00 O ATOM 829 OD2 ASP A 60 -4.141 3.613 8.230 1.00 0.00 O ATOM 0 H ASP A 60 -5.232 -1.012 7.523 1.00 0.00 H new ATOM 0 HA ASP A 60 -5.908 0.442 9.778 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -3.887 0.718 8.298 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.905 1.500 7.104 1.00 0.00 H new ATOM 834 N GLY A 61 -7.531 1.543 7.103 1.00 0.00 N ATOM 835 CA GLY A 61 -8.724 2.264 6.699 1.00 0.00 C ATOM 836 C GLY A 61 -8.407 3.627 6.114 1.00 0.00 C ATOM 837 O GLY A 61 -9.251 4.239 5.459 1.00 0.00 O ATOM 0 H GLY A 61 -6.931 1.241 6.335 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -9.270 1.674 5.963 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -9.381 2.385 7.560 1.00 0.00 H new ATOM 841 N ARG A 62 -7.190 4.102 6.352 1.00 0.00 N ATOM 842 CA ARG A 62 -6.765 5.402 5.847 1.00 0.00 C ATOM 843 C ARG A 62 -5.874 5.243 4.618 1.00 0.00 C ATOM 844 O ARG A 62 -5.836 6.114 3.748 1.00 0.00 O ATOM 845 CB ARG A 62 -6.019 6.177 6.934 1.00 0.00 C ATOM 846 CG ARG A 62 -6.586 5.969 8.329 1.00 0.00 C ATOM 847 CD ARG A 62 -7.762 6.895 8.596 1.00 0.00 C ATOM 848 NE ARG A 62 -8.910 6.581 7.750 1.00 0.00 N ATOM 849 CZ ARG A 62 -9.868 7.453 7.458 1.00 0.00 C ATOM 850 NH1 ARG A 62 -9.817 8.686 7.941 1.00 0.00 N ATOM 851 NH2 ARG A 62 -10.881 7.091 6.681 1.00 0.00 N ATOM 0 H ARG A 62 -6.480 3.606 6.891 1.00 0.00 H new ATOM 0 HA ARG A 62 -7.656 5.960 5.559 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.971 5.876 6.928 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -6.047 7.240 6.694 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.904 4.933 8.443 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -5.806 6.146 9.070 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -8.052 6.819 9.644 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -7.457 7.927 8.424 1.00 0.00 H new ATOM 0 HE ARG A 62 -8.980 5.640 7.362 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -9.040 8.968 8.539 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -10.555 9.353 7.715 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -10.924 6.143 6.308 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.617 7.761 6.457 1.00 0.00 H new ATOM 865 N LEU A 63 -5.158 4.126 4.554 1.00 0.00 N ATOM 866 CA LEU A 63 -4.267 3.852 3.432 1.00 0.00 C ATOM 867 C LEU A 63 -5.016 3.162 2.296 1.00 0.00 C ATOM 868 O LEU A 63 -5.776 2.221 2.523 1.00 0.00 O ATOM 869 CB LEU A 63 -3.094 2.982 3.887 1.00 0.00 C ATOM 870 CG LEU A 63 -1.908 2.896 2.926 1.00 0.00 C ATOM 871 CD1 LEU A 63 -2.357 2.375 1.570 1.00 0.00 C ATOM 872 CD2 LEU A 63 -1.240 4.256 2.782 1.00 0.00 C ATOM 0 H LEU A 63 -5.177 3.395 5.266 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.884 4.804 3.064 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.734 3.364 4.843 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.465 1.973 4.066 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.180 2.197 3.338 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.500 2.321 0.899 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.790 1.382 1.687 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.104 3.049 1.150 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.398 4.177 2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.960 4.976 2.392 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.883 4.591 3.756 1.00 0.00 H new ATOM 884 N ARG A 64 -4.795 3.636 1.075 1.00 0.00 N ATOM 885 CA ARG A 64 -5.449 3.064 -0.096 1.00 0.00 C ATOM 886 C ARG A 64 -4.648 3.354 -1.362 1.00 0.00 C ATOM 887 O ARG A 64 -3.961 4.372 -1.455 1.00 0.00 O ATOM 888 CB ARG A 64 -6.867 3.621 -0.238 1.00 0.00 C ATOM 889 CG ARG A 64 -6.958 5.121 -0.009 1.00 0.00 C ATOM 890 CD ARG A 64 -6.746 5.896 -1.300 1.00 0.00 C ATOM 891 NE ARG A 64 -7.902 5.806 -2.188 1.00 0.00 N ATOM 892 CZ ARG A 64 -8.082 6.594 -3.242 1.00 0.00 C ATOM 893 NH1 ARG A 64 -7.185 7.525 -3.539 1.00 0.00 N ATOM 894 NH2 ARG A 64 -9.160 6.451 -4.002 1.00 0.00 N ATOM 0 H ARG A 64 -4.168 4.414 0.870 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.502 1.984 0.040 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -7.240 3.391 -1.236 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -7.520 3.113 0.472 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.934 5.368 0.409 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.211 5.424 0.725 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -6.549 6.942 -1.067 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -5.864 5.512 -1.813 1.00 0.00 H new ATOM 0 HE ARG A 64 -8.610 5.099 -1.988 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -6.355 7.637 -2.957 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.326 8.129 -4.349 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -9.851 5.736 -3.777 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -9.297 7.057 -4.811 1.00 0.00 H new ATOM 908 N VAL A 65 -4.740 2.453 -2.335 1.00 0.00 N ATOM 909 CA VAL A 65 -4.025 2.612 -3.595 1.00 0.00 C ATOM 910 C VAL A 65 -4.384 3.932 -4.268 1.00 0.00 C ATOM 911 O VAL A 65 -5.464 4.075 -4.841 1.00 0.00 O ATOM 912 CB VAL A 65 -4.331 1.455 -4.564 1.00 0.00 C ATOM 913 CG1 VAL A 65 -3.503 1.588 -5.833 1.00 0.00 C ATOM 914 CG2 VAL A 65 -4.077 0.115 -3.890 1.00 0.00 C ATOM 0 H VAL A 65 -5.303 1.605 -2.274 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.961 2.606 -3.358 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.384 1.504 -4.840 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -3.733 0.762 -6.506 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.739 2.532 -6.324 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -2.443 1.566 -5.580 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -4.298 -0.692 -4.589 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.033 0.054 -3.584 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -4.718 0.021 -3.013 1.00 0.00 H new ATOM 924 N GLY A 66 -3.471 4.896 -4.195 1.00 0.00 N ATOM 925 CA GLY A 66 -3.710 6.192 -4.801 1.00 0.00 C ATOM 926 C GLY A 66 -3.078 7.325 -4.017 1.00 0.00 C ATOM 927 O GLY A 66 -2.975 8.449 -4.509 1.00 0.00 O ATOM 0 H GLY A 66 -2.570 4.802 -3.727 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.315 6.193 -5.817 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.784 6.362 -4.877 1.00 0.00 H new ATOM 931 N LEU A 67 -2.654 7.030 -2.793 1.00 0.00 N ATOM 932 CA LEU A 67 -2.029 8.033 -1.938 1.00 0.00 C ATOM 933 C LEU A 67 -0.544 8.173 -2.258 1.00 0.00 C ATOM 934 O LEU A 67 0.206 7.198 -2.211 1.00 0.00 O ATOM 935 CB LEU A 67 -2.212 7.662 -0.465 1.00 0.00 C ATOM 936 CG LEU A 67 -3.656 7.542 0.022 1.00 0.00 C ATOM 937 CD1 LEU A 67 -3.695 7.063 1.465 1.00 0.00 C ATOM 938 CD2 LEU A 67 -4.379 8.874 -0.119 1.00 0.00 C ATOM 0 H LEU A 67 -2.732 6.105 -2.371 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.515 8.990 -2.128 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.709 6.712 -0.285 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.705 8.411 0.143 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.168 6.806 -0.598 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.731 6.984 1.794 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.215 6.087 1.537 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.166 7.775 2.099 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.406 8.770 0.232 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.867 9.631 0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.383 9.177 -1.166 1.00 0.00 H new ATOM 950 N ARG A 68 -0.126 9.393 -2.581 1.00 0.00 N ATOM 951 CA ARG A 68 1.269 9.661 -2.907 1.00 0.00 C ATOM 952 C ARG A 68 2.140 9.608 -1.656 1.00 0.00 C ATOM 953 O ARG A 68 1.875 10.300 -0.672 1.00 0.00 O ATOM 954 CB ARG A 68 1.404 11.029 -3.578 1.00 0.00 C ATOM 955 CG ARG A 68 2.838 11.402 -3.917 1.00 0.00 C ATOM 956 CD ARG A 68 2.970 12.886 -4.223 1.00 0.00 C ATOM 957 NE ARG A 68 4.189 13.185 -4.969 1.00 0.00 N ATOM 958 CZ ARG A 68 4.463 14.379 -5.483 1.00 0.00 C ATOM 959 NH1 ARG A 68 3.608 15.381 -5.331 1.00 0.00 N ATOM 960 NH2 ARG A 68 5.593 14.573 -6.149 1.00 0.00 N ATOM 0 H ARG A 68 -0.734 10.211 -2.624 1.00 0.00 H new ATOM 0 HA ARG A 68 1.609 8.890 -3.598 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.810 11.036 -4.492 1.00 0.00 H new ATOM 0 HB3 ARG A 68 0.985 11.790 -2.920 1.00 0.00 H new ATOM 0 HG2 ARG A 68 3.490 11.142 -3.083 1.00 0.00 H new ATOM 0 HG3 ARG A 68 3.173 10.821 -4.776 1.00 0.00 H new ATOM 0 HD2 ARG A 68 2.104 13.216 -4.797 1.00 0.00 H new ATOM 0 HD3 ARG A 68 2.968 13.450 -3.290 1.00 0.00 H new ATOM 0 HE ARG A 68 4.868 12.436 -5.103 1.00 0.00 H new ATOM 0 HH11 ARG A 68 2.738 15.236 -4.819 1.00 0.00 H new ATOM 0 HH12 ARG A 68 3.820 16.297 -5.726 1.00 0.00 H new ATOM 0 HH21 ARG A 68 6.254 13.805 -6.267 1.00 0.00 H new ATOM 0 HH22 ARG A 68 5.802 15.490 -6.543 1.00 0.00 H new ATOM 974 N LEU A 69 3.181 8.783 -1.700 1.00 0.00 N ATOM 975 CA LEU A 69 4.091 8.639 -0.570 1.00 0.00 C ATOM 976 C LEU A 69 5.006 9.854 -0.449 1.00 0.00 C ATOM 977 O LEU A 69 5.920 10.039 -1.253 1.00 0.00 O ATOM 978 CB LEU A 69 4.930 7.369 -0.723 1.00 0.00 C ATOM 979 CG LEU A 69 4.436 6.142 0.044 1.00 0.00 C ATOM 980 CD1 LEU A 69 4.767 6.268 1.523 1.00 0.00 C ATOM 981 CD2 LEU A 69 2.939 5.955 -0.156 1.00 0.00 C ATOM 0 H LEU A 69 3.415 8.204 -2.506 1.00 0.00 H new ATOM 0 HA LEU A 69 3.493 8.565 0.338 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.979 7.115 -1.782 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.948 7.589 -0.400 1.00 0.00 H new ATOM 0 HG LEU A 69 4.947 5.262 -0.348 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.408 5.386 2.053 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.846 6.352 1.648 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.284 7.157 1.929 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.605 5.077 0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.410 6.836 0.208 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.728 5.818 -1.217 1.00 0.00 H new ATOM 993 N LEU A 70 4.755 10.679 0.562 1.00 0.00 N ATOM 994 CA LEU A 70 5.557 11.875 0.791 1.00 0.00 C ATOM 995 C LEU A 70 6.784 11.555 1.638 1.00 0.00 C ATOM 996 O LEU A 70 7.903 11.934 1.293 1.00 0.00 O ATOM 997 CB LEU A 70 4.716 12.953 1.478 1.00 0.00 C ATOM 998 CG LEU A 70 3.679 13.656 0.601 1.00 0.00 C ATOM 999 CD1 LEU A 70 2.783 14.548 1.446 1.00 0.00 C ATOM 1000 CD2 LEU A 70 4.364 14.465 -0.491 1.00 0.00 C ATOM 0 H LEU A 70 4.002 10.541 1.236 1.00 0.00 H new ATOM 0 HA LEU A 70 5.894 12.247 -0.177 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.199 12.499 2.323 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.390 13.707 1.884 1.00 0.00 H new ATOM 0 HG LEU A 70 3.057 12.897 0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.051 15.040 0.805 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.265 13.943 2.190 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.390 15.301 1.949 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.611 14.958 -1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.010 15.216 -0.036 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.963 13.801 -1.115 1.00 0.00 H new ATOM 1012 N GLU A 71 6.566 10.853 2.745 1.00 0.00 N ATOM 1013 CA GLU A 71 7.655 10.481 3.640 1.00 0.00 C ATOM 1014 C GLU A 71 7.262 9.291 4.510 1.00 0.00 C ATOM 1015 O GLU A 71 6.139 9.217 5.009 1.00 0.00 O ATOM 1016 CB GLU A 71 8.046 11.667 4.525 1.00 0.00 C ATOM 1017 CG GLU A 71 8.064 12.996 3.788 1.00 0.00 C ATOM 1018 CD GLU A 71 8.353 14.167 4.706 1.00 0.00 C ATOM 1019 OE1 GLU A 71 8.842 13.932 5.831 1.00 0.00 O ATOM 1020 OE2 GLU A 71 8.089 15.319 4.301 1.00 0.00 O ATOM 0 H GLU A 71 5.646 10.530 3.044 1.00 0.00 H new ATOM 0 HA GLU A 71 8.511 10.195 3.029 1.00 0.00 H new ATOM 0 HB2 GLU A 71 7.347 11.733 5.359 1.00 0.00 H new ATOM 0 HB3 GLU A 71 9.033 11.483 4.950 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.818 12.961 3.001 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.101 13.150 3.300 1.00 0.00 H new ATOM 1027 N VAL A 72 8.195 8.361 4.688 1.00 0.00 N ATOM 1028 CA VAL A 72 7.947 7.174 5.498 1.00 0.00 C ATOM 1029 C VAL A 72 8.800 7.184 6.762 1.00 0.00 C ATOM 1030 O VAL A 72 10.018 7.029 6.702 1.00 0.00 O ATOM 1031 CB VAL A 72 8.236 5.884 4.707 1.00 0.00 C ATOM 1032 CG1 VAL A 72 8.076 4.663 5.599 1.00 0.00 C ATOM 1033 CG2 VAL A 72 7.326 5.790 3.492 1.00 0.00 C ATOM 0 H VAL A 72 9.130 8.407 4.282 1.00 0.00 H new ATOM 0 HA VAL A 72 6.893 7.193 5.774 1.00 0.00 H new ATOM 0 HB VAL A 72 9.268 5.916 4.358 1.00 0.00 H new ATOM 0 HG11 VAL A 72 8.284 3.762 5.023 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.773 4.729 6.434 1.00 0.00 H new ATOM 0 HG13 VAL A 72 7.056 4.622 5.980 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.544 4.873 2.945 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.285 5.781 3.817 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.496 6.649 2.843 1.00 0.00 H new ATOM 1043 N ASN A 73 8.149 7.366 7.906 1.00 0.00 N ATOM 1044 CA ASN A 73 8.847 7.396 9.186 1.00 0.00 C ATOM 1045 C ASN A 73 9.778 8.602 9.270 1.00 0.00 C ATOM 1046 O ASN A 73 10.896 8.502 9.774 1.00 0.00 O ATOM 1047 CB ASN A 73 9.647 6.107 9.385 1.00 0.00 C ATOM 1048 CG ASN A 73 8.866 5.055 10.149 1.00 0.00 C ATOM 1049 OD1 ASN A 73 8.013 5.377 10.976 1.00 0.00 O ATOM 1050 ND2 ASN A 73 9.155 3.788 9.875 1.00 0.00 N ATOM 0 H ASN A 73 7.139 7.495 7.973 1.00 0.00 H new ATOM 0 HA ASN A 73 8.101 7.479 9.976 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.935 5.707 8.413 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.568 6.333 9.922 1.00 0.00 H new ATOM 0 HD21 ASN A 73 8.662 3.037 10.358 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.870 3.566 9.182 1.00 0.00 H new ATOM 1057 N GLN A 74 9.307 9.742 8.773 1.00 0.00 N ATOM 1058 CA GLN A 74 10.097 10.967 8.792 1.00 0.00 C ATOM 1059 C GLN A 74 11.343 10.825 7.925 1.00 0.00 C ATOM 1060 O GLN A 74 12.384 11.412 8.218 1.00 0.00 O ATOM 1061 CB GLN A 74 10.497 11.319 10.226 1.00 0.00 C ATOM 1062 CG GLN A 74 9.328 11.758 11.094 1.00 0.00 C ATOM 1063 CD GLN A 74 9.594 11.563 12.573 1.00 0.00 C ATOM 1064 OE1 GLN A 74 10.362 12.309 13.182 1.00 0.00 O ATOM 1065 NE2 GLN A 74 8.958 10.557 13.162 1.00 0.00 N ATOM 0 H GLN A 74 8.383 9.842 8.353 1.00 0.00 H new ATOM 0 HA GLN A 74 9.483 11.771 8.385 1.00 0.00 H new ATOM 0 HB2 GLN A 74 10.974 10.453 10.684 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.240 12.116 10.202 1.00 0.00 H new ATOM 0 HG2 GLN A 74 9.113 12.809 10.903 1.00 0.00 H new ATOM 0 HG3 GLN A 74 8.439 11.195 10.811 1.00 0.00 H new ATOM 0 HE21 GLN A 74 8.330 9.963 12.620 1.00 0.00 H new ATOM 0 HE22 GLN A 74 9.097 10.378 14.157 1.00 0.00 H new ATOM 1074 N GLN A 75 11.228 10.042 6.857 1.00 0.00 N ATOM 1075 CA GLN A 75 12.347 9.823 5.947 1.00 0.00 C ATOM 1076 C GLN A 75 11.943 10.117 4.507 1.00 0.00 C ATOM 1077 O GLN A 75 11.485 9.230 3.786 1.00 0.00 O ATOM 1078 CB GLN A 75 12.851 8.384 6.064 1.00 0.00 C ATOM 1079 CG GLN A 75 13.277 8.001 7.472 1.00 0.00 C ATOM 1080 CD GLN A 75 14.210 6.806 7.495 1.00 0.00 C ATOM 1081 OE1 GLN A 75 15.270 6.819 6.868 1.00 0.00 O ATOM 1082 NE2 GLN A 75 13.821 5.764 8.219 1.00 0.00 N ATOM 0 H GLN A 75 10.373 9.549 6.601 1.00 0.00 H new ATOM 0 HA GLN A 75 13.149 10.506 6.226 1.00 0.00 H new ATOM 0 HB2 GLN A 75 12.065 7.705 5.734 1.00 0.00 H new ATOM 0 HB3 GLN A 75 13.695 8.247 5.388 1.00 0.00 H new ATOM 0 HG2 GLN A 75 13.771 8.852 7.942 1.00 0.00 H new ATOM 0 HG3 GLN A 75 12.392 7.777 8.067 1.00 0.00 H new ATOM 0 HE21 GLN A 75 12.935 5.796 8.723 1.00 0.00 H new ATOM 0 HE22 GLN A 75 14.408 4.932 8.271 1.00 0.00 H new ATOM 1091 N SER A 76 12.114 11.369 4.093 1.00 0.00 N ATOM 1092 CA SER A 76 11.764 11.781 2.739 1.00 0.00 C ATOM 1093 C SER A 76 12.247 10.757 1.717 1.00 0.00 C ATOM 1094 O SER A 76 13.397 10.317 1.757 1.00 0.00 O ATOM 1095 CB SER A 76 12.367 13.152 2.428 1.00 0.00 C ATOM 1096 OG SER A 76 11.965 13.608 1.148 1.00 0.00 O ATOM 0 H SER A 76 12.493 12.115 4.676 1.00 0.00 H new ATOM 0 HA SER A 76 10.678 11.847 2.676 1.00 0.00 H new ATOM 0 HB2 SER A 76 12.057 13.870 3.187 1.00 0.00 H new ATOM 0 HB3 SER A 76 13.455 13.093 2.471 1.00 0.00 H new ATOM 0 HG SER A 76 12.362 14.487 0.974 1.00 0.00 H new ATOM 1102 N LEU A 77 11.361 10.382 0.801 1.00 0.00 N ATOM 1103 CA LEU A 77 11.696 9.409 -0.234 1.00 0.00 C ATOM 1104 C LEU A 77 12.490 10.063 -1.360 1.00 0.00 C ATOM 1105 O LEU A 77 12.869 9.405 -2.330 1.00 0.00 O ATOM 1106 CB LEU A 77 10.422 8.774 -0.795 1.00 0.00 C ATOM 1107 CG LEU A 77 9.510 8.088 0.222 1.00 0.00 C ATOM 1108 CD1 LEU A 77 8.471 7.231 -0.484 1.00 0.00 C ATOM 1109 CD2 LEU A 77 10.328 7.246 1.191 1.00 0.00 C ATOM 0 H LEU A 77 10.406 10.736 0.753 1.00 0.00 H new ATOM 0 HA LEU A 77 12.314 8.633 0.218 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.848 9.548 -1.304 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.707 8.041 -1.550 1.00 0.00 H new ATOM 0 HG LEU A 77 8.990 8.859 0.791 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.831 6.751 0.257 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.864 7.859 -1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.972 6.468 -1.079 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.662 6.765 1.907 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.876 6.484 0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 77 11.033 7.885 1.723 1.00 0.00 H new ATOM 1121 N LEU A 78 12.741 11.360 -1.224 1.00 0.00 N ATOM 1122 CA LEU A 78 13.493 12.104 -2.229 1.00 0.00 C ATOM 1123 C LEU A 78 14.974 11.741 -2.179 1.00 0.00 C ATOM 1124 O LEU A 78 15.635 11.929 -1.159 1.00 0.00 O ATOM 1125 CB LEU A 78 13.317 13.608 -2.016 1.00 0.00 C ATOM 1126 CG LEU A 78 13.499 14.487 -3.254 1.00 0.00 C ATOM 1127 CD1 LEU A 78 14.931 14.406 -3.760 1.00 0.00 C ATOM 1128 CD2 LEU A 78 12.521 14.078 -4.346 1.00 0.00 C ATOM 0 H LEU A 78 12.435 11.919 -0.428 1.00 0.00 H new ATOM 0 HA LEU A 78 13.105 11.835 -3.211 1.00 0.00 H new ATOM 0 HB2 LEU A 78 12.319 13.783 -1.614 1.00 0.00 H new ATOM 0 HB3 LEU A 78 14.028 13.933 -1.257 1.00 0.00 H new ATOM 0 HG LEU A 78 13.292 15.521 -2.977 1.00 0.00 H new ATOM 0 HD11 LEU A 78 15.042 15.038 -4.641 1.00 0.00 H new ATOM 0 HD12 LEU A 78 15.612 14.748 -2.981 1.00 0.00 H new ATOM 0 HD13 LEU A 78 15.167 13.374 -4.021 1.00 0.00 H new ATOM 0 HD21 LEU A 78 12.664 14.714 -5.220 1.00 0.00 H new ATOM 0 HD22 LEU A 78 12.697 13.038 -4.621 1.00 0.00 H new ATOM 0 HD23 LEU A 78 11.500 14.189 -3.980 1.00 0.00 H new ATOM 1140 N GLY A 79 15.488 11.222 -3.290 1.00 0.00 N ATOM 1141 CA GLY A 79 16.888 10.843 -3.352 1.00 0.00 C ATOM 1142 C GLY A 79 17.077 9.354 -3.562 1.00 0.00 C ATOM 1143 O GLY A 79 18.017 8.928 -4.235 1.00 0.00 O ATOM 0 H GLY A 79 14.961 11.057 -4.147 1.00 0.00 H new ATOM 0 HA2 GLY A 79 17.372 11.386 -4.164 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.383 11.142 -2.428 1.00 0.00 H new ATOM 1147 N LEU A 80 16.184 8.559 -2.983 1.00 0.00 N ATOM 1148 CA LEU A 80 16.257 7.107 -3.108 1.00 0.00 C ATOM 1149 C LEU A 80 15.424 6.620 -4.289 1.00 0.00 C ATOM 1150 O LEU A 80 14.515 7.311 -4.749 1.00 0.00 O ATOM 1151 CB LEU A 80 15.776 6.440 -1.819 1.00 0.00 C ATOM 1152 CG LEU A 80 14.583 7.100 -1.126 1.00 0.00 C ATOM 1153 CD1 LEU A 80 13.774 6.068 -0.356 1.00 0.00 C ATOM 1154 CD2 LEU A 80 15.054 8.212 -0.199 1.00 0.00 C ATOM 0 H LEU A 80 15.401 8.895 -2.422 1.00 0.00 H new ATOM 0 HA LEU A 80 17.297 6.833 -3.284 1.00 0.00 H new ATOM 0 HB2 LEU A 80 15.513 5.406 -2.045 1.00 0.00 H new ATOM 0 HB3 LEU A 80 16.609 6.411 -1.116 1.00 0.00 H new ATOM 0 HG LEU A 80 13.940 7.538 -1.890 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.930 6.557 0.130 1.00 0.00 H new ATOM 0 HD12 LEU A 80 13.406 5.307 -1.044 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.406 5.600 0.399 1.00 0.00 H new ATOM 0 HD21 LEU A 80 14.192 8.671 0.286 1.00 0.00 H new ATOM 0 HD22 LEU A 80 15.718 7.797 0.559 1.00 0.00 H new ATOM 0 HD23 LEU A 80 15.589 8.966 -0.777 1.00 0.00 H new ATOM 1166 N THR A 81 15.739 5.423 -4.774 1.00 0.00 N ATOM 1167 CA THR A 81 15.019 4.841 -5.900 1.00 0.00 C ATOM 1168 C THR A 81 13.859 3.974 -5.423 1.00 0.00 C ATOM 1169 O THR A 81 13.641 3.818 -4.221 1.00 0.00 O ATOM 1170 CB THR A 81 15.951 3.992 -6.784 1.00 0.00 C ATOM 1171 OG1 THR A 81 16.409 2.847 -6.055 1.00 0.00 O ATOM 1172 CG2 THR A 81 17.143 4.810 -7.256 1.00 0.00 C ATOM 0 H THR A 81 16.488 4.838 -4.404 1.00 0.00 H new ATOM 0 HA THR A 81 14.629 5.671 -6.489 1.00 0.00 H new ATOM 0 HB THR A 81 15.388 3.664 -7.658 1.00 0.00 H new ATOM 0 HG1 THR A 81 17.000 2.311 -6.625 1.00 0.00 H new ATOM 0 HG21 THR A 81 17.787 4.189 -7.879 1.00 0.00 H new ATOM 0 HG22 THR A 81 16.792 5.664 -7.836 1.00 0.00 H new ATOM 0 HG23 THR A 81 17.706 5.165 -6.393 1.00 0.00 H new ATOM 1180 N HIS A 82 13.119 3.410 -6.372 1.00 0.00 N ATOM 1181 CA HIS A 82 11.982 2.556 -6.048 1.00 0.00 C ATOM 1182 C HIS A 82 12.375 1.491 -5.029 1.00 0.00 C ATOM 1183 O HIS A 82 11.740 1.352 -3.984 1.00 0.00 O ATOM 1184 CB HIS A 82 11.438 1.892 -7.313 1.00 0.00 C ATOM 1185 CG HIS A 82 10.012 1.451 -7.193 1.00 0.00 C ATOM 1186 ND1 HIS A 82 9.592 0.171 -7.487 1.00 0.00 N ATOM 1187 CD2 HIS A 82 8.905 2.129 -6.806 1.00 0.00 C ATOM 1188 CE1 HIS A 82 8.290 0.080 -7.289 1.00 0.00 C ATOM 1189 NE2 HIS A 82 7.848 1.255 -6.874 1.00 0.00 N ATOM 0 H HIS A 82 13.286 3.529 -7.371 1.00 0.00 H new ATOM 0 HA HIS A 82 11.203 3.181 -5.612 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.525 2.590 -8.146 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.057 1.028 -7.555 1.00 0.00 H new ATOM 0 HD2 HIS A 82 8.862 3.164 -6.501 1.00 0.00 H new ATOM 0 HE1 HIS A 82 7.688 -0.804 -7.440 1.00 0.00 H new ATOM 0 HE2 HIS A 82 6.880 1.476 -6.642 1.00 0.00 H new ATOM 1198 N GLY A 83 13.426 0.739 -5.342 1.00 0.00 N ATOM 1199 CA GLY A 83 13.885 -0.305 -4.444 1.00 0.00 C ATOM 1200 C GLY A 83 14.162 0.213 -3.046 1.00 0.00 C ATOM 1201 O GLY A 83 13.712 -0.371 -2.061 1.00 0.00 O ATOM 0 H GLY A 83 13.968 0.834 -6.201 1.00 0.00 H new ATOM 0 HA2 GLY A 83 13.134 -1.093 -4.394 1.00 0.00 H new ATOM 0 HA3 GLY A 83 14.792 -0.755 -4.848 1.00 0.00 H new ATOM 1205 N GLU A 84 14.907 1.311 -2.960 1.00 0.00 N ATOM 1206 CA GLU A 84 15.245 1.905 -1.672 1.00 0.00 C ATOM 1207 C GLU A 84 13.986 2.333 -0.923 1.00 0.00 C ATOM 1208 O GLU A 84 13.789 1.974 0.237 1.00 0.00 O ATOM 1209 CB GLU A 84 16.169 3.108 -1.867 1.00 0.00 C ATOM 1210 CG GLU A 84 17.641 2.739 -1.944 1.00 0.00 C ATOM 1211 CD GLU A 84 18.545 3.955 -2.019 1.00 0.00 C ATOM 1212 OE1 GLU A 84 18.730 4.620 -0.978 1.00 0.00 O ATOM 1213 OE2 GLU A 84 19.065 4.241 -3.117 1.00 0.00 O ATOM 0 H GLU A 84 15.287 1.807 -3.766 1.00 0.00 H new ATOM 0 HA GLU A 84 15.762 1.151 -1.078 1.00 0.00 H new ATOM 0 HB2 GLU A 84 15.885 3.629 -2.782 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.021 3.806 -1.043 1.00 0.00 H new ATOM 0 HG2 GLU A 84 17.909 2.145 -1.070 1.00 0.00 H new ATOM 0 HG3 GLU A 84 17.809 2.112 -2.819 1.00 0.00 H new ATOM 1220 N ALA A 85 13.137 3.103 -1.597 1.00 0.00 N ATOM 1221 CA ALA A 85 11.897 3.579 -0.997 1.00 0.00 C ATOM 1222 C ALA A 85 11.118 2.431 -0.363 1.00 0.00 C ATOM 1223 O ALA A 85 10.708 2.510 0.795 1.00 0.00 O ATOM 1224 CB ALA A 85 11.044 4.287 -2.039 1.00 0.00 C ATOM 0 H ALA A 85 13.286 3.410 -2.558 1.00 0.00 H new ATOM 0 HA ALA A 85 12.152 4.289 -0.210 1.00 0.00 H new ATOM 0 HB1 ALA A 85 10.121 4.637 -1.577 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.593 5.138 -2.442 1.00 0.00 H new ATOM 0 HB3 ALA A 85 10.805 3.594 -2.846 1.00 0.00 H new ATOM 1230 N VAL A 86 10.915 1.365 -1.131 1.00 0.00 N ATOM 1231 CA VAL A 86 10.184 0.201 -0.644 1.00 0.00 C ATOM 1232 C VAL A 86 10.759 -0.296 0.678 1.00 0.00 C ATOM 1233 O VAL A 86 10.058 -0.355 1.687 1.00 0.00 O ATOM 1234 CB VAL A 86 10.215 -0.949 -1.669 1.00 0.00 C ATOM 1235 CG1 VAL A 86 9.668 -2.228 -1.053 1.00 0.00 C ATOM 1236 CG2 VAL A 86 9.431 -0.571 -2.916 1.00 0.00 C ATOM 0 H VAL A 86 11.246 1.283 -2.092 1.00 0.00 H new ATOM 0 HA VAL A 86 9.152 0.516 -0.492 1.00 0.00 H new ATOM 0 HB VAL A 86 11.251 -1.127 -1.958 1.00 0.00 H new ATOM 0 HG11 VAL A 86 9.698 -3.029 -1.791 1.00 0.00 H new ATOM 0 HG12 VAL A 86 10.276 -2.506 -0.192 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.638 -2.067 -0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.463 -1.394 -3.630 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.395 -0.365 -2.646 1.00 0.00 H new ATOM 0 HG23 VAL A 86 9.872 0.318 -3.367 1.00 0.00 H new ATOM 1246 N GLN A 87 12.040 -0.650 0.664 1.00 0.00 N ATOM 1247 CA GLN A 87 12.709 -1.142 1.862 1.00 0.00 C ATOM 1248 C GLN A 87 12.530 -0.170 3.023 1.00 0.00 C ATOM 1249 O GLN A 87 12.664 -0.546 4.189 1.00 0.00 O ATOM 1250 CB GLN A 87 14.199 -1.358 1.588 1.00 0.00 C ATOM 1251 CG GLN A 87 14.474 -2.349 0.469 1.00 0.00 C ATOM 1252 CD GLN A 87 13.632 -3.605 0.581 1.00 0.00 C ATOM 1253 OE1 GLN A 87 13.860 -4.443 1.454 1.00 0.00 O ATOM 1254 NE2 GLN A 87 12.651 -3.742 -0.303 1.00 0.00 N ATOM 0 H GLN A 87 12.635 -0.605 -0.163 1.00 0.00 H new ATOM 0 HA GLN A 87 12.255 -2.095 2.136 1.00 0.00 H new ATOM 0 HB2 GLN A 87 14.656 -0.401 1.335 1.00 0.00 H new ATOM 0 HB3 GLN A 87 14.680 -1.710 2.500 1.00 0.00 H new ATOM 0 HG2 GLN A 87 14.280 -1.870 -0.491 1.00 0.00 H new ATOM 0 HG3 GLN A 87 15.529 -2.621 0.481 1.00 0.00 H new ATOM 0 HE21 GLN A 87 12.497 -3.023 -1.010 1.00 0.00 H new ATOM 0 HE22 GLN A 87 12.051 -4.566 -0.275 1.00 0.00 H new ATOM 1263 N LEU A 88 12.226 1.082 2.699 1.00 0.00 N ATOM 1264 CA LEU A 88 12.028 2.110 3.715 1.00 0.00 C ATOM 1265 C LEU A 88 10.652 1.979 4.360 1.00 0.00 C ATOM 1266 O LEU A 88 10.453 2.377 5.509 1.00 0.00 O ATOM 1267 CB LEU A 88 12.186 3.501 3.100 1.00 0.00 C ATOM 1268 CG LEU A 88 12.719 4.590 4.031 1.00 0.00 C ATOM 1269 CD1 LEU A 88 12.878 5.903 3.280 1.00 0.00 C ATOM 1270 CD2 LEU A 88 11.797 4.767 5.228 1.00 0.00 C ATOM 0 H LEU A 88 12.111 1.410 1.740 1.00 0.00 H new ATOM 0 HA LEU A 88 12.785 1.974 4.487 1.00 0.00 H new ATOM 0 HB2 LEU A 88 12.856 3.424 2.243 1.00 0.00 H new ATOM 0 HB3 LEU A 88 11.216 3.820 2.719 1.00 0.00 H new ATOM 0 HG LEU A 88 13.699 4.282 4.395 1.00 0.00 H new ATOM 0 HD11 LEU A 88 13.258 6.667 3.959 1.00 0.00 H new ATOM 0 HD12 LEU A 88 13.579 5.768 2.456 1.00 0.00 H new ATOM 0 HD13 LEU A 88 11.911 6.216 2.886 1.00 0.00 H new ATOM 0 HD21 LEU A 88 12.192 5.546 5.880 1.00 0.00 H new ATOM 0 HD22 LEU A 88 10.803 5.052 4.883 1.00 0.00 H new ATOM 0 HD23 LEU A 88 11.734 3.829 5.780 1.00 0.00 H new ATOM 1282 N LEU A 89 9.706 1.419 3.615 1.00 0.00 N ATOM 1283 CA LEU A 89 8.348 1.233 4.115 1.00 0.00 C ATOM 1284 C LEU A 89 8.239 -0.050 4.933 1.00 0.00 C ATOM 1285 O LEU A 89 7.412 -0.151 5.839 1.00 0.00 O ATOM 1286 CB LEU A 89 7.355 1.196 2.952 1.00 0.00 C ATOM 1287 CG LEU A 89 7.060 -0.185 2.365 1.00 0.00 C ATOM 1288 CD1 LEU A 89 6.111 -0.956 3.269 1.00 0.00 C ATOM 1289 CD2 LEU A 89 6.480 -0.056 0.965 1.00 0.00 C ATOM 0 H LEU A 89 9.854 1.086 2.662 1.00 0.00 H new ATOM 0 HA LEU A 89 8.108 2.076 4.763 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.415 1.634 3.289 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.736 1.834 2.155 1.00 0.00 H new ATOM 0 HG LEU A 89 7.996 -0.739 2.298 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.912 -1.936 2.836 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.565 -1.079 4.252 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.175 -0.406 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 89 6.276 -1.048 0.563 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.553 0.516 1.006 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.194 0.457 0.321 1.00 0.00 H new ATOM 1301 N ARG A 90 9.079 -1.026 4.607 1.00 0.00 N ATOM 1302 CA ARG A 90 9.078 -2.302 5.311 1.00 0.00 C ATOM 1303 C ARG A 90 10.099 -2.298 6.446 1.00 0.00 C ATOM 1304 O ARG A 90 10.267 -3.296 7.147 1.00 0.00 O ATOM 1305 CB ARG A 90 9.382 -3.445 4.341 1.00 0.00 C ATOM 1306 CG ARG A 90 10.557 -3.164 3.419 1.00 0.00 C ATOM 1307 CD ARG A 90 11.039 -4.431 2.729 1.00 0.00 C ATOM 1308 NE ARG A 90 11.723 -5.331 3.654 1.00 0.00 N ATOM 1309 CZ ARG A 90 12.031 -6.590 3.362 1.00 0.00 C ATOM 1310 NH1 ARG A 90 11.718 -7.094 2.177 1.00 0.00 N ATOM 1311 NH2 ARG A 90 12.653 -7.347 4.257 1.00 0.00 N ATOM 0 H ARG A 90 9.769 -0.957 3.859 1.00 0.00 H new ATOM 0 HA ARG A 90 8.086 -2.452 5.738 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.588 -4.350 4.912 1.00 0.00 H new ATOM 0 HB3 ARG A 90 8.496 -3.643 3.737 1.00 0.00 H new ATOM 0 HG2 ARG A 90 10.265 -2.429 2.669 1.00 0.00 H new ATOM 0 HG3 ARG A 90 11.375 -2.727 3.992 1.00 0.00 H new ATOM 0 HD2 ARG A 90 10.189 -4.947 2.283 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.714 -4.166 1.915 1.00 0.00 H new ATOM 0 HE ARG A 90 11.978 -4.973 4.575 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.240 -6.515 1.487 1.00 0.00 H new ATOM 0 HH12 ARG A 90 11.956 -8.061 1.955 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.895 -6.962 5.170 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.889 -8.313 4.032 1.00 0.00 H new ATOM 1325 N SER A 91 10.779 -1.169 6.619 1.00 0.00 N ATOM 1326 CA SER A 91 11.786 -1.036 7.665 1.00 0.00 C ATOM 1327 C SER A 91 11.195 -0.380 8.908 1.00 0.00 C ATOM 1328 O SER A 91 11.880 0.353 9.623 1.00 0.00 O ATOM 1329 CB SER A 91 12.974 -0.217 7.157 1.00 0.00 C ATOM 1330 OG SER A 91 13.953 -0.057 8.169 1.00 0.00 O ATOM 0 H SER A 91 10.651 -0.333 6.048 1.00 0.00 H new ATOM 0 HA SER A 91 12.131 -2.035 7.933 1.00 0.00 H new ATOM 0 HB2 SER A 91 13.417 -0.711 6.293 1.00 0.00 H new ATOM 0 HB3 SER A 91 12.629 0.761 6.823 1.00 0.00 H new ATOM 0 HG SER A 91 13.544 0.358 8.957 1.00 0.00 H new ATOM 1336 N VAL A 92 9.918 -0.648 9.161 1.00 0.00 N ATOM 1337 CA VAL A 92 9.233 -0.085 10.319 1.00 0.00 C ATOM 1338 C VAL A 92 8.905 -1.165 11.343 1.00 0.00 C ATOM 1339 O VAL A 92 8.451 -2.253 10.989 1.00 0.00 O ATOM 1340 CB VAL A 92 7.932 0.630 9.908 1.00 0.00 C ATOM 1341 CG1 VAL A 92 7.112 -0.247 8.974 1.00 0.00 C ATOM 1342 CG2 VAL A 92 7.124 1.014 11.139 1.00 0.00 C ATOM 0 H VAL A 92 9.337 -1.252 8.580 1.00 0.00 H new ATOM 0 HA VAL A 92 9.912 0.641 10.767 1.00 0.00 H new ATOM 0 HB VAL A 92 8.193 1.543 9.373 1.00 0.00 H new ATOM 0 HG11 VAL A 92 6.197 0.275 8.695 1.00 0.00 H new ATOM 0 HG12 VAL A 92 7.692 -0.467 8.078 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.858 -1.179 9.479 1.00 0.00 H new ATOM 0 HG21 VAL A 92 6.208 1.518 10.830 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.872 0.116 11.703 1.00 0.00 H new ATOM 0 HG23 VAL A 92 7.713 1.683 11.766 1.00 0.00 H new ATOM 1352 N GLY A 93 9.138 -0.858 12.615 1.00 0.00 N ATOM 1353 CA GLY A 93 8.860 -1.813 13.672 1.00 0.00 C ATOM 1354 C GLY A 93 7.414 -2.265 13.680 1.00 0.00 C ATOM 1355 O GLY A 93 7.015 -3.108 12.876 1.00 0.00 O ATOM 0 H GLY A 93 9.514 0.035 12.933 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.508 -2.681 13.552 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.102 -1.365 14.635 1.00 0.00 H new ATOM 1359 N ASP A 94 6.626 -1.705 14.592 1.00 0.00 N ATOM 1360 CA ASP A 94 5.215 -2.056 14.703 1.00 0.00 C ATOM 1361 C ASP A 94 4.330 -0.878 14.308 1.00 0.00 C ATOM 1362 O ASP A 94 3.104 -0.993 14.271 1.00 0.00 O ATOM 1363 CB ASP A 94 4.888 -2.501 16.129 1.00 0.00 C ATOM 1364 CG ASP A 94 5.051 -1.379 17.136 1.00 0.00 C ATOM 1365 OD1 ASP A 94 4.277 -0.402 17.066 1.00 0.00 O ATOM 1366 OD2 ASP A 94 5.954 -1.479 17.994 1.00 0.00 O ATOM 0 H ASP A 94 6.941 -1.006 15.265 1.00 0.00 H new ATOM 0 HA ASP A 94 5.016 -2.882 14.020 1.00 0.00 H new ATOM 0 HB2 ASP A 94 3.864 -2.872 16.165 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.538 -3.331 16.406 1.00 0.00 H new ATOM 1371 N THR A 95 4.958 0.256 14.015 1.00 0.00 N ATOM 1372 CA THR A 95 4.228 1.456 13.625 1.00 0.00 C ATOM 1373 C THR A 95 5.124 2.418 12.853 1.00 0.00 C ATOM 1374 O THR A 95 6.267 2.664 13.239 1.00 0.00 O ATOM 1375 CB THR A 95 3.650 2.184 14.853 1.00 0.00 C ATOM 1376 OG1 THR A 95 3.040 1.241 15.740 1.00 0.00 O ATOM 1377 CG2 THR A 95 2.625 3.226 14.430 1.00 0.00 C ATOM 0 H THR A 95 5.971 0.369 14.040 1.00 0.00 H new ATOM 0 HA THR A 95 3.408 1.134 12.983 1.00 0.00 H new ATOM 0 HB THR A 95 4.468 2.688 15.367 1.00 0.00 H new ATOM 0 HG1 THR A 95 3.684 0.977 16.430 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.230 3.728 15.314 1.00 0.00 H new ATOM 0 HG22 THR A 95 3.100 3.959 13.778 1.00 0.00 H new ATOM 0 HG23 THR A 95 1.810 2.738 13.895 1.00 0.00 H new ATOM 1385 N LEU A 96 4.598 2.960 11.760 1.00 0.00 N ATOM 1386 CA LEU A 96 5.350 3.897 10.933 1.00 0.00 C ATOM 1387 C LEU A 96 4.597 5.215 10.781 1.00 0.00 C ATOM 1388 O LEU A 96 3.419 5.314 11.127 1.00 0.00 O ATOM 1389 CB LEU A 96 5.620 3.289 9.556 1.00 0.00 C ATOM 1390 CG LEU A 96 4.611 3.633 8.460 1.00 0.00 C ATOM 1391 CD1 LEU A 96 5.150 3.237 7.094 1.00 0.00 C ATOM 1392 CD2 LEU A 96 3.278 2.950 8.729 1.00 0.00 C ATOM 0 H LEU A 96 3.654 2.767 11.426 1.00 0.00 H new ATOM 0 HA LEU A 96 6.300 4.098 11.427 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.608 3.611 9.226 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.657 2.205 9.661 1.00 0.00 H new ATOM 0 HG LEU A 96 4.451 4.711 8.465 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.418 3.490 6.327 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.079 3.773 6.900 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.340 2.164 7.075 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.572 3.206 7.939 1.00 0.00 H new ATOM 0 HD22 LEU A 96 3.421 1.870 8.752 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.885 3.284 9.689 1.00 0.00 H new ATOM 1404 N THR A 97 5.284 6.226 10.258 1.00 0.00 N ATOM 1405 CA THR A 97 4.681 7.538 10.059 1.00 0.00 C ATOM 1406 C THR A 97 4.663 7.916 8.582 1.00 0.00 C ATOM 1407 O THR A 97 5.650 8.422 8.048 1.00 0.00 O ATOM 1408 CB THR A 97 5.431 8.627 10.847 1.00 0.00 C ATOM 1409 OG1 THR A 97 5.927 8.088 12.077 1.00 0.00 O ATOM 1410 CG2 THR A 97 4.520 9.811 11.136 1.00 0.00 C ATOM 0 H THR A 97 6.259 6.161 9.965 1.00 0.00 H new ATOM 0 HA THR A 97 3.657 7.474 10.428 1.00 0.00 H new ATOM 0 HB THR A 97 6.267 8.973 10.239 1.00 0.00 H new ATOM 0 HG1 THR A 97 6.404 8.787 12.571 1.00 0.00 H new ATOM 0 HG21 THR A 97 5.072 10.567 11.694 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.168 10.237 10.196 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.666 9.478 11.725 1.00 0.00 H new ATOM 1418 N VAL A 98 3.534 7.667 7.926 1.00 0.00 N ATOM 1419 CA VAL A 98 3.387 7.983 6.510 1.00 0.00 C ATOM 1420 C VAL A 98 2.759 9.359 6.317 1.00 0.00 C ATOM 1421 O VAL A 98 1.725 9.671 6.909 1.00 0.00 O ATOM 1422 CB VAL A 98 2.525 6.932 5.786 1.00 0.00 C ATOM 1423 CG1 VAL A 98 2.956 5.527 6.179 1.00 0.00 C ATOM 1424 CG2 VAL A 98 1.051 7.151 6.090 1.00 0.00 C ATOM 0 H VAL A 98 2.708 7.247 8.352 1.00 0.00 H new ATOM 0 HA VAL A 98 4.388 7.979 6.080 1.00 0.00 H new ATOM 0 HB VAL A 98 2.671 7.044 4.712 1.00 0.00 H new ATOM 0 HG11 VAL A 98 2.336 4.797 5.658 1.00 0.00 H new ATOM 0 HG12 VAL A 98 4.000 5.377 5.906 1.00 0.00 H new ATOM 0 HG13 VAL A 98 2.841 5.399 7.255 1.00 0.00 H new ATOM 0 HG21 VAL A 98 0.457 6.399 5.570 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.884 7.066 7.164 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.754 8.144 5.754 1.00 0.00 H new ATOM 1434 N LEU A 99 3.390 10.179 5.483 1.00 0.00 N ATOM 1435 CA LEU A 99 2.893 11.523 5.210 1.00 0.00 C ATOM 1436 C LEU A 99 2.118 11.561 3.898 1.00 0.00 C ATOM 1437 O LEU A 99 2.011 12.607 3.257 1.00 0.00 O ATOM 1438 CB LEU A 99 4.055 12.517 5.158 1.00 0.00 C ATOM 1439 CG LEU A 99 3.674 13.998 5.178 1.00 0.00 C ATOM 1440 CD1 LEU A 99 2.879 14.326 6.432 1.00 0.00 C ATOM 1441 CD2 LEU A 99 4.917 14.870 5.089 1.00 0.00 C ATOM 0 H LEU A 99 4.246 9.937 4.985 1.00 0.00 H new ATOM 0 HA LEU A 99 2.217 11.805 6.018 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.713 12.320 6.004 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.632 12.323 4.254 1.00 0.00 H new ATOM 0 HG LEU A 99 3.048 14.205 4.310 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.616 15.384 6.430 1.00 0.00 H new ATOM 0 HD12 LEU A 99 1.969 13.726 6.453 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.481 14.103 7.313 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.626 15.920 5.105 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.569 14.661 5.937 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.447 14.654 4.162 1.00 0.00 H new ATOM 1453 N VAL A 100 1.575 10.413 3.504 1.00 0.00 N ATOM 1454 CA VAL A 100 0.806 10.315 2.269 1.00 0.00 C ATOM 1455 C VAL A 100 -0.435 11.199 2.323 1.00 0.00 C ATOM 1456 O VAL A 100 -0.816 11.687 3.388 1.00 0.00 O ATOM 1457 CB VAL A 100 0.376 8.862 1.989 1.00 0.00 C ATOM 1458 CG1 VAL A 100 1.549 7.912 2.180 1.00 0.00 C ATOM 1459 CG2 VAL A 100 -0.789 8.470 2.885 1.00 0.00 C ATOM 0 H VAL A 100 1.654 9.538 4.022 1.00 0.00 H new ATOM 0 HA VAL A 100 1.456 10.655 1.463 1.00 0.00 H new ATOM 0 HB VAL A 100 0.047 8.792 0.952 1.00 0.00 H new ATOM 0 HG11 VAL A 100 1.227 6.891 1.978 1.00 0.00 H new ATOM 0 HG12 VAL A 100 2.351 8.182 1.493 1.00 0.00 H new ATOM 0 HG13 VAL A 100 1.911 7.982 3.206 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -1.080 7.441 2.674 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.490 8.556 3.930 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -1.634 9.132 2.694 1.00 0.00 H new ATOM 1469 N CYS A 101 -1.061 11.401 1.169 1.00 0.00 N ATOM 1470 CA CYS A 101 -2.260 12.228 1.084 1.00 0.00 C ATOM 1471 C CYS A 101 -3.068 11.887 -0.164 1.00 0.00 C ATOM 1472 O CYS A 101 -2.519 11.424 -1.164 1.00 0.00 O ATOM 1473 CB CYS A 101 -1.883 13.710 1.073 1.00 0.00 C ATOM 1474 SG CYS A 101 -1.279 14.306 -0.524 1.00 0.00 S ATOM 0 H CYS A 101 -0.759 11.004 0.279 1.00 0.00 H new ATOM 0 HA CYS A 101 -2.875 12.024 1.960 1.00 0.00 H new ATOM 0 HB2 CYS A 101 -2.754 14.298 1.362 1.00 0.00 H new ATOM 0 HB3 CYS A 101 -1.116 13.884 1.828 1.00 0.00 H new ATOM 0 HG CYS A 101 -0.988 15.570 -0.434 1.00 0.00 H new ATOM 1480 N ASP A 102 -4.374 12.116 -0.097 1.00 0.00 N ATOM 1481 CA ASP A 102 -5.259 11.833 -1.221 1.00 0.00 C ATOM 1482 C ASP A 102 -4.642 12.311 -2.532 1.00 0.00 C ATOM 1483 O ASP A 102 -4.618 13.507 -2.819 1.00 0.00 O ATOM 1484 CB ASP A 102 -6.618 12.502 -1.009 1.00 0.00 C ATOM 1485 CG ASP A 102 -7.496 11.735 -0.039 1.00 0.00 C ATOM 1486 OD1 ASP A 102 -7.410 12.002 1.178 1.00 0.00 O ATOM 1487 OD2 ASP A 102 -8.269 10.868 -0.498 1.00 0.00 O ATOM 0 H ASP A 102 -4.844 12.497 0.724 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.399 10.754 -1.278 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.467 13.515 -0.635 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.130 12.589 -1.967 1.00 0.00 H new ATOM 1492 N GLY A 103 -4.142 11.367 -3.324 1.00 0.00 N ATOM 1493 CA GLY A 103 -3.531 11.711 -4.594 1.00 0.00 C ATOM 1494 C GLY A 103 -4.525 11.702 -5.738 1.00 0.00 C ATOM 1495 O GLY A 103 -4.503 12.583 -6.597 1.00 0.00 O ATOM 0 H GLY A 103 -4.149 10.370 -3.108 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.077 12.699 -4.519 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.728 11.007 -4.810 1.00 0.00 H new ATOM 1499 N PHE A 104 -5.400 10.701 -5.751 1.00 0.00 N ATOM 1500 CA PHE A 104 -6.406 10.579 -6.800 1.00 0.00 C ATOM 1501 C PHE A 104 -7.707 10.010 -6.241 1.00 0.00 C ATOM 1502 O PHE A 104 -7.796 8.822 -5.935 1.00 0.00 O ATOM 1503 CB PHE A 104 -5.889 9.685 -7.929 1.00 0.00 C ATOM 1504 CG PHE A 104 -4.404 9.777 -8.134 1.00 0.00 C ATOM 1505 CD1 PHE A 104 -3.866 10.731 -8.982 1.00 0.00 C ATOM 1506 CD2 PHE A 104 -3.546 8.909 -7.479 1.00 0.00 C ATOM 1507 CE1 PHE A 104 -2.500 10.817 -9.173 1.00 0.00 C ATOM 1508 CE2 PHE A 104 -2.179 8.990 -7.665 1.00 0.00 C ATOM 1509 CZ PHE A 104 -1.655 9.946 -8.513 1.00 0.00 C ATOM 0 H PHE A 104 -5.433 9.963 -5.047 1.00 0.00 H new ATOM 0 HA PHE A 104 -6.606 11.575 -7.196 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -6.154 8.650 -7.713 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -6.393 9.956 -8.856 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -4.522 11.415 -9.500 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -3.950 8.160 -6.815 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -2.093 11.565 -9.838 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -1.521 8.307 -7.148 1.00 0.00 H new ATOM 0 HZ PHE A 104 -0.587 10.012 -8.660 1.00 0.00 H new ATOM 1519 N GLU A 105 -8.714 10.869 -6.112 1.00 0.00 N ATOM 1520 CA GLU A 105 -10.010 10.453 -5.589 1.00 0.00 C ATOM 1521 C GLU A 105 -10.387 9.069 -6.109 1.00 0.00 C ATOM 1522 O GLU A 105 -10.946 8.251 -5.378 1.00 0.00 O ATOM 1523 CB GLU A 105 -11.089 11.466 -5.975 1.00 0.00 C ATOM 1524 CG GLU A 105 -11.150 11.753 -7.466 1.00 0.00 C ATOM 1525 CD GLU A 105 -10.043 12.681 -7.927 1.00 0.00 C ATOM 1526 OE1 GLU A 105 -10.050 13.862 -7.522 1.00 0.00 O ATOM 1527 OE2 GLU A 105 -9.169 12.225 -8.694 1.00 0.00 O ATOM 0 H GLU A 105 -8.657 11.856 -6.362 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.937 10.407 -4.502 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -12.059 11.094 -5.645 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.907 12.399 -5.441 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.085 10.814 -8.016 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -12.116 12.197 -7.708 1.00 0.00 H new ATOM 1534 N SER A 106 -10.077 8.815 -7.376 1.00 0.00 N ATOM 1535 CA SER A 106 -10.387 7.531 -7.996 1.00 0.00 C ATOM 1536 C SER A 106 -11.805 7.088 -7.648 1.00 0.00 C ATOM 1537 O SER A 106 -12.048 5.917 -7.360 1.00 0.00 O ATOM 1538 CB SER A 106 -9.383 6.468 -7.546 1.00 0.00 C ATOM 1539 OG SER A 106 -9.227 5.464 -8.534 1.00 0.00 O ATOM 0 H SER A 106 -9.612 9.480 -7.993 1.00 0.00 H new ATOM 0 HA SER A 106 -10.318 7.651 -9.077 1.00 0.00 H new ATOM 0 HB2 SER A 106 -8.420 6.936 -7.343 1.00 0.00 H new ATOM 0 HB3 SER A 106 -9.721 6.016 -6.613 1.00 0.00 H new ATOM 0 HG SER A 106 -8.579 4.797 -8.223 1.00 0.00 H new ATOM 1545 N GLY A 107 -12.738 8.035 -7.677 1.00 0.00 N ATOM 1546 CA GLY A 107 -14.120 7.724 -7.362 1.00 0.00 C ATOM 1547 C GLY A 107 -14.303 7.285 -5.923 1.00 0.00 C ATOM 1548 O GLY A 107 -13.710 6.305 -5.470 1.00 0.00 O ATOM 0 H GLY A 107 -12.561 9.011 -7.913 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.739 8.601 -7.552 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -14.472 6.935 -8.027 1.00 0.00 H new ATOM 1552 N PRO A 108 -15.139 8.022 -5.177 1.00 0.00 N ATOM 1553 CA PRO A 108 -15.416 7.723 -3.769 1.00 0.00 C ATOM 1554 C PRO A 108 -16.231 6.445 -3.597 1.00 0.00 C ATOM 1555 O PRO A 108 -15.868 5.566 -2.816 1.00 0.00 O ATOM 1556 CB PRO A 108 -16.220 8.938 -3.299 1.00 0.00 C ATOM 1557 CG PRO A 108 -16.853 9.474 -4.537 1.00 0.00 C ATOM 1558 CD PRO A 108 -15.879 9.203 -5.650 1.00 0.00 C ATOM 0 HA PRO A 108 -14.501 7.555 -3.201 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -16.971 8.655 -2.561 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -15.576 9.682 -2.830 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -17.810 8.988 -4.728 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.051 10.542 -4.443 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -16.390 9.006 -6.592 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -15.216 10.051 -5.819 1.00 0.00 H new ATOM 1566 N SER A 109 -17.335 6.350 -4.331 1.00 0.00 N ATOM 1567 CA SER A 109 -18.204 5.182 -4.258 1.00 0.00 C ATOM 1568 C SER A 109 -17.567 3.986 -4.958 1.00 0.00 C ATOM 1569 O SER A 109 -16.861 4.140 -5.955 1.00 0.00 O ATOM 1570 CB SER A 109 -19.564 5.490 -4.886 1.00 0.00 C ATOM 1571 OG SER A 109 -20.187 6.588 -4.241 1.00 0.00 O ATOM 0 H SER A 109 -17.649 7.069 -4.983 1.00 0.00 H new ATOM 0 HA SER A 109 -18.346 4.932 -3.207 1.00 0.00 H new ATOM 0 HB2 SER A 109 -19.437 5.711 -5.946 1.00 0.00 H new ATOM 0 HB3 SER A 109 -20.207 4.612 -4.818 1.00 0.00 H new ATOM 0 HG SER A 109 -21.054 6.766 -4.662 1.00 0.00 H new ATOM 1577 N SER A 110 -17.822 2.793 -4.430 1.00 0.00 N ATOM 1578 CA SER A 110 -17.271 1.570 -5.001 1.00 0.00 C ATOM 1579 C SER A 110 -17.533 1.506 -6.503 1.00 0.00 C ATOM 1580 O SER A 110 -18.672 1.628 -6.951 1.00 0.00 O ATOM 1581 CB SER A 110 -17.874 0.344 -4.314 1.00 0.00 C ATOM 1582 OG SER A 110 -19.287 0.340 -4.425 1.00 0.00 O ATOM 0 H SER A 110 -18.407 2.648 -3.607 1.00 0.00 H new ATOM 0 HA SER A 110 -16.193 1.575 -4.837 1.00 0.00 H new ATOM 0 HB2 SER A 110 -17.468 -0.564 -4.761 1.00 0.00 H new ATOM 0 HB3 SER A 110 -17.589 0.336 -3.262 1.00 0.00 H new ATOM 0 HG SER A 110 -19.552 0.811 -5.242 1.00 0.00 H new ATOM 1588 N GLY A 111 -16.469 1.313 -7.276 1.00 0.00 N ATOM 1589 CA GLY A 111 -16.604 1.236 -8.719 1.00 0.00 C ATOM 1590 C GLY A 111 -15.635 0.248 -9.340 1.00 0.00 C ATOM 1591 O GLY A 111 -15.939 -0.371 -10.359 1.00 0.00 O ATOM 0 H GLY A 111 -15.516 1.209 -6.929 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -17.624 0.947 -8.971 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.437 2.223 -9.150 1.00 0.00 H new TER 1595 GLY A 111