USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1198 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 117 ASN : amide:sc= -6.02! C(o=-12!,f=-18!) USER MOD Set 1.2: A 134 GLN : amide:sc= -5.64! C(o=-12!,f=-12!) USER MOD Set 2.1: A 115 ASN : amide:sc= -0.243 K(o=-2.7,f=-7.7!) USER MOD Set 2.2: A 131 GLN :FLIP amide:sc= -2.45! F(o=-4.7,f=-2.7!) USER MOD Set 3.1: A 47 HIS :FLIP no HD1:sc= -6.09 F(o=-9.8,f=-7.6) USER MOD Set 3.2: A 78 ASN : amide:sc= -1.47! C(o=-7.6!,f=-17!) USER MOD Set 4.1: A 24 HIS : no HD1:sc= -9.74! C(o=-25!,f=-26!) USER MOD Set 4.2: A 71 SER OG : rot -58:sc= -3.35! USER MOD Set 4.3: A 136 MET CE :methyl -122:sc= -12.1! (180deg=-14!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -121:sc= -0.0233 (180deg=-0.448) USER MOD Single : A 2 HIS :FLIP no HD1:sc= -0.63 F(o=-1.2,f=-0.63) USER MOD Single : A 3 HIS : no HE2:sc= -0.502 K(o=-0.5,f=-1.7) USER MOD Single : A 4 HIS : no HD1:sc= -0.725 X(o=-0.73,f=-0.63) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.0131 X(o=-0.013,f=-0.0084) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 10:sc= 0.765 USER MOD Single : A 12 HIS : no HD1:sc= -2.6 X(o=-2.6,f=-2.9!) USER MOD Single : A 13 ASN : amide:sc= -0.0238 X(o=-0.024,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-1.7) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -116:sc= -3.05 (180deg=-6.41!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= -0.132 (180deg=-0.132) USER MOD Single : A 49 SER OG : rot -130:sc= -1.62 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -112:sc= -2.75! (180deg=-7.75!) USER MOD Single : A 64 SER OG : rot -44:sc= -1.77! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0156 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 72 HIS : no HD1:sc= -0.517 X(o=-0.52,f=-0.029) USER MOD Single : A 73 ASN : amide:sc= -11.1! C(o=-11!,f=-13!) USER MOD Single : A 76 MET CE :methyl 174:sc= -7.35! (180deg=-7.59!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -159:sc= 1 USER MOD Single : A 96 TYR OH : rot -43:sc= 0.938 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -1.86 K(o=-1.9,f=-3.2!) USER MOD Single : A 119 ASN : amide:sc= -4.92! C(o=-4.9!,f=-11!) USER MOD Single : A 121 SER OG : rot -6:sc= 1.07 USER MOD Single : A 122 TYR OH : rot 180:sc= -0.164 USER MOD Single : A 123 LYS NZ :NH3+ 167:sc= -1.22 (180deg=-1.49) USER MOD Single : A 124 TYR OH : rot -177:sc= -2.14! USER MOD Single : A 126 TYR OH : rot 171:sc= -0.818! USER MOD Single : A 128 SER OG : rot -68:sc= 1.11 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc= -7.11! C(o=-7.1!,f=-12!) USER MOD Single : A 144 THR OG1 : rot 1:sc= 0.69 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 HIS : no HE2:sc= -3.53 K(o=-3.5,f=-4.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -27.397 -15.089 26.456 1.00 0.00 N ATOM 2 CA MET A 1 -26.465 -14.248 25.660 1.00 0.00 C ATOM 3 C MET A 1 -27.193 -13.551 24.516 1.00 0.00 C ATOM 4 O MET A 1 -28.193 -14.055 24.003 1.00 0.00 O ATOM 5 CB MET A 1 -25.351 -15.141 25.111 1.00 0.00 C ATOM 6 CG MET A 1 -24.425 -15.689 26.186 1.00 0.00 C ATOM 7 SD MET A 1 -23.197 -14.483 26.725 1.00 0.00 S ATOM 8 CE MET A 1 -22.301 -15.436 27.947 1.00 0.00 C ATOM 0 H1 MET A 1 -27.396 -14.768 27.445 1.00 0.00 H new ATOM 0 H2 MET A 1 -28.358 -15.006 26.067 1.00 0.00 H new ATOM 0 H3 MET A 1 -27.091 -16.082 26.414 1.00 0.00 H new ATOM 0 HA MET A 1 -26.044 -13.474 26.302 1.00 0.00 H new ATOM 0 HB2 MET A 1 -25.798 -15.974 24.569 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.762 -14.572 24.391 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.018 -16.006 27.044 1.00 0.00 H new ATOM 0 HG3 MET A 1 -23.916 -16.575 25.805 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.505 -14.825 28.373 1.00 0.00 H new ATOM 0 HE2 MET A 1 -22.983 -15.747 28.738 1.00 0.00 H new ATOM 0 HE3 MET A 1 -21.868 -16.318 27.475 1.00 0.00 H new ATOM 20 N HIS A 2 -26.685 -12.388 24.119 1.00 0.00 N ATOM 21 CA HIS A 2 -27.288 -11.621 23.035 1.00 0.00 C ATOM 22 C HIS A 2 -26.217 -10.923 22.202 1.00 0.00 C ATOM 23 O HIS A 2 -26.236 -10.983 20.972 1.00 0.00 O ATOM 24 CB HIS A 2 -28.268 -10.588 23.595 1.00 0.00 C ATOM 25 CG HIS A 2 -27.666 -9.693 24.633 1.00 0.00 C ATOM 26 ND1 HIS A 2 -27.077 -8.478 24.521 1.00 0.00 N flip ATOM 27 CD2 HIS A 2 -27.626 -10.014 25.974 1.00 0.00 C flip ATOM 28 CE1 HIS A 2 -26.696 -8.095 25.783 1.00 0.00 C flip ATOM 29 NE2 HIS A 2 -27.039 -9.037 26.642 1.00 0.00 N flip ATOM 0 H HIS A 2 -25.858 -11.957 24.532 1.00 0.00 H new ATOM 0 HA HIS A 2 -27.830 -12.314 22.392 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -28.647 -9.977 22.776 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -29.123 -11.108 24.027 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -28.014 -10.923 26.410 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -26.196 -7.171 26.033 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -26.878 -9.014 27.649 1.00 0.00 H new ATOM 38 N HIS A 3 -25.285 -10.261 22.880 1.00 0.00 N ATOM 39 CA HIS A 3 -24.207 -9.552 22.202 1.00 0.00 C ATOM 40 C HIS A 3 -23.052 -9.274 23.161 1.00 0.00 C ATOM 41 O HIS A 3 -23.265 -9.002 24.342 1.00 0.00 O ATOM 42 CB HIS A 3 -24.725 -8.238 21.611 1.00 0.00 C ATOM 43 CG HIS A 3 -24.878 -8.273 20.123 1.00 0.00 C ATOM 44 ND1 HIS A 3 -26.016 -8.733 19.494 1.00 0.00 N ATOM 45 CD2 HIS A 3 -24.030 -7.900 19.135 1.00 0.00 C ATOM 46 CE1 HIS A 3 -25.861 -8.644 18.184 1.00 0.00 C ATOM 47 NE2 HIS A 3 -24.666 -8.140 17.941 1.00 0.00 N ATOM 0 H HIS A 3 -25.255 -10.201 23.898 1.00 0.00 H new ATOM 0 HA HIS A 3 -23.840 -10.185 21.394 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -25.689 -8.001 22.062 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -24.041 -7.433 21.879 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -26.848 -9.087 19.966 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -23.039 -7.490 19.262 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -26.588 -8.934 17.440 1.00 0.00 H new ATOM 56 N HIS A 4 -21.831 -9.345 22.643 1.00 0.00 N ATOM 57 CA HIS A 4 -20.642 -9.102 23.453 1.00 0.00 C ATOM 58 C HIS A 4 -19.380 -9.165 22.599 1.00 0.00 C ATOM 59 O HIS A 4 -18.986 -10.235 22.133 1.00 0.00 O ATOM 60 CB HIS A 4 -20.555 -10.122 24.589 1.00 0.00 C ATOM 61 CG HIS A 4 -20.624 -11.544 24.123 1.00 0.00 C ATOM 62 ND1 HIS A 4 -21.813 -12.204 23.894 1.00 0.00 N ATOM 63 CD2 HIS A 4 -19.642 -12.432 23.840 1.00 0.00 C ATOM 64 CE1 HIS A 4 -21.559 -13.437 23.493 1.00 0.00 C ATOM 65 NE2 HIS A 4 -20.250 -13.601 23.452 1.00 0.00 N ATOM 0 H HIS A 4 -21.638 -9.569 21.667 1.00 0.00 H new ATOM 0 HA HIS A 4 -20.721 -8.102 23.879 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -19.622 -9.971 25.131 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -21.366 -9.939 25.293 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -18.579 -12.254 23.907 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -22.297 -14.184 23.241 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -19.768 -14.457 23.177 1.00 0.00 H new ATOM 74 N HIS A 5 -18.750 -8.013 22.398 1.00 0.00 N ATOM 75 CA HIS A 5 -17.530 -7.936 21.601 1.00 0.00 C ATOM 76 C HIS A 5 -17.790 -8.392 20.167 1.00 0.00 C ATOM 77 O HIS A 5 -18.867 -8.898 19.851 1.00 0.00 O ATOM 78 CB HIS A 5 -16.429 -8.791 22.234 1.00 0.00 C ATOM 79 CG HIS A 5 -15.257 -7.993 22.716 1.00 0.00 C ATOM 80 ND1 HIS A 5 -14.445 -7.265 21.872 1.00 0.00 N ATOM 81 CD2 HIS A 5 -14.764 -7.811 23.963 1.00 0.00 C ATOM 82 CE1 HIS A 5 -13.499 -6.671 22.580 1.00 0.00 C ATOM 83 NE2 HIS A 5 -13.672 -6.984 23.851 1.00 0.00 N ATOM 0 H HIS A 5 -19.064 -7.119 22.776 1.00 0.00 H new ATOM 0 HA HIS A 5 -17.202 -6.897 21.578 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -16.849 -9.348 23.072 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -16.084 -9.524 21.505 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -15.155 -8.236 24.875 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -12.718 -6.038 22.186 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -13.089 -6.664 24.625 1.00 0.00 H new ATOM 92 N HIS A 6 -16.795 -8.208 19.305 1.00 0.00 N ATOM 93 CA HIS A 6 -16.913 -8.602 17.906 1.00 0.00 C ATOM 94 C HIS A 6 -18.044 -7.841 17.221 1.00 0.00 C ATOM 95 O HIS A 6 -18.803 -7.121 17.869 1.00 0.00 O ATOM 96 CB HIS A 6 -17.156 -10.107 17.794 1.00 0.00 C ATOM 97 CG HIS A 6 -15.894 -10.913 17.737 1.00 0.00 C ATOM 98 ND1 HIS A 6 -15.395 -11.610 18.818 1.00 0.00 N ATOM 99 CD2 HIS A 6 -15.029 -11.132 16.718 1.00 0.00 C ATOM 100 CE1 HIS A 6 -14.278 -12.221 18.468 1.00 0.00 C ATOM 101 NE2 HIS A 6 -14.034 -11.947 17.200 1.00 0.00 N ATOM 0 H HIS A 6 -15.898 -7.789 19.551 1.00 0.00 H new ATOM 0 HA HIS A 6 -15.976 -8.356 17.406 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -17.750 -10.436 18.647 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -17.746 -10.306 16.899 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -15.107 -10.740 15.715 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -13.668 -12.839 19.110 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -13.235 -12.286 16.664 1.00 0.00 H new ATOM 110 N HIS A 7 -18.150 -8.005 15.907 1.00 0.00 N ATOM 111 CA HIS A 7 -19.188 -7.335 15.133 1.00 0.00 C ATOM 112 C HIS A 7 -19.048 -5.820 15.232 1.00 0.00 C ATOM 113 O HIS A 7 -19.276 -5.233 16.289 1.00 0.00 O ATOM 114 CB HIS A 7 -20.575 -7.761 15.619 1.00 0.00 C ATOM 115 CG HIS A 7 -21.064 -9.029 14.991 1.00 0.00 C ATOM 116 ND1 HIS A 7 -21.389 -10.155 15.719 1.00 0.00 N ATOM 117 CD2 HIS A 7 -21.286 -9.346 13.693 1.00 0.00 C ATOM 118 CE1 HIS A 7 -21.788 -11.108 14.897 1.00 0.00 C ATOM 119 NE2 HIS A 7 -21.736 -10.644 13.663 1.00 0.00 N ATOM 0 H HIS A 7 -17.529 -8.597 15.355 1.00 0.00 H new ATOM 0 HA HIS A 7 -19.071 -7.627 14.089 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -20.549 -7.887 16.701 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -21.286 -6.962 15.408 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -21.137 -8.699 12.841 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -22.104 -12.100 15.186 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -21.989 -11.164 12.823 1.00 0.00 H new ATOM 128 N MET A 8 -18.671 -5.192 14.124 1.00 0.00 N ATOM 129 CA MET A 8 -18.501 -3.743 14.085 1.00 0.00 C ATOM 130 C MET A 8 -19.025 -3.171 12.772 1.00 0.00 C ATOM 131 O MET A 8 -19.615 -3.887 11.962 1.00 0.00 O ATOM 132 CB MET A 8 -17.026 -3.377 14.266 1.00 0.00 C ATOM 133 CG MET A 8 -16.714 -2.770 15.626 1.00 0.00 C ATOM 134 SD MET A 8 -15.724 -3.860 16.666 1.00 0.00 S ATOM 135 CE MET A 8 -14.096 -3.615 15.959 1.00 0.00 C ATOM 0 H MET A 8 -18.477 -5.663 13.240 1.00 0.00 H new ATOM 0 HA MET A 8 -19.077 -3.310 14.903 1.00 0.00 H new ATOM 0 HB2 MET A 8 -16.418 -4.271 14.128 1.00 0.00 H new ATOM 0 HB3 MET A 8 -16.737 -2.672 13.487 1.00 0.00 H new ATOM 0 HG2 MET A 8 -16.183 -1.828 15.486 1.00 0.00 H new ATOM 0 HG3 MET A 8 -17.648 -2.536 16.138 1.00 0.00 H new ATOM 0 HE1 MET A 8 -13.370 -4.225 16.497 1.00 0.00 H new ATOM 0 HE2 MET A 8 -14.108 -3.907 14.909 1.00 0.00 H new ATOM 0 HE3 MET A 8 -13.818 -2.564 16.041 1.00 0.00 H new ATOM 145 N SER A 9 -18.808 -1.875 12.568 1.00 0.00 N ATOM 146 CA SER A 9 -19.259 -1.208 11.353 1.00 0.00 C ATOM 147 C SER A 9 -18.442 0.053 11.089 1.00 0.00 C ATOM 148 O SER A 9 -18.220 0.862 11.991 1.00 0.00 O ATOM 149 CB SER A 9 -20.743 -0.854 11.460 1.00 0.00 C ATOM 150 OG SER A 9 -21.549 -2.020 11.422 1.00 0.00 O ATOM 0 H SER A 9 -18.323 -1.267 13.228 1.00 0.00 H new ATOM 0 HA SER A 9 -19.116 -1.894 10.518 1.00 0.00 H new ATOM 0 HB2 SER A 9 -20.925 -0.312 12.388 1.00 0.00 H new ATOM 0 HB3 SER A 9 -21.021 -0.189 10.643 1.00 0.00 H new ATOM 0 HG SER A 9 -20.979 -2.814 11.488 1.00 0.00 H new ATOM 156 N ASP A 10 -17.995 0.212 9.847 1.00 0.00 N ATOM 157 CA ASP A 10 -17.202 1.376 9.463 1.00 0.00 C ATOM 158 C ASP A 10 -16.969 1.399 7.956 1.00 0.00 C ATOM 159 O ASP A 10 -16.941 0.355 7.306 1.00 0.00 O ATOM 160 CB ASP A 10 -15.860 1.369 10.200 1.00 0.00 C ATOM 161 CG ASP A 10 -15.887 2.215 11.458 1.00 0.00 C ATOM 162 OD1 ASP A 10 -15.886 3.458 11.337 1.00 0.00 O ATOM 163 OD2 ASP A 10 -15.910 1.634 12.564 1.00 0.00 O ATOM 0 H ASP A 10 -18.168 -0.449 9.090 1.00 0.00 H new ATOM 0 HA ASP A 10 -17.756 2.273 9.741 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -15.597 0.344 10.460 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -15.081 1.739 9.534 1.00 0.00 H new ATOM 168 N GLY A 11 -16.803 2.598 7.405 1.00 0.00 N ATOM 169 CA GLY A 11 -16.574 2.733 5.979 1.00 0.00 C ATOM 170 C GLY A 11 -16.360 4.174 5.558 1.00 0.00 C ATOM 171 O GLY A 11 -16.621 5.097 6.329 1.00 0.00 O ATOM 0 H GLY A 11 -16.823 3.478 7.921 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -15.702 2.142 5.697 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -17.426 2.322 5.437 1.00 0.00 H new ATOM 175 N HIS A 12 -15.882 4.366 4.334 1.00 0.00 N ATOM 176 CA HIS A 12 -15.632 5.706 3.813 1.00 0.00 C ATOM 177 C HIS A 12 -15.251 5.656 2.337 1.00 0.00 C ATOM 178 O HIS A 12 -15.220 4.585 1.731 1.00 0.00 O ATOM 179 CB HIS A 12 -14.523 6.389 4.615 1.00 0.00 C ATOM 180 CG HIS A 12 -13.307 5.533 4.800 1.00 0.00 C ATOM 181 ND1 HIS A 12 -12.671 5.382 6.014 1.00 0.00 N ATOM 182 CD2 HIS A 12 -12.613 4.777 3.916 1.00 0.00 C ATOM 183 CE1 HIS A 12 -11.638 4.571 5.870 1.00 0.00 C ATOM 184 NE2 HIS A 12 -11.580 4.191 4.608 1.00 0.00 N ATOM 0 H HIS A 12 -15.660 3.612 3.684 1.00 0.00 H new ATOM 0 HA HIS A 12 -16.551 6.283 3.912 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -14.235 7.311 4.110 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -14.913 6.669 5.594 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -12.830 4.657 2.865 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -10.957 4.270 6.652 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -10.881 3.564 4.210 1.00 0.00 H new ATOM 193 N ASN A 13 -14.962 6.820 1.766 1.00 0.00 N ATOM 194 CA ASN A 13 -14.582 6.909 0.361 1.00 0.00 C ATOM 195 C ASN A 13 -13.286 7.697 0.196 1.00 0.00 C ATOM 196 O ASN A 13 -12.683 8.133 1.176 1.00 0.00 O ATOM 197 CB ASN A 13 -15.699 7.566 -0.452 1.00 0.00 C ATOM 198 CG ASN A 13 -16.867 6.632 -0.691 1.00 0.00 C ATOM 199 OD1 ASN A 13 -17.977 6.871 -0.218 1.00 0.00 O ATOM 200 ND2 ASN A 13 -16.621 5.556 -1.431 1.00 0.00 N ATOM 0 H ASN A 13 -14.984 7.715 2.254 1.00 0.00 H new ATOM 0 HA ASN A 13 -14.420 5.897 -0.010 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -16.050 8.455 0.071 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -15.300 7.897 -1.411 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -17.368 4.890 -1.626 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -15.685 5.397 -1.804 1.00 0.00 H new ATOM 207 N GLY A 14 -12.866 7.875 -1.052 1.00 0.00 N ATOM 208 CA GLY A 14 -11.644 8.610 -1.324 1.00 0.00 C ATOM 209 C GLY A 14 -10.458 7.693 -1.546 1.00 0.00 C ATOM 210 O GLY A 14 -9.789 7.291 -0.592 1.00 0.00 O ATOM 0 H GLY A 14 -13.349 7.524 -1.879 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -11.787 9.235 -2.206 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.432 9.279 -0.490 1.00 0.00 H new ATOM 214 N LEU A 15 -10.198 7.358 -2.806 1.00 0.00 N ATOM 215 CA LEU A 15 -9.086 6.480 -3.148 1.00 0.00 C ATOM 216 C LEU A 15 -8.724 6.608 -4.626 1.00 0.00 C ATOM 217 O LEU A 15 -9.229 7.490 -5.320 1.00 0.00 O ATOM 218 CB LEU A 15 -9.431 5.024 -2.809 1.00 0.00 C ATOM 219 CG LEU A 15 -10.849 4.575 -3.177 1.00 0.00 C ATOM 220 CD1 LEU A 15 -11.866 5.152 -2.204 1.00 0.00 C ATOM 221 CD2 LEU A 15 -11.190 4.975 -4.606 1.00 0.00 C ATOM 0 H LEU A 15 -10.742 7.681 -3.606 1.00 0.00 H new ATOM 0 HA LEU A 15 -8.221 6.783 -2.558 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -8.720 4.373 -3.318 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -9.289 4.876 -1.738 1.00 0.00 H new ATOM 0 HG LEU A 15 -10.887 3.488 -3.109 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -12.866 4.821 -2.484 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -11.639 4.809 -1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -11.823 6.241 -2.235 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -12.201 4.646 -4.845 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -11.128 6.059 -4.705 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -10.485 4.507 -5.293 1.00 0.00 H new ATOM 233 N GLY A 16 -7.844 5.723 -5.094 1.00 0.00 N ATOM 234 CA GLY A 16 -7.411 5.735 -6.487 1.00 0.00 C ATOM 235 C GLY A 16 -8.538 6.014 -7.464 1.00 0.00 C ATOM 236 O GLY A 16 -9.222 5.094 -7.917 1.00 0.00 O ATOM 0 H GLY A 16 -7.418 4.990 -4.527 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.635 6.491 -6.613 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -6.960 4.772 -6.728 1.00 0.00 H new ATOM 240 N LYS A 17 -8.725 7.289 -7.791 1.00 0.00 N ATOM 241 CA LYS A 17 -9.767 7.703 -8.725 1.00 0.00 C ATOM 242 C LYS A 17 -9.166 8.534 -9.855 1.00 0.00 C ATOM 243 O LYS A 17 -9.301 9.757 -9.882 1.00 0.00 O ATOM 244 CB LYS A 17 -10.846 8.509 -7.997 1.00 0.00 C ATOM 245 CG LYS A 17 -11.931 7.647 -7.371 1.00 0.00 C ATOM 246 CD LYS A 17 -13.153 8.473 -6.993 1.00 0.00 C ATOM 247 CE LYS A 17 -13.265 8.648 -5.486 1.00 0.00 C ATOM 248 NZ LYS A 17 -14.648 9.008 -5.070 1.00 0.00 N ATOM 0 H LYS A 17 -8.165 8.057 -7.421 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.224 6.810 -9.151 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -10.376 9.109 -7.218 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.306 9.203 -8.700 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -12.223 6.863 -8.070 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -11.537 7.152 -6.484 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.094 9.451 -7.470 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -14.053 7.988 -7.372 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -12.966 7.725 -4.990 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -12.574 9.424 -5.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -14.682 9.118 -4.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -14.925 9.902 -5.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -15.305 8.255 -5.360 1.00 0.00 H new ATOM 262 N GLY A 18 -8.492 7.856 -10.777 1.00 0.00 N ATOM 263 CA GLY A 18 -7.864 8.537 -11.895 1.00 0.00 C ATOM 264 C GLY A 18 -6.567 7.869 -12.302 1.00 0.00 C ATOM 265 O GLY A 18 -6.170 7.923 -13.465 1.00 0.00 O ATOM 0 H GLY A 18 -8.369 6.843 -10.770 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.548 8.550 -12.743 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.670 9.575 -11.626 1.00 0.00 H new ATOM 269 N PHE A 19 -5.911 7.236 -11.333 1.00 0.00 N ATOM 270 CA PHE A 19 -4.648 6.546 -11.575 1.00 0.00 C ATOM 271 C PHE A 19 -4.865 5.308 -12.435 1.00 0.00 C ATOM 272 O PHE A 19 -4.193 5.116 -13.449 1.00 0.00 O ATOM 273 CB PHE A 19 -3.997 6.152 -10.246 1.00 0.00 C ATOM 274 CG PHE A 19 -4.183 7.177 -9.161 1.00 0.00 C ATOM 275 CD1 PHE A 19 -4.218 8.528 -9.466 1.00 0.00 C ATOM 276 CD2 PHE A 19 -4.330 6.787 -7.841 1.00 0.00 C ATOM 277 CE1 PHE A 19 -4.395 9.472 -8.472 1.00 0.00 C ATOM 278 CE2 PHE A 19 -4.507 7.725 -6.842 1.00 0.00 C ATOM 279 CZ PHE A 19 -4.540 9.069 -7.159 1.00 0.00 C ATOM 0 H PHE A 19 -6.236 7.187 -10.367 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.984 7.226 -12.109 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.415 5.202 -9.913 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.931 5.993 -10.406 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.106 8.847 -10.492 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.306 5.737 -7.589 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -4.420 10.522 -8.722 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -4.619 7.408 -5.816 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.679 9.804 -6.380 1.00 0.00 H new ATOM 289 N GLY A 20 -5.808 4.472 -12.022 1.00 0.00 N ATOM 290 CA GLY A 20 -6.102 3.263 -12.763 1.00 0.00 C ATOM 291 C GLY A 20 -7.544 2.835 -12.615 1.00 0.00 C ATOM 292 O GLY A 20 -8.402 3.207 -13.417 1.00 0.00 O ATOM 0 H GLY A 20 -6.375 4.610 -11.186 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.879 3.423 -13.818 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -5.450 2.461 -12.418 1.00 0.00 H new ATOM 296 N ASP A 21 -7.803 2.044 -11.579 1.00 0.00 N ATOM 297 CA ASP A 21 -9.138 1.537 -11.295 1.00 0.00 C ATOM 298 C ASP A 21 -9.088 0.587 -10.095 1.00 0.00 C ATOM 299 O ASP A 21 -8.311 0.803 -9.164 1.00 0.00 O ATOM 300 CB ASP A 21 -9.709 0.824 -12.528 1.00 0.00 C ATOM 301 CG ASP A 21 -11.212 0.986 -12.644 1.00 0.00 C ATOM 302 OD1 ASP A 21 -11.907 0.827 -11.618 1.00 0.00 O ATOM 303 OD2 ASP A 21 -11.695 1.273 -13.760 1.00 0.00 O ATOM 0 H ASP A 21 -7.093 1.737 -10.914 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.793 2.373 -11.051 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -9.233 1.219 -13.426 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -9.463 -0.237 -12.477 1.00 0.00 H new ATOM 308 N HIS A 22 -9.901 -0.465 -10.119 1.00 0.00 N ATOM 309 CA HIS A 22 -9.920 -1.438 -9.031 1.00 0.00 C ATOM 310 C HIS A 22 -8.563 -2.119 -8.915 1.00 0.00 C ATOM 311 O HIS A 22 -8.341 -3.184 -9.490 1.00 0.00 O ATOM 312 CB HIS A 22 -11.007 -2.485 -9.277 1.00 0.00 C ATOM 313 CG HIS A 22 -10.937 -3.113 -10.632 1.00 0.00 C ATOM 314 ND1 HIS A 22 -11.537 -2.568 -11.747 1.00 0.00 N ATOM 315 CD2 HIS A 22 -10.334 -4.251 -11.052 1.00 0.00 C ATOM 316 CE1 HIS A 22 -11.310 -3.343 -12.793 1.00 0.00 C ATOM 317 NE2 HIS A 22 -10.580 -4.370 -12.397 1.00 0.00 N ATOM 0 H HIS A 22 -10.553 -0.665 -10.877 1.00 0.00 H new ATOM 0 HA HIS A 22 -10.137 -0.916 -8.099 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -10.927 -3.265 -8.520 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.984 -2.019 -9.152 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -9.765 -4.937 -10.442 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -11.661 -3.167 -13.799 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -10.252 -5.129 -12.994 1.00 0.00 H new ATOM 326 N ILE A 23 -7.649 -1.485 -8.189 1.00 0.00 N ATOM 327 CA ILE A 23 -6.303 -2.018 -8.027 1.00 0.00 C ATOM 328 C ILE A 23 -5.839 -1.937 -6.556 1.00 0.00 C ATOM 329 O ILE A 23 -6.321 -2.700 -5.703 1.00 0.00 O ATOM 330 CB ILE A 23 -5.326 -1.268 -8.968 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.711 -1.501 -10.433 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.887 -1.692 -8.732 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.734 -0.234 -11.260 1.00 0.00 C ATOM 0 H ILE A 23 -7.816 -0.603 -7.704 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.311 -3.073 -8.301 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.403 -0.204 -8.743 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -5.006 -2.203 -10.878 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.695 -1.969 -10.472 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.231 -1.145 -9.409 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.608 -1.473 -7.701 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.788 -2.762 -8.916 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.014 -0.474 -12.286 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.459 0.462 -10.839 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.745 0.224 -11.252 1.00 0.00 H new ATOM 345 N HIS A 24 -4.921 -1.012 -6.249 1.00 0.00 N ATOM 346 CA HIS A 24 -4.430 -0.859 -4.887 1.00 0.00 C ATOM 347 C HIS A 24 -5.332 0.077 -4.086 1.00 0.00 C ATOM 348 O HIS A 24 -4.944 0.572 -3.031 1.00 0.00 O ATOM 349 CB HIS A 24 -2.989 -0.344 -4.877 1.00 0.00 C ATOM 350 CG HIS A 24 -2.121 -0.969 -5.924 1.00 0.00 C ATOM 351 ND1 HIS A 24 -2.321 -2.248 -6.397 1.00 0.00 N ATOM 352 CD2 HIS A 24 -1.048 -0.486 -6.591 1.00 0.00 C ATOM 353 CE1 HIS A 24 -1.409 -2.526 -7.310 1.00 0.00 C ATOM 354 NE2 HIS A 24 -0.625 -1.474 -7.447 1.00 0.00 N ATOM 0 H HIS A 24 -4.510 -0.367 -6.924 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.446 -1.842 -4.416 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -2.997 0.736 -5.022 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.552 -0.531 -3.896 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.607 0.493 -6.473 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -1.320 -3.456 -7.852 1.00 0.00 H new ATOM 0 HE2 HIS A 24 0.167 -1.405 -8.085 1.00 0.00 H new ATOM 363 N TRP A 25 -6.542 0.307 -4.599 1.00 0.00 N ATOM 364 CA TRP A 25 -7.513 1.175 -3.940 1.00 0.00 C ATOM 365 C TRP A 25 -8.920 0.610 -4.030 1.00 0.00 C ATOM 366 O TRP A 25 -9.856 1.195 -3.486 1.00 0.00 O ATOM 367 CB TRP A 25 -7.512 2.561 -4.569 1.00 0.00 C ATOM 368 CG TRP A 25 -6.943 2.580 -5.946 1.00 0.00 C ATOM 369 CD1 TRP A 25 -7.633 2.560 -7.119 1.00 0.00 C ATOM 370 CD2 TRP A 25 -5.561 2.617 -6.289 1.00 0.00 C ATOM 371 NE1 TRP A 25 -6.758 2.600 -8.172 1.00 0.00 N ATOM 372 CE2 TRP A 25 -5.478 2.636 -7.689 1.00 0.00 C ATOM 373 CE3 TRP A 25 -4.389 2.643 -5.545 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.258 2.681 -8.360 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.181 2.688 -6.202 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.120 2.709 -7.599 1.00 0.00 C ATOM 0 H TRP A 25 -6.872 -0.100 -5.474 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.218 1.239 -2.893 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.534 2.940 -4.600 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -6.939 3.240 -3.937 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.709 2.519 -7.206 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.019 2.603 -9.158 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.425 2.628 -4.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.212 2.693 -9.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.265 2.707 -5.630 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.157 2.748 -8.087 1.00 0.00 H new ATOM 387 N ARG A 26 -9.076 -0.517 -4.721 1.00 0.00 N ATOM 388 CA ARG A 26 -10.391 -1.134 -4.871 1.00 0.00 C ATOM 389 C ARG A 26 -11.209 -1.008 -3.574 1.00 0.00 C ATOM 390 O ARG A 26 -12.401 -0.704 -3.618 1.00 0.00 O ATOM 391 CB ARG A 26 -10.234 -2.604 -5.266 1.00 0.00 C ATOM 392 CG ARG A 26 -11.497 -3.443 -5.164 1.00 0.00 C ATOM 393 CD ARG A 26 -12.558 -2.989 -6.141 1.00 0.00 C ATOM 394 NE ARG A 26 -13.334 -1.858 -5.636 1.00 0.00 N ATOM 395 CZ ARG A 26 -14.635 -1.908 -5.352 1.00 0.00 C ATOM 396 NH1 ARG A 26 -15.322 -3.036 -5.502 1.00 0.00 N ATOM 397 NH2 ARG A 26 -15.254 -0.821 -4.909 1.00 0.00 N ATOM 0 H ARG A 26 -8.316 -1.017 -5.182 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.932 -0.611 -5.660 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -9.869 -2.650 -6.292 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -9.467 -3.053 -4.634 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.254 -4.489 -5.353 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.890 -3.385 -4.149 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -12.085 -2.710 -7.083 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -13.230 -3.820 -6.356 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.848 -0.973 -5.492 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -14.854 -3.877 -5.838 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.317 -3.060 -5.281 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -14.734 0.048 -4.787 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -16.250 -0.855 -4.690 1.00 0.00 H new ATOM 411 N THR A 27 -10.553 -1.223 -2.420 1.00 0.00 N ATOM 412 CA THR A 27 -11.209 -1.121 -1.107 1.00 0.00 C ATOM 413 C THR A 27 -10.451 -1.930 -0.059 1.00 0.00 C ATOM 414 O THR A 27 -9.981 -3.033 -0.332 1.00 0.00 O ATOM 415 CB THR A 27 -12.665 -1.599 -1.162 1.00 0.00 C ATOM 416 OG1 THR A 27 -13.165 -1.826 0.144 1.00 0.00 O ATOM 417 CG2 THR A 27 -12.848 -2.877 -1.949 1.00 0.00 C ATOM 0 H THR A 27 -9.564 -1.470 -2.372 1.00 0.00 H new ATOM 0 HA THR A 27 -11.201 -0.067 -0.828 1.00 0.00 H new ATOM 0 HB THR A 27 -13.212 -0.801 -1.665 1.00 0.00 H new ATOM 0 HG1 THR A 27 -14.096 -2.129 0.090 1.00 0.00 H new ATOM 0 HG21 THR A 27 -13.901 -3.158 -1.947 1.00 0.00 H new ATOM 0 HG22 THR A 27 -12.515 -2.723 -2.975 1.00 0.00 H new ATOM 0 HG23 THR A 27 -12.260 -3.673 -1.492 1.00 0.00 H new ATOM 425 N LEU A 28 -10.341 -1.382 1.145 1.00 0.00 N ATOM 426 CA LEU A 28 -9.642 -2.061 2.230 1.00 0.00 C ATOM 427 C LEU A 28 -10.469 -3.227 2.762 1.00 0.00 C ATOM 428 O LEU A 28 -9.923 -4.236 3.207 1.00 0.00 O ATOM 429 CB LEU A 28 -9.336 -1.080 3.363 1.00 0.00 C ATOM 430 CG LEU A 28 -8.346 -1.591 4.411 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.745 -0.428 5.185 1.00 0.00 C ATOM 432 CD2 LEU A 28 -9.028 -2.568 5.357 1.00 0.00 C ATOM 0 H LEU A 28 -10.726 -0.471 1.395 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.704 -2.452 1.836 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.942 -0.160 2.931 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.270 -0.822 3.862 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.540 -2.116 3.898 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -7.043 -0.809 5.927 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.221 0.235 4.497 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.539 0.124 5.687 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.309 -2.921 6.096 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.853 -2.068 5.864 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.412 -3.416 4.790 1.00 0.00 H new ATOM 444 N GLU A 29 -11.789 -3.081 2.715 1.00 0.00 N ATOM 445 CA GLU A 29 -12.689 -4.123 3.193 1.00 0.00 C ATOM 446 C GLU A 29 -12.517 -5.406 2.386 1.00 0.00 C ATOM 447 O GLU A 29 -12.068 -6.426 2.911 1.00 0.00 O ATOM 448 CB GLU A 29 -14.141 -3.646 3.118 1.00 0.00 C ATOM 449 CG GLU A 29 -14.896 -3.790 4.429 1.00 0.00 C ATOM 450 CD GLU A 29 -16.399 -3.830 4.234 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.989 -2.765 3.953 1.00 0.00 O ATOM 452 OE2 GLU A 29 -16.985 -4.925 4.361 1.00 0.00 O ATOM 0 H GLU A 29 -12.258 -2.252 2.351 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.438 -4.336 4.232 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -14.156 -2.600 2.813 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.661 -4.211 2.345 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.574 -4.702 4.931 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -14.640 -2.958 5.085 1.00 0.00 H new ATOM 459 N ASP A 30 -12.875 -5.350 1.106 1.00 0.00 N ATOM 460 CA ASP A 30 -12.760 -6.509 0.227 1.00 0.00 C ATOM 461 C ASP A 30 -11.328 -7.033 0.200 1.00 0.00 C ATOM 462 O ASP A 30 -11.098 -8.231 0.035 1.00 0.00 O ATOM 463 CB ASP A 30 -13.207 -6.149 -1.191 1.00 0.00 C ATOM 464 CG ASP A 30 -14.669 -5.751 -1.252 1.00 0.00 C ATOM 465 OD1 ASP A 30 -15.162 -5.147 -0.275 1.00 0.00 O ATOM 466 OD2 ASP A 30 -15.323 -6.047 -2.274 1.00 0.00 O ATOM 0 H ASP A 30 -13.247 -4.514 0.655 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.409 -7.293 0.618 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -12.594 -5.329 -1.565 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -13.037 -7.001 -1.850 1.00 0.00 H new ATOM 471 N GLY A 31 -10.368 -6.129 0.364 1.00 0.00 N ATOM 472 CA GLY A 31 -8.972 -6.520 0.356 1.00 0.00 C ATOM 473 C GLY A 31 -8.611 -7.398 1.537 1.00 0.00 C ATOM 474 O GLY A 31 -7.781 -8.297 1.419 1.00 0.00 O ATOM 0 H GLY A 31 -10.533 -5.132 0.502 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.752 -7.052 -0.569 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.347 -5.627 0.366 1.00 0.00 H new ATOM 478 N LYS A 32 -9.235 -7.137 2.681 1.00 0.00 N ATOM 479 CA LYS A 32 -8.972 -7.913 3.888 1.00 0.00 C ATOM 480 C LYS A 32 -9.572 -9.312 3.778 1.00 0.00 C ATOM 481 O LYS A 32 -8.927 -10.303 4.118 1.00 0.00 O ATOM 482 CB LYS A 32 -9.539 -7.196 5.114 1.00 0.00 C ATOM 483 CG LYS A 32 -8.837 -7.564 6.412 1.00 0.00 C ATOM 484 CD LYS A 32 -9.789 -8.224 7.397 1.00 0.00 C ATOM 485 CE LYS A 32 -10.658 -7.196 8.107 1.00 0.00 C ATOM 486 NZ LYS A 32 -12.064 -7.665 8.260 1.00 0.00 N ATOM 0 H LYS A 32 -9.925 -6.395 2.798 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.892 -8.009 4.000 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.464 -6.119 4.962 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -10.599 -7.432 5.204 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.008 -8.239 6.199 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -8.411 -6.668 6.862 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.424 -8.936 6.870 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -9.218 -8.790 8.133 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -10.238 -6.983 9.090 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.646 -6.262 7.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.622 -6.936 8.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.474 -7.844 7.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.078 -8.543 8.817 1.00 0.00 H new ATOM 500 N LYS A 33 -10.812 -9.382 3.303 1.00 0.00 N ATOM 501 CA LYS A 33 -11.501 -10.659 3.148 1.00 0.00 C ATOM 502 C LYS A 33 -10.849 -11.502 2.055 1.00 0.00 C ATOM 503 O LYS A 33 -10.688 -12.712 2.204 1.00 0.00 O ATOM 504 CB LYS A 33 -12.976 -10.429 2.820 1.00 0.00 C ATOM 505 CG LYS A 33 -13.819 -11.693 2.886 1.00 0.00 C ATOM 506 CD LYS A 33 -15.090 -11.555 2.063 1.00 0.00 C ATOM 507 CE LYS A 33 -14.941 -12.206 0.697 1.00 0.00 C ATOM 508 NZ LYS A 33 -16.250 -12.331 -0.004 1.00 0.00 N ATOM 0 H LYS A 33 -11.360 -8.570 3.019 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.426 -11.200 4.091 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.384 -9.694 3.514 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -13.055 -10.002 1.820 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -13.237 -12.540 2.521 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.077 -11.907 3.923 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.922 -12.013 2.597 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -15.333 -10.499 1.940 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.257 -11.617 0.086 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.495 -13.194 0.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.106 -12.779 -0.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -16.895 -12.915 0.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -16.664 -11.386 -0.137 1.00 0.00 H new ATOM 522 N GLU A 34 -10.480 -10.852 0.955 1.00 0.00 N ATOM 523 CA GLU A 34 -9.851 -11.541 -0.164 1.00 0.00 C ATOM 524 C GLU A 34 -8.414 -11.928 0.169 1.00 0.00 C ATOM 525 O GLU A 34 -7.998 -13.063 -0.057 1.00 0.00 O ATOM 526 CB GLU A 34 -9.876 -10.657 -1.412 1.00 0.00 C ATOM 527 CG GLU A 34 -9.533 -11.406 -2.689 1.00 0.00 C ATOM 528 CD GLU A 34 -10.508 -11.117 -3.814 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.391 -10.042 -4.440 1.00 0.00 O ATOM 530 OE2 GLU A 34 -11.388 -11.965 -4.070 1.00 0.00 O ATOM 0 H GLU A 34 -10.606 -9.849 0.816 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.416 -12.452 -0.359 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.867 -10.214 -1.514 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.171 -9.836 -1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.526 -11.134 -3.006 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.524 -12.477 -2.487 1.00 0.00 H new ATOM 537 N ALA A 35 -7.660 -10.975 0.710 1.00 0.00 N ATOM 538 CA ALA A 35 -6.266 -11.217 1.077 1.00 0.00 C ATOM 539 C ALA A 35 -6.142 -12.432 1.990 1.00 0.00 C ATOM 540 O ALA A 35 -5.110 -13.104 2.005 1.00 0.00 O ATOM 541 CB ALA A 35 -5.675 -9.988 1.750 1.00 0.00 C ATOM 0 H ALA A 35 -7.989 -10.029 0.904 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.707 -11.421 0.164 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.637 -10.184 2.017 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.720 -9.141 1.065 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.244 -9.757 2.650 1.00 0.00 H new ATOM 547 N ALA A 36 -7.199 -12.708 2.746 1.00 0.00 N ATOM 548 CA ALA A 36 -7.211 -13.842 3.661 1.00 0.00 C ATOM 549 C ALA A 36 -7.158 -15.162 2.898 1.00 0.00 C ATOM 550 O ALA A 36 -6.381 -16.055 3.237 1.00 0.00 O ATOM 551 CB ALA A 36 -8.447 -13.790 4.546 1.00 0.00 C ATOM 0 H ALA A 36 -8.060 -12.161 2.743 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.324 -13.781 4.291 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.444 -14.643 5.225 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.442 -12.866 5.124 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -9.342 -13.824 3.924 1.00 0.00 H new ATOM 557 N ALA A 37 -7.988 -15.279 1.865 1.00 0.00 N ATOM 558 CA ALA A 37 -8.033 -16.490 1.054 1.00 0.00 C ATOM 559 C ALA A 37 -6.664 -16.797 0.457 1.00 0.00 C ATOM 560 O ALA A 37 -6.007 -17.760 0.850 1.00 0.00 O ATOM 561 CB ALA A 37 -9.073 -16.350 -0.048 1.00 0.00 C ATOM 0 H ALA A 37 -8.638 -14.550 1.571 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.316 -17.322 1.699 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.095 -17.262 -0.645 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -10.054 -16.183 0.397 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.816 -15.505 -0.686 1.00 0.00 H new ATOM 567 N SER A 38 -6.236 -15.969 -0.491 1.00 0.00 N ATOM 568 CA SER A 38 -4.942 -16.150 -1.134 1.00 0.00 C ATOM 569 C SER A 38 -3.812 -16.000 -0.120 1.00 0.00 C ATOM 570 O SER A 38 -2.769 -16.643 -0.236 1.00 0.00 O ATOM 571 CB SER A 38 -4.765 -15.139 -2.267 1.00 0.00 C ATOM 572 OG SER A 38 -5.715 -15.358 -3.296 1.00 0.00 O ATOM 0 H SER A 38 -6.767 -15.167 -0.830 1.00 0.00 H new ATOM 0 HA SER A 38 -4.905 -17.157 -1.550 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.873 -14.127 -1.877 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.757 -15.217 -2.675 1.00 0.00 H new ATOM 0 HG SER A 38 -5.583 -14.698 -4.009 1.00 0.00 H new ATOM 578 N GLY A 39 -4.036 -15.151 0.878 1.00 0.00 N ATOM 579 CA GLY A 39 -3.037 -14.931 1.906 1.00 0.00 C ATOM 580 C GLY A 39 -1.900 -14.043 1.442 1.00 0.00 C ATOM 581 O GLY A 39 -0.742 -14.281 1.785 1.00 0.00 O ATOM 0 H GLY A 39 -4.894 -14.611 0.993 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.512 -14.479 2.777 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.634 -15.892 2.226 1.00 0.00 H new ATOM 585 N LEU A 40 -2.225 -13.009 0.671 1.00 0.00 N ATOM 586 CA LEU A 40 -1.210 -12.086 0.179 1.00 0.00 C ATOM 587 C LEU A 40 -1.232 -10.784 0.975 1.00 0.00 C ATOM 588 O LEU A 40 -2.231 -10.456 1.612 1.00 0.00 O ATOM 589 CB LEU A 40 -1.404 -11.796 -1.313 1.00 0.00 C ATOM 590 CG LEU A 40 -2.824 -11.418 -1.745 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.249 -10.108 -1.105 1.00 0.00 C ATOM 592 CD2 LEU A 40 -2.910 -11.328 -3.262 1.00 0.00 C ATOM 0 H LEU A 40 -3.177 -12.791 0.376 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.238 -12.561 0.312 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.732 -10.986 -1.596 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.096 -12.677 -1.877 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.506 -12.198 -1.406 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.260 -9.858 -1.425 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.226 -10.209 -0.020 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.566 -9.315 -1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.925 -11.059 -3.554 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.216 -10.569 -3.621 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.651 -12.292 -3.699 1.00 0.00 H new ATOM 604 N PRO A 41 -0.122 -10.024 0.956 1.00 0.00 N ATOM 605 CA PRO A 41 -0.024 -8.756 1.684 1.00 0.00 C ATOM 606 C PRO A 41 -0.949 -7.684 1.124 1.00 0.00 C ATOM 607 O PRO A 41 -1.455 -7.793 0.003 1.00 0.00 O ATOM 608 CB PRO A 41 1.441 -8.348 1.501 1.00 0.00 C ATOM 609 CG PRO A 41 1.871 -9.038 0.257 1.00 0.00 C ATOM 610 CD PRO A 41 1.123 -10.339 0.229 1.00 0.00 C ATOM 0 HA PRO A 41 -0.323 -8.867 2.726 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.543 -7.267 1.410 1.00 0.00 H new ATOM 0 HB3 PRO A 41 2.047 -8.654 2.354 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.642 -8.437 -0.623 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.948 -9.206 0.256 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.922 -10.667 -0.791 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.683 -11.137 0.716 1.00 0.00 H new ATOM 618 N LEU A 42 -1.170 -6.642 1.909 1.00 0.00 N ATOM 619 CA LEU A 42 -2.035 -5.556 1.487 1.00 0.00 C ATOM 620 C LEU A 42 -1.233 -4.458 0.797 1.00 0.00 C ATOM 621 O LEU A 42 -0.095 -4.163 1.173 1.00 0.00 O ATOM 622 CB LEU A 42 -2.805 -4.989 2.682 1.00 0.00 C ATOM 623 CG LEU A 42 -4.211 -5.561 2.877 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.175 -7.083 2.876 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.824 -5.041 4.169 1.00 0.00 C ATOM 0 H LEU A 42 -0.764 -6.527 2.837 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.753 -5.953 0.769 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.226 -5.172 3.587 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.882 -3.908 2.565 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.834 -5.233 2.045 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.184 -7.471 3.016 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.779 -7.437 1.924 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.536 -7.432 3.687 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.824 -5.458 4.291 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.201 -5.338 5.013 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.887 -3.954 4.130 1.00 0.00 H new ATOM 637 N MET A 43 -1.843 -3.866 -0.221 1.00 0.00 N ATOM 638 CA MET A 43 -1.215 -2.799 -0.985 1.00 0.00 C ATOM 639 C MET A 43 -1.636 -1.442 -0.429 1.00 0.00 C ATOM 640 O MET A 43 -2.662 -0.892 -0.829 1.00 0.00 O ATOM 641 CB MET A 43 -1.610 -2.929 -2.462 1.00 0.00 C ATOM 642 CG MET A 43 -0.537 -2.444 -3.424 1.00 0.00 C ATOM 643 SD MET A 43 -0.021 -0.751 -3.098 1.00 0.00 S ATOM 644 CE MET A 43 1.332 -1.024 -1.958 1.00 0.00 C ATOM 0 H MET A 43 -2.781 -4.111 -0.538 1.00 0.00 H new ATOM 0 HA MET A 43 -0.131 -2.879 -0.903 1.00 0.00 H new ATOM 0 HB2 MET A 43 -1.835 -3.973 -2.679 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.525 -2.363 -2.636 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.329 -3.102 -3.357 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.912 -2.514 -4.445 1.00 0.00 H new ATOM 0 HE1 MET A 43 1.084 -0.592 -0.989 1.00 0.00 H new ATOM 0 HE2 MET A 43 1.502 -2.095 -1.845 1.00 0.00 H new ATOM 0 HE3 MET A 43 2.235 -0.552 -2.345 1.00 0.00 H new ATOM 654 N VAL A 44 -0.853 -0.913 0.513 1.00 0.00 N ATOM 655 CA VAL A 44 -1.174 0.367 1.132 1.00 0.00 C ATOM 656 C VAL A 44 -0.602 1.543 0.354 1.00 0.00 C ATOM 657 O VAL A 44 0.548 1.521 -0.084 1.00 0.00 O ATOM 658 CB VAL A 44 -0.675 0.439 2.587 1.00 0.00 C ATOM 659 CG1 VAL A 44 -0.998 1.793 3.204 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.282 -0.680 3.410 1.00 0.00 C ATOM 0 H VAL A 44 0.001 -1.350 0.860 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.262 0.436 1.121 1.00 0.00 H new ATOM 0 HB VAL A 44 0.408 0.318 2.583 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.636 1.820 4.232 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.513 2.581 2.627 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.077 1.949 3.195 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.919 -0.615 4.436 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.368 -0.589 3.403 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.996 -1.642 2.984 1.00 0.00 H new ATOM 670 N ILE A 45 -1.421 2.576 0.210 1.00 0.00 N ATOM 671 CA ILE A 45 -1.029 3.790 -0.487 1.00 0.00 C ATOM 672 C ILE A 45 -1.908 4.950 -0.042 1.00 0.00 C ATOM 673 O ILE A 45 -3.120 4.933 -0.241 1.00 0.00 O ATOM 674 CB ILE A 45 -1.141 3.645 -2.019 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.345 2.433 -2.501 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.666 4.917 -2.712 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.357 2.258 -4.005 1.00 0.00 C ATOM 0 H ILE A 45 -2.374 2.595 0.573 1.00 0.00 H new ATOM 0 HA ILE A 45 0.015 3.979 -0.236 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.188 3.489 -2.277 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.687 2.529 -2.163 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.750 1.534 -2.036 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.752 4.797 -3.792 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.281 5.758 -2.390 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.375 5.107 -2.450 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.228 1.378 -4.274 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.384 2.130 -4.348 1.00 0.00 H new ATOM 0 HD13 ILE A 45 0.076 3.140 -4.477 1.00 0.00 H new ATOM 689 N ILE A 46 -1.299 5.955 0.562 1.00 0.00 N ATOM 690 CA ILE A 46 -2.046 7.113 1.020 1.00 0.00 C ATOM 691 C ILE A 46 -1.646 8.339 0.218 1.00 0.00 C ATOM 692 O ILE A 46 -0.540 8.854 0.359 1.00 0.00 O ATOM 693 CB ILE A 46 -1.826 7.362 2.522 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.187 6.107 3.313 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.648 8.548 3.004 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.298 5.880 4.513 1.00 0.00 C ATOM 0 H ILE A 46 -0.296 5.993 0.746 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.107 6.915 0.867 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.774 7.596 2.684 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.222 6.181 3.646 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.125 5.241 2.655 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.474 8.702 4.069 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.353 9.442 2.455 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.706 8.350 2.834 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.609 4.972 5.030 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.264 5.774 4.185 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.379 6.729 5.191 1.00 0.00 H new ATOM 708 N HIS A 47 -2.548 8.786 -0.641 1.00 0.00 N ATOM 709 CA HIS A 47 -2.287 9.941 -1.489 1.00 0.00 C ATOM 710 C HIS A 47 -2.737 11.228 -0.815 1.00 0.00 C ATOM 711 O HIS A 47 -3.897 11.624 -0.927 1.00 0.00 O ATOM 712 CB HIS A 47 -2.983 9.776 -2.845 1.00 0.00 C ATOM 713 CG HIS A 47 -4.481 9.729 -2.769 1.00 0.00 C ATOM 714 ND1 HIS A 47 -5.320 8.874 -2.132 1.00 0.00 N flip ATOM 715 CD2 HIS A 47 -5.289 10.634 -3.424 1.00 0.00 C flip ATOM 716 CE1 HIS A 47 -6.604 9.276 -2.414 1.00 0.00 C flip ATOM 717 NE2 HIS A 47 -6.555 10.340 -3.195 1.00 0.00 N flip ATOM 0 H HIS A 47 -3.469 8.367 -0.770 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.211 10.004 -1.652 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.690 10.601 -3.494 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.626 8.859 -3.314 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.940 11.456 -4.031 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -7.505 8.800 -2.056 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -7.360 10.849 -3.560 1.00 0.00 H new ATOM 726 N LYS A 48 -1.816 11.882 -0.111 1.00 0.00 N ATOM 727 CA LYS A 48 -2.149 13.128 0.578 1.00 0.00 C ATOM 728 C LYS A 48 -1.466 14.329 -0.071 1.00 0.00 C ATOM 729 O LYS A 48 -0.408 14.198 -0.690 1.00 0.00 O ATOM 730 CB LYS A 48 -1.757 13.040 2.052 1.00 0.00 C ATOM 731 CG LYS A 48 -2.941 12.890 2.993 1.00 0.00 C ATOM 732 CD LYS A 48 -2.634 13.449 4.372 1.00 0.00 C ATOM 733 CE LYS A 48 -3.907 13.771 5.136 1.00 0.00 C ATOM 734 NZ LYS A 48 -4.255 15.215 5.052 1.00 0.00 N ATOM 0 H LYS A 48 -0.849 11.577 -0.003 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.227 13.270 0.499 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.085 12.193 2.190 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.199 13.936 2.324 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.806 13.405 2.575 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.208 11.837 3.078 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.043 12.727 4.935 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -2.029 14.350 4.274 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.729 13.176 4.739 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -3.784 13.487 6.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.129 15.393 5.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -3.482 15.782 5.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.397 15.480 4.057 1.00 0.00 H new ATOM 748 N SER A 49 -2.083 15.499 0.080 1.00 0.00 N ATOM 749 CA SER A 49 -1.546 16.735 -0.483 1.00 0.00 C ATOM 750 C SER A 49 -1.313 16.601 -1.985 1.00 0.00 C ATOM 751 O SER A 49 -1.617 15.566 -2.579 1.00 0.00 O ATOM 752 CB SER A 49 -0.240 17.116 0.218 1.00 0.00 C ATOM 753 OG SER A 49 -0.461 18.120 1.194 1.00 0.00 O ATOM 0 H SER A 49 -2.959 15.617 0.590 1.00 0.00 H new ATOM 0 HA SER A 49 -2.281 17.524 -0.321 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.194 16.235 0.690 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.481 17.472 -0.518 1.00 0.00 H new ATOM 0 HG SER A 49 0.184 18.847 1.067 1.00 0.00 H new ATOM 759 N TRP A 50 -0.773 17.654 -2.589 1.00 0.00 N ATOM 760 CA TRP A 50 -0.494 17.656 -4.022 1.00 0.00 C ATOM 761 C TRP A 50 0.593 16.643 -4.357 1.00 0.00 C ATOM 762 O TRP A 50 1.736 17.005 -4.629 1.00 0.00 O ATOM 763 CB TRP A 50 -0.075 19.055 -4.487 1.00 0.00 C ATOM 764 CG TRP A 50 1.111 19.602 -3.751 1.00 0.00 C ATOM 765 CD1 TRP A 50 1.116 20.164 -2.508 1.00 0.00 C ATOM 766 CD2 TRP A 50 2.465 19.647 -4.217 1.00 0.00 C ATOM 767 NE1 TRP A 50 2.390 20.550 -2.168 1.00 0.00 N ATOM 768 CE2 TRP A 50 3.236 20.244 -3.203 1.00 0.00 C ATOM 769 CE3 TRP A 50 3.102 19.238 -5.393 1.00 0.00 C ATOM 770 CZ2 TRP A 50 4.608 20.443 -3.327 1.00 0.00 C ATOM 771 CZ3 TRP A 50 4.464 19.434 -5.516 1.00 0.00 C ATOM 772 CH2 TRP A 50 5.205 20.032 -4.488 1.00 0.00 C ATOM 0 H TRP A 50 -0.519 18.518 -2.109 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.406 17.374 -4.547 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.153 19.022 -5.552 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -0.916 19.737 -4.362 1.00 0.00 H new ATOM 0 HD1 TRP A 50 0.245 20.288 -1.882 1.00 0.00 H new ATOM 0 HE1 TRP A 50 2.662 20.992 -1.290 1.00 0.00 H new ATOM 0 HE3 TRP A 50 2.539 18.777 -6.191 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 5.180 20.905 -2.536 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 4.966 19.121 -6.420 1.00 0.00 H new ATOM 0 HH2 TRP A 50 6.268 20.171 -4.614 1.00 0.00 H new ATOM 783 N CYS A 51 0.223 15.368 -4.324 1.00 0.00 N ATOM 784 CA CYS A 51 1.159 14.291 -4.612 1.00 0.00 C ATOM 785 C CYS A 51 1.303 14.075 -6.116 1.00 0.00 C ATOM 786 O CYS A 51 0.404 13.537 -6.762 1.00 0.00 O ATOM 787 CB CYS A 51 0.686 12.995 -3.951 1.00 0.00 C ATOM 788 SG CYS A 51 -1.013 12.510 -4.404 1.00 0.00 S ATOM 0 H CYS A 51 -0.722 15.056 -4.100 1.00 0.00 H new ATOM 0 HA CYS A 51 2.132 14.573 -4.209 1.00 0.00 H new ATOM 0 HB2 CYS A 51 1.368 12.190 -4.224 1.00 0.00 H new ATOM 0 HB3 CYS A 51 0.744 13.109 -2.869 1.00 0.00 H new ATOM 793 N GLY A 52 2.440 14.489 -6.669 1.00 0.00 N ATOM 794 CA GLY A 52 2.670 14.316 -8.093 1.00 0.00 C ATOM 795 C GLY A 52 2.650 12.857 -8.494 1.00 0.00 C ATOM 796 O GLY A 52 2.223 12.513 -9.596 1.00 0.00 O ATOM 0 H GLY A 52 3.202 14.938 -6.160 1.00 0.00 H new ATOM 0 HA2 GLY A 52 1.907 14.857 -8.652 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.632 14.753 -8.361 1.00 0.00 H new ATOM 800 N ALA A 53 3.105 11.996 -7.588 1.00 0.00 N ATOM 801 CA ALA A 53 3.129 10.562 -7.843 1.00 0.00 C ATOM 802 C ALA A 53 1.744 10.049 -8.180 1.00 0.00 C ATOM 803 O ALA A 53 1.595 8.991 -8.791 1.00 0.00 O ATOM 804 CB ALA A 53 3.699 9.820 -6.643 1.00 0.00 C ATOM 0 H ALA A 53 3.461 12.268 -6.672 1.00 0.00 H new ATOM 0 HA ALA A 53 3.774 10.379 -8.702 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.710 8.750 -6.849 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.716 10.164 -6.452 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.080 10.014 -5.767 1.00 0.00 H new ATOM 810 N CYS A 54 0.735 10.806 -7.787 1.00 0.00 N ATOM 811 CA CYS A 54 -0.630 10.425 -8.058 1.00 0.00 C ATOM 812 C CYS A 54 -1.097 11.032 -9.378 1.00 0.00 C ATOM 813 O CYS A 54 -1.802 10.389 -10.161 1.00 0.00 O ATOM 814 CB CYS A 54 -1.539 10.871 -6.909 1.00 0.00 C ATOM 815 SG CYS A 54 -0.791 10.680 -5.257 1.00 0.00 S ATOM 0 H CYS A 54 0.840 11.685 -7.281 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.683 9.339 -8.141 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -1.808 11.917 -7.057 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -2.464 10.296 -6.947 1.00 0.00 H new ATOM 820 N LYS A 55 -0.680 12.270 -9.630 1.00 0.00 N ATOM 821 CA LYS A 55 -1.045 12.951 -10.863 1.00 0.00 C ATOM 822 C LYS A 55 -0.454 12.209 -12.057 1.00 0.00 C ATOM 823 O LYS A 55 -1.123 12.009 -13.069 1.00 0.00 O ATOM 824 CB LYS A 55 -0.585 14.417 -10.836 1.00 0.00 C ATOM 825 CG LYS A 55 0.737 14.672 -11.545 1.00 0.00 C ATOM 826 CD LYS A 55 1.296 16.045 -11.205 1.00 0.00 C ATOM 827 CE LYS A 55 2.450 16.426 -12.119 1.00 0.00 C ATOM 828 NZ LYS A 55 3.611 16.956 -11.352 1.00 0.00 N ATOM 0 H LYS A 55 -0.093 12.817 -9.000 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.131 12.952 -10.958 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.356 15.036 -11.296 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.495 14.738 -9.798 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.457 13.904 -11.261 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.594 14.593 -12.623 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.505 16.790 -11.288 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.635 16.053 -10.169 1.00 0.00 H new ATOM 0 HE2 LYS A 55 2.762 15.554 -12.694 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.114 17.176 -12.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.377 17.205 -12.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.320 17.803 -10.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.948 16.231 -10.687 1.00 0.00 H new ATOM 842 N ALA A 56 0.797 11.775 -11.920 1.00 0.00 N ATOM 843 CA ALA A 56 1.451 11.023 -12.977 1.00 0.00 C ATOM 844 C ALA A 56 0.852 9.624 -13.057 1.00 0.00 C ATOM 845 O ALA A 56 0.872 8.984 -14.108 1.00 0.00 O ATOM 846 CB ALA A 56 2.951 10.952 -12.731 1.00 0.00 C ATOM 0 H ALA A 56 1.371 11.932 -11.092 1.00 0.00 H new ATOM 0 HA ALA A 56 1.289 11.531 -13.928 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.425 10.385 -13.532 1.00 0.00 H new ATOM 0 HB2 ALA A 56 3.364 11.960 -12.707 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.140 10.459 -11.777 1.00 0.00 H new ATOM 852 N LEU A 57 0.311 9.164 -11.934 1.00 0.00 N ATOM 853 CA LEU A 57 -0.308 7.849 -11.852 1.00 0.00 C ATOM 854 C LEU A 57 -1.490 7.738 -12.814 1.00 0.00 C ATOM 855 O LEU A 57 -1.806 6.659 -13.303 1.00 0.00 O ATOM 856 CB LEU A 57 -0.780 7.597 -10.414 1.00 0.00 C ATOM 857 CG LEU A 57 -0.342 6.270 -9.781 1.00 0.00 C ATOM 858 CD1 LEU A 57 1.113 5.961 -10.103 1.00 0.00 C ATOM 859 CD2 LEU A 57 -0.555 6.312 -8.274 1.00 0.00 C ATOM 0 H LEU A 57 0.290 9.690 -11.060 1.00 0.00 H new ATOM 0 HA LEU A 57 0.430 7.099 -12.135 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.418 8.412 -9.787 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.869 7.642 -10.398 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.955 5.474 -10.203 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.395 5.015 -9.641 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.239 5.889 -11.183 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.748 6.757 -9.716 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.241 5.365 -7.836 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.034 7.123 -7.846 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.611 6.478 -8.060 1.00 0.00 H new ATOM 871 N LYS A 58 -2.152 8.854 -13.068 1.00 0.00 N ATOM 872 CA LYS A 58 -3.310 8.855 -13.958 1.00 0.00 C ATOM 873 C LYS A 58 -2.967 8.321 -15.357 1.00 0.00 C ATOM 874 O LYS A 58 -3.526 7.314 -15.788 1.00 0.00 O ATOM 875 CB LYS A 58 -3.938 10.255 -14.041 1.00 0.00 C ATOM 876 CG LYS A 58 -3.968 10.991 -12.708 1.00 0.00 C ATOM 877 CD LYS A 58 -4.520 12.401 -12.851 1.00 0.00 C ATOM 878 CE LYS A 58 -3.730 13.223 -13.861 1.00 0.00 C ATOM 879 NZ LYS A 58 -4.573 13.647 -15.013 1.00 0.00 N ATOM 0 H LYS A 58 -1.914 9.765 -12.677 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.045 8.174 -13.528 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.381 10.852 -14.763 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -4.956 10.165 -14.420 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.578 10.432 -11.999 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.960 11.036 -12.295 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.564 12.352 -13.161 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.498 12.899 -11.882 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.318 14.104 -13.369 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.886 12.637 -14.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.998 14.204 -15.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.946 12.806 -15.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.364 14.228 -14.669 1.00 0.00 H new ATOM 893 N PRO A 59 -2.058 8.986 -16.098 1.00 0.00 N ATOM 894 CA PRO A 59 -1.679 8.562 -17.458 1.00 0.00 C ATOM 895 C PRO A 59 -0.811 7.303 -17.509 1.00 0.00 C ATOM 896 O PRO A 59 -0.784 6.608 -18.524 1.00 0.00 O ATOM 897 CB PRO A 59 -0.884 9.757 -17.981 1.00 0.00 C ATOM 898 CG PRO A 59 -0.297 10.366 -16.760 1.00 0.00 C ATOM 899 CD PRO A 59 -1.339 10.209 -15.690 1.00 0.00 C ATOM 0 HA PRO A 59 -2.563 8.299 -18.040 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.110 9.444 -18.682 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.526 10.462 -18.509 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.631 9.867 -16.480 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.057 11.417 -16.922 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.890 10.102 -14.703 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.004 11.071 -15.646 1.00 0.00 H new ATOM 907 N LYS A 60 -0.087 7.018 -16.432 1.00 0.00 N ATOM 908 CA LYS A 60 0.788 5.847 -16.401 1.00 0.00 C ATOM 909 C LYS A 60 0.132 4.677 -15.681 1.00 0.00 C ATOM 910 O LYS A 60 0.080 3.571 -16.213 1.00 0.00 O ATOM 911 CB LYS A 60 2.116 6.185 -15.729 1.00 0.00 C ATOM 912 CG LYS A 60 1.976 6.400 -14.232 1.00 0.00 C ATOM 913 CD LYS A 60 3.073 7.286 -13.626 1.00 0.00 C ATOM 914 CE LYS A 60 3.873 8.070 -14.665 1.00 0.00 C ATOM 915 NZ LYS A 60 3.050 9.096 -15.364 1.00 0.00 N ATOM 0 H LYS A 60 -0.086 7.574 -15.577 1.00 0.00 H new ATOM 0 HA LYS A 60 0.972 5.553 -17.434 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.827 5.379 -15.911 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.531 7.084 -16.184 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.005 6.851 -14.029 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.988 5.431 -13.733 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.617 7.987 -12.927 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.756 6.661 -13.050 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.717 8.557 -14.177 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.285 7.378 -15.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.927 8.823 -16.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.119 9.165 -14.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.529 10.018 -15.315 1.00 0.00 H new ATOM 929 N PHE A 61 -0.384 4.917 -14.478 1.00 0.00 N ATOM 930 CA PHE A 61 -1.036 3.859 -13.736 1.00 0.00 C ATOM 931 C PHE A 61 -2.278 3.416 -14.484 1.00 0.00 C ATOM 932 O PHE A 61 -2.765 2.305 -14.293 1.00 0.00 O ATOM 933 CB PHE A 61 -1.360 4.291 -12.310 1.00 0.00 C ATOM 934 CG PHE A 61 -1.411 3.134 -11.356 1.00 0.00 C ATOM 935 CD1 PHE A 61 -2.499 2.276 -11.342 1.00 0.00 C ATOM 936 CD2 PHE A 61 -0.359 2.890 -10.486 1.00 0.00 C ATOM 937 CE1 PHE A 61 -2.539 1.199 -10.475 1.00 0.00 C ATOM 938 CE2 PHE A 61 -0.393 1.816 -9.620 1.00 0.00 C ATOM 939 CZ PHE A 61 -1.484 0.969 -9.614 1.00 0.00 C ATOM 0 H PHE A 61 -0.361 5.822 -14.008 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.354 3.012 -13.653 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.609 5.005 -11.971 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.319 4.809 -12.300 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.325 2.450 -12.016 1.00 0.00 H new ATOM 0 HD2 PHE A 61 0.497 3.548 -10.486 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.394 0.539 -10.471 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.433 1.638 -8.947 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.512 0.128 -8.937 1.00 0.00 H new ATOM 949 N ALA A 62 -2.742 4.262 -15.406 1.00 0.00 N ATOM 950 CA ALA A 62 -3.866 3.900 -16.247 1.00 0.00 C ATOM 951 C ALA A 62 -3.451 2.678 -17.075 1.00 0.00 C ATOM 952 O ALA A 62 -4.281 1.944 -17.611 1.00 0.00 O ATOM 953 CB ALA A 62 -4.259 5.072 -17.134 1.00 0.00 C ATOM 0 H ALA A 62 -2.357 5.190 -15.582 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.740 3.652 -15.645 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -5.104 4.787 -17.760 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.539 5.922 -16.511 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.415 5.348 -17.767 1.00 0.00 H new ATOM 959 N GLU A 63 -2.128 2.470 -17.116 1.00 0.00 N ATOM 960 CA GLU A 63 -1.490 1.353 -17.798 1.00 0.00 C ATOM 961 C GLU A 63 -1.590 0.100 -16.944 1.00 0.00 C ATOM 962 O GLU A 63 -1.319 -1.011 -17.403 1.00 0.00 O ATOM 963 CB GLU A 63 -0.022 1.696 -18.064 1.00 0.00 C ATOM 964 CG GLU A 63 0.638 0.796 -19.096 1.00 0.00 C ATOM 965 CD GLU A 63 0.460 1.304 -20.512 1.00 0.00 C ATOM 966 OE1 GLU A 63 -0.625 1.085 -21.090 1.00 0.00 O ATOM 967 OE2 GLU A 63 1.405 1.924 -21.044 1.00 0.00 O ATOM 0 H GLU A 63 -1.461 3.094 -16.662 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.994 1.168 -18.747 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.045 2.730 -18.401 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.533 1.629 -17.128 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.702 0.715 -18.874 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.219 -0.207 -19.019 1.00 0.00 H new ATOM 974 N SER A 64 -1.969 0.303 -15.688 1.00 0.00 N ATOM 975 CA SER A 64 -2.110 -0.769 -14.715 1.00 0.00 C ATOM 976 C SER A 64 -2.924 -1.956 -15.231 1.00 0.00 C ATOM 977 O SER A 64 -3.097 -2.931 -14.506 1.00 0.00 O ATOM 978 CB SER A 64 -2.756 -0.219 -13.447 1.00 0.00 C ATOM 979 OG SER A 64 -3.121 -1.261 -12.557 1.00 0.00 O ATOM 0 H SER A 64 -2.189 1.226 -15.314 1.00 0.00 H new ATOM 0 HA SER A 64 -1.107 -1.144 -14.510 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.064 0.460 -12.950 1.00 0.00 H new ATOM 0 HB3 SER A 64 -3.639 0.363 -13.710 1.00 0.00 H new ATOM 0 HG SER A 64 -3.547 -1.986 -13.060 1.00 0.00 H new ATOM 985 N THR A 65 -3.416 -1.897 -16.470 1.00 0.00 N ATOM 986 CA THR A 65 -4.182 -3.011 -17.024 1.00 0.00 C ATOM 987 C THR A 65 -3.472 -4.319 -16.709 1.00 0.00 C ATOM 988 O THR A 65 -4.100 -5.304 -16.320 1.00 0.00 O ATOM 989 CB THR A 65 -4.360 -2.860 -18.536 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.295 -2.110 -19.096 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.658 -2.182 -18.924 1.00 0.00 C ATOM 0 H THR A 65 -3.300 -1.102 -17.099 1.00 0.00 H new ATOM 0 HA THR A 65 -5.172 -3.013 -16.569 1.00 0.00 H new ATOM 0 HB THR A 65 -4.372 -3.877 -18.927 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.427 -2.026 -20.063 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.719 -2.108 -20.010 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.499 -2.767 -18.552 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.691 -1.183 -18.489 1.00 0.00 H new ATOM 999 N GLU A 66 -2.147 -4.302 -16.826 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.351 -5.473 -16.498 1.00 0.00 C ATOM 1001 C GLU A 66 -1.235 -5.563 -14.995 1.00 0.00 C ATOM 1002 O GLU A 66 -1.284 -6.644 -14.415 1.00 0.00 O ATOM 1003 CB GLU A 66 0.048 -5.399 -17.110 1.00 0.00 C ATOM 1004 CG GLU A 66 0.723 -4.054 -16.916 1.00 0.00 C ATOM 1005 CD GLU A 66 0.952 -3.320 -18.223 1.00 0.00 C ATOM 1006 OE1 GLU A 66 1.033 -3.988 -19.274 1.00 0.00 O ATOM 1007 OE2 GLU A 66 1.053 -2.074 -18.193 1.00 0.00 O ATOM 0 H GLU A 66 -1.609 -3.496 -17.143 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.844 -6.355 -16.908 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.671 -6.176 -16.668 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -0.019 -5.613 -18.177 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.110 -3.436 -16.260 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.679 -4.201 -16.414 1.00 0.00 H new ATOM 1014 N ILE A 67 -1.106 -4.402 -14.370 1.00 0.00 N ATOM 1015 CA ILE A 67 -1.005 -4.324 -12.928 1.00 0.00 C ATOM 1016 C ILE A 67 -2.295 -4.827 -12.275 1.00 0.00 C ATOM 1017 O ILE A 67 -2.324 -5.129 -11.084 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.663 -2.878 -12.510 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.731 -2.537 -13.036 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.729 -2.668 -11.004 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.060 -1.062 -12.971 1.00 0.00 C ATOM 0 H ILE A 67 -1.069 -3.500 -14.845 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.199 -4.970 -12.580 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.410 -2.213 -12.943 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.473 -3.092 -12.461 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.812 -2.873 -14.070 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.479 -1.633 -10.770 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.736 -2.887 -10.650 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -0.019 -3.333 -10.512 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.064 -0.896 -13.361 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.341 -0.502 -13.569 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.012 -0.724 -11.936 1.00 0.00 H new ATOM 1033 N SER A 68 -3.359 -4.954 -13.071 1.00 0.00 N ATOM 1034 CA SER A 68 -4.628 -5.457 -12.559 1.00 0.00 C ATOM 1035 C SER A 68 -4.476 -6.911 -12.112 1.00 0.00 C ATOM 1036 O SER A 68 -5.180 -7.373 -11.215 1.00 0.00 O ATOM 1037 CB SER A 68 -5.715 -5.346 -13.629 1.00 0.00 C ATOM 1038 OG SER A 68 -6.833 -4.622 -13.146 1.00 0.00 O ATOM 0 H SER A 68 -3.364 -4.717 -14.063 1.00 0.00 H new ATOM 0 HA SER A 68 -4.921 -4.853 -11.700 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.311 -4.851 -14.512 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.029 -6.343 -13.938 1.00 0.00 H new ATOM 0 HG SER A 68 -7.513 -4.563 -13.849 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.542 -7.623 -12.743 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.279 -9.024 -12.416 1.00 0.00 C ATOM 1046 C GLU A 69 -1.838 -9.196 -11.944 1.00 0.00 C ATOM 1047 O GLU A 69 -1.582 -9.723 -10.862 1.00 0.00 O ATOM 1048 CB GLU A 69 -3.546 -9.921 -13.630 1.00 0.00 C ATOM 1049 CG GLU A 69 -3.250 -9.256 -14.966 1.00 0.00 C ATOM 1050 CD GLU A 69 -3.821 -10.029 -16.140 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -3.287 -11.113 -16.452 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -4.803 -9.549 -16.745 1.00 0.00 O ATOM 0 H GLU A 69 -2.952 -7.250 -13.487 1.00 0.00 H new ATOM 0 HA GLU A 69 -3.952 -9.320 -11.611 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.941 -10.823 -13.543 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.590 -10.235 -13.615 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.662 -8.247 -14.965 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.171 -9.160 -15.089 1.00 0.00 H new ATOM 1059 N LEU A 70 -0.901 -8.732 -12.763 1.00 0.00 N ATOM 1060 CA LEU A 70 0.523 -8.807 -12.444 1.00 0.00 C ATOM 1061 C LEU A 70 0.786 -8.213 -11.052 1.00 0.00 C ATOM 1062 O LEU A 70 1.717 -8.615 -10.355 1.00 0.00 O ATOM 1063 CB LEU A 70 1.314 -8.095 -13.573 1.00 0.00 C ATOM 1064 CG LEU A 70 2.533 -7.242 -13.195 1.00 0.00 C ATOM 1065 CD1 LEU A 70 2.089 -5.867 -12.735 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.406 -7.929 -12.154 1.00 0.00 C ATOM 0 H LEU A 70 -1.104 -8.295 -13.662 1.00 0.00 H new ATOM 0 HA LEU A 70 0.862 -9.842 -12.398 1.00 0.00 H new ATOM 0 HB2 LEU A 70 1.650 -8.859 -14.274 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.616 -7.454 -14.112 1.00 0.00 H new ATOM 0 HG LEU A 70 3.150 -7.122 -14.085 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.963 -5.272 -12.470 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.544 -5.373 -13.539 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.440 -5.966 -11.865 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.257 -7.291 -11.915 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.822 -8.109 -11.251 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.764 -8.879 -12.550 1.00 0.00 H new ATOM 1078 N SER A 71 -0.061 -7.270 -10.649 1.00 0.00 N ATOM 1079 CA SER A 71 0.056 -6.622 -9.343 1.00 0.00 C ATOM 1080 C SER A 71 -0.889 -7.231 -8.308 1.00 0.00 C ATOM 1081 O SER A 71 -0.770 -6.962 -7.114 1.00 0.00 O ATOM 1082 CB SER A 71 -0.232 -5.137 -9.465 1.00 0.00 C ATOM 1083 OG SER A 71 0.651 -4.374 -8.662 1.00 0.00 O ATOM 0 H SER A 71 -0.842 -6.934 -11.212 1.00 0.00 H new ATOM 0 HA SER A 71 1.079 -6.780 -9.002 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.137 -4.830 -10.507 1.00 0.00 H new ATOM 0 HB3 SER A 71 -1.262 -4.938 -9.167 1.00 0.00 H new ATOM 0 HG SER A 71 0.570 -4.657 -7.727 1.00 0.00 H new ATOM 1089 N HIS A 72 -1.834 -8.045 -8.771 1.00 0.00 N ATOM 1090 CA HIS A 72 -2.809 -8.691 -7.892 1.00 0.00 C ATOM 1091 C HIS A 72 -2.111 -9.373 -6.723 1.00 0.00 C ATOM 1092 O HIS A 72 -2.746 -9.738 -5.733 1.00 0.00 O ATOM 1093 CB HIS A 72 -3.646 -9.708 -8.674 1.00 0.00 C ATOM 1094 CG HIS A 72 -5.122 -9.500 -8.530 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -6.023 -10.536 -8.396 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -5.857 -8.362 -8.506 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -7.247 -10.045 -8.298 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -7.172 -8.727 -8.361 1.00 0.00 N ATOM 0 H HIS A 72 -1.947 -8.275 -9.758 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.473 -7.922 -7.498 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -3.380 -9.651 -9.730 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -3.393 -10.713 -8.335 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -5.478 -7.354 -8.586 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -8.153 -10.622 -8.186 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -7.963 -8.085 -8.310 1.00 0.00 H new ATOM 1107 N ASN A 73 -0.796 -9.529 -6.851 1.00 0.00 N ATOM 1108 CA ASN A 73 0.027 -10.147 -5.826 1.00 0.00 C ATOM 1109 C ASN A 73 -0.437 -9.753 -4.419 1.00 0.00 C ATOM 1110 O ASN A 73 -0.363 -10.549 -3.490 1.00 0.00 O ATOM 1111 CB ASN A 73 1.483 -9.749 -6.041 1.00 0.00 C ATOM 1112 CG ASN A 73 1.648 -8.298 -6.448 1.00 0.00 C ATOM 1113 OD1 ASN A 73 1.189 -7.394 -5.754 1.00 0.00 O ATOM 1114 ND2 ASN A 73 2.309 -8.068 -7.576 1.00 0.00 N ATOM 0 H ASN A 73 -0.273 -9.228 -7.673 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.071 -11.229 -5.908 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.042 -9.929 -5.123 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.919 -10.388 -6.809 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.452 -7.110 -7.897 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.674 -8.849 -8.122 1.00 0.00 H new ATOM 1121 N PHE A 74 -0.947 -8.532 -4.296 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.480 -8.019 -3.040 1.00 0.00 C ATOM 1123 C PHE A 74 -2.861 -7.432 -3.318 1.00 0.00 C ATOM 1124 O PHE A 74 -3.442 -7.740 -4.359 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.546 -6.979 -2.411 1.00 0.00 C ATOM 1126 CG PHE A 74 0.290 -6.203 -3.387 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -0.299 -5.393 -4.342 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.675 -6.273 -3.333 1.00 0.00 C ATOM 1129 CE1 PHE A 74 0.476 -4.670 -5.228 1.00 0.00 C ATOM 1130 CE2 PHE A 74 2.453 -5.551 -4.212 1.00 0.00 C ATOM 1131 CZ PHE A 74 1.854 -4.748 -5.162 1.00 0.00 C ATOM 0 H PHE A 74 -1.002 -7.868 -5.068 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.560 -8.831 -2.317 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.146 -6.277 -1.832 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.117 -7.486 -1.710 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.376 -5.325 -4.395 1.00 0.00 H new ATOM 0 HD2 PHE A 74 2.149 -6.901 -2.593 1.00 0.00 H new ATOM 0 HE1 PHE A 74 0.005 -4.044 -5.972 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.530 -5.613 -4.158 1.00 0.00 H new ATOM 0 HZ PHE A 74 2.461 -4.182 -5.852 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.419 -6.617 -2.420 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.758 -6.086 -2.699 1.00 0.00 C ATOM 1143 C VAL A 75 -4.995 -4.615 -2.327 1.00 0.00 C ATOM 1144 O VAL A 75 -4.358 -4.038 -1.446 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.857 -6.948 -2.041 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.869 -6.754 -0.532 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.221 -6.623 -2.648 1.00 0.00 C ATOM 0 H VAL A 75 -2.995 -6.322 -1.540 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.817 -6.134 -3.786 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.637 -7.997 -2.238 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.652 -7.372 -0.092 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.903 -7.045 -0.120 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.061 -5.706 -0.301 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.986 -7.238 -2.174 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.450 -5.570 -2.485 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.201 -6.829 -3.718 1.00 0.00 H new ATOM 1157 N MET A 76 -5.958 -4.066 -3.062 1.00 0.00 N ATOM 1158 CA MET A 76 -6.453 -2.700 -2.986 1.00 0.00 C ATOM 1159 C MET A 76 -6.553 -2.085 -1.593 1.00 0.00 C ATOM 1160 O MET A 76 -7.546 -2.299 -0.888 1.00 0.00 O ATOM 1161 CB MET A 76 -7.865 -2.749 -3.537 1.00 0.00 C ATOM 1162 CG MET A 76 -8.739 -3.795 -2.826 1.00 0.00 C ATOM 1163 SD MET A 76 -9.339 -5.161 -3.873 1.00 0.00 S ATOM 1164 CE MET A 76 -8.326 -5.039 -5.352 1.00 0.00 C ATOM 0 H MET A 76 -6.446 -4.605 -3.777 1.00 0.00 H new ATOM 0 HA MET A 76 -5.738 -2.081 -3.528 1.00 0.00 H new ATOM 0 HB2 MET A 76 -8.325 -1.766 -3.435 1.00 0.00 H new ATOM 0 HB3 MET A 76 -7.828 -2.975 -4.603 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.168 -4.218 -1.999 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.601 -3.288 -2.392 1.00 0.00 H new ATOM 0 HE1 MET A 76 -8.535 -5.885 -6.007 1.00 0.00 H new ATOM 0 HE2 MET A 76 -8.556 -4.110 -5.875 1.00 0.00 H new ATOM 0 HE3 MET A 76 -7.272 -5.047 -5.073 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.575 -1.244 -1.239 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.605 -0.539 0.041 1.00 0.00 C ATOM 1176 C VAL A 77 -4.993 0.859 -0.070 1.00 0.00 C ATOM 1177 O VAL A 77 -3.996 1.172 0.576 1.00 0.00 O ATOM 1178 CB VAL A 77 -4.897 -1.337 1.156 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -4.833 -0.534 2.450 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -5.613 -2.653 1.389 1.00 0.00 C ATOM 0 H VAL A 77 -4.761 -1.038 -1.817 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.656 -0.436 0.311 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.875 -1.539 0.834 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.329 -1.121 3.218 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.280 0.390 2.278 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.844 -0.296 2.781 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.106 -3.209 2.178 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.643 -2.459 1.687 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.606 -3.239 0.470 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.612 1.701 -0.885 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.150 3.067 -1.078 1.00 0.00 C ATOM 1192 C ASN A 78 -6.195 4.053 -0.570 1.00 0.00 C ATOM 1193 O ASN A 78 -7.194 4.317 -1.238 1.00 0.00 O ATOM 1194 CB ASN A 78 -4.849 3.296 -2.559 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.012 4.736 -3.015 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -5.685 5.012 -4.006 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -4.388 5.660 -2.302 1.00 0.00 N ATOM 0 H ASN A 78 -6.442 1.459 -1.427 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.235 3.228 -0.508 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -3.827 2.976 -2.764 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -5.507 2.662 -3.154 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -4.456 6.642 -2.569 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -3.839 5.390 -1.486 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.965 4.577 0.627 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.894 5.521 1.241 1.00 0.00 C ATOM 1206 C LEU A 79 -6.508 6.970 0.951 1.00 0.00 C ATOM 1207 O LEU A 79 -5.398 7.257 0.492 1.00 0.00 O ATOM 1208 CB LEU A 79 -6.960 5.290 2.753 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.634 5.479 3.494 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -5.592 6.839 4.174 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -5.424 4.368 4.515 1.00 0.00 C ATOM 0 H LEU A 79 -5.143 4.365 1.193 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.877 5.345 0.803 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -7.697 5.972 3.178 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -7.320 4.277 2.935 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.826 5.431 2.764 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.642 6.956 4.696 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.693 7.624 3.424 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.411 6.913 4.890 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.476 4.522 5.030 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.237 4.382 5.240 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -5.408 3.404 4.006 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.444 7.876 1.226 1.00 0.00 N ATOM 1224 CA GLU A 80 -7.235 9.303 1.007 1.00 0.00 C ATOM 1225 C GLU A 80 -7.220 10.053 2.336 1.00 0.00 C ATOM 1226 O GLU A 80 -7.514 9.479 3.385 1.00 0.00 O ATOM 1227 CB GLU A 80 -8.345 9.859 0.108 1.00 0.00 C ATOM 1228 CG GLU A 80 -8.006 11.190 -0.543 1.00 0.00 C ATOM 1229 CD GLU A 80 -8.907 11.507 -1.722 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -9.943 10.826 -1.879 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -8.576 12.436 -2.489 1.00 0.00 O ATOM 0 H GLU A 80 -8.362 7.643 1.604 1.00 0.00 H new ATOM 0 HA GLU A 80 -6.271 9.442 0.518 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.565 9.130 -0.672 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.253 9.977 0.700 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -8.090 11.985 0.198 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.969 11.174 -0.877 1.00 0.00 H new ATOM 1238 N ASP A 81 -6.879 11.338 2.288 1.00 0.00 N ATOM 1239 CA ASP A 81 -6.828 12.168 3.489 1.00 0.00 C ATOM 1240 C ASP A 81 -8.117 12.054 4.301 1.00 0.00 C ATOM 1241 O ASP A 81 -8.118 12.261 5.514 1.00 0.00 O ATOM 1242 CB ASP A 81 -6.582 13.630 3.110 1.00 0.00 C ATOM 1243 CG ASP A 81 -7.734 14.229 2.323 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -8.772 14.549 2.939 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -7.597 14.377 1.089 1.00 0.00 O ATOM 0 H ASP A 81 -6.633 11.828 1.428 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.004 11.809 4.107 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.422 14.215 4.016 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.668 13.700 2.520 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.216 11.729 3.623 1.00 0.00 N ATOM 1251 CA GLU A 82 -10.515 11.591 4.278 1.00 0.00 C ATOM 1252 C GLU A 82 -10.410 10.752 5.550 1.00 0.00 C ATOM 1253 O GLU A 82 -11.172 10.944 6.495 1.00 0.00 O ATOM 1254 CB GLU A 82 -11.527 10.962 3.318 1.00 0.00 C ATOM 1255 CG GLU A 82 -12.499 11.963 2.714 1.00 0.00 C ATOM 1256 CD GLU A 82 -12.827 11.656 1.266 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -11.886 11.568 0.449 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -14.026 11.504 0.948 1.00 0.00 O ATOM 0 H GLU A 82 -9.232 11.556 2.618 1.00 0.00 H new ATOM 0 HA GLU A 82 -10.856 12.588 4.558 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.989 10.461 2.514 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -12.091 10.196 3.850 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -13.419 11.968 3.298 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -12.073 12.964 2.782 1.00 0.00 H new ATOM 1265 N GLU A 83 -9.458 9.822 5.564 1.00 0.00 N ATOM 1266 CA GLU A 83 -9.256 8.956 6.720 1.00 0.00 C ATOM 1267 C GLU A 83 -7.779 8.888 7.096 1.00 0.00 C ATOM 1268 O GLU A 83 -7.079 7.939 6.740 1.00 0.00 O ATOM 1269 CB GLU A 83 -9.786 7.551 6.431 1.00 0.00 C ATOM 1270 CG GLU A 83 -9.211 6.931 5.168 1.00 0.00 C ATOM 1271 CD GLU A 83 -8.726 5.510 5.386 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -8.060 5.261 6.414 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -9.011 4.648 4.530 1.00 0.00 O ATOM 0 H GLU A 83 -8.817 9.650 4.790 1.00 0.00 H new ATOM 0 HA GLU A 83 -9.808 9.378 7.560 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -9.559 6.905 7.279 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -10.872 7.592 6.344 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -9.971 6.936 4.386 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -8.383 7.543 4.811 1.00 0.00 H new ATOM 1280 N GLU A 84 -7.312 9.901 7.821 1.00 0.00 N ATOM 1281 CA GLU A 84 -5.918 9.957 8.248 1.00 0.00 C ATOM 1282 C GLU A 84 -5.620 8.871 9.282 1.00 0.00 C ATOM 1283 O GLU A 84 -6.130 8.917 10.401 1.00 0.00 O ATOM 1284 CB GLU A 84 -5.602 11.335 8.835 1.00 0.00 C ATOM 1285 CG GLU A 84 -6.496 11.718 10.003 1.00 0.00 C ATOM 1286 CD GLU A 84 -5.829 11.495 11.346 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -4.681 11.952 11.520 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -6.456 10.866 12.223 1.00 0.00 O ATOM 0 H GLU A 84 -7.878 10.693 8.125 1.00 0.00 H new ATOM 0 HA GLU A 84 -5.288 9.785 7.375 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.563 11.351 9.163 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.701 12.086 8.051 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -6.778 12.767 9.911 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -7.416 11.136 9.957 1.00 0.00 H new ATOM 1295 N PRO A 85 -4.787 7.877 8.923 1.00 0.00 N ATOM 1296 CA PRO A 85 -4.429 6.785 9.833 1.00 0.00 C ATOM 1297 C PRO A 85 -3.898 7.293 11.168 1.00 0.00 C ATOM 1298 O PRO A 85 -3.998 6.612 12.189 1.00 0.00 O ATOM 1299 CB PRO A 85 -3.336 6.029 9.075 1.00 0.00 C ATOM 1300 CG PRO A 85 -3.588 6.337 7.639 1.00 0.00 C ATOM 1301 CD PRO A 85 -4.129 7.739 7.610 1.00 0.00 C ATOM 0 HA PRO A 85 -5.292 6.169 10.086 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -2.343 6.357 9.382 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -3.391 4.957 9.266 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -2.671 6.260 7.056 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -4.300 5.634 7.207 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -3.335 8.474 7.479 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -4.833 7.881 6.790 1.00 0.00 H new ATOM 1309 N LYS A 86 -3.332 8.497 11.155 1.00 0.00 N ATOM 1310 CA LYS A 86 -2.784 9.099 12.366 1.00 0.00 C ATOM 1311 C LYS A 86 -1.646 8.254 12.927 1.00 0.00 C ATOM 1312 O LYS A 86 -1.409 8.239 14.135 1.00 0.00 O ATOM 1313 CB LYS A 86 -3.881 9.266 13.419 1.00 0.00 C ATOM 1314 CG LYS A 86 -3.594 10.370 14.422 1.00 0.00 C ATOM 1315 CD LYS A 86 -4.719 10.507 15.436 1.00 0.00 C ATOM 1316 CE LYS A 86 -4.219 11.088 16.751 1.00 0.00 C ATOM 1317 NZ LYS A 86 -4.919 12.355 17.098 1.00 0.00 N ATOM 0 H LYS A 86 -3.241 9.074 10.319 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.388 10.081 12.107 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.826 9.478 12.918 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -4.007 8.324 13.953 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.659 10.158 14.941 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.460 11.315 13.896 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -5.501 11.147 15.028 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -5.168 9.530 15.616 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -4.367 10.361 17.549 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -3.147 11.272 16.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -4.551 12.719 18.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.757 13.058 16.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -5.939 12.174 17.188 1.00 0.00 H new ATOM 1331 N ASP A 87 -0.942 7.551 12.044 1.00 0.00 N ATOM 1332 CA ASP A 87 0.171 6.704 12.453 1.00 0.00 C ATOM 1333 C ASP A 87 1.306 6.764 11.438 1.00 0.00 C ATOM 1334 O ASP A 87 1.147 7.303 10.344 1.00 0.00 O ATOM 1335 CB ASP A 87 -0.298 5.259 12.627 1.00 0.00 C ATOM 1336 CG ASP A 87 0.373 4.571 13.800 1.00 0.00 C ATOM 1337 OD1 ASP A 87 1.542 4.902 14.094 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -0.270 3.703 14.427 1.00 0.00 O ATOM 0 H ASP A 87 -1.124 7.552 11.040 1.00 0.00 H new ATOM 0 HA ASP A 87 0.544 7.076 13.407 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.378 5.245 12.771 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.091 4.700 11.714 1.00 0.00 H new ATOM 1343 N GLU A 88 2.454 6.205 11.807 1.00 0.00 N ATOM 1344 CA GLU A 88 3.619 6.192 10.930 1.00 0.00 C ATOM 1345 C GLU A 88 3.337 5.432 9.632 1.00 0.00 C ATOM 1346 O GLU A 88 4.095 5.534 8.670 1.00 0.00 O ATOM 1347 CB GLU A 88 4.814 5.568 11.650 1.00 0.00 C ATOM 1348 CG GLU A 88 5.815 6.591 12.154 1.00 0.00 C ATOM 1349 CD GLU A 88 5.331 7.323 13.390 1.00 0.00 C ATOM 1350 OE1 GLU A 88 4.805 6.657 14.306 1.00 0.00 O ATOM 1351 OE2 GLU A 88 5.479 8.562 13.442 1.00 0.00 O ATOM 0 H GLU A 88 2.602 5.754 12.710 1.00 0.00 H new ATOM 0 HA GLU A 88 3.851 7.225 10.671 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.453 4.978 12.492 1.00 0.00 H new ATOM 0 HB3 GLU A 88 5.319 4.880 10.972 1.00 0.00 H new ATOM 0 HG2 GLU A 88 6.757 6.091 12.378 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.018 7.314 11.364 1.00 0.00 H new ATOM 1358 N ASP A 89 2.249 4.663 9.615 1.00 0.00 N ATOM 1359 CA ASP A 89 1.882 3.878 8.439 1.00 0.00 C ATOM 1360 C ASP A 89 1.912 4.715 7.155 1.00 0.00 C ATOM 1361 O ASP A 89 2.090 4.172 6.065 1.00 0.00 O ATOM 1362 CB ASP A 89 0.492 3.260 8.629 1.00 0.00 C ATOM 1363 CG ASP A 89 0.486 2.157 9.674 1.00 0.00 C ATOM 1364 OD1 ASP A 89 1.148 2.327 10.719 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -0.182 1.121 9.448 1.00 0.00 O ATOM 0 H ASP A 89 1.607 4.567 10.402 1.00 0.00 H new ATOM 0 HA ASP A 89 2.623 3.086 8.333 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.212 4.039 8.923 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.143 2.858 7.678 1.00 0.00 H new ATOM 1370 N PHE A 90 1.736 6.029 7.282 1.00 0.00 N ATOM 1371 CA PHE A 90 1.746 6.911 6.113 1.00 0.00 C ATOM 1372 C PHE A 90 3.116 7.556 5.903 1.00 0.00 C ATOM 1373 O PHE A 90 3.476 7.917 4.779 1.00 0.00 O ATOM 1374 CB PHE A 90 0.667 7.993 6.241 1.00 0.00 C ATOM 1375 CG PHE A 90 0.739 8.792 7.514 1.00 0.00 C ATOM 1376 CD1 PHE A 90 1.831 9.605 7.783 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -0.293 8.737 8.438 1.00 0.00 C ATOM 1378 CE1 PHE A 90 1.891 10.344 8.949 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -0.238 9.477 9.604 1.00 0.00 C ATOM 1380 CZ PHE A 90 0.856 10.280 9.860 1.00 0.00 C ATOM 0 H PHE A 90 1.586 6.504 8.172 1.00 0.00 H new ATOM 0 HA PHE A 90 1.528 6.295 5.240 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.749 8.674 5.394 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.313 7.521 6.177 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.643 9.661 7.073 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.150 8.109 8.244 1.00 0.00 H new ATOM 0 HE1 PHE A 90 2.747 10.971 9.147 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.050 9.427 10.314 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.902 10.857 10.772 1.00 0.00 H new ATOM 1390 N SER A 91 3.874 7.695 6.990 1.00 0.00 N ATOM 1391 CA SER A 91 5.206 8.289 6.931 1.00 0.00 C ATOM 1392 C SER A 91 6.089 7.723 8.042 1.00 0.00 C ATOM 1393 O SER A 91 6.416 8.415 9.006 1.00 0.00 O ATOM 1394 CB SER A 91 5.122 9.813 7.052 1.00 0.00 C ATOM 1395 OG SER A 91 4.452 10.379 5.940 1.00 0.00 O ATOM 0 H SER A 91 3.586 7.403 7.924 1.00 0.00 H new ATOM 0 HA SER A 91 5.650 8.041 5.967 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.598 10.079 7.970 1.00 0.00 H new ATOM 0 HB3 SER A 91 6.126 10.230 7.126 1.00 0.00 H new ATOM 0 HG SER A 91 4.687 11.328 5.865 1.00 0.00 H new ATOM 1401 N PRO A 92 6.470 6.441 7.922 1.00 0.00 N ATOM 1402 CA PRO A 92 7.299 5.763 8.915 1.00 0.00 C ATOM 1403 C PRO A 92 8.798 5.959 8.687 1.00 0.00 C ATOM 1404 O PRO A 92 9.556 6.147 9.639 1.00 0.00 O ATOM 1405 CB PRO A 92 6.916 4.300 8.712 1.00 0.00 C ATOM 1406 CG PRO A 92 6.602 4.188 7.259 1.00 0.00 C ATOM 1407 CD PRO A 92 6.104 5.542 6.812 1.00 0.00 C ATOM 0 HA PRO A 92 7.130 6.146 9.921 1.00 0.00 H new ATOM 0 HB2 PRO A 92 7.732 3.635 8.993 1.00 0.00 H new ATOM 0 HB3 PRO A 92 6.057 4.027 9.325 1.00 0.00 H new ATOM 0 HG2 PRO A 92 7.487 3.896 6.694 1.00 0.00 H new ATOM 0 HG3 PRO A 92 5.846 3.422 7.085 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.572 5.851 5.877 1.00 0.00 H new ATOM 0 HD3 PRO A 92 5.027 5.535 6.642 1.00 0.00 H new ATOM 1415 N ASP A 93 9.223 5.897 7.428 1.00 0.00 N ATOM 1416 CA ASP A 93 10.636 6.050 7.096 1.00 0.00 C ATOM 1417 C ASP A 93 11.006 7.510 6.836 1.00 0.00 C ATOM 1418 O ASP A 93 11.960 8.025 7.419 1.00 0.00 O ATOM 1419 CB ASP A 93 10.990 5.201 5.871 1.00 0.00 C ATOM 1420 CG ASP A 93 10.076 5.468 4.690 1.00 0.00 C ATOM 1421 OD1 ASP A 93 8.850 5.585 4.899 1.00 0.00 O ATOM 1422 OD2 ASP A 93 10.589 5.563 3.556 1.00 0.00 O ATOM 0 H ASP A 93 8.613 5.743 6.625 1.00 0.00 H new ATOM 0 HA ASP A 93 11.210 5.707 7.957 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.021 5.402 5.580 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.934 4.145 6.137 1.00 0.00 H new ATOM 1427 N GLY A 94 10.259 8.169 5.956 1.00 0.00 N ATOM 1428 CA GLY A 94 10.546 9.557 5.638 1.00 0.00 C ATOM 1429 C GLY A 94 9.611 10.523 6.338 1.00 0.00 C ATOM 1430 O GLY A 94 8.957 10.164 7.316 1.00 0.00 O ATOM 0 H GLY A 94 9.463 7.769 5.459 1.00 0.00 H new ATOM 0 HA2 GLY A 94 11.574 9.785 5.919 1.00 0.00 H new ATOM 0 HA3 GLY A 94 10.471 9.702 4.560 1.00 0.00 H new ATOM 1434 N GLY A 95 9.552 11.752 5.835 1.00 0.00 N ATOM 1435 CA GLY A 95 8.693 12.755 6.432 1.00 0.00 C ATOM 1436 C GLY A 95 7.825 13.462 5.409 1.00 0.00 C ATOM 1437 O GLY A 95 7.715 14.689 5.421 1.00 0.00 O ATOM 0 H GLY A 95 10.084 12.070 5.025 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.056 12.284 7.180 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.306 13.490 6.953 1.00 0.00 H new ATOM 1441 N TYR A 96 7.198 12.689 4.527 1.00 0.00 N ATOM 1442 CA TYR A 96 6.327 13.258 3.502 1.00 0.00 C ATOM 1443 C TYR A 96 4.874 13.225 3.965 1.00 0.00 C ATOM 1444 O TYR A 96 4.598 12.975 5.140 1.00 0.00 O ATOM 1445 CB TYR A 96 6.479 12.522 2.160 1.00 0.00 C ATOM 1446 CG TYR A 96 7.234 11.212 2.235 1.00 0.00 C ATOM 1447 CD1 TYR A 96 8.616 11.186 2.367 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.559 10.003 2.158 1.00 0.00 C ATOM 1449 CE1 TYR A 96 9.303 9.989 2.425 1.00 0.00 C ATOM 1450 CE2 TYR A 96 7.239 8.800 2.213 1.00 0.00 C ATOM 1451 CZ TYR A 96 8.610 8.798 2.347 1.00 0.00 C ATOM 1452 OH TYR A 96 9.294 7.605 2.403 1.00 0.00 O ATOM 0 H TYR A 96 7.276 11.672 4.501 1.00 0.00 H new ATOM 0 HA TYR A 96 6.627 14.294 3.347 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.486 12.330 1.753 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.990 13.180 1.457 1.00 0.00 H new ATOM 0 HD1 TYR A 96 9.162 12.116 2.425 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.484 10.001 2.053 1.00 0.00 H new ATOM 0 HE1 TYR A 96 10.378 9.985 2.531 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.698 7.867 2.151 1.00 0.00 H new ATOM 0 HH TYR A 96 10.100 7.664 1.849 1.00 0.00 H new ATOM 1462 N ILE A 97 3.944 13.488 3.051 1.00 0.00 N ATOM 1463 CA ILE A 97 2.529 13.495 3.401 1.00 0.00 C ATOM 1464 C ILE A 97 1.626 13.141 2.181 1.00 0.00 C ATOM 1465 O ILE A 97 0.874 14.072 1.889 1.00 0.00 O ATOM 1466 CB ILE A 97 2.112 14.879 3.918 1.00 0.00 C ATOM 1467 CG1 ILE A 97 2.557 15.945 2.920 1.00 0.00 C ATOM 1468 CG2 ILE A 97 2.701 15.144 5.293 1.00 0.00 C ATOM 1469 CD1 ILE A 97 1.546 17.049 2.721 1.00 0.00 C ATOM 0 H ILE A 97 4.143 13.697 2.073 1.00 0.00 H new ATOM 0 HA ILE A 97 2.394 12.740 4.175 1.00 0.00 H new ATOM 0 HB ILE A 97 1.027 14.912 4.015 1.00 0.00 H new ATOM 0 HG12 ILE A 97 3.496 16.381 3.262 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.757 15.470 1.960 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.391 16.131 5.638 1.00 0.00 H new ATOM 0 HG22 ILE A 97 2.346 14.387 5.993 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.789 15.104 5.237 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.931 17.769 1.999 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.613 16.625 2.349 1.00 0.00 H new ATOM 0 HD13 ILE A 97 1.363 17.550 3.671 1.00 0.00 H new ATOM 1481 N PRO A 98 1.037 11.918 2.273 1.00 0.00 N ATOM 1482 CA PRO A 98 1.409 10.498 2.566 1.00 0.00 C ATOM 1483 C PRO A 98 1.840 9.792 1.288 1.00 0.00 C ATOM 1484 O PRO A 98 1.424 10.188 0.191 1.00 0.00 O ATOM 1485 CB PRO A 98 0.132 9.868 3.098 1.00 0.00 C ATOM 1486 CG PRO A 98 -0.229 10.890 4.039 1.00 0.00 C ATOM 1487 CD PRO A 98 0.878 11.866 3.804 1.00 0.00 C ATOM 0 HA PRO A 98 2.237 10.426 3.271 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.621 9.719 2.324 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.301 8.899 3.568 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.211 11.317 3.834 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -0.249 10.523 5.065 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.633 12.847 4.210 1.00 0.00 H new ATOM 0 HD3 PRO A 98 1.800 11.542 4.287 1.00 0.00 H new ATOM 1495 N ARG A 99 2.685 8.767 1.434 1.00 0.00 N ATOM 1496 CA ARG A 99 3.207 8.013 0.291 1.00 0.00 C ATOM 1497 C ARG A 99 2.747 6.552 0.306 1.00 0.00 C ATOM 1498 O ARG A 99 1.855 6.178 1.067 1.00 0.00 O ATOM 1499 CB ARG A 99 4.731 8.076 0.285 1.00 0.00 C ATOM 1500 CG ARG A 99 5.303 9.084 -0.698 1.00 0.00 C ATOM 1501 CD ARG A 99 4.772 10.487 -0.446 1.00 0.00 C ATOM 1502 NE ARG A 99 4.259 11.106 -1.667 1.00 0.00 N ATOM 1503 CZ ARG A 99 4.171 12.422 -1.852 1.00 0.00 C ATOM 1504 NH1 ARG A 99 4.536 13.260 -0.891 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.709 12.900 -2.999 1.00 0.00 N ATOM 0 H ARG A 99 3.024 8.439 2.339 1.00 0.00 H new ATOM 0 HA ARG A 99 2.812 8.472 -0.615 1.00 0.00 H new ATOM 0 HB2 ARG A 99 5.078 8.324 1.288 1.00 0.00 H new ATOM 0 HB3 ARG A 99 5.125 7.088 0.047 1.00 0.00 H new ATOM 0 HG2 ARG A 99 6.390 9.088 -0.622 1.00 0.00 H new ATOM 0 HG3 ARG A 99 5.056 8.780 -1.715 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.979 10.446 0.300 1.00 0.00 H new ATOM 0 HD3 ARG A 99 5.567 11.107 -0.032 1.00 0.00 H new ATOM 0 HE ARG A 99 3.950 10.494 -2.422 1.00 0.00 H new ATOM 0 HH11 ARG A 99 4.886 12.898 -0.004 1.00 0.00 H new ATOM 0 HH12 ARG A 99 4.466 14.267 -1.039 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.421 12.260 -3.739 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.641 13.908 -3.141 1.00 0.00 H new ATOM 1519 N ILE A 100 3.357 5.734 -0.561 1.00 0.00 N ATOM 1520 CA ILE A 100 3.005 4.315 -0.674 1.00 0.00 C ATOM 1521 C ILE A 100 3.876 3.423 0.215 1.00 0.00 C ATOM 1522 O ILE A 100 4.986 3.791 0.583 1.00 0.00 O ATOM 1523 CB ILE A 100 3.142 3.820 -2.134 1.00 0.00 C ATOM 1524 CG1 ILE A 100 4.620 3.675 -2.523 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.435 4.766 -3.089 1.00 0.00 C ATOM 1526 CD1 ILE A 100 5.053 2.239 -2.733 1.00 0.00 C ATOM 0 H ILE A 100 4.098 6.032 -1.195 1.00 0.00 H new ATOM 0 HA ILE A 100 1.969 4.240 -0.344 1.00 0.00 H new ATOM 0 HB ILE A 100 2.670 2.840 -2.205 1.00 0.00 H new ATOM 0 HG12 ILE A 100 4.803 4.239 -3.438 1.00 0.00 H new ATOM 0 HG13 ILE A 100 5.238 4.122 -1.744 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.543 4.400 -4.110 1.00 0.00 H new ATOM 0 HG22 ILE A 100 1.377 4.818 -2.832 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.877 5.759 -3.011 1.00 0.00 H new ATOM 0 HD11 ILE A 100 6.108 2.213 -3.005 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.902 1.675 -1.812 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.461 1.794 -3.533 1.00 0.00 H new ATOM 1538 N LEU A 101 3.364 2.229 0.520 1.00 0.00 N ATOM 1539 CA LEU A 101 4.092 1.250 1.329 1.00 0.00 C ATOM 1540 C LEU A 101 3.288 -0.039 1.474 1.00 0.00 C ATOM 1541 O LEU A 101 2.061 -0.039 1.347 1.00 0.00 O ATOM 1542 CB LEU A 101 4.478 1.823 2.703 1.00 0.00 C ATOM 1543 CG LEU A 101 3.391 2.594 3.461 1.00 0.00 C ATOM 1544 CD1 LEU A 101 3.423 4.067 3.096 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.019 2.001 3.201 1.00 0.00 C ATOM 0 H LEU A 101 2.442 1.916 0.217 1.00 0.00 H new ATOM 0 HA LEU A 101 5.019 1.014 0.806 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.812 0.999 3.333 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.332 2.486 2.567 1.00 0.00 H new ATOM 0 HG LEU A 101 3.596 2.504 4.528 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.643 4.595 3.645 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.396 4.485 3.355 1.00 0.00 H new ATOM 0 HD13 LEU A 101 3.253 4.180 2.025 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.268 2.567 3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.799 2.047 2.134 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.003 0.962 3.530 1.00 0.00 H new ATOM 1557 N PHE A 102 3.988 -1.147 1.713 1.00 0.00 N ATOM 1558 CA PHE A 102 3.321 -2.442 1.846 1.00 0.00 C ATOM 1559 C PHE A 102 3.219 -2.877 3.305 1.00 0.00 C ATOM 1560 O PHE A 102 3.870 -2.311 4.192 1.00 0.00 O ATOM 1561 CB PHE A 102 4.051 -3.505 1.022 1.00 0.00 C ATOM 1562 CG PHE A 102 4.423 -3.038 -0.359 1.00 0.00 C ATOM 1563 CD1 PHE A 102 5.468 -2.146 -0.548 1.00 0.00 C ATOM 1564 CD2 PHE A 102 3.725 -3.489 -1.469 1.00 0.00 C ATOM 1565 CE1 PHE A 102 5.809 -1.714 -1.814 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.063 -3.059 -2.739 1.00 0.00 C ATOM 1567 CZ PHE A 102 5.106 -2.170 -2.912 1.00 0.00 C ATOM 0 H PHE A 102 5.002 -1.176 1.817 1.00 0.00 H new ATOM 0 HA PHE A 102 2.306 -2.331 1.463 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.955 -3.807 1.551 1.00 0.00 H new ATOM 0 HB3 PHE A 102 3.419 -4.389 0.941 1.00 0.00 H new ATOM 0 HD1 PHE A 102 6.022 -1.785 0.306 1.00 0.00 H new ATOM 0 HD2 PHE A 102 2.908 -4.184 -1.340 1.00 0.00 H new ATOM 0 HE1 PHE A 102 6.625 -1.019 -1.946 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.512 -3.418 -3.595 1.00 0.00 H new ATOM 0 HZ PHE A 102 5.371 -1.832 -3.903 1.00 0.00 H new ATOM 1577 N LEU A 103 2.376 -3.875 3.557 1.00 0.00 N ATOM 1578 CA LEU A 103 2.181 -4.360 4.915 1.00 0.00 C ATOM 1579 C LEU A 103 1.680 -5.798 4.954 1.00 0.00 C ATOM 1580 O LEU A 103 1.503 -6.441 3.917 1.00 0.00 O ATOM 1581 CB LEU A 103 1.192 -3.454 5.636 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.270 -3.646 5.256 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.153 -2.652 5.993 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.437 -3.510 3.754 1.00 0.00 C ATOM 0 H LEU A 103 1.825 -4.357 2.847 1.00 0.00 H new ATOM 0 HA LEU A 103 3.150 -4.342 5.413 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.295 -3.615 6.709 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.467 -2.417 5.441 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.580 -4.649 5.551 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.193 -2.807 5.706 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.047 -2.798 7.068 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.853 -1.637 5.734 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.486 -3.649 3.490 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.112 -2.518 3.440 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.167 -4.265 3.251 1.00 0.00 H new ATOM 1596 N ASP A 104 1.446 -6.292 6.168 1.00 0.00 N ATOM 1597 CA ASP A 104 0.957 -7.651 6.360 1.00 0.00 C ATOM 1598 C ASP A 104 -0.564 -7.706 6.226 1.00 0.00 C ATOM 1599 O ASP A 104 -1.262 -6.742 6.576 1.00 0.00 O ATOM 1600 CB ASP A 104 1.384 -8.189 7.728 1.00 0.00 C ATOM 1601 CG ASP A 104 0.954 -7.287 8.867 1.00 0.00 C ATOM 1602 OD1 ASP A 104 -0.127 -6.670 8.760 1.00 0.00 O ATOM 1603 OD2 ASP A 104 1.696 -7.201 9.867 1.00 0.00 O ATOM 0 H ASP A 104 1.588 -5.769 7.032 1.00 0.00 H new ATOM 0 HA ASP A 104 1.395 -8.279 5.584 1.00 0.00 H new ATOM 0 HB2 ASP A 104 0.957 -9.181 7.874 1.00 0.00 H new ATOM 0 HB3 ASP A 104 2.468 -8.302 7.748 1.00 0.00 H new ATOM 1608 N PRO A 105 -1.091 -8.840 5.717 1.00 0.00 N ATOM 1609 CA PRO A 105 -2.532 -9.039 5.524 1.00 0.00 C ATOM 1610 C PRO A 105 -3.312 -8.927 6.825 1.00 0.00 C ATOM 1611 O PRO A 105 -3.406 -9.886 7.593 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.642 -10.456 4.949 1.00 0.00 C ATOM 1613 CG PRO A 105 -1.344 -11.115 5.267 1.00 0.00 C ATOM 1614 CD PRO A 105 -0.318 -10.020 5.293 1.00 0.00 C ATOM 0 HA PRO A 105 -2.956 -8.276 4.871 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -3.477 -10.997 5.395 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.817 -10.431 3.873 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -1.392 -11.627 6.228 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -1.094 -11.866 4.518 1.00 0.00 H new ATOM 0 HD2 PRO A 105 0.490 -10.243 5.990 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.137 -9.872 4.314 1.00 0.00 H new ATOM 1622 N SER A 106 -3.866 -7.744 7.060 1.00 0.00 N ATOM 1623 CA SER A 106 -4.644 -7.459 8.262 1.00 0.00 C ATOM 1624 C SER A 106 -4.758 -5.953 8.458 1.00 0.00 C ATOM 1625 O SER A 106 -5.733 -5.458 9.023 1.00 0.00 O ATOM 1626 CB SER A 106 -3.998 -8.092 9.499 1.00 0.00 C ATOM 1627 OG SER A 106 -4.489 -7.500 10.690 1.00 0.00 O ATOM 0 H SER A 106 -3.789 -6.952 6.421 1.00 0.00 H new ATOM 0 HA SER A 106 -5.638 -7.889 8.135 1.00 0.00 H new ATOM 0 HB2 SER A 106 -4.201 -9.163 9.511 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.916 -7.973 9.449 1.00 0.00 H new ATOM 0 HG SER A 106 -4.063 -7.922 11.465 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.744 -5.232 7.985 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.730 -3.791 8.113 1.00 0.00 C ATOM 1635 C GLY A 107 -2.606 -3.311 9.007 1.00 0.00 C ATOM 1636 O GLY A 107 -2.800 -2.409 9.822 1.00 0.00 O ATOM 0 H GLY A 107 -2.930 -5.626 7.514 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.625 -3.341 7.126 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.684 -3.454 8.518 1.00 0.00 H new ATOM 1640 N LYS A 108 -1.426 -3.920 8.870 1.00 0.00 N ATOM 1641 CA LYS A 108 -0.286 -3.535 9.701 1.00 0.00 C ATOM 1642 C LYS A 108 0.916 -3.091 8.867 1.00 0.00 C ATOM 1643 O LYS A 108 1.860 -3.859 8.669 1.00 0.00 O ATOM 1644 CB LYS A 108 0.112 -4.696 10.616 1.00 0.00 C ATOM 1645 CG LYS A 108 0.280 -4.291 12.072 1.00 0.00 C ATOM 1646 CD LYS A 108 1.534 -4.897 12.678 1.00 0.00 C ATOM 1647 CE LYS A 108 1.334 -5.247 14.144 1.00 0.00 C ATOM 1648 NZ LYS A 108 2.583 -5.768 14.767 1.00 0.00 N ATOM 0 H LYS A 108 -1.237 -4.669 8.203 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.597 -2.681 10.303 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.646 -5.477 10.549 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.046 -5.127 10.257 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.328 -3.205 12.145 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.592 -4.611 12.642 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.810 -5.794 12.124 1.00 0.00 H new ATOM 0 HD3 LYS A 108 2.362 -4.195 12.581 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.000 -4.362 14.686 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.545 -5.993 14.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 2.404 -5.995 15.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 2.889 -6.627 14.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 3.329 -5.047 14.704 1.00 0.00 H new ATOM 1662 N VAL A 109 0.883 -1.843 8.392 1.00 0.00 N ATOM 1663 CA VAL A 109 1.974 -1.292 7.594 1.00 0.00 C ATOM 1664 C VAL A 109 3.273 -1.300 8.373 1.00 0.00 C ATOM 1665 O VAL A 109 3.327 -0.906 9.538 1.00 0.00 O ATOM 1666 CB VAL A 109 1.650 0.145 7.116 1.00 0.00 C ATOM 1667 CG1 VAL A 109 2.893 1.017 7.090 1.00 0.00 C ATOM 1668 CG2 VAL A 109 0.991 0.117 5.746 1.00 0.00 C ATOM 0 H VAL A 109 0.110 -1.197 8.548 1.00 0.00 H new ATOM 0 HA VAL A 109 2.090 -1.928 6.716 1.00 0.00 H new ATOM 0 HB VAL A 109 0.953 0.582 7.831 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.628 2.018 6.750 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.318 1.075 8.092 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.626 0.585 6.409 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.771 1.136 5.427 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.665 -0.350 5.028 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.064 -0.454 5.800 1.00 0.00 H new ATOM 1678 N HIS A 110 4.325 -1.744 7.704 1.00 0.00 N ATOM 1679 CA HIS A 110 5.641 -1.799 8.309 1.00 0.00 C ATOM 1680 C HIS A 110 6.666 -1.201 7.363 1.00 0.00 C ATOM 1681 O HIS A 110 6.608 -1.429 6.153 1.00 0.00 O ATOM 1682 CB HIS A 110 6.017 -3.243 8.648 1.00 0.00 C ATOM 1683 CG HIS A 110 6.974 -3.358 9.795 1.00 0.00 C ATOM 1684 ND1 HIS A 110 8.341 -3.260 9.647 1.00 0.00 N ATOM 1685 CD2 HIS A 110 6.755 -3.562 11.116 1.00 0.00 C ATOM 1686 CE1 HIS A 110 8.921 -3.399 10.824 1.00 0.00 C ATOM 1687 NE2 HIS A 110 7.982 -3.582 11.734 1.00 0.00 N ATOM 0 H HIS A 110 4.290 -2.072 6.739 1.00 0.00 H new ATOM 0 HA HIS A 110 5.626 -1.222 9.233 1.00 0.00 H new ATOM 0 HB2 HIS A 110 5.110 -3.800 8.884 1.00 0.00 H new ATOM 0 HB3 HIS A 110 6.459 -3.711 7.768 1.00 0.00 H new ATOM 0 HD2 HIS A 110 5.795 -3.686 11.594 1.00 0.00 H new ATOM 0 HE1 HIS A 110 9.984 -3.368 11.011 1.00 0.00 H new ATOM 0 HE2 HIS A 110 8.141 -3.716 12.732 1.00 0.00 H new ATOM 1696 N PRO A 111 7.623 -0.426 7.886 1.00 0.00 N ATOM 1697 CA PRO A 111 8.655 0.194 7.061 1.00 0.00 C ATOM 1698 C PRO A 111 9.661 -0.830 6.554 1.00 0.00 C ATOM 1699 O PRO A 111 10.868 -0.586 6.556 1.00 0.00 O ATOM 1700 CB PRO A 111 9.325 1.185 8.013 1.00 0.00 C ATOM 1701 CG PRO A 111 9.103 0.611 9.369 1.00 0.00 C ATOM 1702 CD PRO A 111 7.776 -0.096 9.313 1.00 0.00 C ATOM 0 HA PRO A 111 8.245 0.664 6.167 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.388 1.287 7.795 1.00 0.00 H new ATOM 0 HB3 PRO A 111 8.885 2.178 7.926 1.00 0.00 H new ATOM 0 HG2 PRO A 111 9.902 -0.081 9.634 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.095 1.394 10.127 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.771 -0.991 9.935 1.00 0.00 H new ATOM 0 HD3 PRO A 111 6.966 0.542 9.667 1.00 0.00 H new ATOM 1710 N GLU A 112 9.155 -1.985 6.130 1.00 0.00 N ATOM 1711 CA GLU A 112 10.012 -3.055 5.631 1.00 0.00 C ATOM 1712 C GLU A 112 9.986 -3.125 4.107 1.00 0.00 C ATOM 1713 O GLU A 112 10.986 -3.473 3.478 1.00 0.00 O ATOM 1714 CB GLU A 112 9.576 -4.397 6.220 1.00 0.00 C ATOM 1715 CG GLU A 112 10.738 -5.308 6.582 1.00 0.00 C ATOM 1716 CD GLU A 112 11.341 -5.992 5.370 1.00 0.00 C ATOM 1717 OE1 GLU A 112 12.249 -5.402 4.747 1.00 0.00 O ATOM 1718 OE2 GLU A 112 10.902 -7.115 5.043 1.00 0.00 O ATOM 0 H GLU A 112 8.159 -2.203 6.122 1.00 0.00 H new ATOM 0 HA GLU A 112 11.033 -2.837 5.943 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.976 -4.215 7.112 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.934 -4.908 5.502 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.508 -4.725 7.087 1.00 0.00 H new ATOM 0 HG3 GLU A 112 10.396 -6.064 7.289 1.00 0.00 H new ATOM 1725 N ILE A 113 8.839 -2.804 3.517 1.00 0.00 N ATOM 1726 CA ILE A 113 8.696 -2.843 2.067 1.00 0.00 C ATOM 1727 C ILE A 113 8.604 -1.441 1.472 1.00 0.00 C ATOM 1728 O ILE A 113 7.554 -0.791 1.536 1.00 0.00 O ATOM 1729 CB ILE A 113 7.455 -3.649 1.638 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.253 -4.858 2.554 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.595 -4.096 0.189 1.00 0.00 C ATOM 1732 CD1 ILE A 113 8.395 -5.850 2.503 1.00 0.00 C ATOM 0 H ILE A 113 7.999 -2.515 4.018 1.00 0.00 H new ATOM 0 HA ILE A 113 9.591 -3.335 1.686 1.00 0.00 H new ATOM 0 HB ILE A 113 6.578 -3.007 1.723 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.129 -4.510 3.580 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.329 -5.365 2.276 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.712 -4.665 -0.103 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.692 -3.221 -0.454 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.481 -4.723 0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.185 -6.681 3.176 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.505 -6.226 1.486 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.318 -5.358 2.810 1.00 0.00 H new ATOM 1744 N ILE A 114 9.717 -0.993 0.888 1.00 0.00 N ATOM 1745 CA ILE A 114 9.801 0.325 0.266 1.00 0.00 C ATOM 1746 C ILE A 114 9.985 0.206 -1.243 1.00 0.00 C ATOM 1747 O ILE A 114 9.918 -0.889 -1.803 1.00 0.00 O ATOM 1748 CB ILE A 114 10.978 1.143 0.848 1.00 0.00 C ATOM 1749 CG1 ILE A 114 12.322 0.480 0.501 1.00 0.00 C ATOM 1750 CG2 ILE A 114 10.825 1.304 2.355 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.731 -0.634 1.444 1.00 0.00 C ATOM 0 H ILE A 114 10.581 -1.533 0.834 1.00 0.00 H new ATOM 0 HA ILE A 114 8.864 0.839 0.479 1.00 0.00 H new ATOM 0 HB ILE A 114 10.964 2.136 0.398 1.00 0.00 H new ATOM 0 HG12 ILE A 114 12.266 0.080 -0.512 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.100 1.243 0.500 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.662 1.882 2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.892 1.824 2.573 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.811 0.321 2.826 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.689 -1.046 1.127 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.823 -0.239 2.456 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.975 -1.420 1.429 1.00 0.00 H new ATOM 1763 N ASN A 115 10.237 1.337 -1.894 1.00 0.00 N ATOM 1764 CA ASN A 115 10.453 1.360 -3.334 1.00 0.00 C ATOM 1765 C ASN A 115 11.945 1.255 -3.640 1.00 0.00 C ATOM 1766 O ASN A 115 12.632 2.264 -3.786 1.00 0.00 O ATOM 1767 CB ASN A 115 9.886 2.642 -3.942 1.00 0.00 C ATOM 1768 CG ASN A 115 9.843 2.591 -5.458 1.00 0.00 C ATOM 1769 OD1 ASN A 115 10.524 1.777 -6.082 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.039 3.460 -6.059 1.00 0.00 N ATOM 0 H ASN A 115 10.296 2.251 -1.445 1.00 0.00 H new ATOM 0 HA ASN A 115 9.936 0.508 -3.775 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.880 2.809 -3.558 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.493 3.490 -3.626 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.968 3.470 -7.076 1.00 0.00 H new ATOM 0 HD22 ASN A 115 8.492 4.118 -5.503 1.00 0.00 H new ATOM 1777 N GLU A 116 12.439 0.025 -3.718 1.00 0.00 N ATOM 1778 CA GLU A 116 13.850 -0.222 -3.990 1.00 0.00 C ATOM 1779 C GLU A 116 14.327 0.529 -5.232 1.00 0.00 C ATOM 1780 O GLU A 116 15.514 0.818 -5.371 1.00 0.00 O ATOM 1781 CB GLU A 116 14.099 -1.721 -4.155 1.00 0.00 C ATOM 1782 CG GLU A 116 14.180 -2.465 -2.833 1.00 0.00 C ATOM 1783 CD GLU A 116 15.457 -2.166 -2.073 1.00 0.00 C ATOM 1784 OE1 GLU A 116 15.599 -1.030 -1.573 1.00 0.00 O ATOM 1785 OE2 GLU A 116 16.316 -3.068 -1.976 1.00 0.00 O ATOM 0 H GLU A 116 11.881 -0.820 -3.596 1.00 0.00 H new ATOM 0 HA GLU A 116 14.421 0.149 -3.139 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.299 -2.151 -4.758 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.028 -1.870 -4.705 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.323 -2.196 -2.216 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.115 -3.537 -3.019 1.00 0.00 H new ATOM 1792 N ASN A 117 13.398 0.847 -6.128 1.00 0.00 N ATOM 1793 CA ASN A 117 13.744 1.567 -7.350 1.00 0.00 C ATOM 1794 C ASN A 117 13.425 3.055 -7.228 1.00 0.00 C ATOM 1795 O ASN A 117 13.488 3.791 -8.213 1.00 0.00 O ATOM 1796 CB ASN A 117 13.004 0.976 -8.548 1.00 0.00 C ATOM 1797 CG ASN A 117 13.525 1.521 -9.864 1.00 0.00 C ATOM 1798 OD1 ASN A 117 12.825 2.249 -10.569 1.00 0.00 O ATOM 1799 ND2 ASN A 117 14.760 1.171 -10.202 1.00 0.00 N ATOM 0 H ASN A 117 12.408 0.620 -6.033 1.00 0.00 H new ATOM 0 HA ASN A 117 14.818 1.458 -7.503 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.108 -0.109 -8.539 1.00 0.00 H new ATOM 0 HB3 ASN A 117 11.940 1.195 -8.461 1.00 0.00 H new ATOM 0 HD21 ASN A 117 15.164 1.507 -11.076 1.00 0.00 H new ATOM 0 HD22 ASN A 117 15.305 0.566 -9.588 1.00 0.00 H new ATOM 1806 N GLY A 118 13.089 3.499 -6.019 1.00 0.00 N ATOM 1807 CA GLY A 118 12.777 4.896 -5.810 1.00 0.00 C ATOM 1808 C GLY A 118 13.988 5.686 -5.363 1.00 0.00 C ATOM 1809 O GLY A 118 15.039 5.114 -5.073 1.00 0.00 O ATOM 0 H GLY A 118 13.028 2.915 -5.185 1.00 0.00 H new ATOM 0 HA2 GLY A 118 12.387 5.323 -6.734 1.00 0.00 H new ATOM 0 HA3 GLY A 118 11.990 4.984 -5.061 1.00 0.00 H new ATOM 1813 N ASN A 119 13.842 7.002 -5.307 1.00 0.00 N ATOM 1814 CA ASN A 119 14.936 7.873 -4.890 1.00 0.00 C ATOM 1815 C ASN A 119 15.463 7.456 -3.518 1.00 0.00 C ATOM 1816 O ASN A 119 14.693 7.036 -2.655 1.00 0.00 O ATOM 1817 CB ASN A 119 14.479 9.333 -4.855 1.00 0.00 C ATOM 1818 CG ASN A 119 13.097 9.494 -4.256 1.00 0.00 C ATOM 1819 OD1 ASN A 119 12.596 8.604 -3.570 1.00 0.00 O ATOM 1820 ND2 ASN A 119 12.475 10.636 -4.518 1.00 0.00 N ATOM 0 H ASN A 119 12.979 7.491 -5.544 1.00 0.00 H new ATOM 0 HA ASN A 119 15.742 7.776 -5.618 1.00 0.00 H new ATOM 0 HB2 ASN A 119 15.193 9.920 -4.277 1.00 0.00 H new ATOM 0 HB3 ASN A 119 14.482 9.736 -5.868 1.00 0.00 H new ATOM 0 HD21 ASN A 119 11.541 10.805 -4.145 1.00 0.00 H new ATOM 0 HD22 ASN A 119 12.931 11.345 -5.092 1.00 0.00 H new ATOM 1827 N PRO A 120 16.788 7.551 -3.298 1.00 0.00 N ATOM 1828 CA PRO A 120 17.411 7.167 -2.027 1.00 0.00 C ATOM 1829 C PRO A 120 17.172 8.188 -0.913 1.00 0.00 C ATOM 1830 O PRO A 120 18.118 8.647 -0.271 1.00 0.00 O ATOM 1831 CB PRO A 120 18.913 7.088 -2.362 1.00 0.00 C ATOM 1832 CG PRO A 120 19.015 7.263 -3.844 1.00 0.00 C ATOM 1833 CD PRO A 120 17.789 8.019 -4.263 1.00 0.00 C ATOM 0 HA PRO A 120 16.993 6.234 -1.649 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.471 7.864 -1.838 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.332 6.130 -2.052 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.919 7.810 -4.110 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.067 6.297 -4.347 1.00 0.00 H new ATOM 0 HD2 PRO A 120 17.937 9.097 -4.205 1.00 0.00 H new ATOM 0 HD3 PRO A 120 17.502 7.791 -5.290 1.00 0.00 H new ATOM 1841 N SER A 121 15.910 8.538 -0.679 1.00 0.00 N ATOM 1842 CA SER A 121 15.570 9.497 0.366 1.00 0.00 C ATOM 1843 C SER A 121 14.073 9.487 0.605 1.00 0.00 C ATOM 1844 O SER A 121 13.603 9.624 1.735 1.00 0.00 O ATOM 1845 CB SER A 121 16.012 10.905 -0.034 1.00 0.00 C ATOM 1846 OG SER A 121 17.425 11.018 -0.031 1.00 0.00 O ATOM 0 H SER A 121 15.110 8.174 -1.196 1.00 0.00 H new ATOM 0 HA SER A 121 16.089 9.211 1.281 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.628 11.142 -1.026 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.585 11.633 0.656 1.00 0.00 H new ATOM 0 HG SER A 121 17.818 10.193 0.322 1.00 0.00 H new ATOM 1852 N TYR A 122 13.338 9.338 -0.482 1.00 0.00 N ATOM 1853 CA TYR A 122 11.894 9.322 -0.443 1.00 0.00 C ATOM 1854 C TYR A 122 11.355 7.891 -0.462 1.00 0.00 C ATOM 1855 O TYR A 122 10.351 7.590 0.178 1.00 0.00 O ATOM 1856 CB TYR A 122 11.377 10.102 -1.638 1.00 0.00 C ATOM 1857 CG TYR A 122 10.494 11.273 -1.267 1.00 0.00 C ATOM 1858 CD1 TYR A 122 9.198 11.084 -0.802 1.00 0.00 C ATOM 1859 CD2 TYR A 122 10.967 12.572 -1.381 1.00 0.00 C ATOM 1860 CE1 TYR A 122 8.400 12.159 -0.463 1.00 0.00 C ATOM 1861 CE2 TYR A 122 10.176 13.652 -1.043 1.00 0.00 C ATOM 1862 CZ TYR A 122 8.893 13.441 -0.585 1.00 0.00 C ATOM 1863 OH TYR A 122 8.102 14.515 -0.249 1.00 0.00 O ATOM 0 H TYR A 122 13.730 9.225 -1.417 1.00 0.00 H new ATOM 0 HA TYR A 122 11.551 9.782 0.483 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.226 10.468 -2.216 1.00 0.00 H new ATOM 0 HB3 TYR A 122 10.817 9.427 -2.286 1.00 0.00 H new ATOM 0 HD1 TYR A 122 8.809 10.081 -0.704 1.00 0.00 H new ATOM 0 HD2 TYR A 122 11.971 12.742 -1.740 1.00 0.00 H new ATOM 0 HE1 TYR A 122 7.394 11.996 -0.104 1.00 0.00 H new ATOM 0 HE2 TYR A 122 10.560 14.657 -1.137 1.00 0.00 H new ATOM 0 HH TYR A 122 8.601 15.346 -0.392 1.00 0.00 H new ATOM 1873 N LYS A 123 12.037 7.017 -1.201 1.00 0.00 N ATOM 1874 CA LYS A 123 11.640 5.611 -1.308 1.00 0.00 C ATOM 1875 C LYS A 123 10.157 5.462 -1.661 1.00 0.00 C ATOM 1876 O LYS A 123 9.797 5.330 -2.830 1.00 0.00 O ATOM 1877 CB LYS A 123 11.945 4.875 0.000 1.00 0.00 C ATOM 1878 CG LYS A 123 13.330 4.246 0.041 1.00 0.00 C ATOM 1879 CD LYS A 123 13.562 3.320 -1.143 1.00 0.00 C ATOM 1880 CE LYS A 123 14.544 3.919 -2.134 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.899 4.087 -1.539 1.00 0.00 N ATOM 0 H LYS A 123 12.871 7.258 -1.737 1.00 0.00 H new ATOM 0 HA LYS A 123 12.219 5.167 -2.118 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.849 5.574 0.831 1.00 0.00 H new ATOM 0 HB3 LYS A 123 11.198 4.096 0.151 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.086 5.031 0.043 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.449 3.687 0.969 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.941 2.362 -0.788 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.614 3.122 -1.643 1.00 0.00 H new ATOM 0 HE2 LYS A 123 14.610 3.277 -3.013 1.00 0.00 H new ATOM 0 HE3 LYS A 123 14.174 4.887 -2.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.587 4.287 -2.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.886 4.878 -0.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.171 3.214 -1.044 1.00 0.00 H new ATOM 1895 N TYR A 124 9.302 5.477 -0.640 1.00 0.00 N ATOM 1896 CA TYR A 124 7.857 5.332 -0.826 1.00 0.00 C ATOM 1897 C TYR A 124 7.321 6.199 -1.967 1.00 0.00 C ATOM 1898 O TYR A 124 6.237 5.937 -2.493 1.00 0.00 O ATOM 1899 CB TYR A 124 7.123 5.674 0.471 1.00 0.00 C ATOM 1900 CG TYR A 124 7.267 4.635 1.564 1.00 0.00 C ATOM 1901 CD1 TYR A 124 7.847 3.394 1.318 1.00 0.00 C ATOM 1902 CD2 TYR A 124 6.801 4.895 2.845 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.958 2.449 2.318 1.00 0.00 C ATOM 1904 CE2 TYR A 124 6.911 3.954 3.848 1.00 0.00 C ATOM 1905 CZ TYR A 124 7.489 2.734 3.579 1.00 0.00 C ATOM 1906 OH TYR A 124 7.595 1.794 4.576 1.00 0.00 O ATOM 0 H TYR A 124 9.587 5.589 0.333 1.00 0.00 H new ATOM 0 HA TYR A 124 7.674 4.292 -1.095 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.494 6.629 0.843 1.00 0.00 H new ATOM 0 HB3 TYR A 124 6.064 5.807 0.251 1.00 0.00 H new ATOM 0 HD1 TYR A 124 8.216 3.167 0.329 1.00 0.00 H new ATOM 0 HD2 TYR A 124 6.345 5.850 3.060 1.00 0.00 H new ATOM 0 HE1 TYR A 124 8.411 1.491 2.111 1.00 0.00 H new ATOM 0 HE2 TYR A 124 6.545 4.174 4.840 1.00 0.00 H new ATOM 0 HH TYR A 124 7.174 2.135 5.393 1.00 0.00 H new ATOM 1916 N PHE A 125 8.075 7.229 -2.347 1.00 0.00 N ATOM 1917 CA PHE A 125 7.664 8.117 -3.430 1.00 0.00 C ATOM 1918 C PHE A 125 7.450 7.328 -4.717 1.00 0.00 C ATOM 1919 O PHE A 125 8.222 6.421 -5.032 1.00 0.00 O ATOM 1920 CB PHE A 125 8.722 9.198 -3.657 1.00 0.00 C ATOM 1921 CG PHE A 125 8.341 10.214 -4.697 1.00 0.00 C ATOM 1922 CD1 PHE A 125 7.048 10.710 -4.761 1.00 0.00 C ATOM 1923 CD2 PHE A 125 9.276 10.673 -5.610 1.00 0.00 C ATOM 1924 CE1 PHE A 125 6.697 11.644 -5.719 1.00 0.00 C ATOM 1925 CE2 PHE A 125 8.931 11.608 -6.569 1.00 0.00 C ATOM 1926 CZ PHE A 125 7.640 12.094 -6.623 1.00 0.00 C ATOM 0 H PHE A 125 8.971 7.468 -1.922 1.00 0.00 H new ATOM 0 HA PHE A 125 6.724 8.590 -3.147 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.911 9.711 -2.714 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.656 8.722 -3.954 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.307 10.364 -4.056 1.00 0.00 H new ATOM 0 HD2 PHE A 125 10.287 10.296 -5.573 1.00 0.00 H new ATOM 0 HE1 PHE A 125 5.686 12.021 -5.760 1.00 0.00 H new ATOM 0 HE2 PHE A 125 9.670 11.957 -7.274 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.368 12.825 -7.370 1.00 0.00 H new ATOM 1936 N TYR A 126 6.405 7.675 -5.460 1.00 0.00 N ATOM 1937 CA TYR A 126 6.106 6.992 -6.714 1.00 0.00 C ATOM 1938 C TYR A 126 6.284 7.932 -7.900 1.00 0.00 C ATOM 1939 O TYR A 126 6.005 9.127 -7.810 1.00 0.00 O ATOM 1940 CB TYR A 126 4.674 6.436 -6.702 1.00 0.00 C ATOM 1941 CG TYR A 126 4.566 4.959 -6.364 1.00 0.00 C ATOM 1942 CD1 TYR A 126 5.642 4.087 -6.525 1.00 0.00 C ATOM 1943 CD2 TYR A 126 3.370 4.433 -5.889 1.00 0.00 C ATOM 1944 CE1 TYR A 126 5.526 2.745 -6.219 1.00 0.00 C ATOM 1945 CE2 TYR A 126 3.249 3.092 -5.581 1.00 0.00 C ATOM 1946 CZ TYR A 126 4.329 2.252 -5.749 1.00 0.00 C ATOM 1947 OH TYR A 126 4.211 0.915 -5.444 1.00 0.00 O ATOM 0 H TYR A 126 5.753 8.421 -5.218 1.00 0.00 H new ATOM 0 HA TYR A 126 6.806 6.163 -6.816 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.085 7.003 -5.981 1.00 0.00 H new ATOM 0 HB3 TYR A 126 4.226 6.604 -7.681 1.00 0.00 H new ATOM 0 HD1 TYR A 126 6.582 4.467 -6.895 1.00 0.00 H new ATOM 0 HD2 TYR A 126 2.519 5.085 -5.758 1.00 0.00 H new ATOM 0 HE1 TYR A 126 6.371 2.085 -6.348 1.00 0.00 H new ATOM 0 HE2 TYR A 126 2.312 2.703 -5.210 1.00 0.00 H new ATOM 0 HH TYR A 126 3.356 0.757 -4.992 1.00 0.00 H new ATOM 1957 N VAL A 127 6.747 7.377 -9.012 1.00 0.00 N ATOM 1958 CA VAL A 127 6.967 8.141 -10.229 1.00 0.00 C ATOM 1959 C VAL A 127 7.176 7.203 -11.407 1.00 0.00 C ATOM 1960 O VAL A 127 8.268 6.670 -11.598 1.00 0.00 O ATOM 1961 CB VAL A 127 8.186 9.076 -10.111 1.00 0.00 C ATOM 1962 CG1 VAL A 127 7.819 10.339 -9.352 1.00 0.00 C ATOM 1963 CG2 VAL A 127 9.348 8.361 -9.437 1.00 0.00 C ATOM 0 H VAL A 127 6.980 6.387 -9.094 1.00 0.00 H new ATOM 0 HA VAL A 127 6.079 8.753 -10.388 1.00 0.00 H new ATOM 0 HB VAL A 127 8.498 9.360 -11.116 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.693 10.987 -9.279 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.022 10.863 -9.881 1.00 0.00 H new ATOM 0 HG13 VAL A 127 7.478 10.076 -8.351 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.199 9.039 -9.363 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.050 8.043 -8.438 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.629 7.488 -10.026 1.00 0.00 H new ATOM 1973 N SER A 128 6.116 6.997 -12.184 1.00 0.00 N ATOM 1974 CA SER A 128 6.163 6.109 -13.348 1.00 0.00 C ATOM 1975 C SER A 128 5.868 4.666 -12.948 1.00 0.00 C ATOM 1976 O SER A 128 6.485 4.122 -12.030 1.00 0.00 O ATOM 1977 CB SER A 128 7.520 6.195 -14.059 1.00 0.00 C ATOM 1978 OG SER A 128 8.416 5.203 -13.582 1.00 0.00 O ATOM 0 H SER A 128 5.208 7.435 -12.029 1.00 0.00 H new ATOM 0 HA SER A 128 5.391 6.441 -14.043 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.379 6.074 -15.133 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.952 7.183 -13.904 1.00 0.00 H new ATOM 0 HG SER A 128 8.663 5.404 -12.655 1.00 0.00 H new ATOM 1984 N ALA A 129 4.923 4.050 -13.653 1.00 0.00 N ATOM 1985 CA ALA A 129 4.540 2.668 -13.387 1.00 0.00 C ATOM 1986 C ALA A 129 5.731 1.725 -13.540 1.00 0.00 C ATOM 1987 O ALA A 129 5.694 0.588 -13.074 1.00 0.00 O ATOM 1988 CB ALA A 129 3.412 2.248 -14.315 1.00 0.00 C ATOM 0 H ALA A 129 4.407 4.489 -14.416 1.00 0.00 H new ATOM 0 HA ALA A 129 4.193 2.606 -12.356 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.135 1.215 -14.107 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.549 2.894 -14.154 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.742 2.334 -15.350 1.00 0.00 H new ATOM 1994 N GLU A 130 6.784 2.197 -14.201 1.00 0.00 N ATOM 1995 CA GLU A 130 7.974 1.386 -14.413 1.00 0.00 C ATOM 1996 C GLU A 130 8.568 0.926 -13.085 1.00 0.00 C ATOM 1997 O GLU A 130 8.822 -0.261 -12.883 1.00 0.00 O ATOM 1998 CB GLU A 130 9.020 2.168 -15.211 1.00 0.00 C ATOM 1999 CG GLU A 130 9.678 1.352 -16.310 1.00 0.00 C ATOM 2000 CD GLU A 130 11.163 1.627 -16.430 1.00 0.00 C ATOM 2001 OE1 GLU A 130 11.533 2.605 -17.115 1.00 0.00 O ATOM 2002 OE2 GLU A 130 11.958 0.866 -15.840 1.00 0.00 O ATOM 0 H GLU A 130 6.836 3.135 -14.598 1.00 0.00 H new ATOM 0 HA GLU A 130 7.680 0.504 -14.982 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.547 3.044 -15.654 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.789 2.531 -14.529 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.523 0.291 -16.112 1.00 0.00 H new ATOM 0 HG3 GLU A 130 9.193 1.573 -17.261 1.00 0.00 H new ATOM 2009 N GLN A 131 8.794 1.865 -12.176 1.00 0.00 N ATOM 2010 CA GLN A 131 9.362 1.515 -10.886 1.00 0.00 C ATOM 2011 C GLN A 131 8.334 0.841 -9.989 1.00 0.00 C ATOM 2012 O GLN A 131 8.611 -0.195 -9.386 1.00 0.00 O ATOM 2013 CB GLN A 131 9.936 2.729 -10.175 1.00 0.00 C ATOM 2014 CG GLN A 131 8.948 3.864 -9.982 1.00 0.00 C ATOM 2015 CD GLN A 131 9.568 5.050 -9.271 1.00 0.00 C ATOM 2016 OE1 GLN A 131 8.913 5.513 -8.214 1.00 0.00 O flip ATOM 2017 NE2 GLN A 131 10.627 5.541 -9.664 1.00 0.00 N flip ATOM 0 H GLN A 131 8.596 2.857 -12.306 1.00 0.00 H new ATOM 0 HA GLN A 131 10.172 0.813 -11.085 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.312 2.420 -9.200 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.790 3.098 -10.743 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.569 4.183 -10.953 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.093 3.505 -9.409 1.00 0.00 H new ATOM 0 HE21 GLN A 131 11.097 5.153 -10.482 1.00 0.00 H new ATOM 0 HE22 GLN A 131 11.034 6.336 -9.172 1.00 0.00 H new ATOM 2026 N VAL A 132 7.145 1.431 -9.899 1.00 0.00 N ATOM 2027 CA VAL A 132 6.086 0.873 -9.069 1.00 0.00 C ATOM 2028 C VAL A 132 5.895 -0.612 -9.367 1.00 0.00 C ATOM 2029 O VAL A 132 5.463 -1.377 -8.505 1.00 0.00 O ATOM 2030 CB VAL A 132 4.742 1.617 -9.254 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.958 3.113 -9.419 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.951 1.056 -10.429 1.00 0.00 C ATOM 0 H VAL A 132 6.893 2.290 -10.388 1.00 0.00 H new ATOM 0 HA VAL A 132 6.398 1.001 -8.033 1.00 0.00 H new ATOM 0 HB VAL A 132 4.157 1.456 -8.349 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.995 3.608 -9.547 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.454 3.509 -8.533 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.579 3.296 -10.296 1.00 0.00 H new ATOM 0 HG21 VAL A 132 3.013 1.602 -10.530 1.00 0.00 H new ATOM 0 HG22 VAL A 132 4.533 1.163 -11.344 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.740 0.001 -10.255 1.00 0.00 H new ATOM 2042 N VAL A 133 6.221 -1.013 -10.597 1.00 0.00 N ATOM 2043 CA VAL A 133 6.078 -2.405 -11.001 1.00 0.00 C ATOM 2044 C VAL A 133 7.294 -3.239 -10.611 1.00 0.00 C ATOM 2045 O VAL A 133 7.164 -4.442 -10.387 1.00 0.00 O ATOM 2046 CB VAL A 133 5.830 -2.555 -12.516 1.00 0.00 C ATOM 2047 CG1 VAL A 133 7.059 -2.152 -13.309 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.426 -3.985 -12.846 1.00 0.00 C ATOM 0 H VAL A 133 6.583 -0.395 -11.323 1.00 0.00 H new ATOM 0 HA VAL A 133 5.204 -2.776 -10.466 1.00 0.00 H new ATOM 0 HB VAL A 133 5.014 -1.888 -12.797 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.858 -2.267 -14.374 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.304 -1.112 -13.096 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.898 -2.788 -13.027 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.254 -4.076 -13.918 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.222 -4.666 -12.547 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.512 -4.238 -12.309 1.00 0.00 H new ATOM 2058 N GLN A 134 8.476 -2.620 -10.520 1.00 0.00 N ATOM 2059 CA GLN A 134 9.661 -3.388 -10.132 1.00 0.00 C ATOM 2060 C GLN A 134 9.639 -3.611 -8.632 1.00 0.00 C ATOM 2061 O GLN A 134 9.919 -4.709 -8.149 1.00 0.00 O ATOM 2062 CB GLN A 134 10.976 -2.725 -10.563 1.00 0.00 C ATOM 2063 CG GLN A 134 10.916 -1.218 -10.686 1.00 0.00 C ATOM 2064 CD GLN A 134 12.162 -0.637 -11.326 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.081 0.272 -12.153 1.00 0.00 O ATOM 2066 NE2 GLN A 134 13.322 -1.157 -10.947 1.00 0.00 N ATOM 0 H GLN A 134 8.635 -1.629 -10.702 1.00 0.00 H new ATOM 0 HA GLN A 134 9.622 -4.343 -10.655 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.751 -2.986 -9.843 1.00 0.00 H new ATOM 0 HB3 GLN A 134 11.279 -3.142 -11.523 1.00 0.00 H new ATOM 0 HG2 GLN A 134 10.044 -0.940 -11.278 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.782 -0.781 -9.696 1.00 0.00 H new ATOM 0 HE21 GLN A 134 13.343 -1.909 -10.259 1.00 0.00 H new ATOM 0 HE22 GLN A 134 14.193 -0.804 -11.344 1.00 0.00 H new ATOM 2075 N GLY A 135 9.254 -2.575 -7.898 1.00 0.00 N ATOM 2076 CA GLY A 135 9.144 -2.699 -6.463 1.00 0.00 C ATOM 2077 C GLY A 135 7.937 -3.539 -6.096 1.00 0.00 C ATOM 2078 O GLY A 135 7.862 -4.098 -5.001 1.00 0.00 O ATOM 0 H GLY A 135 9.017 -1.656 -8.271 1.00 0.00 H new ATOM 0 HA2 GLY A 135 10.048 -3.155 -6.061 1.00 0.00 H new ATOM 0 HA3 GLY A 135 9.058 -1.711 -6.012 1.00 0.00 H new ATOM 2082 N MET A 136 6.991 -3.632 -7.037 1.00 0.00 N ATOM 2083 CA MET A 136 5.779 -4.414 -6.839 1.00 0.00 C ATOM 2084 C MET A 136 6.027 -5.879 -7.189 1.00 0.00 C ATOM 2085 O MET A 136 5.557 -6.782 -6.503 1.00 0.00 O ATOM 2086 CB MET A 136 4.650 -3.836 -7.704 1.00 0.00 C ATOM 2087 CG MET A 136 3.487 -4.787 -7.938 1.00 0.00 C ATOM 2088 SD MET A 136 3.399 -5.365 -9.642 1.00 0.00 S ATOM 2089 CE MET A 136 2.680 -3.934 -10.444 1.00 0.00 C ATOM 0 H MET A 136 7.048 -3.171 -7.945 1.00 0.00 H new ATOM 0 HA MET A 136 5.486 -4.362 -5.790 1.00 0.00 H new ATOM 0 HB2 MET A 136 4.273 -2.930 -7.229 1.00 0.00 H new ATOM 0 HB3 MET A 136 5.063 -3.542 -8.669 1.00 0.00 H new ATOM 0 HG2 MET A 136 3.583 -5.644 -7.272 1.00 0.00 H new ATOM 0 HG3 MET A 136 2.554 -4.286 -7.679 1.00 0.00 H new ATOM 0 HE1 MET A 136 1.751 -4.221 -10.936 1.00 0.00 H new ATOM 0 HE2 MET A 136 2.474 -3.165 -9.700 1.00 0.00 H new ATOM 0 HE3 MET A 136 3.377 -3.544 -11.185 1.00 0.00 H new ATOM 2099 N LYS A 137 6.774 -6.094 -8.264 1.00 0.00 N ATOM 2100 CA LYS A 137 7.104 -7.437 -8.728 1.00 0.00 C ATOM 2101 C LYS A 137 8.125 -8.111 -7.810 1.00 0.00 C ATOM 2102 O LYS A 137 8.353 -9.316 -7.902 1.00 0.00 O ATOM 2103 CB LYS A 137 7.612 -7.396 -10.173 1.00 0.00 C ATOM 2104 CG LYS A 137 9.064 -6.972 -10.326 1.00 0.00 C ATOM 2105 CD LYS A 137 9.351 -6.478 -11.738 1.00 0.00 C ATOM 2106 CE LYS A 137 8.939 -7.499 -12.786 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.874 -8.655 -12.830 1.00 0.00 N ATOM 0 H LYS A 137 7.167 -5.347 -8.837 1.00 0.00 H new ATOM 0 HA LYS A 137 6.193 -8.034 -8.699 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.488 -8.385 -10.615 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.986 -6.711 -10.744 1.00 0.00 H new ATOM 0 HG2 LYS A 137 9.292 -6.183 -9.609 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.717 -7.813 -10.093 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.818 -5.543 -11.912 1.00 0.00 H new ATOM 0 HD3 LYS A 137 10.415 -6.262 -11.839 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.931 -7.855 -12.570 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.906 -7.021 -13.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.559 -9.329 -13.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.831 -8.319 -13.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.887 -9.127 -11.903 1.00 0.00 H new ATOM 2121 N GLU A 138 8.741 -7.323 -6.933 1.00 0.00 N ATOM 2122 CA GLU A 138 9.743 -7.841 -6.005 1.00 0.00 C ATOM 2123 C GLU A 138 9.114 -8.245 -4.678 1.00 0.00 C ATOM 2124 O GLU A 138 9.037 -9.427 -4.344 1.00 0.00 O ATOM 2125 CB GLU A 138 10.828 -6.789 -5.761 1.00 0.00 C ATOM 2126 CG GLU A 138 12.241 -7.310 -5.972 1.00 0.00 C ATOM 2127 CD GLU A 138 12.877 -7.805 -4.687 1.00 0.00 C ATOM 2128 OE1 GLU A 138 13.299 -6.958 -3.871 1.00 0.00 O ATOM 2129 OE2 GLU A 138 12.953 -9.035 -4.498 1.00 0.00 O ATOM 0 H GLU A 138 8.564 -6.322 -6.845 1.00 0.00 H new ATOM 0 HA GLU A 138 10.188 -8.728 -6.456 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.658 -5.943 -6.427 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.736 -6.415 -4.741 1.00 0.00 H new ATOM 0 HG2 GLU A 138 12.220 -8.122 -6.699 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.857 -6.517 -6.396 1.00 0.00 H new ATOM 2136 N ALA A 139 8.675 -7.247 -3.921 1.00 0.00 N ATOM 2137 CA ALA A 139 8.061 -7.478 -2.619 1.00 0.00 C ATOM 2138 C ALA A 139 6.872 -8.429 -2.710 1.00 0.00 C ATOM 2139 O ALA A 139 6.455 -9.009 -1.708 1.00 0.00 O ATOM 2140 CB ALA A 139 7.630 -6.156 -2.005 1.00 0.00 C ATOM 0 H ALA A 139 8.733 -6.264 -4.188 1.00 0.00 H new ATOM 0 HA ALA A 139 8.808 -7.949 -1.980 1.00 0.00 H new ATOM 0 HB1 ALA A 139 7.172 -6.338 -1.033 1.00 0.00 H new ATOM 0 HB2 ALA A 139 8.500 -5.511 -1.881 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.908 -5.669 -2.660 1.00 0.00 H new ATOM 2146 N GLN A 140 6.317 -8.575 -3.908 1.00 0.00 N ATOM 2147 CA GLN A 140 5.167 -9.440 -4.114 1.00 0.00 C ATOM 2148 C GLN A 140 5.481 -10.911 -3.833 1.00 0.00 C ATOM 2149 O GLN A 140 4.569 -11.729 -3.721 1.00 0.00 O ATOM 2150 CB GLN A 140 4.645 -9.292 -5.540 1.00 0.00 C ATOM 2151 CG GLN A 140 5.708 -9.487 -6.601 1.00 0.00 C ATOM 2152 CD GLN A 140 6.146 -10.931 -6.741 1.00 0.00 C ATOM 2153 OE1 GLN A 140 7.337 -11.237 -6.703 1.00 0.00 O ATOM 2154 NE2 GLN A 140 5.182 -11.831 -6.908 1.00 0.00 N ATOM 0 H GLN A 140 6.647 -8.104 -4.750 1.00 0.00 H new ATOM 0 HA GLN A 140 4.403 -9.126 -3.403 1.00 0.00 H new ATOM 0 HB2 GLN A 140 3.846 -10.015 -5.702 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.206 -8.301 -5.656 1.00 0.00 H new ATOM 0 HG2 GLN A 140 5.326 -9.134 -7.559 1.00 0.00 H new ATOM 0 HG3 GLN A 140 6.574 -8.872 -6.357 1.00 0.00 H new ATOM 0 HE21 GLN A 140 4.206 -11.535 -6.934 1.00 0.00 H new ATOM 0 HE22 GLN A 140 5.418 -12.818 -7.010 1.00 0.00 H new ATOM 2163 N GLU A 141 6.765 -11.256 -3.743 1.00 0.00 N ATOM 2164 CA GLU A 141 7.156 -12.645 -3.501 1.00 0.00 C ATOM 2165 C GLU A 141 8.114 -12.795 -2.317 1.00 0.00 C ATOM 2166 O GLU A 141 8.325 -13.905 -1.828 1.00 0.00 O ATOM 2167 CB GLU A 141 7.790 -13.234 -4.748 1.00 0.00 C ATOM 2168 CG GLU A 141 9.094 -12.568 -5.076 1.00 0.00 C ATOM 2169 CD GLU A 141 9.702 -13.053 -6.377 1.00 0.00 C ATOM 2170 OE1 GLU A 141 10.407 -14.085 -6.355 1.00 0.00 O ATOM 2171 OE2 GLU A 141 9.474 -12.403 -7.419 1.00 0.00 O ATOM 0 H GLU A 141 7.543 -10.603 -3.833 1.00 0.00 H new ATOM 0 HA GLU A 141 6.245 -13.189 -3.251 1.00 0.00 H new ATOM 0 HB2 GLU A 141 7.953 -14.302 -4.603 1.00 0.00 H new ATOM 0 HB3 GLU A 141 7.105 -13.127 -5.589 1.00 0.00 H new ATOM 0 HG2 GLU A 141 8.940 -11.491 -5.134 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.800 -12.746 -4.264 1.00 0.00 H new ATOM 2178 N ARG A 142 8.704 -11.693 -1.866 1.00 0.00 N ATOM 2179 CA ARG A 142 9.645 -11.747 -0.750 1.00 0.00 C ATOM 2180 C ARG A 142 9.039 -11.198 0.543 1.00 0.00 C ATOM 2181 O ARG A 142 9.583 -11.415 1.625 1.00 0.00 O ATOM 2182 CB ARG A 142 10.937 -10.994 -1.089 1.00 0.00 C ATOM 2183 CG ARG A 142 10.715 -9.586 -1.616 1.00 0.00 C ATOM 2184 CD ARG A 142 10.653 -8.572 -0.486 1.00 0.00 C ATOM 2185 NE ARG A 142 11.832 -8.641 0.374 1.00 0.00 N ATOM 2186 CZ ARG A 142 11.846 -8.256 1.651 1.00 0.00 C ATOM 2187 NH1 ARG A 142 10.749 -7.765 2.220 1.00 0.00 N ATOM 2188 NH2 ARG A 142 12.961 -8.360 2.359 1.00 0.00 N ATOM 0 H ARG A 142 8.551 -10.761 -2.250 1.00 0.00 H new ATOM 0 HA ARG A 142 9.879 -12.799 -0.584 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.559 -10.942 -0.196 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.493 -11.565 -1.832 1.00 0.00 H new ATOM 0 HG2 ARG A 142 11.521 -9.321 -2.300 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.788 -9.552 -2.188 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.566 -7.569 -0.903 1.00 0.00 H new ATOM 0 HD3 ARG A 142 9.758 -8.748 0.111 1.00 0.00 H new ATOM 0 HE ARG A 142 12.696 -9.006 -0.026 1.00 0.00 H new ATOM 0 HH11 ARG A 142 9.888 -7.680 1.679 1.00 0.00 H new ATOM 0 HH12 ARG A 142 10.768 -7.473 3.197 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.806 -8.734 1.927 1.00 0.00 H new ATOM 0 HH22 ARG A 142 12.974 -8.066 3.336 1.00 0.00 H new ATOM 2202 N LEU A 143 7.916 -10.490 0.435 1.00 0.00 N ATOM 2203 CA LEU A 143 7.265 -9.930 1.617 1.00 0.00 C ATOM 2204 C LEU A 143 6.055 -10.765 2.031 1.00 0.00 C ATOM 2205 O LEU A 143 5.739 -10.867 3.216 1.00 0.00 O ATOM 2206 CB LEU A 143 6.857 -8.469 1.365 1.00 0.00 C ATOM 2207 CG LEU A 143 5.409 -8.247 0.913 1.00 0.00 C ATOM 2208 CD1 LEU A 143 4.465 -8.276 2.105 1.00 0.00 C ATOM 2209 CD2 LEU A 143 5.284 -6.929 0.166 1.00 0.00 C ATOM 0 H LEU A 143 7.443 -10.292 -0.447 1.00 0.00 H new ATOM 0 HA LEU A 143 7.981 -9.954 2.438 1.00 0.00 H new ATOM 0 HB2 LEU A 143 7.022 -7.903 2.282 1.00 0.00 H new ATOM 0 HB3 LEU A 143 7.522 -8.052 0.608 1.00 0.00 H new ATOM 0 HG LEU A 143 5.131 -9.056 0.237 1.00 0.00 H new ATOM 0 HD11 LEU A 143 3.442 -8.117 1.763 1.00 0.00 H new ATOM 0 HD12 LEU A 143 4.535 -9.244 2.601 1.00 0.00 H new ATOM 0 HD13 LEU A 143 4.740 -7.488 2.806 1.00 0.00 H new ATOM 0 HD21 LEU A 143 4.250 -6.786 -0.148 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.581 -6.110 0.821 1.00 0.00 H new ATOM 0 HD23 LEU A 143 5.931 -6.945 -0.711 1.00 0.00 H new ATOM 2221 N THR A 144 5.382 -11.361 1.050 1.00 0.00 N ATOM 2222 CA THR A 144 4.209 -12.187 1.312 1.00 0.00 C ATOM 2223 C THR A 144 4.488 -13.208 2.413 1.00 0.00 C ATOM 2224 O THR A 144 5.368 -14.057 2.276 1.00 0.00 O ATOM 2225 CB THR A 144 3.779 -12.904 0.033 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.674 -13.957 -0.277 1.00 0.00 O ATOM 2227 CG2 THR A 144 3.710 -11.991 -1.170 1.00 0.00 C ATOM 0 H THR A 144 5.631 -11.286 0.064 1.00 0.00 H new ATOM 0 HA THR A 144 3.404 -11.535 1.650 1.00 0.00 H new ATOM 0 HB THR A 144 2.778 -13.284 0.238 1.00 0.00 H new ATOM 0 HG1 THR A 144 5.376 -14.002 0.406 1.00 0.00 H new ATOM 0 HG21 THR A 144 3.399 -12.563 -2.044 1.00 0.00 H new ATOM 0 HG22 THR A 144 2.989 -11.195 -0.982 1.00 0.00 H new ATOM 0 HG23 THR A 144 4.692 -11.555 -1.353 1.00 0.00 H new ATOM 2235 N GLY A 145 3.733 -13.117 3.504 1.00 0.00 N ATOM 2236 CA GLY A 145 3.916 -14.038 4.613 1.00 0.00 C ATOM 2237 C GLY A 145 4.412 -13.344 5.867 1.00 0.00 C ATOM 2238 O GLY A 145 3.747 -12.453 6.394 1.00 0.00 O ATOM 0 H GLY A 145 2.998 -12.423 3.640 1.00 0.00 H new ATOM 0 HA2 GLY A 145 2.971 -14.537 4.827 1.00 0.00 H new ATOM 0 HA3 GLY A 145 4.627 -14.812 4.325 1.00 0.00 H new ATOM 2242 N ASP A 146 5.583 -13.753 6.344 1.00 0.00 N ATOM 2243 CA ASP A 146 6.168 -13.160 7.544 1.00 0.00 C ATOM 2244 C ASP A 146 7.685 -13.065 7.428 1.00 0.00 C ATOM 2245 O ASP A 146 8.391 -13.028 8.434 1.00 0.00 O ATOM 2246 CB ASP A 146 5.792 -13.973 8.787 1.00 0.00 C ATOM 2247 CG ASP A 146 5.755 -15.466 8.522 1.00 0.00 C ATOM 2248 OD1 ASP A 146 6.817 -16.114 8.625 1.00 0.00 O ATOM 2249 OD2 ASP A 146 4.662 -15.987 8.213 1.00 0.00 O ATOM 0 H ASP A 146 6.145 -14.491 5.920 1.00 0.00 H new ATOM 0 HA ASP A 146 5.765 -12.152 7.643 1.00 0.00 H new ATOM 0 HB2 ASP A 146 6.509 -13.767 9.581 1.00 0.00 H new ATOM 0 HB3 ASP A 146 4.816 -13.648 9.147 1.00 0.00 H new ATOM 2254 N ALA A 147 8.183 -13.014 6.197 1.00 0.00 N ATOM 2255 CA ALA A 147 9.617 -12.909 5.963 1.00 0.00 C ATOM 2256 C ALA A 147 10.134 -11.538 6.388 1.00 0.00 C ATOM 2257 O ALA A 147 11.321 -11.368 6.667 1.00 0.00 O ATOM 2258 CB ALA A 147 9.936 -13.167 4.497 1.00 0.00 C ATOM 0 H ALA A 147 7.616 -13.044 5.349 1.00 0.00 H new ATOM 0 HA ALA A 147 10.119 -13.666 6.566 1.00 0.00 H new ATOM 0 HB1 ALA A 147 11.011 -13.085 4.339 1.00 0.00 H new ATOM 0 HB2 ALA A 147 9.604 -14.169 4.223 1.00 0.00 H new ATOM 0 HB3 ALA A 147 9.421 -12.433 3.878 1.00 0.00 H new ATOM 2264 N PHE A 148 9.229 -10.564 6.442 1.00 0.00 N ATOM 2265 CA PHE A 148 9.580 -9.206 6.838 1.00 0.00 C ATOM 2266 C PHE A 148 9.694 -9.093 8.358 1.00 0.00 C ATOM 2267 O PHE A 148 10.406 -8.234 8.875 1.00 0.00 O ATOM 2268 CB PHE A 148 8.531 -8.221 6.310 1.00 0.00 C ATOM 2269 CG PHE A 148 7.240 -8.241 7.080 1.00 0.00 C ATOM 2270 CD1 PHE A 148 7.086 -7.463 8.217 1.00 0.00 C ATOM 2271 CD2 PHE A 148 6.184 -9.040 6.670 1.00 0.00 C ATOM 2272 CE1 PHE A 148 5.903 -7.481 8.930 1.00 0.00 C ATOM 2273 CE2 PHE A 148 4.998 -9.061 7.381 1.00 0.00 C ATOM 2274 CZ PHE A 148 4.858 -8.281 8.511 1.00 0.00 C ATOM 0 H PHE A 148 8.243 -10.693 6.215 1.00 0.00 H new ATOM 0 HA PHE A 148 10.550 -8.961 6.406 1.00 0.00 H new ATOM 0 HB2 PHE A 148 8.945 -7.213 6.339 1.00 0.00 H new ATOM 0 HB3 PHE A 148 8.324 -8.451 5.265 1.00 0.00 H new ATOM 0 HD1 PHE A 148 7.900 -6.836 8.549 1.00 0.00 H new ATOM 0 HD2 PHE A 148 6.289 -9.652 5.786 1.00 0.00 H new ATOM 0 HE1 PHE A 148 5.795 -6.870 9.814 1.00 0.00 H new ATOM 0 HE2 PHE A 148 4.182 -9.687 7.052 1.00 0.00 H new ATOM 0 HZ PHE A 148 3.932 -8.296 9.067 1.00 0.00 H new ATOM 2284 N ARG A 149 8.982 -9.970 9.067 1.00 0.00 N ATOM 2285 CA ARG A 149 8.994 -9.972 10.525 1.00 0.00 C ATOM 2286 C ARG A 149 10.418 -10.043 11.067 1.00 0.00 C ATOM 2287 O ARG A 149 11.175 -10.958 10.740 1.00 0.00 O ATOM 2288 CB ARG A 149 8.177 -11.143 11.053 1.00 0.00 C ATOM 2289 CG ARG A 149 6.703 -10.817 11.206 1.00 0.00 C ATOM 2290 CD ARG A 149 6.464 -9.799 12.309 1.00 0.00 C ATOM 2291 NE ARG A 149 6.890 -10.294 13.616 1.00 0.00 N ATOM 2292 CZ ARG A 149 6.171 -11.130 14.362 1.00 0.00 C ATOM 2293 NH1 ARG A 149 4.994 -11.570 13.932 1.00 0.00 N ATOM 2294 NH2 ARG A 149 6.629 -11.529 15.541 1.00 0.00 N ATOM 0 H ARG A 149 8.389 -10.689 8.651 1.00 0.00 H new ATOM 0 HA ARG A 149 8.548 -9.038 10.867 1.00 0.00 H new ATOM 0 HB2 ARG A 149 8.288 -11.990 10.376 1.00 0.00 H new ATOM 0 HB3 ARG A 149 8.577 -11.452 12.019 1.00 0.00 H new ATOM 0 HG2 ARG A 149 6.316 -10.430 10.263 1.00 0.00 H new ATOM 0 HG3 ARG A 149 6.149 -11.730 11.427 1.00 0.00 H new ATOM 0 HD2 ARG A 149 7.003 -8.880 12.077 1.00 0.00 H new ATOM 0 HD3 ARG A 149 5.404 -9.547 12.345 1.00 0.00 H new ATOM 0 HE ARG A 149 7.791 -9.981 13.978 1.00 0.00 H new ATOM 0 HH11 ARG A 149 4.637 -11.268 13.026 1.00 0.00 H new ATOM 0 HH12 ARG A 149 4.448 -12.210 14.508 1.00 0.00 H new ATOM 0 HH21 ARG A 149 7.533 -11.195 15.877 1.00 0.00 H new ATOM 0 HH22 ARG A 149 6.078 -12.170 16.112 1.00 0.00 H new ATOM 2308 N LYS A 150 10.777 -9.069 11.896 1.00 0.00 N ATOM 2309 CA LYS A 150 12.110 -9.019 12.486 1.00 0.00 C ATOM 2310 C LYS A 150 12.056 -9.300 13.984 1.00 0.00 C ATOM 2311 O LYS A 150 12.983 -9.877 14.551 1.00 0.00 O ATOM 2312 CB LYS A 150 12.749 -7.652 12.235 1.00 0.00 C ATOM 2313 CG LYS A 150 14.265 -7.702 12.121 1.00 0.00 C ATOM 2314 CD LYS A 150 14.899 -6.383 12.531 1.00 0.00 C ATOM 2315 CE LYS A 150 15.302 -6.392 13.997 1.00 0.00 C ATOM 2316 NZ LYS A 150 15.104 -5.062 14.636 1.00 0.00 N ATOM 0 H LYS A 150 10.164 -8.303 12.175 1.00 0.00 H new ATOM 0 HA LYS A 150 12.718 -9.791 12.013 1.00 0.00 H new ATOM 0 HB2 LYS A 150 12.337 -7.230 11.318 1.00 0.00 H new ATOM 0 HB3 LYS A 150 12.476 -6.978 13.047 1.00 0.00 H new ATOM 0 HG2 LYS A 150 14.652 -8.504 12.750 1.00 0.00 H new ATOM 0 HG3 LYS A 150 14.546 -7.938 11.095 1.00 0.00 H new ATOM 0 HD2 LYS A 150 15.776 -6.191 11.912 1.00 0.00 H new ATOM 0 HD3 LYS A 150 14.197 -5.569 12.350 1.00 0.00 H new ATOM 0 HE2 LYS A 150 14.716 -7.141 14.530 1.00 0.00 H new ATOM 0 HE3 LYS A 150 16.348 -6.684 14.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 15.390 -5.111 15.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 15.682 -4.351 14.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 14.101 -4.794 14.576 1.00 0.00 H new ATOM 2330 N LYS A 151 10.965 -8.887 14.621 1.00 0.00 N ATOM 2331 CA LYS A 151 10.792 -9.095 16.054 1.00 0.00 C ATOM 2332 C LYS A 151 10.035 -10.390 16.331 1.00 0.00 C ATOM 2333 O LYS A 151 9.107 -10.747 15.603 1.00 0.00 O ATOM 2334 CB LYS A 151 10.048 -7.912 16.676 1.00 0.00 C ATOM 2335 CG LYS A 151 10.546 -7.544 18.064 1.00 0.00 C ATOM 2336 CD LYS A 151 11.903 -6.860 18.006 1.00 0.00 C ATOM 2337 CE LYS A 151 12.395 -6.481 19.394 1.00 0.00 C ATOM 2338 NZ LYS A 151 13.423 -7.431 19.902 1.00 0.00 N ATOM 0 H LYS A 151 10.188 -8.407 14.168 1.00 0.00 H new ATOM 0 HA LYS A 151 11.781 -9.172 16.506 1.00 0.00 H new ATOM 0 HB2 LYS A 151 10.147 -7.046 16.022 1.00 0.00 H new ATOM 0 HB3 LYS A 151 8.986 -8.150 16.731 1.00 0.00 H new ATOM 0 HG2 LYS A 151 9.825 -6.884 18.547 1.00 0.00 H new ATOM 0 HG3 LYS A 151 10.616 -8.443 18.677 1.00 0.00 H new ATOM 0 HD2 LYS A 151 12.626 -7.523 17.531 1.00 0.00 H new ATOM 0 HD3 LYS A 151 11.835 -5.966 17.386 1.00 0.00 H new ATOM 0 HE2 LYS A 151 12.813 -5.475 19.368 1.00 0.00 H new ATOM 0 HE3 LYS A 151 11.551 -6.458 20.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 13.731 -7.135 20.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 13.017 -8.387 19.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 14.240 -7.435 19.259 1.00 0.00 H new ATOM 2352 N HIS A 152 10.436 -11.089 17.387 1.00 0.00 N ATOM 2353 CA HIS A 152 9.795 -12.344 17.763 1.00 0.00 C ATOM 2354 C HIS A 152 10.041 -12.660 19.235 1.00 0.00 C ATOM 2355 O HIS A 152 11.185 -12.707 19.687 1.00 0.00 O ATOM 2356 CB HIS A 152 10.315 -13.489 16.890 1.00 0.00 C ATOM 2357 CG HIS A 152 9.961 -13.348 15.443 1.00 0.00 C ATOM 2358 ND1 HIS A 152 8.706 -13.630 14.944 1.00 0.00 N ATOM 2359 CD2 HIS A 152 10.704 -12.950 14.383 1.00 0.00 C ATOM 2360 CE1 HIS A 152 8.694 -13.414 13.641 1.00 0.00 C ATOM 2361 NE2 HIS A 152 9.894 -13.000 13.276 1.00 0.00 N ATOM 0 H HIS A 152 11.203 -10.808 17.998 1.00 0.00 H new ATOM 0 HA HIS A 152 8.722 -12.236 17.607 1.00 0.00 H new ATOM 0 HB2 HIS A 152 11.399 -13.545 16.986 1.00 0.00 H new ATOM 0 HB3 HIS A 152 9.913 -14.431 17.264 1.00 0.00 H new ATOM 0 HD1 HIS A 152 7.912 -13.955 15.495 1.00 0.00 H new ATOM 0 HD2 HIS A 152 11.741 -12.649 14.405 1.00 0.00 H new ATOM 0 HE1 HIS A 152 7.847 -13.552 12.985 1.00 0.00 H new ATOM 2370 N LEU A 153 8.961 -12.876 19.978 1.00 0.00 N ATOM 2371 CA LEU A 153 9.063 -13.186 21.400 1.00 0.00 C ATOM 2372 C LEU A 153 7.691 -13.493 21.991 1.00 0.00 C ATOM 2373 O LEU A 153 7.406 -14.629 22.367 1.00 0.00 O ATOM 2374 CB LEU A 153 9.707 -12.019 22.152 1.00 0.00 C ATOM 2375 CG LEU A 153 10.678 -12.425 23.265 1.00 0.00 C ATOM 2376 CD1 LEU A 153 11.969 -11.625 23.169 1.00 0.00 C ATOM 2377 CD2 LEU A 153 10.033 -12.236 24.631 1.00 0.00 C ATOM 0 H LEU A 153 8.006 -12.842 19.620 1.00 0.00 H new ATOM 0 HA LEU A 153 9.690 -14.071 21.509 1.00 0.00 H new ATOM 0 HB2 LEU A 153 10.240 -11.394 21.435 1.00 0.00 H new ATOM 0 HB3 LEU A 153 8.917 -11.405 22.585 1.00 0.00 H new ATOM 0 HG LEU A 153 10.919 -13.481 23.141 1.00 0.00 H new ATOM 0 HD11 LEU A 153 12.645 -11.928 23.968 1.00 0.00 H new ATOM 0 HD12 LEU A 153 12.441 -11.811 22.204 1.00 0.00 H new ATOM 0 HD13 LEU A 153 11.747 -10.562 23.266 1.00 0.00 H new ATOM 0 HD21 LEU A 153 10.737 -12.529 25.410 1.00 0.00 H new ATOM 0 HD22 LEU A 153 9.761 -11.189 24.763 1.00 0.00 H new ATOM 0 HD23 LEU A 153 9.138 -12.854 24.699 1.00 0.00 H new ATOM 2389 N GLU A 154 6.843 -12.471 22.068 1.00 0.00 N ATOM 2390 CA GLU A 154 5.499 -12.633 22.613 1.00 0.00 C ATOM 2391 C GLU A 154 4.482 -12.846 21.496 1.00 0.00 C ATOM 2392 O GLU A 154 3.652 -13.752 21.563 1.00 0.00 O ATOM 2393 CB GLU A 154 5.114 -11.409 23.446 1.00 0.00 C ATOM 2394 CG GLU A 154 4.521 -11.759 24.803 1.00 0.00 C ATOM 2395 CD GLU A 154 5.320 -11.183 25.957 1.00 0.00 C ATOM 2396 OE1 GLU A 154 6.415 -11.710 26.243 1.00 0.00 O ATOM 2397 OE2 GLU A 154 4.850 -10.203 26.573 1.00 0.00 O ATOM 0 H GLU A 154 7.062 -11.524 21.760 1.00 0.00 H new ATOM 0 HA GLU A 154 5.496 -13.514 23.254 1.00 0.00 H new ATOM 0 HB2 GLU A 154 5.997 -10.788 23.594 1.00 0.00 H new ATOM 0 HB3 GLU A 154 4.394 -10.811 22.887 1.00 0.00 H new ATOM 0 HG2 GLU A 154 3.497 -11.388 24.854 1.00 0.00 H new ATOM 0 HG3 GLU A 154 4.473 -12.843 24.905 1.00 0.00 H new ATOM 2404 N ASP A 155 4.553 -12.004 20.470 1.00 0.00 N ATOM 2405 CA ASP A 155 3.637 -12.100 19.338 1.00 0.00 C ATOM 2406 C ASP A 155 2.193 -11.907 19.788 1.00 0.00 C ATOM 2407 O ASP A 155 1.897 -11.924 20.983 1.00 0.00 O ATOM 2408 CB ASP A 155 3.794 -13.454 18.643 1.00 0.00 C ATOM 2409 CG ASP A 155 3.855 -13.326 17.134 1.00 0.00 C ATOM 2410 OD1 ASP A 155 2.985 -12.634 16.561 1.00 0.00 O ATOM 2411 OD2 ASP A 155 4.770 -13.916 16.523 1.00 0.00 O ATOM 0 H ASP A 155 5.234 -11.248 20.399 1.00 0.00 H new ATOM 0 HA ASP A 155 3.885 -11.307 18.632 1.00 0.00 H new ATOM 0 HB2 ASP A 155 4.702 -13.940 19.001 1.00 0.00 H new ATOM 0 HB3 ASP A 155 2.959 -14.099 18.917 1.00 0.00 H new ATOM 2416 N GLU A 156 1.297 -11.726 18.824 1.00 0.00 N ATOM 2417 CA GLU A 156 -0.116 -11.529 19.120 1.00 0.00 C ATOM 2418 C GLU A 156 -0.852 -12.864 19.170 1.00 0.00 C ATOM 2419 O GLU A 156 -1.469 -13.209 20.178 1.00 0.00 O ATOM 2420 CB GLU A 156 -0.758 -10.617 18.072 1.00 0.00 C ATOM 2421 CG GLU A 156 -1.707 -9.586 18.664 1.00 0.00 C ATOM 2422 CD GLU A 156 -0.981 -8.506 19.442 1.00 0.00 C ATOM 2423 OE1 GLU A 156 -0.278 -7.690 18.812 1.00 0.00 O ATOM 2424 OE2 GLU A 156 -1.119 -8.477 20.684 1.00 0.00 O ATOM 0 H GLU A 156 1.525 -11.712 17.830 1.00 0.00 H new ATOM 0 HA GLU A 156 -0.193 -11.055 20.098 1.00 0.00 H new ATOM 0 HB2 GLU A 156 0.028 -10.101 17.520 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -1.302 -11.230 17.353 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -2.284 -9.126 17.862 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -2.418 -10.087 19.321 1.00 0.00 H new ATOM 2431 N LEU A 157 -0.785 -13.612 18.072 1.00 0.00 N ATOM 2432 CA LEU A 157 -1.446 -14.910 17.990 1.00 0.00 C ATOM 2433 C LEU A 157 -0.547 -15.935 17.306 1.00 0.00 C ATOM 2434 O LEU A 157 -0.418 -17.058 17.840 1.00 0.00 O ATOM 2435 CB LEU A 157 -2.768 -14.786 17.230 1.00 0.00 C ATOM 2436 CG LEU A 157 -3.958 -14.325 18.072 1.00 0.00 C ATOM 2437 CD1 LEU A 157 -4.022 -12.807 18.119 1.00 0.00 C ATOM 2438 CD2 LEU A 157 -5.254 -14.899 17.521 1.00 0.00 C ATOM 2439 OXT LEU A 157 0.021 -15.607 16.243 1.00 0.00 O ATOM 0 H LEU A 157 -0.280 -13.342 17.228 1.00 0.00 H new ATOM 0 HA LEU A 157 -1.650 -15.251 19.005 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.632 -14.085 16.407 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -3.008 -15.753 16.789 1.00 0.00 H new ATOM 0 HG LEU A 157 -3.824 -14.694 19.089 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -4.875 -12.497 18.723 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -3.105 -12.418 18.561 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -4.132 -12.416 17.108 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -6.091 -14.561 18.132 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -5.394 -14.560 16.494 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -5.207 -15.988 17.541 1.00 0.00 H new TER 2451 LEU A 157