USER MOD reduce.3.24.130724 H: found=0, std=0, add=748, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 748 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 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 84 GLN : amide:sc= 0.247 X(o=-1.2,f=-1.7) USER MOD Set 1.3: A 123 ASN : amide:sc= -1.46 K(o=-1.2,f=-2.2) USER MOD Set 2.1: A 117 SER OG : rot 180:sc= -0.0392 USER MOD Set 2.2: A 119 THR OG1 : rot -160:sc= 0 USER MOD Set 3.1: A 112 GLN : amide:sc= -3.68! C(o=-4.2!,f=-4.7!) USER MOD Set 3.2: A 114 ASN :FLIP amide:sc= -0.495 F(o=-4.7,f=-4.2) USER MOD Single : A 67 SER OG : rot 180:sc= -0.0987 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -49:sc= 0.568 USER MOD Single : A 71 SER OG : rot 180:sc= -0.078 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 ASN : amide:sc= -0.571 X(o=-0.57,f=-0.76) USER MOD Single : A 91 HIS : no HD1:sc= -0.231 X(o=-0.23,f=-0.012) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.13 K(o=-0.13,f=-1.9!) USER MOD Single : A 104 TYR OH : rot 165:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 CYS SG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot -50:sc= 0.492 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 TYR OH : rot -10:sc= 0.159 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ -157:sc= -0.0784 (180deg=-0.402) USER MOD Single : A 131 GLN : amide:sc= -2.63! C(o=-2.6!,f=-7.7!) USER MOD Single : A 134 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 ASN : amide:sc= -0.674 K(o=-0.67,f=-2.7!) USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 TYR OH : rot 30:sc=-0.00759 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= -0.0829 K(o=-0.083,f=-1) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 66 35.269 -17.642 0.251 1.00 0.00 N ATOM 2 CA GLY A 66 36.276 -17.135 -0.662 1.00 0.00 C ATOM 3 C GLY A 66 37.010 -15.931 -0.105 1.00 0.00 C ATOM 4 O GLY A 66 36.620 -15.379 0.923 1.00 0.00 O ATOM 0 HA2 GLY A 66 36.994 -17.925 -0.881 1.00 0.00 H new ATOM 0 HA3 GLY A 66 35.803 -16.864 -1.606 1.00 0.00 H new ATOM 8 N SER A 67 38.078 -15.524 -0.785 1.00 0.00 N ATOM 9 CA SER A 67 38.872 -14.382 -0.349 1.00 0.00 C ATOM 10 C SER A 67 38.613 -13.169 -1.238 1.00 0.00 C ATOM 11 O SER A 67 38.410 -12.058 -0.749 1.00 0.00 O ATOM 12 CB SER A 67 40.361 -14.732 -0.364 1.00 0.00 C ATOM 13 OG SER A 67 40.818 -14.954 -1.687 1.00 0.00 O ATOM 0 H SER A 67 38.413 -15.969 -1.640 1.00 0.00 H new ATOM 0 HA SER A 67 38.576 -14.133 0.670 1.00 0.00 H new ATOM 0 HB2 SER A 67 40.933 -13.923 0.091 1.00 0.00 H new ATOM 0 HB3 SER A 67 40.535 -15.623 0.239 1.00 0.00 H new ATOM 0 HG SER A 67 41.773 -15.174 -1.671 1.00 0.00 H new ATOM 19 N SER A 68 38.624 -13.392 -2.549 1.00 0.00 N ATOM 20 CA SER A 68 38.395 -12.318 -3.509 1.00 0.00 C ATOM 21 C SER A 68 36.985 -12.398 -4.087 1.00 0.00 C ATOM 22 O SER A 68 36.235 -13.330 -3.798 1.00 0.00 O ATOM 23 CB SER A 68 39.426 -12.386 -4.637 1.00 0.00 C ATOM 24 OG SER A 68 39.354 -13.625 -5.320 1.00 0.00 O ATOM 0 H SER A 68 38.789 -14.306 -2.970 1.00 0.00 H new ATOM 0 HA SER A 68 38.501 -11.367 -2.986 1.00 0.00 H new ATOM 0 HB2 SER A 68 39.256 -11.570 -5.339 1.00 0.00 H new ATOM 0 HB3 SER A 68 40.427 -12.251 -4.228 1.00 0.00 H new ATOM 0 HG SER A 68 40.022 -13.643 -6.037 1.00 0.00 H new ATOM 30 N GLY A 69 36.632 -11.413 -4.907 1.00 0.00 N ATOM 31 CA GLY A 69 35.314 -11.389 -5.513 1.00 0.00 C ATOM 32 C GLY A 69 34.267 -10.778 -4.603 1.00 0.00 C ATOM 33 O GLY A 69 34.441 -10.739 -3.385 1.00 0.00 O ATOM 0 H GLY A 69 37.235 -10.631 -5.162 1.00 0.00 H new ATOM 0 HA2 GLY A 69 35.356 -10.824 -6.444 1.00 0.00 H new ATOM 0 HA3 GLY A 69 35.018 -12.406 -5.771 1.00 0.00 H new ATOM 37 N SER A 70 33.178 -10.298 -5.194 1.00 0.00 N ATOM 38 CA SER A 70 32.102 -9.680 -4.428 1.00 0.00 C ATOM 39 C SER A 70 30.882 -10.595 -4.371 1.00 0.00 C ATOM 40 O SER A 70 29.745 -10.140 -4.495 1.00 0.00 O ATOM 41 CB SER A 70 31.716 -8.334 -5.045 1.00 0.00 C ATOM 42 OG SER A 70 30.780 -7.649 -4.230 1.00 0.00 O ATOM 0 H SER A 70 33.017 -10.325 -6.201 1.00 0.00 H new ATOM 0 HA SER A 70 32.460 -9.516 -3.412 1.00 0.00 H new ATOM 0 HB2 SER A 70 32.608 -7.721 -5.174 1.00 0.00 H new ATOM 0 HB3 SER A 70 31.292 -8.493 -6.036 1.00 0.00 H new ATOM 0 HG SER A 70 30.051 -8.257 -3.987 1.00 0.00 H new ATOM 48 N SER A 71 31.128 -11.887 -4.182 1.00 0.00 N ATOM 49 CA SER A 71 30.051 -12.868 -4.111 1.00 0.00 C ATOM 50 C SER A 71 29.152 -12.602 -2.907 1.00 0.00 C ATOM 51 O SER A 71 27.983 -12.249 -3.056 1.00 0.00 O ATOM 52 CB SER A 71 30.625 -14.283 -4.031 1.00 0.00 C ATOM 53 OG SER A 71 31.493 -14.419 -2.919 1.00 0.00 O ATOM 0 H SER A 71 32.063 -12.279 -4.075 1.00 0.00 H new ATOM 0 HA SER A 71 29.451 -12.778 -5.017 1.00 0.00 H new ATOM 0 HB2 SER A 71 29.812 -15.005 -3.952 1.00 0.00 H new ATOM 0 HB3 SER A 71 31.166 -14.512 -4.949 1.00 0.00 H new ATOM 0 HG SER A 71 31.846 -15.333 -2.889 1.00 0.00 H new ATOM 59 N GLY A 72 29.709 -12.775 -1.712 1.00 0.00 N ATOM 60 CA GLY A 72 28.945 -12.551 -0.499 1.00 0.00 C ATOM 61 C GLY A 72 27.764 -13.493 -0.374 1.00 0.00 C ATOM 62 O GLY A 72 26.905 -13.542 -1.254 1.00 0.00 O ATOM 0 H GLY A 72 30.675 -13.066 -1.563 1.00 0.00 H new ATOM 0 HA2 GLY A 72 29.597 -12.675 0.365 1.00 0.00 H new ATOM 0 HA3 GLY A 72 28.588 -11.521 -0.484 1.00 0.00 H new ATOM 66 N SER A 73 27.721 -14.244 0.722 1.00 0.00 N ATOM 67 CA SER A 73 26.640 -15.194 0.956 1.00 0.00 C ATOM 68 C SER A 73 25.300 -14.612 0.514 1.00 0.00 C ATOM 69 O SER A 73 24.578 -15.217 -0.277 1.00 0.00 O ATOM 70 CB SER A 73 26.580 -15.576 2.436 1.00 0.00 C ATOM 71 OG SER A 73 25.580 -16.552 2.670 1.00 0.00 O ATOM 0 H SER A 73 28.422 -14.213 1.462 1.00 0.00 H new ATOM 0 HA SER A 73 26.841 -16.088 0.365 1.00 0.00 H new ATOM 0 HB2 SER A 73 27.549 -15.960 2.755 1.00 0.00 H new ATOM 0 HB3 SER A 73 26.375 -14.689 3.036 1.00 0.00 H new ATOM 0 HG SER A 73 25.563 -16.781 3.623 1.00 0.00 H new ATOM 77 N VAL A 74 24.976 -13.432 1.033 1.00 0.00 N ATOM 78 CA VAL A 74 23.724 -12.765 0.693 1.00 0.00 C ATOM 79 C VAL A 74 23.542 -12.677 -0.818 1.00 0.00 C ATOM 80 O VAL A 74 24.499 -12.511 -1.575 1.00 0.00 O ATOM 81 CB VAL A 74 23.663 -11.347 1.290 1.00 0.00 C ATOM 82 CG1 VAL A 74 23.689 -11.406 2.810 1.00 0.00 C ATOM 83 CG2 VAL A 74 24.808 -10.497 0.762 1.00 0.00 C ATOM 0 H VAL A 74 25.563 -12.918 1.690 1.00 0.00 H new ATOM 0 HA VAL A 74 22.920 -13.365 1.119 1.00 0.00 H new ATOM 0 HB VAL A 74 22.725 -10.883 0.984 1.00 0.00 H new ATOM 0 HG11 VAL A 74 23.645 -10.395 3.214 1.00 0.00 H new ATOM 0 HG12 VAL A 74 22.832 -11.977 3.167 1.00 0.00 H new ATOM 0 HG13 VAL A 74 24.609 -11.889 3.140 1.00 0.00 H new ATOM 0 HG21 VAL A 74 24.749 -9.498 1.194 1.00 0.00 H new ATOM 0 HG22 VAL A 74 25.758 -10.956 1.036 1.00 0.00 H new ATOM 0 HG23 VAL A 74 24.739 -10.427 -0.324 1.00 0.00 H new ATOM 93 N PRO A 75 22.284 -12.789 -1.270 1.00 0.00 N ATOM 94 CA PRO A 75 21.946 -12.723 -2.695 1.00 0.00 C ATOM 95 C PRO A 75 22.132 -11.324 -3.271 1.00 0.00 C ATOM 96 O PRO A 75 21.636 -10.342 -2.718 1.00 0.00 O ATOM 97 CB PRO A 75 20.468 -13.122 -2.727 1.00 0.00 C ATOM 98 CG PRO A 75 19.951 -12.769 -1.376 1.00 0.00 C ATOM 99 CD PRO A 75 21.095 -12.987 -0.424 1.00 0.00 C ATOM 0 HA PRO A 75 22.589 -13.365 -3.297 1.00 0.00 H new ATOM 0 HB2 PRO A 75 19.930 -12.586 -3.509 1.00 0.00 H new ATOM 0 HB3 PRO A 75 20.350 -14.186 -2.931 1.00 0.00 H new ATOM 0 HG2 PRO A 75 19.611 -11.734 -1.347 1.00 0.00 H new ATOM 0 HG3 PRO A 75 19.098 -13.393 -1.110 1.00 0.00 H new ATOM 0 HD2 PRO A 75 21.069 -12.279 0.405 1.00 0.00 H new ATOM 0 HD3 PRO A 75 21.072 -13.987 0.010 1.00 0.00 H new ATOM 107 N LYS A 76 22.850 -11.239 -4.386 1.00 0.00 N ATOM 108 CA LYS A 76 23.101 -9.960 -5.039 1.00 0.00 C ATOM 109 C LYS A 76 21.876 -9.055 -4.953 1.00 0.00 C ATOM 110 O LYS A 76 20.742 -9.515 -5.086 1.00 0.00 O ATOM 111 CB LYS A 76 23.484 -10.179 -6.505 1.00 0.00 C ATOM 112 CG LYS A 76 22.298 -10.481 -7.404 1.00 0.00 C ATOM 113 CD LYS A 76 21.846 -11.925 -7.265 1.00 0.00 C ATOM 114 CE LYS A 76 20.807 -12.288 -8.315 1.00 0.00 C ATOM 115 NZ LYS A 76 20.393 -13.715 -8.215 1.00 0.00 N ATOM 0 H LYS A 76 23.268 -12.042 -4.856 1.00 0.00 H new ATOM 0 HA LYS A 76 23.928 -9.473 -4.522 1.00 0.00 H new ATOM 0 HB2 LYS A 76 23.993 -9.289 -6.876 1.00 0.00 H new ATOM 0 HB3 LYS A 76 24.195 -11.003 -6.567 1.00 0.00 H new ATOM 0 HG2 LYS A 76 21.472 -9.815 -7.154 1.00 0.00 H new ATOM 0 HG3 LYS A 76 22.566 -10.281 -8.441 1.00 0.00 H new ATOM 0 HD2 LYS A 76 22.707 -12.587 -7.359 1.00 0.00 H new ATOM 0 HD3 LYS A 76 21.430 -12.083 -6.270 1.00 0.00 H new ATOM 0 HE2 LYS A 76 19.933 -11.647 -8.198 1.00 0.00 H new ATOM 0 HE3 LYS A 76 21.212 -12.096 -9.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 19.684 -13.923 -8.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 21.222 -14.327 -8.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 19.983 -13.892 -7.276 1.00 0.00 H new ATOM 129 N ARG A 77 22.113 -7.766 -4.730 1.00 0.00 N ATOM 130 CA ARG A 77 21.029 -6.797 -4.626 1.00 0.00 C ATOM 131 C ARG A 77 20.188 -6.783 -5.899 1.00 0.00 C ATOM 132 O ARG A 77 20.568 -7.372 -6.911 1.00 0.00 O ATOM 133 CB ARG A 77 21.590 -5.399 -4.357 1.00 0.00 C ATOM 134 CG ARG A 77 22.317 -4.796 -5.548 1.00 0.00 C ATOM 135 CD ARG A 77 23.265 -3.687 -5.118 1.00 0.00 C ATOM 136 NE ARG A 77 22.549 -2.473 -4.736 1.00 0.00 N ATOM 137 CZ ARG A 77 23.142 -1.301 -4.538 1.00 0.00 C ATOM 138 NH1 ARG A 77 24.455 -1.186 -4.685 1.00 0.00 N ATOM 139 NH2 ARG A 77 22.423 -0.241 -4.193 1.00 0.00 N ATOM 0 H ARG A 77 23.046 -7.369 -4.618 1.00 0.00 H new ATOM 0 HA ARG A 77 20.391 -7.092 -3.793 1.00 0.00 H new ATOM 0 HB2 ARG A 77 20.773 -4.738 -4.068 1.00 0.00 H new ATOM 0 HB3 ARG A 77 22.275 -5.448 -3.511 1.00 0.00 H new ATOM 0 HG2 ARG A 77 22.877 -5.574 -6.066 1.00 0.00 H new ATOM 0 HG3 ARG A 77 21.590 -4.400 -6.257 1.00 0.00 H new ATOM 0 HD2 ARG A 77 23.869 -4.031 -4.278 1.00 0.00 H new ATOM 0 HD3 ARG A 77 23.952 -3.461 -5.933 1.00 0.00 H new ATOM 0 HE ARG A 77 21.538 -2.528 -4.615 1.00 0.00 H new ATOM 0 HH11 ARG A 77 25.012 -1.998 -4.951 1.00 0.00 H new ATOM 0 HH12 ARG A 77 24.908 -0.285 -4.532 1.00 0.00 H new ATOM 0 HH21 ARG A 77 21.413 -0.325 -4.079 1.00 0.00 H new ATOM 0 HH22 ARG A 77 22.880 0.658 -4.041 1.00 0.00 H new ATOM 153 N GLN A 78 19.044 -6.109 -5.839 1.00 0.00 N ATOM 154 CA GLN A 78 18.149 -6.021 -6.987 1.00 0.00 C ATOM 155 C GLN A 78 17.066 -4.973 -6.753 1.00 0.00 C ATOM 156 O GLN A 78 16.840 -4.541 -5.622 1.00 0.00 O ATOM 157 CB GLN A 78 17.507 -7.381 -7.266 1.00 0.00 C ATOM 158 CG GLN A 78 16.424 -7.759 -6.269 1.00 0.00 C ATOM 159 CD GLN A 78 15.416 -8.734 -6.844 1.00 0.00 C ATOM 160 OE1 GLN A 78 15.648 -9.943 -6.868 1.00 0.00 O ATOM 161 NE2 GLN A 78 14.288 -8.212 -7.312 1.00 0.00 N ATOM 0 H GLN A 78 18.715 -5.616 -5.009 1.00 0.00 H new ATOM 0 HA GLN A 78 18.739 -5.721 -7.853 1.00 0.00 H new ATOM 0 HB2 GLN A 78 17.079 -7.373 -8.269 1.00 0.00 H new ATOM 0 HB3 GLN A 78 18.282 -8.148 -7.256 1.00 0.00 H new ATOM 0 HG2 GLN A 78 16.886 -8.199 -5.386 1.00 0.00 H new ATOM 0 HG3 GLN A 78 15.906 -6.857 -5.942 1.00 0.00 H new ATOM 0 HE21 GLN A 78 14.137 -7.204 -7.272 1.00 0.00 H new ATOM 0 HE22 GLN A 78 13.572 -8.819 -7.711 1.00 0.00 H new ATOM 170 N ARG A 79 16.399 -4.568 -7.829 1.00 0.00 N ATOM 171 CA ARG A 79 15.340 -3.569 -7.741 1.00 0.00 C ATOM 172 C ARG A 79 14.552 -3.726 -6.444 1.00 0.00 C ATOM 173 O ARG A 79 14.300 -4.843 -5.990 1.00 0.00 O ATOM 174 CB ARG A 79 14.398 -3.687 -8.940 1.00 0.00 C ATOM 175 CG ARG A 79 15.064 -3.374 -10.270 1.00 0.00 C ATOM 176 CD ARG A 79 14.140 -3.675 -11.440 1.00 0.00 C ATOM 177 NE ARG A 79 13.906 -5.107 -11.599 1.00 0.00 N ATOM 178 CZ ARG A 79 13.512 -5.666 -12.739 1.00 0.00 C ATOM 179 NH1 ARG A 79 13.309 -4.916 -13.813 1.00 0.00 N ATOM 180 NH2 ARG A 79 13.321 -6.977 -12.805 1.00 0.00 N ATOM 0 H ARG A 79 16.573 -4.916 -8.772 1.00 0.00 H new ATOM 0 HA ARG A 79 15.803 -2.582 -7.748 1.00 0.00 H new ATOM 0 HB2 ARG A 79 13.993 -4.698 -8.975 1.00 0.00 H new ATOM 0 HB3 ARG A 79 13.555 -3.011 -8.797 1.00 0.00 H new ATOM 0 HG2 ARG A 79 15.354 -2.324 -10.295 1.00 0.00 H new ATOM 0 HG3 ARG A 79 15.978 -3.959 -10.367 1.00 0.00 H new ATOM 0 HD2 ARG A 79 13.188 -3.167 -11.290 1.00 0.00 H new ATOM 0 HD3 ARG A 79 14.574 -3.275 -12.356 1.00 0.00 H new ATOM 0 HE ARG A 79 14.053 -5.712 -10.791 1.00 0.00 H new ATOM 0 HH11 ARG A 79 13.455 -3.908 -13.766 1.00 0.00 H new ATOM 0 HH12 ARG A 79 13.007 -5.347 -14.687 1.00 0.00 H new ATOM 0 HH21 ARG A 79 13.476 -7.557 -11.981 1.00 0.00 H new ATOM 0 HH22 ARG A 79 13.019 -7.405 -13.680 1.00 0.00 H new ATOM 194 N ILE A 80 14.166 -2.600 -5.853 1.00 0.00 N ATOM 195 CA ILE A 80 13.406 -2.613 -4.609 1.00 0.00 C ATOM 196 C ILE A 80 11.906 -2.571 -4.881 1.00 0.00 C ATOM 197 O ILE A 80 11.141 -3.355 -4.320 1.00 0.00 O ATOM 198 CB ILE A 80 13.786 -1.426 -3.705 1.00 0.00 C ATOM 199 CG1 ILE A 80 15.288 -1.438 -3.413 1.00 0.00 C ATOM 200 CG2 ILE A 80 12.989 -1.470 -2.410 1.00 0.00 C ATOM 201 CD1 ILE A 80 15.838 -0.086 -3.019 1.00 0.00 C ATOM 0 H ILE A 80 14.367 -1.668 -6.215 1.00 0.00 H new ATOM 0 HA ILE A 80 13.654 -3.543 -4.097 1.00 0.00 H new ATOM 0 HB ILE A 80 13.544 -0.500 -4.227 1.00 0.00 H new ATOM 0 HG12 ILE A 80 15.488 -2.150 -2.612 1.00 0.00 H new ATOM 0 HG13 ILE A 80 15.819 -1.794 -4.296 1.00 0.00 H new ATOM 0 HG21 ILE A 80 13.269 -0.624 -1.782 1.00 0.00 H new ATOM 0 HG22 ILE A 80 11.924 -1.417 -2.636 1.00 0.00 H new ATOM 0 HG23 ILE A 80 13.202 -2.400 -1.883 1.00 0.00 H new ATOM 0 HD11 ILE A 80 16.908 -0.170 -2.827 1.00 0.00 H new ATOM 0 HD12 ILE A 80 15.669 0.625 -3.828 1.00 0.00 H new ATOM 0 HD13 ILE A 80 15.334 0.263 -2.118 1.00 0.00 H new ATOM 213 N ARG A 81 11.493 -1.651 -5.747 1.00 0.00 N ATOM 214 CA ARG A 81 10.084 -1.507 -6.094 1.00 0.00 C ATOM 215 C ARG A 81 9.210 -1.536 -4.843 1.00 0.00 C ATOM 216 O ARG A 81 8.197 -2.234 -4.797 1.00 0.00 O ATOM 217 CB ARG A 81 9.657 -2.619 -7.053 1.00 0.00 C ATOM 218 CG ARG A 81 10.370 -2.574 -8.395 1.00 0.00 C ATOM 219 CD ARG A 81 9.648 -1.667 -9.379 1.00 0.00 C ATOM 220 NE ARG A 81 10.371 -1.545 -10.642 1.00 0.00 N ATOM 221 CZ ARG A 81 9.838 -1.034 -11.747 1.00 0.00 C ATOM 222 NH1 ARG A 81 8.586 -0.600 -11.744 1.00 0.00 N ATOM 223 NH2 ARG A 81 10.560 -0.957 -12.858 1.00 0.00 N ATOM 0 H ARG A 81 12.114 -0.995 -6.221 1.00 0.00 H new ATOM 0 HA ARG A 81 9.953 -0.543 -6.585 1.00 0.00 H new ATOM 0 HB2 ARG A 81 9.846 -3.584 -6.583 1.00 0.00 H new ATOM 0 HB3 ARG A 81 8.582 -2.550 -7.220 1.00 0.00 H new ATOM 0 HG2 ARG A 81 11.391 -2.220 -8.254 1.00 0.00 H new ATOM 0 HG3 ARG A 81 10.436 -3.581 -8.807 1.00 0.00 H new ATOM 0 HD2 ARG A 81 8.649 -2.060 -9.569 1.00 0.00 H new ATOM 0 HD3 ARG A 81 9.522 -0.679 -8.936 1.00 0.00 H new ATOM 0 HE ARG A 81 11.337 -1.870 -10.678 1.00 0.00 H new ATOM 0 HH11 ARG A 81 8.028 -0.658 -10.892 1.00 0.00 H new ATOM 0 HH12 ARG A 81 8.180 -0.208 -12.594 1.00 0.00 H new ATOM 0 HH21 ARG A 81 11.524 -1.290 -12.864 1.00 0.00 H new ATOM 0 HH22 ARG A 81 10.151 -0.565 -13.706 1.00 0.00 H new ATOM 237 N LYS A 82 9.610 -0.774 -3.831 1.00 0.00 N ATOM 238 CA LYS A 82 8.864 -0.711 -2.579 1.00 0.00 C ATOM 239 C LYS A 82 7.481 -0.105 -2.800 1.00 0.00 C ATOM 240 O LYS A 82 7.142 0.306 -3.911 1.00 0.00 O ATOM 241 CB LYS A 82 9.634 0.112 -1.544 1.00 0.00 C ATOM 242 CG LYS A 82 9.374 -0.317 -0.111 1.00 0.00 C ATOM 243 CD LYS A 82 10.572 -0.034 0.781 1.00 0.00 C ATOM 244 CE LYS A 82 10.697 1.449 1.092 1.00 0.00 C ATOM 245 NZ LYS A 82 11.707 1.710 2.155 1.00 0.00 N ATOM 0 H LYS A 82 10.447 -0.191 -3.853 1.00 0.00 H new ATOM 0 HA LYS A 82 8.740 -1.728 -2.206 1.00 0.00 H new ATOM 0 HB2 LYS A 82 10.701 0.033 -1.750 1.00 0.00 H new ATOM 0 HB3 LYS A 82 9.365 1.163 -1.654 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.500 0.208 0.274 1.00 0.00 H new ATOM 0 HG3 LYS A 82 9.143 -1.382 -0.085 1.00 0.00 H new ATOM 0 HD2 LYS A 82 10.475 -0.595 1.711 1.00 0.00 H new ATOM 0 HD3 LYS A 82 11.482 -0.382 0.292 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.976 1.988 0.186 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.729 1.837 1.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.762 2.732 2.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.428 1.217 3.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 12.637 1.363 1.843 1.00 0.00 H new ATOM 259 N LEU A 83 6.688 -0.051 -1.736 1.00 0.00 N ATOM 260 CA LEU A 83 5.342 0.506 -1.813 1.00 0.00 C ATOM 261 C LEU A 83 5.056 1.407 -0.616 1.00 0.00 C ATOM 262 O LEU A 83 5.290 1.024 0.530 1.00 0.00 O ATOM 263 CB LEU A 83 4.306 -0.618 -1.879 1.00 0.00 C ATOM 264 CG LEU A 83 4.130 -1.289 -3.242 1.00 0.00 C ATOM 265 CD1 LEU A 83 3.359 -2.592 -3.099 1.00 0.00 C ATOM 266 CD2 LEU A 83 3.424 -0.352 -4.211 1.00 0.00 C ATOM 0 H LEU A 83 6.953 -0.386 -0.810 1.00 0.00 H new ATOM 0 HA LEU A 83 5.276 1.106 -2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.582 -1.383 -1.153 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.342 -0.216 -1.567 1.00 0.00 H new ATOM 0 HG LEU A 83 5.117 -1.517 -3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.243 -3.056 -4.079 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.905 -3.267 -2.440 1.00 0.00 H new ATOM 0 HD13 LEU A 83 2.376 -2.388 -2.676 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.308 -0.846 -5.175 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.442 -0.092 -3.816 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.016 0.555 -4.337 1.00 0.00 H new ATOM 278 N GLN A 84 4.547 2.604 -0.890 1.00 0.00 N ATOM 279 CA GLN A 84 4.228 3.558 0.165 1.00 0.00 C ATOM 280 C GLN A 84 2.719 3.686 0.346 1.00 0.00 C ATOM 281 O GLN A 84 1.978 3.819 -0.628 1.00 0.00 O ATOM 282 CB GLN A 84 4.833 4.926 -0.155 1.00 0.00 C ATOM 283 CG GLN A 84 4.408 6.020 0.811 1.00 0.00 C ATOM 284 CD GLN A 84 5.457 7.104 0.964 1.00 0.00 C ATOM 285 OE1 GLN A 84 5.293 8.218 0.466 1.00 0.00 O ATOM 286 NE2 GLN A 84 6.544 6.782 1.656 1.00 0.00 N ATOM 0 H GLN A 84 4.347 2.936 -1.834 1.00 0.00 H new ATOM 0 HA GLN A 84 4.657 3.188 1.096 1.00 0.00 H new ATOM 0 HB2 GLN A 84 5.920 4.845 -0.144 1.00 0.00 H new ATOM 0 HB3 GLN A 84 4.545 5.214 -1.166 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.478 6.467 0.461 1.00 0.00 H new ATOM 0 HG3 GLN A 84 4.202 5.579 1.786 1.00 0.00 H new ATOM 0 HE21 GLN A 84 6.638 5.846 2.051 1.00 0.00 H new ATOM 0 HE22 GLN A 84 7.284 7.470 1.792 1.00 0.00 H new ATOM 295 N ILE A 85 2.272 3.645 1.596 1.00 0.00 N ATOM 296 CA ILE A 85 0.852 3.757 1.903 1.00 0.00 C ATOM 297 C ILE A 85 0.575 4.967 2.788 1.00 0.00 C ATOM 298 O ILE A 85 1.265 5.194 3.782 1.00 0.00 O ATOM 299 CB ILE A 85 0.326 2.491 2.606 1.00 0.00 C ATOM 300 CG1 ILE A 85 0.644 1.249 1.770 1.00 0.00 C ATOM 301 CG2 ILE A 85 -1.171 2.603 2.849 1.00 0.00 C ATOM 302 CD1 ILE A 85 0.166 -0.041 2.400 1.00 0.00 C ATOM 0 H ILE A 85 2.873 3.535 2.413 1.00 0.00 H new ATOM 0 HA ILE A 85 0.333 3.878 0.952 1.00 0.00 H new ATOM 0 HB ILE A 85 0.824 2.395 3.571 1.00 0.00 H new ATOM 0 HG12 ILE A 85 0.186 1.356 0.787 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.721 1.191 1.615 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.527 1.701 3.346 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -1.374 3.469 3.479 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -1.687 2.720 1.896 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.425 -0.879 1.753 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.644 -0.171 3.371 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.916 -0.004 2.530 1.00 0.00 H new ATOM 314 N ARG A 86 -0.442 5.741 2.421 1.00 0.00 N ATOM 315 CA ARG A 86 -0.811 6.929 3.181 1.00 0.00 C ATOM 316 C ARG A 86 -2.325 7.011 3.360 1.00 0.00 C ATOM 317 O ARG A 86 -3.058 6.113 2.947 1.00 0.00 O ATOM 318 CB ARG A 86 -0.301 8.189 2.480 1.00 0.00 C ATOM 319 CG ARG A 86 1.213 8.318 2.485 1.00 0.00 C ATOM 320 CD ARG A 86 1.688 9.348 1.473 1.00 0.00 C ATOM 321 NE ARG A 86 1.894 8.762 0.151 1.00 0.00 N ATOM 322 CZ ARG A 86 1.900 9.468 -0.974 1.00 0.00 C ATOM 323 NH1 ARG A 86 1.713 10.780 -0.937 1.00 0.00 N ATOM 324 NH2 ARG A 86 2.094 8.863 -2.138 1.00 0.00 N ATOM 0 H ARG A 86 -1.025 5.566 1.602 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.349 6.858 4.165 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -0.654 8.189 1.449 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -0.733 9.064 2.965 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.552 8.602 3.481 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.662 7.351 2.260 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.955 10.152 1.403 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.619 9.795 1.821 1.00 0.00 H new ATOM 0 HE ARG A 86 2.041 7.755 0.088 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.564 11.249 -0.043 1.00 0.00 H new ATOM 0 HH12 ARG A 86 1.718 11.320 -1.802 1.00 0.00 H new ATOM 0 HH21 ARG A 86 2.239 7.854 -2.170 1.00 0.00 H new ATOM 0 HH22 ARG A 86 2.098 9.407 -3.001 1.00 0.00 H new ATOM 338 N ASN A 87 -2.784 8.093 3.979 1.00 0.00 N ATOM 339 CA ASN A 87 -4.210 8.292 4.213 1.00 0.00 C ATOM 340 C ASN A 87 -4.765 7.212 5.138 1.00 0.00 C ATOM 341 O ASN A 87 -5.941 6.858 5.058 1.00 0.00 O ATOM 342 CB ASN A 87 -4.972 8.285 2.887 1.00 0.00 C ATOM 343 CG ASN A 87 -5.111 9.673 2.292 1.00 0.00 C ATOM 344 OD1 ASN A 87 -4.120 10.374 2.085 1.00 0.00 O ATOM 345 ND2 ASN A 87 -6.346 10.077 2.015 1.00 0.00 N ATOM 0 H ASN A 87 -2.190 8.845 4.328 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.342 9.261 4.694 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -4.455 7.639 2.178 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.963 7.859 3.043 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -6.502 11.002 1.614 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -7.138 9.462 2.203 1.00 0.00 H new ATOM 352 N ILE A 88 -3.911 6.695 6.014 1.00 0.00 N ATOM 353 CA ILE A 88 -4.316 5.658 6.954 1.00 0.00 C ATOM 354 C ILE A 88 -4.905 6.265 8.222 1.00 0.00 C ATOM 355 O ILE A 88 -4.361 7.206 8.800 1.00 0.00 O ATOM 356 CB ILE A 88 -3.132 4.750 7.335 1.00 0.00 C ATOM 357 CG1 ILE A 88 -2.576 4.051 6.093 1.00 0.00 C ATOM 358 CG2 ILE A 88 -3.562 3.728 8.377 1.00 0.00 C ATOM 359 CD1 ILE A 88 -1.149 3.576 6.254 1.00 0.00 C ATOM 0 H ILE A 88 -2.934 6.977 6.092 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.077 5.059 6.454 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.343 5.368 7.764 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.209 3.197 5.853 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -2.629 4.736 5.247 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.714 3.094 8.636 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.915 4.245 9.270 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -4.366 3.112 7.973 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.821 3.090 5.335 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -0.503 4.429 6.464 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.093 2.866 7.079 1.00 0.00 H new ATOM 371 N PRO A 89 -6.044 5.714 8.669 1.00 0.00 N ATOM 372 CA PRO A 89 -6.731 6.184 9.875 1.00 0.00 C ATOM 373 C PRO A 89 -5.958 5.855 11.148 1.00 0.00 C ATOM 374 O PRO A 89 -5.600 4.706 11.406 1.00 0.00 O ATOM 375 CB PRO A 89 -8.060 5.425 9.845 1.00 0.00 C ATOM 376 CG PRO A 89 -7.775 4.195 9.054 1.00 0.00 C ATOM 377 CD PRO A 89 -6.748 4.589 8.030 1.00 0.00 C ATOM 0 HA PRO A 89 -6.844 7.268 9.883 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -8.398 5.179 10.852 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -8.846 6.021 9.381 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -7.400 3.397 9.695 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -8.680 3.821 8.575 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -6.069 3.766 7.804 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -7.212 4.887 7.090 1.00 0.00 H new ATOM 385 N PRO A 90 -5.694 6.886 11.964 1.00 0.00 N ATOM 386 CA PRO A 90 -4.962 6.731 13.225 1.00 0.00 C ATOM 387 C PRO A 90 -5.771 5.978 14.276 1.00 0.00 C ATOM 388 O PRO A 90 -5.303 5.761 15.394 1.00 0.00 O ATOM 389 CB PRO A 90 -4.715 8.174 13.672 1.00 0.00 C ATOM 390 CG PRO A 90 -5.807 8.961 13.032 1.00 0.00 C ATOM 391 CD PRO A 90 -6.091 8.283 11.720 1.00 0.00 C ATOM 0 HA PRO A 90 -4.050 6.148 13.098 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.747 8.263 14.758 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -3.734 8.525 13.352 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -6.696 8.979 13.662 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.504 9.997 12.879 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.144 8.360 11.448 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -5.518 8.727 10.906 1.00 0.00 H new ATOM 399 N HIS A 91 -6.986 5.582 13.910 1.00 0.00 N ATOM 400 CA HIS A 91 -7.859 4.853 14.822 1.00 0.00 C ATOM 401 C HIS A 91 -7.616 3.350 14.721 1.00 0.00 C ATOM 402 O HIS A 91 -7.542 2.653 15.733 1.00 0.00 O ATOM 403 CB HIS A 91 -9.324 5.166 14.519 1.00 0.00 C ATOM 404 CG HIS A 91 -9.573 6.605 14.186 1.00 0.00 C ATOM 405 ND1 HIS A 91 -10.496 7.011 13.246 1.00 0.00 N ATOM 406 CD2 HIS A 91 -9.014 7.736 14.676 1.00 0.00 C ATOM 407 CE1 HIS A 91 -10.492 8.330 13.170 1.00 0.00 C ATOM 408 NE2 HIS A 91 -9.602 8.794 14.029 1.00 0.00 N ATOM 0 H HIS A 91 -7.388 5.754 12.988 1.00 0.00 H new ATOM 0 HA HIS A 91 -7.630 5.173 15.839 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -9.654 4.546 13.685 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -9.932 4.891 15.381 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -8.248 7.795 15.435 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -11.111 8.927 12.517 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -9.387 9.779 14.186 1.00 0.00 H new ATOM 416 N LEU A 92 -7.494 2.857 13.493 1.00 0.00 N ATOM 417 CA LEU A 92 -7.260 1.436 13.259 1.00 0.00 C ATOM 418 C LEU A 92 -6.056 0.944 14.055 1.00 0.00 C ATOM 419 O LEU A 92 -5.115 1.697 14.303 1.00 0.00 O ATOM 420 CB LEU A 92 -7.042 1.173 11.768 1.00 0.00 C ATOM 421 CG LEU A 92 -6.225 -0.070 11.418 1.00 0.00 C ATOM 422 CD1 LEU A 92 -6.627 -0.606 10.052 1.00 0.00 C ATOM 423 CD2 LEU A 92 -4.736 0.242 11.453 1.00 0.00 C ATOM 0 H LEU A 92 -7.553 3.420 12.644 1.00 0.00 H new ATOM 0 HA LEU A 92 -8.141 0.889 13.593 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.017 1.089 11.288 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -6.547 2.042 11.335 1.00 0.00 H new ATOM 0 HG LEU A 92 -6.432 -0.838 12.163 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -6.035 -1.491 9.820 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.685 -0.869 10.061 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -6.450 0.158 9.295 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.170 -0.655 11.201 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -4.512 1.027 10.731 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.458 0.578 12.452 1.00 0.00 H new ATOM 435 N GLN A 93 -6.092 -0.325 14.450 1.00 0.00 N ATOM 436 CA GLN A 93 -5.002 -0.917 15.216 1.00 0.00 C ATOM 437 C GLN A 93 -4.038 -1.666 14.302 1.00 0.00 C ATOM 438 O GLN A 93 -4.459 -2.420 13.424 1.00 0.00 O ATOM 439 CB GLN A 93 -5.556 -1.866 16.281 1.00 0.00 C ATOM 440 CG GLN A 93 -6.245 -1.153 17.433 1.00 0.00 C ATOM 441 CD GLN A 93 -7.067 -2.092 18.292 1.00 0.00 C ATOM 442 OE1 GLN A 93 -8.140 -2.544 17.888 1.00 0.00 O ATOM 443 NE2 GLN A 93 -6.569 -2.393 19.486 1.00 0.00 N ATOM 0 H GLN A 93 -6.864 -0.962 14.252 1.00 0.00 H new ATOM 0 HA GLN A 93 -4.456 -0.111 15.706 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -6.264 -2.550 15.813 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -4.740 -2.472 16.676 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -5.494 -0.663 18.053 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -6.891 -0.370 17.036 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -5.677 -1.996 19.781 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -7.079 -3.021 20.108 1.00 0.00 H new ATOM 452 N TRP A 94 -2.744 -1.453 14.514 1.00 0.00 N ATOM 453 CA TRP A 94 -1.720 -2.108 13.708 1.00 0.00 C ATOM 454 C TRP A 94 -2.060 -3.578 13.486 1.00 0.00 C ATOM 455 O TRP A 94 -2.153 -4.037 12.348 1.00 0.00 O ATOM 456 CB TRP A 94 -0.354 -1.984 14.383 1.00 0.00 C ATOM 457 CG TRP A 94 0.794 -2.083 13.425 1.00 0.00 C ATOM 458 CD1 TRP A 94 1.401 -3.225 12.988 1.00 0.00 C ATOM 459 CD2 TRP A 94 1.472 -0.996 12.786 1.00 0.00 C ATOM 460 NE1 TRP A 94 2.417 -2.914 12.116 1.00 0.00 N ATOM 461 CE2 TRP A 94 2.480 -1.553 11.975 1.00 0.00 C ATOM 462 CE3 TRP A 94 1.326 0.393 12.818 1.00 0.00 C ATOM 463 CZ2 TRP A 94 3.335 -0.768 11.206 1.00 0.00 C ATOM 464 CZ3 TRP A 94 2.175 1.171 12.055 1.00 0.00 C ATOM 465 CH2 TRP A 94 3.169 0.589 11.256 1.00 0.00 C ATOM 0 H TRP A 94 -2.379 -0.832 15.237 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.684 -1.612 12.738 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.300 -1.029 14.905 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -0.257 -2.765 15.137 1.00 0.00 H new ATOM 0 HD1 TRP A 94 1.124 -4.226 13.284 1.00 0.00 H new ATOM 0 HE1 TRP A 94 3.025 -3.587 11.650 1.00 0.00 H new ATOM 0 HE3 TRP A 94 0.562 0.851 13.429 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 4.103 -1.215 10.591 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 2.071 2.246 12.074 1.00 0.00 H new ATOM 0 HH2 TRP A 94 3.816 1.224 10.669 1.00 0.00 H new ATOM 476 N GLU A 95 -2.244 -4.310 14.580 1.00 0.00 N ATOM 477 CA GLU A 95 -2.573 -5.729 14.503 1.00 0.00 C ATOM 478 C GLU A 95 -3.512 -6.007 13.333 1.00 0.00 C ATOM 479 O GLU A 95 -3.443 -7.062 12.704 1.00 0.00 O ATOM 480 CB GLU A 95 -3.215 -6.198 15.810 1.00 0.00 C ATOM 481 CG GLU A 95 -4.461 -5.415 16.191 1.00 0.00 C ATOM 482 CD GLU A 95 -5.124 -5.949 17.446 1.00 0.00 C ATOM 483 OE1 GLU A 95 -5.232 -7.187 17.579 1.00 0.00 O ATOM 484 OE2 GLU A 95 -5.534 -5.131 18.295 1.00 0.00 O ATOM 0 H GLU A 95 -2.171 -3.945 15.529 1.00 0.00 H new ATOM 0 HA GLU A 95 -1.648 -6.282 14.343 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -3.472 -7.253 15.720 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -2.484 -6.115 16.614 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -4.196 -4.368 16.342 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -5.173 -5.448 15.366 1.00 0.00 H new ATOM 491 N VAL A 96 -4.391 -5.051 13.048 1.00 0.00 N ATOM 492 CA VAL A 96 -5.345 -5.192 11.954 1.00 0.00 C ATOM 493 C VAL A 96 -4.662 -5.012 10.603 1.00 0.00 C ATOM 494 O VAL A 96 -4.882 -5.791 9.675 1.00 0.00 O ATOM 495 CB VAL A 96 -6.493 -4.172 12.076 1.00 0.00 C ATOM 496 CG1 VAL A 96 -7.452 -4.305 10.903 1.00 0.00 C ATOM 497 CG2 VAL A 96 -7.225 -4.350 13.397 1.00 0.00 C ATOM 0 H VAL A 96 -4.462 -4.171 13.559 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.755 -6.200 12.019 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.068 -3.168 12.055 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -8.256 -3.577 11.006 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -6.915 -4.123 9.972 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -7.873 -5.310 10.889 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.033 -3.621 13.466 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.639 -5.357 13.451 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.529 -4.199 14.222 1.00 0.00 H new ATOM 507 N LEU A 97 -3.831 -3.981 10.499 1.00 0.00 N ATOM 508 CA LEU A 97 -3.114 -3.698 9.261 1.00 0.00 C ATOM 509 C LEU A 97 -2.335 -4.923 8.791 1.00 0.00 C ATOM 510 O LEU A 97 -2.509 -5.387 7.664 1.00 0.00 O ATOM 511 CB LEU A 97 -2.161 -2.518 9.458 1.00 0.00 C ATOM 512 CG LEU A 97 -1.307 -2.135 8.249 1.00 0.00 C ATOM 513 CD1 LEU A 97 -2.180 -1.572 7.137 1.00 0.00 C ATOM 514 CD2 LEU A 97 -0.236 -1.130 8.648 1.00 0.00 C ATOM 0 H LEU A 97 -3.637 -3.327 11.257 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.847 -3.441 8.496 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -2.748 -1.648 9.753 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.495 -2.750 10.289 1.00 0.00 H new ATOM 0 HG LEU A 97 -0.813 -3.033 7.878 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.556 -1.305 6.284 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -2.909 -2.322 6.832 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -2.701 -0.685 7.497 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.362 -0.869 7.775 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -0.709 -0.232 9.045 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.408 -1.568 9.411 1.00 0.00 H new ATOM 526 N ASP A 98 -1.477 -5.442 9.663 1.00 0.00 N ATOM 527 CA ASP A 98 -0.673 -6.615 9.339 1.00 0.00 C ATOM 528 C ASP A 98 -1.495 -7.639 8.562 1.00 0.00 C ATOM 529 O ASP A 98 -1.100 -8.077 7.482 1.00 0.00 O ATOM 530 CB ASP A 98 -0.120 -7.249 10.616 1.00 0.00 C ATOM 531 CG ASP A 98 0.925 -8.310 10.330 1.00 0.00 C ATOM 532 OD1 ASP A 98 2.018 -7.950 9.845 1.00 0.00 O ATOM 533 OD2 ASP A 98 0.648 -9.500 10.589 1.00 0.00 O ATOM 0 H ASP A 98 -1.320 -5.069 10.599 1.00 0.00 H new ATOM 0 HA ASP A 98 0.159 -6.293 8.713 1.00 0.00 H new ATOM 0 HB2 ASP A 98 0.317 -6.473 11.244 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -0.939 -7.693 11.182 1.00 0.00 H new ATOM 538 N SER A 99 -2.641 -8.017 9.121 1.00 0.00 N ATOM 539 CA SER A 99 -3.516 -8.994 8.484 1.00 0.00 C ATOM 540 C SER A 99 -3.881 -8.555 7.069 1.00 0.00 C ATOM 541 O SER A 99 -3.730 -9.315 6.112 1.00 0.00 O ATOM 542 CB SER A 99 -4.787 -9.189 9.313 1.00 0.00 C ATOM 543 OG SER A 99 -5.323 -10.487 9.126 1.00 0.00 O ATOM 0 H SER A 99 -2.985 -7.661 10.013 1.00 0.00 H new ATOM 0 HA SER A 99 -2.980 -9.941 8.425 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.564 -9.033 10.368 1.00 0.00 H new ATOM 0 HB3 SER A 99 -5.528 -8.442 9.030 1.00 0.00 H new ATOM 0 HG SER A 99 -6.134 -10.587 9.668 1.00 0.00 H new ATOM 549 N LEU A 100 -4.361 -7.322 6.944 1.00 0.00 N ATOM 550 CA LEU A 100 -4.748 -6.780 5.647 1.00 0.00 C ATOM 551 C LEU A 100 -3.608 -6.905 4.642 1.00 0.00 C ATOM 552 O LEU A 100 -3.837 -7.032 3.438 1.00 0.00 O ATOM 553 CB LEU A 100 -5.161 -5.313 5.787 1.00 0.00 C ATOM 554 CG LEU A 100 -6.543 -5.059 6.388 1.00 0.00 C ATOM 555 CD1 LEU A 100 -6.708 -3.591 6.749 1.00 0.00 C ATOM 556 CD2 LEU A 100 -7.634 -5.498 5.421 1.00 0.00 C ATOM 0 H LEU A 100 -4.491 -6.679 7.725 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.597 -7.357 5.279 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.420 -4.805 6.404 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.125 -4.851 4.801 1.00 0.00 H new ATOM 0 HG LEU A 100 -6.634 -5.648 7.300 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -7.698 -3.430 7.175 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.949 -3.308 7.478 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -6.596 -2.981 5.853 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.611 -5.310 5.865 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -7.544 -4.936 4.491 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.529 -6.563 5.213 1.00 0.00 H new ATOM 568 N LEU A 101 -2.378 -6.870 5.143 1.00 0.00 N ATOM 569 CA LEU A 101 -1.200 -6.982 4.290 1.00 0.00 C ATOM 570 C LEU A 101 -1.021 -8.413 3.794 1.00 0.00 C ATOM 571 O LEU A 101 -1.079 -8.678 2.593 1.00 0.00 O ATOM 572 CB LEU A 101 0.049 -6.533 5.050 1.00 0.00 C ATOM 573 CG LEU A 101 0.012 -5.116 5.624 1.00 0.00 C ATOM 574 CD1 LEU A 101 1.259 -4.843 6.451 1.00 0.00 C ATOM 575 CD2 LEU A 101 -0.123 -4.092 4.507 1.00 0.00 C ATOM 0 H LEU A 101 -2.171 -6.765 6.136 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.344 -6.333 3.426 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.222 -7.231 5.869 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.905 -6.610 4.380 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.858 -5.031 6.276 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.215 -3.830 6.851 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.314 -5.556 7.273 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.143 -4.947 5.822 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.148 -3.089 4.934 1.00 0.00 H new ATOM 0 HD22 LEU A 101 0.727 -4.178 3.830 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.045 -4.275 3.956 1.00 0.00 H new ATOM 587 N VAL A 102 -0.805 -9.335 4.728 1.00 0.00 N ATOM 588 CA VAL A 102 -0.621 -10.740 4.387 1.00 0.00 C ATOM 589 C VAL A 102 -1.803 -11.271 3.585 1.00 0.00 C ATOM 590 O VAL A 102 -1.705 -12.307 2.928 1.00 0.00 O ATOM 591 CB VAL A 102 -0.441 -11.605 5.649 1.00 0.00 C ATOM 592 CG1 VAL A 102 0.775 -11.149 6.440 1.00 0.00 C ATOM 593 CG2 VAL A 102 -1.695 -11.559 6.509 1.00 0.00 C ATOM 0 H VAL A 102 -0.753 -9.133 5.727 1.00 0.00 H new ATOM 0 HA VAL A 102 0.283 -10.802 3.781 1.00 0.00 H new ATOM 0 HB VAL A 102 -0.277 -12.638 5.341 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.886 -11.772 7.328 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.667 -11.239 5.820 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.645 -10.109 6.740 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -1.551 -12.175 7.396 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -1.892 -10.530 6.810 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.542 -11.938 5.938 1.00 0.00 H new ATOM 603 N GLN A 103 -2.921 -10.553 3.644 1.00 0.00 N ATOM 604 CA GLN A 103 -4.123 -10.953 2.922 1.00 0.00 C ATOM 605 C GLN A 103 -3.926 -10.813 1.416 1.00 0.00 C ATOM 606 O GLN A 103 -4.478 -11.588 0.634 1.00 0.00 O ATOM 607 CB GLN A 103 -5.317 -10.109 3.372 1.00 0.00 C ATOM 608 CG GLN A 103 -6.055 -10.689 4.568 1.00 0.00 C ATOM 609 CD GLN A 103 -7.530 -10.340 4.569 1.00 0.00 C ATOM 610 OE1 GLN A 103 -8.130 -10.125 3.515 1.00 0.00 O ATOM 611 NE2 GLN A 103 -8.125 -10.283 5.755 1.00 0.00 N ATOM 0 H GLN A 103 -3.019 -9.693 4.183 1.00 0.00 H new ATOM 0 HA GLN A 103 -4.321 -12.001 3.148 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -4.969 -9.106 3.621 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -6.014 -10.007 2.540 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -5.942 -11.773 4.569 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -5.598 -10.320 5.486 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -7.590 -10.468 6.603 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -9.117 -10.054 5.817 1.00 0.00 H new ATOM 620 N TYR A 104 -3.137 -9.822 1.017 1.00 0.00 N ATOM 621 CA TYR A 104 -2.869 -9.580 -0.395 1.00 0.00 C ATOM 622 C TYR A 104 -1.830 -10.560 -0.929 1.00 0.00 C ATOM 623 O TYR A 104 -2.050 -11.228 -1.939 1.00 0.00 O ATOM 624 CB TYR A 104 -2.387 -8.143 -0.605 1.00 0.00 C ATOM 625 CG TYR A 104 -3.452 -7.102 -0.343 1.00 0.00 C ATOM 626 CD1 TYR A 104 -4.450 -6.849 -1.276 1.00 0.00 C ATOM 627 CD2 TYR A 104 -3.460 -6.372 0.840 1.00 0.00 C ATOM 628 CE1 TYR A 104 -5.424 -5.899 -1.040 1.00 0.00 C ATOM 629 CE2 TYR A 104 -4.431 -5.421 1.085 1.00 0.00 C ATOM 630 CZ TYR A 104 -5.410 -5.187 0.142 1.00 0.00 C ATOM 631 OH TYR A 104 -6.380 -4.240 0.381 1.00 0.00 O ATOM 0 H TYR A 104 -2.672 -9.173 1.652 1.00 0.00 H new ATOM 0 HA TYR A 104 -3.798 -9.729 -0.945 1.00 0.00 H new ATOM 0 HB2 TYR A 104 -1.537 -7.954 0.051 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -2.029 -8.035 -1.629 1.00 0.00 H new ATOM 0 HD1 TYR A 104 -4.464 -7.405 -2.202 1.00 0.00 H new ATOM 0 HD2 TYR A 104 -2.694 -6.552 1.580 1.00 0.00 H new ATOM 0 HE1 TYR A 104 -6.192 -5.714 -1.776 1.00 0.00 H new ATOM 0 HE2 TYR A 104 -4.424 -4.864 2.010 1.00 0.00 H new ATOM 0 HH TYR A 104 -6.379 -4.003 1.332 1.00 0.00 H new ATOM 641 N GLY A 105 -0.695 -10.642 -0.242 1.00 0.00 N ATOM 642 CA GLY A 105 0.363 -11.543 -0.660 1.00 0.00 C ATOM 643 C GLY A 105 1.368 -11.810 0.443 1.00 0.00 C ATOM 644 O GLY A 105 1.064 -11.639 1.624 1.00 0.00 O ATOM 0 H GLY A 105 -0.489 -10.100 0.597 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -0.075 -12.487 -0.984 1.00 0.00 H new ATOM 0 HA3 GLY A 105 0.878 -11.118 -1.522 1.00 0.00 H new ATOM 648 N VAL A 106 2.568 -12.232 0.059 1.00 0.00 N ATOM 649 CA VAL A 106 3.621 -12.524 1.024 1.00 0.00 C ATOM 650 C VAL A 106 4.463 -11.286 1.311 1.00 0.00 C ATOM 651 O VAL A 106 5.437 -11.009 0.612 1.00 0.00 O ATOM 652 CB VAL A 106 4.542 -13.653 0.526 1.00 0.00 C ATOM 653 CG1 VAL A 106 5.631 -13.945 1.548 1.00 0.00 C ATOM 654 CG2 VAL A 106 3.733 -14.906 0.224 1.00 0.00 C ATOM 0 H VAL A 106 2.835 -12.379 -0.914 1.00 0.00 H new ATOM 0 HA VAL A 106 3.128 -12.845 1.942 1.00 0.00 H new ATOM 0 HB VAL A 106 5.022 -13.326 -0.397 1.00 0.00 H new ATOM 0 HG11 VAL A 106 6.272 -14.746 1.178 1.00 0.00 H new ATOM 0 HG12 VAL A 106 6.228 -13.048 1.710 1.00 0.00 H new ATOM 0 HG13 VAL A 106 5.174 -14.251 2.489 1.00 0.00 H new ATOM 0 HG21 VAL A 106 4.400 -15.694 -0.127 1.00 0.00 H new ATOM 0 HG22 VAL A 106 3.224 -15.238 1.129 1.00 0.00 H new ATOM 0 HG23 VAL A 106 2.995 -14.685 -0.547 1.00 0.00 H new ATOM 664 N VAL A 107 4.080 -10.543 2.345 1.00 0.00 N ATOM 665 CA VAL A 107 4.800 -9.334 2.726 1.00 0.00 C ATOM 666 C VAL A 107 6.165 -9.671 3.317 1.00 0.00 C ATOM 667 O VAL A 107 6.267 -10.454 4.260 1.00 0.00 O ATOM 668 CB VAL A 107 4.001 -8.503 3.748 1.00 0.00 C ATOM 669 CG1 VAL A 107 3.751 -9.310 5.013 1.00 0.00 C ATOM 670 CG2 VAL A 107 4.731 -7.207 4.067 1.00 0.00 C ATOM 0 H VAL A 107 3.275 -10.758 2.934 1.00 0.00 H new ATOM 0 HA VAL A 107 4.935 -8.746 1.818 1.00 0.00 H new ATOM 0 HB VAL A 107 3.035 -8.251 3.310 1.00 0.00 H new ATOM 0 HG11 VAL A 107 3.185 -8.707 5.723 1.00 0.00 H new ATOM 0 HG12 VAL A 107 3.184 -10.207 4.766 1.00 0.00 H new ATOM 0 HG13 VAL A 107 4.705 -9.595 5.457 1.00 0.00 H new ATOM 0 HG21 VAL A 107 4.153 -6.632 4.790 1.00 0.00 H new ATOM 0 HG22 VAL A 107 5.711 -7.435 4.485 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.853 -6.624 3.154 1.00 0.00 H new ATOM 680 N GLU A 108 7.211 -9.072 2.755 1.00 0.00 N ATOM 681 CA GLU A 108 8.570 -9.309 3.227 1.00 0.00 C ATOM 682 C GLU A 108 8.836 -8.550 4.524 1.00 0.00 C ATOM 683 O GLU A 108 9.362 -9.109 5.486 1.00 0.00 O ATOM 684 CB GLU A 108 9.584 -8.890 2.161 1.00 0.00 C ATOM 685 CG GLU A 108 10.873 -9.693 2.198 1.00 0.00 C ATOM 686 CD GLU A 108 11.716 -9.388 3.422 1.00 0.00 C ATOM 687 OE1 GLU A 108 11.492 -10.029 4.470 1.00 0.00 O ATOM 688 OE2 GLU A 108 12.598 -8.509 3.331 1.00 0.00 O ATOM 0 H GLU A 108 7.143 -8.420 1.973 1.00 0.00 H new ATOM 0 HA GLU A 108 8.678 -10.376 3.422 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.128 -8.996 1.177 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.820 -7.834 2.291 1.00 0.00 H new ATOM 0 HG2 GLU A 108 10.635 -10.756 2.181 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.454 -9.482 1.300 1.00 0.00 H new ATOM 695 N SER A 109 8.469 -7.273 4.541 1.00 0.00 N ATOM 696 CA SER A 109 8.672 -6.435 5.717 1.00 0.00 C ATOM 697 C SER A 109 7.808 -5.179 5.644 1.00 0.00 C ATOM 698 O SER A 109 7.582 -4.629 4.566 1.00 0.00 O ATOM 699 CB SER A 109 10.146 -6.046 5.845 1.00 0.00 C ATOM 700 OG SER A 109 10.487 -5.774 7.193 1.00 0.00 O ATOM 0 H SER A 109 8.030 -6.796 3.754 1.00 0.00 H new ATOM 0 HA SER A 109 8.377 -7.008 6.596 1.00 0.00 H new ATOM 0 HB2 SER A 109 10.772 -6.852 5.464 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.348 -5.168 5.231 1.00 0.00 H new ATOM 0 HG SER A 109 11.434 -5.530 7.248 1.00 0.00 H new ATOM 706 N CYS A 110 7.328 -4.732 6.800 1.00 0.00 N ATOM 707 CA CYS A 110 6.487 -3.542 6.869 1.00 0.00 C ATOM 708 C CYS A 110 7.144 -2.462 7.722 1.00 0.00 C ATOM 709 O CYS A 110 7.058 -2.490 8.949 1.00 0.00 O ATOM 710 CB CYS A 110 5.113 -3.895 7.440 1.00 0.00 C ATOM 711 SG CYS A 110 4.026 -2.471 7.682 1.00 0.00 S ATOM 0 H CYS A 110 7.507 -5.175 7.701 1.00 0.00 H new ATOM 0 HA CYS A 110 6.363 -3.155 5.857 1.00 0.00 H new ATOM 0 HB2 CYS A 110 4.624 -4.602 6.770 1.00 0.00 H new ATOM 0 HB3 CYS A 110 5.248 -4.402 8.395 1.00 0.00 H new ATOM 0 HG CYS A 110 2.888 -2.871 8.166 1.00 0.00 H new ATOM 717 N GLU A 111 7.801 -1.512 7.063 1.00 0.00 N ATOM 718 CA GLU A 111 8.474 -0.424 7.763 1.00 0.00 C ATOM 719 C GLU A 111 7.519 0.741 8.005 1.00 0.00 C ATOM 720 O GLU A 111 6.558 0.933 7.260 1.00 0.00 O ATOM 721 CB GLU A 111 9.686 0.054 6.961 1.00 0.00 C ATOM 722 CG GLU A 111 10.661 0.891 7.772 1.00 0.00 C ATOM 723 CD GLU A 111 11.432 0.068 8.786 1.00 0.00 C ATOM 724 OE1 GLU A 111 11.896 -1.034 8.425 1.00 0.00 O ATOM 725 OE2 GLU A 111 11.572 0.526 9.939 1.00 0.00 O ATOM 0 H GLU A 111 7.881 -1.474 6.047 1.00 0.00 H new ATOM 0 HA GLU A 111 8.811 -0.801 8.729 1.00 0.00 H new ATOM 0 HB2 GLU A 111 10.211 -0.813 6.560 1.00 0.00 H new ATOM 0 HB3 GLU A 111 9.340 0.639 6.109 1.00 0.00 H new ATOM 0 HG2 GLU A 111 11.363 1.380 7.097 1.00 0.00 H new ATOM 0 HG3 GLU A 111 10.114 1.679 8.289 1.00 0.00 H new ATOM 732 N GLN A 112 7.791 1.514 9.051 1.00 0.00 N ATOM 733 CA GLN A 112 6.955 2.659 9.392 1.00 0.00 C ATOM 734 C GLN A 112 7.531 3.946 8.811 1.00 0.00 C ATOM 735 O GLN A 112 8.738 4.055 8.592 1.00 0.00 O ATOM 736 CB GLN A 112 6.822 2.786 10.911 1.00 0.00 C ATOM 737 CG GLN A 112 5.637 3.631 11.349 1.00 0.00 C ATOM 738 CD GLN A 112 5.931 5.118 11.298 1.00 0.00 C ATOM 739 OE1 GLN A 112 7.080 5.541 11.427 1.00 0.00 O ATOM 740 NE2 GLN A 112 4.890 5.921 11.109 1.00 0.00 N ATOM 0 H GLN A 112 8.583 1.369 9.677 1.00 0.00 H new ATOM 0 HA GLN A 112 5.967 2.497 8.960 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.727 1.790 11.344 1.00 0.00 H new ATOM 0 HB3 GLN A 112 7.737 3.222 11.312 1.00 0.00 H new ATOM 0 HG2 GLN A 112 4.782 3.411 10.709 1.00 0.00 H new ATOM 0 HG3 GLN A 112 5.354 3.355 12.365 1.00 0.00 H new ATOM 0 HE21 GLN A 112 3.954 5.528 11.007 1.00 0.00 H new ATOM 0 HE22 GLN A 112 5.026 6.931 11.066 1.00 0.00 H new ATOM 749 N VAL A 113 6.661 4.919 8.562 1.00 0.00 N ATOM 750 CA VAL A 113 7.083 6.200 8.007 1.00 0.00 C ATOM 751 C VAL A 113 6.146 7.322 8.438 1.00 0.00 C ATOM 752 O VAL A 113 5.016 7.074 8.857 1.00 0.00 O ATOM 753 CB VAL A 113 7.137 6.154 6.468 1.00 0.00 C ATOM 754 CG1 VAL A 113 7.648 7.474 5.912 1.00 0.00 C ATOM 755 CG2 VAL A 113 8.007 4.997 6.001 1.00 0.00 C ATOM 0 H VAL A 113 5.659 4.845 8.736 1.00 0.00 H new ATOM 0 HA VAL A 113 8.083 6.398 8.393 1.00 0.00 H new ATOM 0 HB VAL A 113 6.127 5.995 6.090 1.00 0.00 H new ATOM 0 HG11 VAL A 113 7.679 7.423 4.824 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.981 8.280 6.218 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.650 7.667 6.295 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.034 4.979 4.911 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.018 5.123 6.387 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.593 4.058 6.369 1.00 0.00 H new ATOM 765 N ASN A 114 6.623 8.558 8.333 1.00 0.00 N ATOM 766 CA ASN A 114 5.827 9.719 8.712 1.00 0.00 C ATOM 767 C ASN A 114 5.990 10.846 7.696 1.00 0.00 C ATOM 768 O ASN A 114 7.064 11.435 7.572 1.00 0.00 O ATOM 769 CB ASN A 114 6.234 10.210 10.104 1.00 0.00 C ATOM 770 CG ASN A 114 6.722 9.083 10.994 1.00 0.00 C ATOM 771 OD1 ASN A 114 5.886 8.672 11.940 1.00 0.00 O flip ATOM 772 ND2 ASN A 114 7.838 8.588 10.832 1.00 0.00 N flip ATOM 0 H ASN A 114 7.557 8.781 7.989 1.00 0.00 H new ATOM 0 HA ASN A 114 4.779 9.419 8.731 1.00 0.00 H new ATOM 0 HB2 ASN A 114 7.020 10.959 10.007 1.00 0.00 H new ATOM 0 HB3 ASN A 114 5.383 10.700 10.577 1.00 0.00 H new ATOM 0 HD21 ASN A 114 8.448 8.936 10.092 1.00 0.00 H new ATOM 0 HD22 ASN A 114 8.153 7.830 11.438 1.00 0.00 H new ATOM 779 N THR A 115 4.916 11.140 6.970 1.00 0.00 N ATOM 780 CA THR A 115 4.939 12.195 5.965 1.00 0.00 C ATOM 781 C THR A 115 4.508 13.531 6.559 1.00 0.00 C ATOM 782 O THR A 115 4.028 14.412 5.846 1.00 0.00 O ATOM 783 CB THR A 115 4.023 11.856 4.774 1.00 0.00 C ATOM 784 OG1 THR A 115 4.296 12.738 3.679 1.00 0.00 O ATOM 785 CG2 THR A 115 2.558 11.967 5.169 1.00 0.00 C ATOM 0 H THR A 115 4.019 10.662 7.059 1.00 0.00 H new ATOM 0 HA THR A 115 5.968 12.273 5.613 1.00 0.00 H new ATOM 0 HB THR A 115 4.224 10.829 4.471 1.00 0.00 H new ATOM 0 HG1 THR A 115 4.293 13.665 3.997 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.931 11.723 4.312 1.00 0.00 H new ATOM 0 HG22 THR A 115 2.347 11.273 5.982 1.00 0.00 H new ATOM 0 HG23 THR A 115 2.345 12.985 5.496 1.00 0.00 H new ATOM 793 N ASP A 116 4.682 13.675 7.868 1.00 0.00 N ATOM 794 CA ASP A 116 4.312 14.905 8.558 1.00 0.00 C ATOM 795 C ASP A 116 2.834 15.221 8.350 1.00 0.00 C ATOM 796 O ASP A 116 2.462 16.371 8.113 1.00 0.00 O ATOM 797 CB ASP A 116 5.170 16.070 8.064 1.00 0.00 C ATOM 798 CG ASP A 116 4.925 17.344 8.849 1.00 0.00 C ATOM 799 OD1 ASP A 116 5.566 17.521 9.906 1.00 0.00 O ATOM 800 OD2 ASP A 116 4.091 18.162 8.407 1.00 0.00 O ATOM 0 H ASP A 116 5.077 12.955 8.473 1.00 0.00 H new ATOM 0 HA ASP A 116 4.488 14.762 9.624 1.00 0.00 H new ATOM 0 HB2 ASP A 116 6.223 15.798 8.137 1.00 0.00 H new ATOM 0 HB3 ASP A 116 4.960 16.250 7.010 1.00 0.00 H new ATOM 805 N SER A 117 1.996 14.194 8.438 1.00 0.00 N ATOM 806 CA SER A 117 0.559 14.361 8.255 1.00 0.00 C ATOM 807 C SER A 117 -0.217 13.637 9.351 1.00 0.00 C ATOM 808 O SER A 117 0.294 12.710 9.978 1.00 0.00 O ATOM 809 CB SER A 117 0.134 13.836 6.882 1.00 0.00 C ATOM 810 OG SER A 117 -1.271 13.917 6.717 1.00 0.00 O ATOM 0 H SER A 117 2.287 13.237 8.635 1.00 0.00 H new ATOM 0 HA SER A 117 0.332 15.425 8.316 1.00 0.00 H new ATOM 0 HB2 SER A 117 0.629 14.412 6.100 1.00 0.00 H new ATOM 0 HB3 SER A 117 0.457 12.801 6.769 1.00 0.00 H new ATOM 0 HG SER A 117 -1.516 13.577 5.831 1.00 0.00 H new ATOM 816 N GLU A 118 -1.454 14.069 9.575 1.00 0.00 N ATOM 817 CA GLU A 118 -2.301 13.463 10.596 1.00 0.00 C ATOM 818 C GLU A 118 -2.407 11.955 10.390 1.00 0.00 C ATOM 819 O GLU A 118 -2.083 11.170 11.281 1.00 0.00 O ATOM 820 CB GLU A 118 -3.695 14.092 10.573 1.00 0.00 C ATOM 821 CG GLU A 118 -3.810 15.350 11.417 1.00 0.00 C ATOM 822 CD GLU A 118 -3.449 16.605 10.645 1.00 0.00 C ATOM 823 OE1 GLU A 118 -2.240 16.887 10.505 1.00 0.00 O ATOM 824 OE2 GLU A 118 -4.374 17.305 10.183 1.00 0.00 O ATOM 0 H GLU A 118 -1.892 14.836 9.064 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.844 13.648 11.568 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -3.960 14.331 9.543 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -4.421 13.360 10.927 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.829 15.439 11.792 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.157 15.262 12.285 1.00 0.00 H new ATOM 831 N THR A 119 -2.865 11.556 9.207 1.00 0.00 N ATOM 832 CA THR A 119 -3.016 10.143 8.883 1.00 0.00 C ATOM 833 C THR A 119 -1.703 9.393 9.070 1.00 0.00 C ATOM 834 O THR A 119 -0.626 9.987 9.029 1.00 0.00 O ATOM 835 CB THR A 119 -3.504 9.949 7.435 1.00 0.00 C ATOM 836 OG1 THR A 119 -2.668 10.681 6.533 1.00 0.00 O ATOM 837 CG2 THR A 119 -4.947 10.408 7.283 1.00 0.00 C ATOM 0 H THR A 119 -3.138 12.192 8.458 1.00 0.00 H new ATOM 0 HA THR A 119 -3.762 9.739 9.567 1.00 0.00 H new ATOM 0 HB THR A 119 -3.451 8.887 7.197 1.00 0.00 H new ATOM 0 HG1 THR A 119 -3.143 10.820 5.687 1.00 0.00 H new ATOM 0 HG21 THR A 119 -5.269 10.261 6.252 1.00 0.00 H new ATOM 0 HG22 THR A 119 -5.586 9.827 7.949 1.00 0.00 H new ATOM 0 HG23 THR A 119 -5.022 11.465 7.539 1.00 0.00 H new ATOM 845 N ALA A 120 -1.799 8.083 9.274 1.00 0.00 N ATOM 846 CA ALA A 120 -0.618 7.250 9.464 1.00 0.00 C ATOM 847 C ALA A 120 0.041 6.920 8.130 1.00 0.00 C ATOM 848 O ALA A 120 -0.622 6.868 7.094 1.00 0.00 O ATOM 849 CB ALA A 120 -0.987 5.973 10.204 1.00 0.00 C ATOM 0 H ALA A 120 -2.683 7.576 9.312 1.00 0.00 H new ATOM 0 HA ALA A 120 0.099 7.810 10.064 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -0.096 5.360 10.339 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -1.405 6.225 11.179 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.725 5.417 9.625 1.00 0.00 H new ATOM 855 N VAL A 121 1.352 6.697 8.162 1.00 0.00 N ATOM 856 CA VAL A 121 2.101 6.371 6.954 1.00 0.00 C ATOM 857 C VAL A 121 3.027 5.183 7.186 1.00 0.00 C ATOM 858 O VAL A 121 3.650 5.064 8.242 1.00 0.00 O ATOM 859 CB VAL A 121 2.936 7.572 6.470 1.00 0.00 C ATOM 860 CG1 VAL A 121 3.734 7.202 5.230 1.00 0.00 C ATOM 861 CG2 VAL A 121 2.038 8.770 6.200 1.00 0.00 C ATOM 0 H VAL A 121 1.916 6.736 9.011 1.00 0.00 H new ATOM 0 HA VAL A 121 1.370 6.114 6.188 1.00 0.00 H new ATOM 0 HB VAL A 121 3.640 7.845 7.257 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.317 8.063 4.903 1.00 0.00 H new ATOM 0 HG12 VAL A 121 4.406 6.376 5.463 1.00 0.00 H new ATOM 0 HG13 VAL A 121 3.052 6.902 4.434 1.00 0.00 H new ATOM 0 HG21 VAL A 121 2.644 9.609 5.859 1.00 0.00 H new ATOM 0 HG22 VAL A 121 1.309 8.513 5.431 1.00 0.00 H new ATOM 0 HG23 VAL A 121 1.516 9.048 7.116 1.00 0.00 H new ATOM 871 N VAL A 122 3.114 4.304 6.192 1.00 0.00 N ATOM 872 CA VAL A 122 3.966 3.125 6.287 1.00 0.00 C ATOM 873 C VAL A 122 4.417 2.661 4.907 1.00 0.00 C ATOM 874 O VAL A 122 3.860 3.071 3.890 1.00 0.00 O ATOM 875 CB VAL A 122 3.242 1.965 6.995 1.00 0.00 C ATOM 876 CG1 VAL A 122 2.829 2.372 8.402 1.00 0.00 C ATOM 877 CG2 VAL A 122 2.035 1.517 6.185 1.00 0.00 C ATOM 0 H VAL A 122 2.605 4.387 5.312 1.00 0.00 H new ATOM 0 HA VAL A 122 4.838 3.411 6.874 1.00 0.00 H new ATOM 0 HB VAL A 122 3.931 1.124 7.073 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.319 1.540 8.887 1.00 0.00 H new ATOM 0 HG12 VAL A 122 3.715 2.640 8.978 1.00 0.00 H new ATOM 0 HG13 VAL A 122 2.157 3.229 8.350 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.535 0.697 6.700 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.342 2.351 6.073 1.00 0.00 H new ATOM 0 HG23 VAL A 122 2.362 1.182 5.200 1.00 0.00 H new ATOM 887 N ASN A 123 5.431 1.801 4.880 1.00 0.00 N ATOM 888 CA ASN A 123 5.958 1.281 3.623 1.00 0.00 C ATOM 889 C ASN A 123 5.895 -0.244 3.597 1.00 0.00 C ATOM 890 O ASN A 123 6.482 -0.915 4.446 1.00 0.00 O ATOM 891 CB ASN A 123 7.401 1.746 3.420 1.00 0.00 C ATOM 892 CG ASN A 123 7.490 3.221 3.078 1.00 0.00 C ATOM 893 OD1 ASN A 123 6.476 3.876 2.839 1.00 0.00 O ATOM 894 ND2 ASN A 123 8.708 3.750 3.053 1.00 0.00 N ATOM 0 H ASN A 123 5.903 1.450 5.713 1.00 0.00 H new ATOM 0 HA ASN A 123 5.341 1.667 2.811 1.00 0.00 H new ATOM 0 HB2 ASN A 123 7.974 1.551 4.327 1.00 0.00 H new ATOM 0 HB3 ASN A 123 7.859 1.162 2.622 1.00 0.00 H new ATOM 0 HD21 ASN A 123 8.831 4.737 2.829 1.00 0.00 H new ATOM 0 HD22 ASN A 123 9.521 3.169 3.258 1.00 0.00 H new ATOM 901 N VAL A 124 5.179 -0.784 2.616 1.00 0.00 N ATOM 902 CA VAL A 124 5.040 -2.229 2.478 1.00 0.00 C ATOM 903 C VAL A 124 6.021 -2.779 1.448 1.00 0.00 C ATOM 904 O VAL A 124 6.180 -2.217 0.363 1.00 0.00 O ATOM 905 CB VAL A 124 3.608 -2.618 2.067 1.00 0.00 C ATOM 906 CG1 VAL A 124 3.529 -4.104 1.749 1.00 0.00 C ATOM 907 CG2 VAL A 124 2.620 -2.245 3.161 1.00 0.00 C ATOM 0 H VAL A 124 4.686 -0.243 1.905 1.00 0.00 H new ATOM 0 HA VAL A 124 5.260 -2.663 3.453 1.00 0.00 H new ATOM 0 HB VAL A 124 3.344 -2.064 1.167 1.00 0.00 H new ATOM 0 HG11 VAL A 124 2.510 -4.361 1.461 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.208 -4.337 0.929 1.00 0.00 H new ATOM 0 HG13 VAL A 124 3.813 -4.680 2.630 1.00 0.00 H new ATOM 0 HG21 VAL A 124 1.613 -2.527 2.854 1.00 0.00 H new ATOM 0 HG22 VAL A 124 2.879 -2.770 4.080 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.658 -1.170 3.335 1.00 0.00 H new ATOM 917 N THR A 125 6.677 -3.882 1.793 1.00 0.00 N ATOM 918 CA THR A 125 7.642 -4.509 0.899 1.00 0.00 C ATOM 919 C THR A 125 7.344 -5.993 0.721 1.00 0.00 C ATOM 920 O THR A 125 7.657 -6.808 1.589 1.00 0.00 O ATOM 921 CB THR A 125 9.082 -4.346 1.424 1.00 0.00 C ATOM 922 OG1 THR A 125 9.263 -3.028 1.954 1.00 0.00 O ATOM 923 CG2 THR A 125 10.093 -4.595 0.315 1.00 0.00 C ATOM 0 H THR A 125 6.557 -4.360 2.686 1.00 0.00 H new ATOM 0 HA THR A 125 7.554 -4.006 -0.064 1.00 0.00 H new ATOM 0 HB THR A 125 9.244 -5.080 2.213 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.180 -2.932 2.287 1.00 0.00 H new ATOM 0 HG21 THR A 125 11.102 -4.474 0.709 1.00 0.00 H new ATOM 0 HG22 THR A 125 9.971 -5.608 -0.067 1.00 0.00 H new ATOM 0 HG23 THR A 125 9.931 -3.881 -0.492 1.00 0.00 H new ATOM 931 N TYR A 126 6.737 -6.338 -0.409 1.00 0.00 N ATOM 932 CA TYR A 126 6.395 -7.725 -0.701 1.00 0.00 C ATOM 933 C TYR A 126 7.558 -8.442 -1.379 1.00 0.00 C ATOM 934 O TYR A 126 8.501 -7.809 -1.853 1.00 0.00 O ATOM 935 CB TYR A 126 5.152 -7.789 -1.591 1.00 0.00 C ATOM 936 CG TYR A 126 3.877 -7.397 -0.879 1.00 0.00 C ATOM 937 CD1 TYR A 126 3.251 -8.272 -0.001 1.00 0.00 C ATOM 938 CD2 TYR A 126 3.299 -6.150 -1.085 1.00 0.00 C ATOM 939 CE1 TYR A 126 2.085 -7.918 0.651 1.00 0.00 C ATOM 940 CE2 TYR A 126 2.134 -5.787 -0.437 1.00 0.00 C ATOM 941 CZ TYR A 126 1.531 -6.675 0.429 1.00 0.00 C ATOM 942 OH TYR A 126 0.370 -6.318 1.077 1.00 0.00 O ATOM 0 H TYR A 126 6.472 -5.676 -1.138 1.00 0.00 H new ATOM 0 HA TYR A 126 6.184 -8.227 0.243 1.00 0.00 H new ATOM 0 HB2 TYR A 126 5.296 -7.132 -2.449 1.00 0.00 H new ATOM 0 HB3 TYR A 126 5.045 -8.802 -1.979 1.00 0.00 H new ATOM 0 HD1 TYR A 126 3.683 -9.246 0.175 1.00 0.00 H new ATOM 0 HD2 TYR A 126 3.769 -5.453 -1.763 1.00 0.00 H new ATOM 0 HE1 TYR A 126 1.611 -8.611 1.330 1.00 0.00 H new ATOM 0 HE2 TYR A 126 1.698 -4.814 -0.608 1.00 0.00 H new ATOM 0 HH TYR A 126 -0.014 -7.105 1.518 1.00 0.00 H new ATOM 952 N SER A 127 7.482 -9.768 -1.422 1.00 0.00 N ATOM 953 CA SER A 127 8.529 -10.574 -2.040 1.00 0.00 C ATOM 954 C SER A 127 8.313 -10.685 -3.546 1.00 0.00 C ATOM 955 O SER A 127 9.241 -10.501 -4.333 1.00 0.00 O ATOM 956 CB SER A 127 8.564 -11.969 -1.414 1.00 0.00 C ATOM 957 OG SER A 127 9.765 -12.646 -1.743 1.00 0.00 O ATOM 0 H SER A 127 6.707 -10.307 -1.036 1.00 0.00 H new ATOM 0 HA SER A 127 9.485 -10.080 -1.864 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.474 -11.887 -0.331 1.00 0.00 H new ATOM 0 HB3 SER A 127 7.709 -12.549 -1.762 1.00 0.00 H new ATOM 0 HG SER A 127 9.764 -13.534 -1.329 1.00 0.00 H new ATOM 963 N SER A 128 7.079 -10.987 -3.939 1.00 0.00 N ATOM 964 CA SER A 128 6.740 -11.126 -5.350 1.00 0.00 C ATOM 965 C SER A 128 6.211 -9.811 -5.915 1.00 0.00 C ATOM 966 O SER A 128 5.743 -8.947 -5.173 1.00 0.00 O ATOM 967 CB SER A 128 5.698 -12.231 -5.539 1.00 0.00 C ATOM 968 OG SER A 128 5.507 -12.522 -6.913 1.00 0.00 O ATOM 0 H SER A 128 6.299 -11.140 -3.300 1.00 0.00 H new ATOM 0 HA SER A 128 7.647 -11.394 -5.891 1.00 0.00 H new ATOM 0 HB2 SER A 128 6.019 -13.131 -5.015 1.00 0.00 H new ATOM 0 HB3 SER A 128 4.752 -11.923 -5.094 1.00 0.00 H new ATOM 0 HG SER A 128 4.838 -13.232 -7.007 1.00 0.00 H new ATOM 974 N LYS A 129 6.289 -9.666 -7.233 1.00 0.00 N ATOM 975 CA LYS A 129 5.819 -8.458 -7.900 1.00 0.00 C ATOM 976 C LYS A 129 4.302 -8.480 -8.059 1.00 0.00 C ATOM 977 O LYS A 129 3.650 -7.436 -8.031 1.00 0.00 O ATOM 978 CB LYS A 129 6.484 -8.315 -9.271 1.00 0.00 C ATOM 979 CG LYS A 129 6.785 -9.644 -9.942 1.00 0.00 C ATOM 980 CD LYS A 129 8.156 -10.169 -9.549 1.00 0.00 C ATOM 981 CE LYS A 129 9.244 -9.621 -10.460 1.00 0.00 C ATOM 982 NZ LYS A 129 9.117 -10.141 -11.850 1.00 0.00 N ATOM 0 H LYS A 129 6.674 -10.371 -7.861 1.00 0.00 H new ATOM 0 HA LYS A 129 6.090 -7.603 -7.281 1.00 0.00 H new ATOM 0 HB2 LYS A 129 5.835 -7.728 -9.921 1.00 0.00 H new ATOM 0 HB3 LYS A 129 7.413 -7.756 -9.159 1.00 0.00 H new ATOM 0 HG2 LYS A 129 6.023 -10.373 -9.666 1.00 0.00 H new ATOM 0 HG3 LYS A 129 6.736 -9.525 -11.024 1.00 0.00 H new ATOM 0 HD2 LYS A 129 8.371 -9.892 -8.517 1.00 0.00 H new ATOM 0 HD3 LYS A 129 8.157 -11.258 -9.594 1.00 0.00 H new ATOM 0 HE2 LYS A 129 9.192 -8.532 -10.473 1.00 0.00 H new ATOM 0 HE3 LYS A 129 10.222 -9.889 -10.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 10.039 -10.082 -12.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 8.804 -11.132 -11.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 8.420 -9.572 -12.371 1.00 0.00 H new ATOM 996 N ASP A 130 3.746 -9.676 -8.223 1.00 0.00 N ATOM 997 CA ASP A 130 2.306 -9.834 -8.384 1.00 0.00 C ATOM 998 C ASP A 130 1.586 -9.646 -7.052 1.00 0.00 C ATOM 999 O ASP A 130 0.460 -9.152 -7.008 1.00 0.00 O ATOM 1000 CB ASP A 130 1.983 -11.213 -8.961 1.00 0.00 C ATOM 1001 CG ASP A 130 2.332 -11.320 -10.433 1.00 0.00 C ATOM 1002 OD1 ASP A 130 2.290 -10.284 -11.129 1.00 0.00 O ATOM 1003 OD2 ASP A 130 2.647 -12.440 -10.889 1.00 0.00 O ATOM 0 H ASP A 130 4.271 -10.550 -8.248 1.00 0.00 H new ATOM 0 HA ASP A 130 1.958 -9.068 -9.077 1.00 0.00 H new ATOM 0 HB2 ASP A 130 2.530 -11.974 -8.404 1.00 0.00 H new ATOM 0 HB3 ASP A 130 0.922 -11.421 -8.826 1.00 0.00 H new ATOM 1008 N GLN A 131 2.245 -10.044 -5.968 1.00 0.00 N ATOM 1009 CA GLN A 131 1.668 -9.921 -4.635 1.00 0.00 C ATOM 1010 C GLN A 131 1.497 -8.455 -4.249 1.00 0.00 C ATOM 1011 O GLN A 131 0.594 -8.104 -3.490 1.00 0.00 O ATOM 1012 CB GLN A 131 2.548 -10.632 -3.607 1.00 0.00 C ATOM 1013 CG GLN A 131 2.361 -12.141 -3.585 1.00 0.00 C ATOM 1014 CD GLN A 131 3.535 -12.866 -2.957 1.00 0.00 C ATOM 1015 OE1 GLN A 131 4.298 -12.285 -2.186 1.00 0.00 O ATOM 1016 NE2 GLN A 131 3.685 -14.144 -3.286 1.00 0.00 N ATOM 0 H GLN A 131 3.179 -10.454 -5.987 1.00 0.00 H new ATOM 0 HA GLN A 131 0.685 -10.392 -4.648 1.00 0.00 H new ATOM 0 HB2 GLN A 131 3.593 -10.407 -3.818 1.00 0.00 H new ATOM 0 HB3 GLN A 131 2.330 -10.233 -2.616 1.00 0.00 H new ATOM 0 HG2 GLN A 131 1.453 -12.383 -3.033 1.00 0.00 H new ATOM 0 HG3 GLN A 131 2.220 -12.501 -4.604 1.00 0.00 H new ATOM 0 HE21 GLN A 131 3.028 -14.585 -3.929 1.00 0.00 H new ATOM 0 HE22 GLN A 131 4.457 -14.684 -2.895 1.00 0.00 H new ATOM 1025 N ALA A 132 2.371 -7.604 -4.776 1.00 0.00 N ATOM 1026 CA ALA A 132 2.317 -6.176 -4.487 1.00 0.00 C ATOM 1027 C ALA A 132 1.278 -5.480 -5.359 1.00 0.00 C ATOM 1028 O ALA A 132 0.549 -4.603 -4.893 1.00 0.00 O ATOM 1029 CB ALA A 132 3.686 -5.544 -4.688 1.00 0.00 C ATOM 0 H ALA A 132 3.125 -7.879 -5.405 1.00 0.00 H new ATOM 0 HA ALA A 132 2.022 -6.052 -3.445 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.630 -4.478 -4.469 1.00 0.00 H new ATOM 0 HB2 ALA A 132 4.406 -6.015 -4.019 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.004 -5.686 -5.721 1.00 0.00 H new ATOM 1035 N ARG A 133 1.215 -5.874 -6.627 1.00 0.00 N ATOM 1036 CA ARG A 133 0.266 -5.286 -7.564 1.00 0.00 C ATOM 1037 C ARG A 133 -1.112 -5.145 -6.926 1.00 0.00 C ATOM 1038 O ARG A 133 -1.619 -4.035 -6.760 1.00 0.00 O ATOM 1039 CB ARG A 133 0.170 -6.141 -8.829 1.00 0.00 C ATOM 1040 CG ARG A 133 -0.991 -5.760 -9.734 1.00 0.00 C ATOM 1041 CD ARG A 133 -2.307 -6.319 -9.217 1.00 0.00 C ATOM 1042 NE ARG A 133 -3.245 -6.601 -10.301 1.00 0.00 N ATOM 1043 CZ ARG A 133 -3.077 -7.579 -11.183 1.00 0.00 C ATOM 1044 NH1 ARG A 133 -2.012 -8.366 -11.110 1.00 0.00 N ATOM 1045 NH2 ARG A 133 -3.975 -7.773 -12.140 1.00 0.00 N ATOM 0 H ARG A 133 1.810 -6.598 -7.029 1.00 0.00 H new ATOM 0 HA ARG A 133 0.626 -4.293 -7.832 1.00 0.00 H new ATOM 0 HB2 ARG A 133 1.101 -6.052 -9.389 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.069 -7.188 -8.543 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -1.058 -4.674 -9.804 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.806 -6.134 -10.741 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -2.117 -7.233 -8.655 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -2.756 -5.607 -8.525 1.00 0.00 H new ATOM 0 HE ARG A 133 -4.075 -6.014 -10.385 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -1.320 -8.221 -10.375 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -1.885 -9.117 -11.789 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -4.796 -7.170 -12.199 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -3.845 -8.525 -12.817 1.00 0.00 H new ATOM 1059 N GLN A 134 -1.713 -6.276 -6.571 1.00 0.00 N ATOM 1060 CA GLN A 134 -3.033 -6.278 -5.952 1.00 0.00 C ATOM 1061 C GLN A 134 -3.070 -5.346 -4.746 1.00 0.00 C ATOM 1062 O GLN A 134 -3.855 -4.399 -4.705 1.00 0.00 O ATOM 1063 CB GLN A 134 -3.419 -7.696 -5.528 1.00 0.00 C ATOM 1064 CG GLN A 134 -4.915 -7.962 -5.583 1.00 0.00 C ATOM 1065 CD GLN A 134 -5.362 -8.506 -6.925 1.00 0.00 C ATOM 1066 OE1 GLN A 134 -4.866 -8.091 -7.973 1.00 0.00 O ATOM 1067 NE2 GLN A 134 -6.305 -9.441 -6.900 1.00 0.00 N ATOM 0 H GLN A 134 -1.307 -7.203 -6.701 1.00 0.00 H new ATOM 0 HA GLN A 134 -3.752 -5.918 -6.688 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -2.907 -8.411 -6.173 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -3.064 -7.872 -4.512 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -5.183 -8.672 -4.800 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -5.453 -7.037 -5.373 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -6.688 -9.755 -6.008 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -6.646 -9.845 -7.772 1.00 0.00 H new ATOM 1076 N ALA A 135 -2.217 -5.621 -3.765 1.00 0.00 N ATOM 1077 CA ALA A 135 -2.151 -4.806 -2.559 1.00 0.00 C ATOM 1078 C ALA A 135 -2.447 -3.342 -2.868 1.00 0.00 C ATOM 1079 O ALA A 135 -3.321 -2.731 -2.252 1.00 0.00 O ATOM 1080 CB ALA A 135 -0.785 -4.943 -1.903 1.00 0.00 C ATOM 0 H ALA A 135 -1.562 -6.403 -3.782 1.00 0.00 H new ATOM 0 HA ALA A 135 -2.912 -5.165 -1.866 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -0.750 -4.329 -1.003 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -0.612 -5.986 -1.637 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -0.013 -4.613 -2.598 1.00 0.00 H new ATOM 1086 N LEU A 136 -1.713 -2.785 -3.825 1.00 0.00 N ATOM 1087 CA LEU A 136 -1.897 -1.391 -4.216 1.00 0.00 C ATOM 1088 C LEU A 136 -3.186 -1.214 -5.011 1.00 0.00 C ATOM 1089 O LEU A 136 -4.042 -0.405 -4.652 1.00 0.00 O ATOM 1090 CB LEU A 136 -0.703 -0.912 -5.044 1.00 0.00 C ATOM 1091 CG LEU A 136 -0.903 0.393 -5.815 1.00 0.00 C ATOM 1092 CD1 LEU A 136 0.440 1.010 -6.176 1.00 0.00 C ATOM 1093 CD2 LEU A 136 -1.734 0.151 -7.067 1.00 0.00 C ATOM 0 H LEU A 136 -0.985 -3.276 -4.344 1.00 0.00 H new ATOM 0 HA LEU A 136 -1.967 -0.791 -3.309 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.151 -0.790 -4.377 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.442 -1.695 -5.756 1.00 0.00 H new ATOM 0 HG LEU A 136 -1.442 1.092 -5.175 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.278 1.938 -6.724 1.00 0.00 H new ATOM 0 HD12 LEU A 136 1.001 1.220 -5.265 1.00 0.00 H new ATOM 0 HD13 LEU A 136 1.004 0.315 -6.798 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -1.866 1.091 -7.603 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -1.223 -0.565 -7.710 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -2.709 -0.246 -6.785 1.00 0.00 H new ATOM 1105 N ASP A 137 -3.319 -1.977 -6.090 1.00 0.00 N ATOM 1106 CA ASP A 137 -4.506 -1.907 -6.935 1.00 0.00 C ATOM 1107 C ASP A 137 -5.771 -1.813 -6.087 1.00 0.00 C ATOM 1108 O ASP A 137 -6.803 -1.321 -6.544 1.00 0.00 O ATOM 1109 CB ASP A 137 -4.579 -3.129 -7.850 1.00 0.00 C ATOM 1110 CG ASP A 137 -3.859 -2.912 -9.166 1.00 0.00 C ATOM 1111 OD1 ASP A 137 -2.666 -2.544 -9.136 1.00 0.00 O ATOM 1112 OD2 ASP A 137 -4.489 -3.108 -10.227 1.00 0.00 O ATOM 0 H ASP A 137 -2.620 -2.651 -6.401 1.00 0.00 H new ATOM 0 HA ASP A 137 -4.434 -1.009 -7.548 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -4.144 -3.988 -7.339 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -5.624 -3.370 -8.046 1.00 0.00 H new ATOM 1117 N LYS A 138 -5.685 -2.290 -4.850 1.00 0.00 N ATOM 1118 CA LYS A 138 -6.821 -2.261 -3.937 1.00 0.00 C ATOM 1119 C LYS A 138 -6.643 -1.176 -2.880 1.00 0.00 C ATOM 1120 O LYS A 138 -7.415 -0.218 -2.822 1.00 0.00 O ATOM 1121 CB LYS A 138 -6.994 -3.623 -3.262 1.00 0.00 C ATOM 1122 CG LYS A 138 -7.219 -4.763 -4.239 1.00 0.00 C ATOM 1123 CD LYS A 138 -8.564 -4.644 -4.936 1.00 0.00 C ATOM 1124 CE LYS A 138 -8.869 -5.876 -5.774 1.00 0.00 C ATOM 1125 NZ LYS A 138 -10.195 -5.776 -6.445 1.00 0.00 N ATOM 0 H LYS A 138 -4.839 -2.702 -4.456 1.00 0.00 H new ATOM 0 HA LYS A 138 -7.715 -2.034 -4.517 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.108 -3.838 -2.664 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.838 -3.573 -2.574 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -6.422 -4.768 -4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -7.166 -5.714 -3.708 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -9.349 -4.505 -4.193 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -8.568 -3.759 -5.573 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -8.090 -6.006 -6.526 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -8.849 -6.761 -5.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -10.366 -6.635 -7.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -10.941 -5.678 -5.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -10.206 -4.946 -7.071 1.00 0.00 H new ATOM 1139 N LEU A 139 -5.620 -1.331 -2.047 1.00 0.00 N ATOM 1140 CA LEU A 139 -5.339 -0.364 -0.992 1.00 0.00 C ATOM 1141 C LEU A 139 -5.363 1.060 -1.538 1.00 0.00 C ATOM 1142 O LEU A 139 -5.953 1.956 -0.936 1.00 0.00 O ATOM 1143 CB LEU A 139 -3.978 -0.654 -0.356 1.00 0.00 C ATOM 1144 CG LEU A 139 -3.858 -1.982 0.394 1.00 0.00 C ATOM 1145 CD1 LEU A 139 -2.398 -2.316 0.656 1.00 0.00 C ATOM 1146 CD2 LEU A 139 -4.637 -1.929 1.700 1.00 0.00 C ATOM 0 H LEU A 139 -4.971 -2.117 -2.082 1.00 0.00 H new ATOM 0 HA LEU A 139 -6.116 -0.456 -0.233 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -3.221 -0.632 -1.140 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -3.743 0.154 0.337 1.00 0.00 H new ATOM 0 HG LEU A 139 -4.284 -2.769 -0.228 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -2.332 -3.264 1.190 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -1.867 -2.396 -0.293 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -1.947 -1.528 1.258 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -4.540 -2.882 2.220 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -4.241 -1.131 2.328 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.689 -1.736 1.489 1.00 0.00 H new ATOM 1158 N ASN A 140 -4.721 1.260 -2.685 1.00 0.00 N ATOM 1159 CA ASN A 140 -4.671 2.574 -3.314 1.00 0.00 C ATOM 1160 C ASN A 140 -6.029 3.265 -3.239 1.00 0.00 C ATOM 1161 O ASN A 140 -6.114 4.493 -3.248 1.00 0.00 O ATOM 1162 CB ASN A 140 -4.230 2.448 -4.774 1.00 0.00 C ATOM 1163 CG ASN A 140 -4.555 3.687 -5.585 1.00 0.00 C ATOM 1164 OD1 ASN A 140 -5.721 3.979 -5.852 1.00 0.00 O ATOM 1165 ND2 ASN A 140 -3.523 4.422 -5.982 1.00 0.00 N ATOM 0 H ASN A 140 -4.228 0.528 -3.197 1.00 0.00 H new ATOM 0 HA ASN A 140 -3.944 3.180 -2.773 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -3.156 2.264 -4.812 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -4.718 1.584 -5.225 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -3.680 5.267 -6.531 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -2.573 4.142 -5.737 1.00 0.00 H new ATOM 1172 N GLY A 141 -7.090 2.467 -3.165 1.00 0.00 N ATOM 1173 CA GLY A 141 -8.430 3.019 -3.090 1.00 0.00 C ATOM 1174 C GLY A 141 -9.273 2.350 -2.023 1.00 0.00 C ATOM 1175 O GLY A 141 -10.469 2.620 -1.907 1.00 0.00 O ATOM 0 H GLY A 141 -7.045 1.448 -3.156 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -8.369 4.087 -2.883 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -8.920 2.909 -4.058 1.00 0.00 H new ATOM 1179 N PHE A 142 -8.651 1.474 -1.242 1.00 0.00 N ATOM 1180 CA PHE A 142 -9.353 0.761 -0.180 1.00 0.00 C ATOM 1181 C PHE A 142 -9.830 1.728 0.899 1.00 0.00 C ATOM 1182 O PHE A 142 -9.043 2.189 1.725 1.00 0.00 O ATOM 1183 CB PHE A 142 -8.443 -0.302 0.437 1.00 0.00 C ATOM 1184 CG PHE A 142 -9.143 -1.190 1.426 1.00 0.00 C ATOM 1185 CD1 PHE A 142 -9.575 -0.689 2.643 1.00 0.00 C ATOM 1186 CD2 PHE A 142 -9.371 -2.526 1.137 1.00 0.00 C ATOM 1187 CE1 PHE A 142 -10.219 -1.504 3.555 1.00 0.00 C ATOM 1188 CE2 PHE A 142 -10.016 -3.346 2.044 1.00 0.00 C ATOM 1189 CZ PHE A 142 -10.441 -2.834 3.254 1.00 0.00 C ATOM 0 H PHE A 142 -7.662 1.240 -1.324 1.00 0.00 H new ATOM 0 HA PHE A 142 -10.224 0.273 -0.617 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -8.025 -0.918 -0.359 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -7.606 0.191 0.932 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -9.407 0.351 2.882 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -9.041 -2.931 0.192 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -10.548 -1.102 4.502 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -10.187 -4.386 1.807 1.00 0.00 H new ATOM 0 HZ PHE A 142 -10.946 -3.472 3.964 1.00 0.00 H new ATOM 1199 N GLN A 143 -11.125 2.029 0.885 1.00 0.00 N ATOM 1200 CA GLN A 143 -11.707 2.942 1.861 1.00 0.00 C ATOM 1201 C GLN A 143 -11.746 2.304 3.246 1.00 0.00 C ATOM 1202 O GLN A 143 -12.216 1.177 3.410 1.00 0.00 O ATOM 1203 CB GLN A 143 -13.119 3.347 1.434 1.00 0.00 C ATOM 1204 CG GLN A 143 -13.544 4.711 1.954 1.00 0.00 C ATOM 1205 CD GLN A 143 -15.050 4.853 2.054 1.00 0.00 C ATOM 1206 OE1 GLN A 143 -15.736 5.035 1.048 1.00 0.00 O ATOM 1207 NE2 GLN A 143 -15.573 4.772 3.272 1.00 0.00 N ATOM 0 H GLN A 143 -11.790 1.654 0.209 1.00 0.00 H new ATOM 0 HA GLN A 143 -11.080 3.832 1.907 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -13.174 3.349 0.345 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -13.826 2.596 1.787 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -13.101 4.875 2.936 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -13.153 5.485 1.294 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -14.967 4.620 4.078 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -16.581 4.861 3.401 1.00 0.00 H new ATOM 1216 N LEU A 144 -11.250 3.031 4.241 1.00 0.00 N ATOM 1217 CA LEU A 144 -11.227 2.536 5.613 1.00 0.00 C ATOM 1218 C LEU A 144 -11.515 3.661 6.602 1.00 0.00 C ATOM 1219 O LEU A 144 -10.997 4.769 6.464 1.00 0.00 O ATOM 1220 CB LEU A 144 -9.871 1.901 5.925 1.00 0.00 C ATOM 1221 CG LEU A 144 -9.842 0.924 7.101 1.00 0.00 C ATOM 1222 CD1 LEU A 144 -8.640 -0.002 6.996 1.00 0.00 C ATOM 1223 CD2 LEU A 144 -9.823 1.679 8.422 1.00 0.00 C ATOM 0 H LEU A 144 -10.858 3.965 4.123 1.00 0.00 H new ATOM 0 HA LEU A 144 -12.006 1.780 5.714 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -9.524 1.377 5.034 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.156 2.699 6.124 1.00 0.00 H new ATOM 0 HG LEU A 144 -10.746 0.317 7.066 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.636 -0.690 7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -8.698 -0.569 6.067 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.724 0.589 7.005 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.802 0.967 9.247 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -8.937 2.312 8.467 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.716 2.299 8.500 1.00 0.00 H new ATOM 1235 N GLU A 145 -12.341 3.367 7.601 1.00 0.00 N ATOM 1236 CA GLU A 145 -12.696 4.355 8.614 1.00 0.00 C ATOM 1237 C GLU A 145 -12.825 5.744 7.998 1.00 0.00 C ATOM 1238 O GLU A 145 -12.392 6.737 8.582 1.00 0.00 O ATOM 1239 CB GLU A 145 -11.646 4.374 9.728 1.00 0.00 C ATOM 1240 CG GLU A 145 -11.521 3.054 10.469 1.00 0.00 C ATOM 1241 CD GLU A 145 -12.394 2.994 11.707 1.00 0.00 C ATOM 1242 OE1 GLU A 145 -12.184 3.817 12.622 1.00 0.00 O ATOM 1243 OE2 GLU A 145 -13.288 2.124 11.760 1.00 0.00 O ATOM 0 H GLU A 145 -12.777 2.454 7.731 1.00 0.00 H new ATOM 0 HA GLU A 145 -13.660 4.074 9.037 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -10.678 4.633 9.299 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -11.899 5.159 10.441 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -11.792 2.238 9.798 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -10.481 2.900 10.755 1.00 0.00 H new ATOM 1250 N ASN A 146 -13.424 5.806 6.813 1.00 0.00 N ATOM 1251 CA ASN A 146 -13.610 7.074 6.115 1.00 0.00 C ATOM 1252 C ASN A 146 -12.267 7.671 5.706 1.00 0.00 C ATOM 1253 O ASN A 146 -12.015 8.859 5.913 1.00 0.00 O ATOM 1254 CB ASN A 146 -14.371 8.061 7.003 1.00 0.00 C ATOM 1255 CG ASN A 146 -15.671 7.483 7.527 1.00 0.00 C ATOM 1256 OD1 ASN A 146 -15.757 7.066 8.682 1.00 0.00 O ATOM 1257 ND2 ASN A 146 -16.692 7.455 6.677 1.00 0.00 N ATOM 0 H ASN A 146 -13.789 4.994 6.316 1.00 0.00 H new ATOM 0 HA ASN A 146 -14.192 6.883 5.214 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -13.740 8.350 7.844 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -14.582 8.968 6.436 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -17.592 7.077 6.973 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -16.576 7.812 5.728 1.00 0.00 H new ATOM 1264 N PHE A 147 -11.409 6.841 5.124 1.00 0.00 N ATOM 1265 CA PHE A 147 -10.091 7.286 4.686 1.00 0.00 C ATOM 1266 C PHE A 147 -9.606 6.462 3.497 1.00 0.00 C ATOM 1267 O PHE A 147 -9.269 5.285 3.638 1.00 0.00 O ATOM 1268 CB PHE A 147 -9.087 7.185 5.836 1.00 0.00 C ATOM 1269 CG PHE A 147 -9.152 8.341 6.792 1.00 0.00 C ATOM 1270 CD1 PHE A 147 -8.574 9.558 6.469 1.00 0.00 C ATOM 1271 CD2 PHE A 147 -9.791 8.211 8.015 1.00 0.00 C ATOM 1272 CE1 PHE A 147 -8.632 10.625 7.347 1.00 0.00 C ATOM 1273 CE2 PHE A 147 -9.853 9.274 8.896 1.00 0.00 C ATOM 1274 CZ PHE A 147 -9.272 10.482 8.562 1.00 0.00 C ATOM 0 H PHE A 147 -11.602 5.856 4.944 1.00 0.00 H new ATOM 0 HA PHE A 147 -10.171 8.327 4.374 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -9.267 6.260 6.384 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -8.080 7.121 5.424 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -8.072 9.675 5.520 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -10.246 7.269 8.282 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -8.177 11.568 7.083 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -10.355 9.160 9.845 1.00 0.00 H new ATOM 0 HZ PHE A 147 -9.318 11.313 9.250 1.00 0.00 H new ATOM 1284 N THR A 148 -9.572 7.087 2.325 1.00 0.00 N ATOM 1285 CA THR A 148 -9.130 6.413 1.111 1.00 0.00 C ATOM 1286 C THR A 148 -7.622 6.191 1.123 1.00 0.00 C ATOM 1287 O THR A 148 -6.850 7.084 0.772 1.00 0.00 O ATOM 1288 CB THR A 148 -9.510 7.215 -0.148 1.00 0.00 C ATOM 1289 OG1 THR A 148 -10.860 7.680 -0.044 1.00 0.00 O ATOM 1290 CG2 THR A 148 -9.356 6.364 -1.399 1.00 0.00 C ATOM 0 H THR A 148 -9.846 8.060 2.191 1.00 0.00 H new ATOM 0 HA THR A 148 -9.636 5.448 1.084 1.00 0.00 H new ATOM 0 HB THR A 148 -8.837 8.069 -0.224 1.00 0.00 H new ATOM 0 HG1 THR A 148 -11.093 8.190 -0.848 1.00 0.00 H new ATOM 0 HG21 THR A 148 -9.630 6.952 -2.275 1.00 0.00 H new ATOM 0 HG22 THR A 148 -8.320 6.037 -1.491 1.00 0.00 H new ATOM 0 HG23 THR A 148 -10.007 5.493 -1.329 1.00 0.00 H new ATOM 1298 N LEU A 149 -7.208 4.996 1.529 1.00 0.00 N ATOM 1299 CA LEU A 149 -5.791 4.656 1.586 1.00 0.00 C ATOM 1300 C LEU A 149 -5.113 4.919 0.245 1.00 0.00 C ATOM 1301 O LEU A 149 -5.491 4.346 -0.777 1.00 0.00 O ATOM 1302 CB LEU A 149 -5.613 3.189 1.981 1.00 0.00 C ATOM 1303 CG LEU A 149 -6.301 2.754 3.276 1.00 0.00 C ATOM 1304 CD1 LEU A 149 -6.207 1.246 3.450 1.00 0.00 C ATOM 1305 CD2 LEU A 149 -5.688 3.470 4.471 1.00 0.00 C ATOM 0 H LEU A 149 -7.834 4.246 1.824 1.00 0.00 H new ATOM 0 HA LEU A 149 -5.322 5.288 2.340 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -5.987 2.567 1.168 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -4.546 2.985 2.074 1.00 0.00 H new ATOM 0 HG LEU A 149 -7.355 3.027 3.215 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -6.702 0.955 4.377 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -6.693 0.752 2.609 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -5.159 0.949 3.490 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -6.189 3.149 5.384 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -4.627 3.228 4.535 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -5.808 4.547 4.351 1.00 0.00 H new ATOM 1317 N LYS A 150 -4.108 5.788 0.256 1.00 0.00 N ATOM 1318 CA LYS A 150 -3.374 6.126 -0.957 1.00 0.00 C ATOM 1319 C LYS A 150 -2.071 5.338 -1.042 1.00 0.00 C ATOM 1320 O LYS A 150 -1.221 5.427 -0.156 1.00 0.00 O ATOM 1321 CB LYS A 150 -3.079 7.627 -0.998 1.00 0.00 C ATOM 1322 CG LYS A 150 -4.326 8.493 -0.996 1.00 0.00 C ATOM 1323 CD LYS A 150 -4.004 9.936 -1.348 1.00 0.00 C ATOM 1324 CE LYS A 150 -5.212 10.649 -1.937 1.00 0.00 C ATOM 1325 NZ LYS A 150 -4.817 11.848 -2.726 1.00 0.00 N ATOM 0 H LYS A 150 -3.783 6.272 1.093 1.00 0.00 H new ATOM 0 HA LYS A 150 -3.995 5.861 -1.813 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -2.462 7.891 -0.139 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -2.494 7.849 -1.890 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -5.047 8.096 -1.710 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -4.796 8.453 -0.013 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -3.669 10.463 -0.455 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -3.181 9.962 -2.062 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -5.765 9.960 -2.575 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -5.885 10.948 -1.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -5.668 12.306 -3.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -4.311 12.517 -2.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -4.195 11.559 -3.508 1.00 0.00 H new ATOM 1339 N VAL A 151 -1.919 4.567 -2.115 1.00 0.00 N ATOM 1340 CA VAL A 151 -0.718 3.766 -2.316 1.00 0.00 C ATOM 1341 C VAL A 151 -0.048 4.104 -3.643 1.00 0.00 C ATOM 1342 O VAL A 151 -0.719 4.368 -4.640 1.00 0.00 O ATOM 1343 CB VAL A 151 -1.037 2.259 -2.285 1.00 0.00 C ATOM 1344 CG1 VAL A 151 0.246 1.442 -2.260 1.00 0.00 C ATOM 1345 CG2 VAL A 151 -1.915 1.926 -1.088 1.00 0.00 C ATOM 0 H VAL A 151 -2.613 4.481 -2.858 1.00 0.00 H new ATOM 0 HA VAL A 151 -0.038 4.004 -1.498 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.585 2.002 -3.192 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.001 0.380 -2.238 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.834 1.660 -3.151 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.824 1.699 -1.372 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -2.131 0.858 -1.081 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -1.395 2.197 -0.169 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -2.849 2.484 -1.155 1.00 0.00 H new ATOM 1355 N ALA A 152 1.281 4.094 -3.648 1.00 0.00 N ATOM 1356 CA ALA A 152 2.043 4.398 -4.852 1.00 0.00 C ATOM 1357 C ALA A 152 3.390 3.682 -4.845 1.00 0.00 C ATOM 1358 O ALA A 152 4.042 3.577 -3.806 1.00 0.00 O ATOM 1359 CB ALA A 152 2.242 5.900 -4.987 1.00 0.00 C ATOM 0 H ALA A 152 1.852 3.878 -2.831 1.00 0.00 H new ATOM 0 HA ALA A 152 1.475 4.040 -5.711 1.00 0.00 H new ATOM 0 HB1 ALA A 152 2.813 6.112 -5.891 1.00 0.00 H new ATOM 0 HB2 ALA A 152 1.271 6.392 -5.048 1.00 0.00 H new ATOM 0 HB3 ALA A 152 2.785 6.275 -4.119 1.00 0.00 H new ATOM 1365 N TYR A 153 3.800 3.192 -6.009 1.00 0.00 N ATOM 1366 CA TYR A 153 5.068 2.483 -6.136 1.00 0.00 C ATOM 1367 C TYR A 153 6.244 3.418 -5.869 1.00 0.00 C ATOM 1368 O TYR A 153 6.582 4.262 -6.700 1.00 0.00 O ATOM 1369 CB TYR A 153 5.197 1.870 -7.531 1.00 0.00 C ATOM 1370 CG TYR A 153 4.606 0.483 -7.640 1.00 0.00 C ATOM 1371 CD1 TYR A 153 5.339 -0.637 -7.269 1.00 0.00 C ATOM 1372 CD2 TYR A 153 3.313 0.293 -8.113 1.00 0.00 C ATOM 1373 CE1 TYR A 153 4.803 -1.907 -7.368 1.00 0.00 C ATOM 1374 CE2 TYR A 153 2.768 -0.973 -8.214 1.00 0.00 C ATOM 1375 CZ TYR A 153 3.517 -2.069 -7.840 1.00 0.00 C ATOM 1376 OH TYR A 153 2.979 -3.332 -7.939 1.00 0.00 O ATOM 0 H TYR A 153 3.273 3.273 -6.879 1.00 0.00 H new ATOM 0 HA TYR A 153 5.085 1.685 -5.393 1.00 0.00 H new ATOM 0 HB2 TYR A 153 4.706 2.523 -8.252 1.00 0.00 H new ATOM 0 HB3 TYR A 153 6.251 1.829 -7.805 1.00 0.00 H new ATOM 0 HD1 TYR A 153 6.345 -0.513 -6.897 1.00 0.00 H new ATOM 0 HD2 TYR A 153 2.724 1.149 -8.407 1.00 0.00 H new ATOM 0 HE1 TYR A 153 5.387 -2.767 -7.078 1.00 0.00 H new ATOM 0 HE2 TYR A 153 1.762 -1.103 -8.584 1.00 0.00 H new ATOM 0 HH TYR A 153 3.370 -3.909 -7.250 1.00 0.00 H new ATOM 1386 N ILE A 154 6.863 3.261 -4.704 1.00 0.00 N ATOM 1387 CA ILE A 154 8.002 4.089 -4.327 1.00 0.00 C ATOM 1388 C ILE A 154 9.127 3.975 -5.350 1.00 0.00 C ATOM 1389 O ILE A 154 9.450 2.891 -5.836 1.00 0.00 O ATOM 1390 CB ILE A 154 8.544 3.702 -2.938 1.00 0.00 C ATOM 1391 CG1 ILE A 154 7.433 3.787 -1.891 1.00 0.00 C ATOM 1392 CG2 ILE A 154 9.710 4.602 -2.555 1.00 0.00 C ATOM 1393 CD1 ILE A 154 7.910 3.523 -0.480 1.00 0.00 C ATOM 0 H ILE A 154 6.595 2.568 -4.005 1.00 0.00 H new ATOM 0 HA ILE A 154 7.647 5.119 -4.295 1.00 0.00 H new ATOM 0 HB ILE A 154 8.902 2.673 -2.978 1.00 0.00 H new ATOM 0 HG12 ILE A 154 6.980 4.778 -1.933 1.00 0.00 H new ATOM 0 HG13 ILE A 154 6.653 3.069 -2.142 1.00 0.00 H new ATOM 0 HG21 ILE A 154 10.082 4.316 -1.571 1.00 0.00 H new ATOM 0 HG22 ILE A 154 10.508 4.496 -3.290 1.00 0.00 H new ATOM 0 HG23 ILE A 154 9.376 5.639 -2.529 1.00 0.00 H new ATOM 0 HD11 ILE A 154 7.069 3.600 0.209 1.00 0.00 H new ATOM 0 HD12 ILE A 154 8.336 2.522 -0.421 1.00 0.00 H new ATOM 0 HD13 ILE A 154 8.669 4.257 -0.209 1.00 0.00 H new ATOM 1405 N PRO A 155 9.741 5.120 -5.684 1.00 0.00 N ATOM 1406 CA PRO A 155 10.842 5.175 -6.650 1.00 0.00 C ATOM 1407 C PRO A 155 12.117 4.533 -6.114 1.00 0.00 C ATOM 1408 O PRO A 155 12.353 4.514 -4.905 1.00 0.00 O ATOM 1409 CB PRO A 155 11.050 6.676 -6.867 1.00 0.00 C ATOM 1410 CG PRO A 155 10.545 7.312 -5.618 1.00 0.00 C ATOM 1411 CD PRO A 155 9.409 6.449 -5.143 1.00 0.00 C ATOM 0 HA PRO A 155 10.610 4.627 -7.563 1.00 0.00 H new ATOM 0 HB2 PRO A 155 12.101 6.910 -7.033 1.00 0.00 H new ATOM 0 HB3 PRO A 155 10.503 7.029 -7.741 1.00 0.00 H new ATOM 0 HG2 PRO A 155 11.331 7.371 -4.865 1.00 0.00 H new ATOM 0 HG3 PRO A 155 10.208 8.331 -5.808 1.00 0.00 H new ATOM 0 HD2 PRO A 155 9.343 6.435 -4.055 1.00 0.00 H new ATOM 0 HD3 PRO A 155 8.449 6.807 -5.516 1.00 0.00 H new ATOM 1419 N ASP A 156 12.936 4.009 -7.019 1.00 0.00 N ATOM 1420 CA ASP A 156 14.189 3.367 -6.636 1.00 0.00 C ATOM 1421 C ASP A 156 15.331 4.378 -6.610 1.00 0.00 C ATOM 1422 O ASP A 156 16.495 4.016 -6.776 1.00 0.00 O ATOM 1423 CB ASP A 156 14.520 2.230 -7.603 1.00 0.00 C ATOM 1424 CG ASP A 156 15.019 2.735 -8.943 1.00 0.00 C ATOM 1425 OD1 ASP A 156 14.269 3.473 -9.615 1.00 0.00 O ATOM 1426 OD2 ASP A 156 16.159 2.392 -9.319 1.00 0.00 O ATOM 0 H ASP A 156 12.755 4.016 -8.023 1.00 0.00 H new ATOM 0 HA ASP A 156 14.068 2.957 -5.633 1.00 0.00 H new ATOM 0 HB2 ASP A 156 15.277 1.586 -7.156 1.00 0.00 H new ATOM 0 HB3 ASP A 156 13.631 1.618 -7.757 1.00 0.00 H new ATOM 1431 N GLU A 157 14.989 5.646 -6.402 1.00 0.00 N ATOM 1432 CA GLU A 157 15.986 6.708 -6.356 1.00 0.00 C ATOM 1433 C GLU A 157 15.947 7.434 -5.015 1.00 0.00 C ATOM 1434 O GLU A 157 14.879 7.809 -4.531 1.00 0.00 O ATOM 1435 CB GLU A 157 15.755 7.704 -7.495 1.00 0.00 C ATOM 1436 CG GLU A 157 17.019 8.419 -7.943 1.00 0.00 C ATOM 1437 CD GLU A 157 17.745 7.681 -9.051 1.00 0.00 C ATOM 1438 OE1 GLU A 157 17.079 6.953 -9.816 1.00 0.00 O ATOM 1439 OE2 GLU A 157 18.981 7.833 -9.153 1.00 0.00 O ATOM 0 H GLU A 157 14.029 5.962 -6.263 1.00 0.00 H new ATOM 0 HA GLU A 157 16.970 6.253 -6.474 1.00 0.00 H new ATOM 0 HB2 GLU A 157 15.325 7.176 -8.346 1.00 0.00 H new ATOM 0 HB3 GLU A 157 15.022 8.445 -7.176 1.00 0.00 H new ATOM 0 HG2 GLU A 157 16.763 9.421 -8.286 1.00 0.00 H new ATOM 0 HG3 GLU A 157 17.688 8.535 -7.090 1.00 0.00 H new ATOM 1446 N MET A 158 17.119 7.629 -4.419 1.00 0.00 N ATOM 1447 CA MET A 158 17.219 8.310 -3.134 1.00 0.00 C ATOM 1448 C MET A 158 17.053 9.817 -3.303 1.00 0.00 C ATOM 1449 O MET A 158 16.432 10.480 -2.473 1.00 0.00 O ATOM 1450 CB MET A 158 18.565 8.005 -2.474 1.00 0.00 C ATOM 1451 CG MET A 158 18.734 8.654 -1.110 1.00 0.00 C ATOM 1452 SD MET A 158 20.277 8.184 -0.303 1.00 0.00 S ATOM 1453 CE MET A 158 21.333 9.555 -0.765 1.00 0.00 C ATOM 0 H MET A 158 18.012 7.325 -4.806 1.00 0.00 H new ATOM 0 HA MET A 158 16.417 7.943 -2.494 1.00 0.00 H new ATOM 0 HB2 MET A 158 18.673 6.925 -2.369 1.00 0.00 H new ATOM 0 HB3 MET A 158 19.367 8.343 -3.130 1.00 0.00 H new ATOM 0 HG2 MET A 158 18.702 9.738 -1.221 1.00 0.00 H new ATOM 0 HG3 MET A 158 17.895 8.374 -0.472 1.00 0.00 H new ATOM 0 HE1 MET A 158 22.326 9.409 -0.339 1.00 0.00 H new ATOM 0 HE2 MET A 158 21.408 9.607 -1.851 1.00 0.00 H new ATOM 0 HE3 MET A 158 20.909 10.485 -0.386 1.00 0.00 H new ATOM 1463 N ALA A 159 17.612 10.352 -4.384 1.00 0.00 N ATOM 1464 CA ALA A 159 17.523 11.780 -4.662 1.00 0.00 C ATOM 1465 C ALA A 159 16.218 12.121 -5.373 1.00 0.00 C ATOM 1466 O ALA A 159 16.136 13.112 -6.099 1.00 0.00 O ATOM 1467 CB ALA A 159 18.714 12.230 -5.496 1.00 0.00 C ATOM 0 H ALA A 159 18.131 9.818 -5.081 1.00 0.00 H new ATOM 0 HA ALA A 159 17.537 12.312 -3.711 1.00 0.00 H new ATOM 0 HB1 ALA A 159 18.635 13.298 -5.696 1.00 0.00 H new ATOM 0 HB2 ALA A 159 19.636 12.030 -4.951 1.00 0.00 H new ATOM 0 HB3 ALA A 159 18.725 11.684 -6.439 1.00 0.00 H new ATOM 1473 N ALA A 160 15.200 11.294 -5.161 1.00 0.00 N ATOM 1474 CA ALA A 160 13.899 11.509 -5.780 1.00 0.00 C ATOM 1475 C ALA A 160 14.046 12.111 -7.173 1.00 0.00 C ATOM 1476 O ALA A 160 13.467 13.155 -7.472 1.00 0.00 O ATOM 1477 CB ALA A 160 13.039 12.407 -4.903 1.00 0.00 C ATOM 0 H ALA A 160 15.252 10.468 -4.565 1.00 0.00 H new ATOM 0 HA ALA A 160 13.408 10.541 -5.881 1.00 0.00 H new ATOM 0 HB1 ALA A 160 12.070 12.559 -5.378 1.00 0.00 H new ATOM 0 HB2 ALA A 160 12.897 11.937 -3.930 1.00 0.00 H new ATOM 0 HB3 ALA A 160 13.534 13.369 -4.772 1.00 0.00 H new ATOM 1483 N GLN A 161 14.826 11.447 -8.021 1.00 0.00 N ATOM 1484 CA GLN A 161 15.050 11.919 -9.382 1.00 0.00 C ATOM 1485 C GLN A 161 14.875 10.785 -10.387 1.00 0.00 C ATOM 1486 O GLN A 161 14.518 9.665 -10.019 1.00 0.00 O ATOM 1487 CB GLN A 161 16.451 12.520 -9.511 1.00 0.00 C ATOM 1488 CG GLN A 161 17.561 11.575 -9.080 1.00 0.00 C ATOM 1489 CD GLN A 161 18.936 12.202 -9.188 1.00 0.00 C ATOM 1490 OE1 GLN A 161 19.281 13.104 -8.424 1.00 0.00 O ATOM 1491 NE2 GLN A 161 19.731 11.728 -10.140 1.00 0.00 N ATOM 0 H GLN A 161 15.313 10.581 -7.789 1.00 0.00 H new ATOM 0 HA GLN A 161 14.310 12.690 -9.600 1.00 0.00 H new ATOM 0 HB2 GLN A 161 16.617 12.813 -10.547 1.00 0.00 H new ATOM 0 HB3 GLN A 161 16.504 13.428 -8.910 1.00 0.00 H new ATOM 0 HG2 GLN A 161 17.388 11.263 -8.050 1.00 0.00 H new ATOM 0 HG3 GLN A 161 17.527 10.676 -9.695 1.00 0.00 H new ATOM 0 HE21 GLN A 161 19.405 10.980 -10.751 1.00 0.00 H new ATOM 0 HE22 GLN A 161 20.668 12.112 -10.260 1.00 0.00 H new TER 1500 GLN A 161