USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1029 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 110 LYS NZ :NH3+ 171:sc= -1.46 (180deg=-2.41) USER MOD Set 1.2: A 112 TYR OH : rot -124:sc= 1.3 USER MOD Set 2.1: A 60 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 91 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 40 LYS NZ :NH3+ 154:sc= 1.11 (180deg=-0.224) USER MOD Set 3.2: A 75 ASN : amide:sc= 0.953 K(o=2.1,f=-3.3) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 151:sc= 1.5 (180deg=0.694) USER MOD Single : A 3 SER OG : rot 10:sc= 0.687 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.136 K(o=-0.14,f=-0.86) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 HIS : no HD1:sc= -0.0157 X(o=-0.016,f=-0.11) USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 163:sc= 1.29 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -173:sc= -0.163 (180deg=-0.244) USER MOD Single : A 28 ASN : amide:sc= -1.27! K(o=-1.3!,f=0.017) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -1.02 K(o=-1,f=-0.047) USER MOD Single : A 35 ASN : amide:sc= 0.606 K(o=0.61,f=-0.056) USER MOD Single : A 37 HIS : no HD1:sc= -0.0654 X(o=-0.065,f=-0.0024) USER MOD Single : A 41 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00236) USER MOD Single : A 49 ASN : amide:sc= -0.214 K(o=-0.21,f=-0.76) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.25 X(o=-0.25,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot -170:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc=0.000589 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot 92:sc= 1.25 USER MOD Single : A 81 SER OG : rot -31:sc= 0.0464 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0.471 K(o=0.47,f=-3.9!) USER MOD Single : A 95 LYS NZ :NH3+ 161:sc= 1.2 (180deg=0.915) USER MOD Single : A 101 SER OG : rot 24:sc= 1.31 USER MOD Single : A 103 THR OG1 : rot -28:sc= 0.158 USER MOD Single : A 104 ASN : amide:sc= 0.66 K(o=0.66,f=-5.4!) USER MOD Single : A 114 THR OG1 : rot -65:sc= 0.676 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 MET CE :methyl 150:sc= -0.208 (180deg=-1.61) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -21.589 8.831 11.078 1.00 0.00 N ATOM 2 CA MET A 1 -20.142 8.720 11.343 1.00 0.00 C ATOM 3 C MET A 1 -19.613 7.644 10.411 1.00 0.00 C ATOM 4 O MET A 1 -20.390 6.761 10.054 1.00 0.00 O ATOM 5 CB MET A 1 -19.840 8.362 12.809 1.00 0.00 C ATOM 6 CG MET A 1 -20.171 9.492 13.794 1.00 0.00 C ATOM 7 SD MET A 1 -21.930 9.923 13.931 1.00 0.00 S ATOM 8 CE MET A 1 -21.852 11.146 15.268 1.00 0.00 C ATOM 0 H1 MET A 1 -22.077 9.142 11.942 1.00 0.00 H new ATOM 0 H2 MET A 1 -21.751 9.524 10.320 1.00 0.00 H new ATOM 0 H3 MET A 1 -21.960 7.905 10.785 1.00 0.00 H new ATOM 0 HA MET A 1 -19.658 9.681 11.166 1.00 0.00 H new ATOM 0 HB2 MET A 1 -20.409 7.473 13.083 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.785 8.106 12.903 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.807 9.207 14.781 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.619 10.383 13.496 1.00 0.00 H new ATOM 0 HE1 MET A 1 -22.855 11.517 15.481 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.439 10.681 16.163 1.00 0.00 H new ATOM 0 HE3 MET A 1 -21.215 11.977 14.964 1.00 0.00 H new ATOM 18 N GLY A 2 -18.353 7.739 9.995 1.00 0.00 N ATOM 19 CA GLY A 2 -17.795 6.931 8.924 1.00 0.00 C ATOM 20 C GLY A 2 -17.168 7.872 7.906 1.00 0.00 C ATOM 21 O GLY A 2 -17.729 8.926 7.595 1.00 0.00 O ATOM 0 H GLY A 2 -17.683 8.392 10.402 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -17.048 6.241 9.316 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -18.573 6.327 8.457 1.00 0.00 H new ATOM 25 N SER A 3 -15.982 7.528 7.429 1.00 0.00 N ATOM 26 CA SER A 3 -15.279 8.114 6.300 1.00 0.00 C ATOM 27 C SER A 3 -14.258 7.071 5.838 1.00 0.00 C ATOM 28 O SER A 3 -13.920 6.157 6.598 1.00 0.00 O ATOM 29 CB SER A 3 -14.574 9.417 6.702 1.00 0.00 C ATOM 30 OG SER A 3 -15.515 10.401 7.107 1.00 0.00 O ATOM 0 H SER A 3 -15.445 6.773 7.855 1.00 0.00 H new ATOM 0 HA SER A 3 -15.975 8.369 5.501 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.875 9.221 7.515 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.989 9.792 5.862 1.00 0.00 H new ATOM 0 HG SER A 3 -16.402 9.992 7.188 1.00 0.00 H new ATOM 36 N ASP A 4 -13.755 7.211 4.617 1.00 0.00 N ATOM 37 CA ASP A 4 -12.929 6.198 3.968 1.00 0.00 C ATOM 38 C ASP A 4 -11.680 6.889 3.459 1.00 0.00 C ATOM 39 O ASP A 4 -10.580 6.618 3.938 1.00 0.00 O ATOM 40 CB ASP A 4 -13.674 5.504 2.813 1.00 0.00 C ATOM 41 CG ASP A 4 -14.831 4.618 3.265 1.00 0.00 C ATOM 42 OD1 ASP A 4 -15.804 5.158 3.837 1.00 0.00 O ATOM 43 OD2 ASP A 4 -14.837 3.414 2.931 1.00 0.00 O ATOM 0 H ASP A 4 -13.910 8.040 4.043 1.00 0.00 H new ATOM 0 HA ASP A 4 -12.677 5.416 4.685 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -14.057 6.264 2.132 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -12.965 4.898 2.249 1.00 0.00 H new ATOM 48 N LYS A 5 -11.868 7.831 2.530 1.00 0.00 N ATOM 49 CA LYS A 5 -10.829 8.539 1.798 1.00 0.00 C ATOM 50 C LYS A 5 -9.828 7.563 1.199 1.00 0.00 C ATOM 51 O LYS A 5 -8.646 7.531 1.554 1.00 0.00 O ATOM 52 CB LYS A 5 -10.209 9.651 2.644 1.00 0.00 C ATOM 53 CG LYS A 5 -11.279 10.599 3.216 1.00 0.00 C ATOM 54 CD LYS A 5 -10.651 11.976 3.391 1.00 0.00 C ATOM 55 CE LYS A 5 -11.431 12.909 4.312 1.00 0.00 C ATOM 56 NZ LYS A 5 -10.709 14.191 4.415 1.00 0.00 N ATOM 0 H LYS A 5 -12.804 8.132 2.258 1.00 0.00 H new ATOM 0 HA LYS A 5 -11.277 9.053 0.948 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -9.639 9.210 3.462 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -9.506 10.221 2.036 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.136 10.655 2.544 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -11.647 10.225 4.171 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -9.642 11.855 3.786 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -10.556 12.446 2.412 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -12.435 13.072 3.921 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -11.542 12.459 5.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -11.233 14.835 5.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -9.760 14.024 4.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -10.625 14.619 3.471 1.00 0.00 H new ATOM 70 N ILE A 6 -10.329 6.759 0.267 1.00 0.00 N ATOM 71 CA ILE A 6 -9.560 5.835 -0.544 1.00 0.00 C ATOM 72 C ILE A 6 -9.609 6.426 -1.944 1.00 0.00 C ATOM 73 O ILE A 6 -10.645 6.326 -2.608 1.00 0.00 O ATOM 74 CB ILE A 6 -10.171 4.416 -0.469 1.00 0.00 C ATOM 75 CG1 ILE A 6 -10.132 3.883 0.979 1.00 0.00 C ATOM 76 CG2 ILE A 6 -9.429 3.450 -1.412 1.00 0.00 C ATOM 77 CD1 ILE A 6 -10.848 2.540 1.128 1.00 0.00 C ATOM 0 H ILE A 6 -11.326 6.736 0.051 1.00 0.00 H new ATOM 0 HA ILE A 6 -8.530 5.718 -0.207 1.00 0.00 H new ATOM 0 HB ILE A 6 -11.211 4.479 -0.789 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.094 3.775 1.295 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -10.594 4.613 1.644 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -9.876 2.458 -1.342 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -9.506 3.812 -2.437 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -8.379 3.396 -1.124 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -10.791 2.210 2.165 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -11.893 2.651 0.840 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -10.371 1.800 0.485 1.00 0.00 H new ATOM 89 N HIS A 7 -8.534 7.072 -2.393 1.00 0.00 N ATOM 90 CA HIS A 7 -8.367 7.432 -3.792 1.00 0.00 C ATOM 91 C HIS A 7 -6.877 7.651 -4.068 1.00 0.00 C ATOM 92 O HIS A 7 -6.260 8.503 -3.431 1.00 0.00 O ATOM 93 CB HIS A 7 -9.192 8.689 -4.128 1.00 0.00 C ATOM 94 CG HIS A 7 -9.112 9.099 -5.576 1.00 0.00 C ATOM 95 ND1 HIS A 7 -8.532 8.383 -6.597 1.00 0.00 N ATOM 96 CD2 HIS A 7 -9.537 10.288 -6.100 1.00 0.00 C ATOM 97 CE1 HIS A 7 -8.516 9.155 -7.685 1.00 0.00 C ATOM 98 NE2 HIS A 7 -9.145 10.319 -7.444 1.00 0.00 N ATOM 0 H HIS A 7 -7.758 7.358 -1.795 1.00 0.00 H new ATOM 0 HA HIS A 7 -8.732 6.627 -4.430 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -10.235 8.508 -3.868 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -8.847 9.515 -3.506 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -10.076 11.062 -5.574 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -8.062 8.883 -8.627 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -9.305 11.075 -8.109 1.00 0.00 H new ATOM 106 N HIS A 8 -6.307 6.920 -5.028 1.00 0.00 N ATOM 107 CA HIS A 8 -4.962 7.141 -5.544 1.00 0.00 C ATOM 108 C HIS A 8 -4.947 6.800 -7.040 1.00 0.00 C ATOM 109 O HIS A 8 -5.199 5.652 -7.422 1.00 0.00 O ATOM 110 CB HIS A 8 -3.955 6.292 -4.751 1.00 0.00 C ATOM 111 CG HIS A 8 -2.676 6.031 -5.504 1.00 0.00 C ATOM 112 ND1 HIS A 8 -1.862 6.966 -6.110 1.00 0.00 N ATOM 113 CD2 HIS A 8 -2.216 4.792 -5.851 1.00 0.00 C ATOM 114 CE1 HIS A 8 -0.928 6.301 -6.805 1.00 0.00 C ATOM 115 NE2 HIS A 8 -1.116 4.973 -6.697 1.00 0.00 N ATOM 0 H HIS A 8 -6.784 6.138 -5.477 1.00 0.00 H new ATOM 0 HA HIS A 8 -4.671 8.185 -5.426 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -3.721 6.798 -3.814 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -4.417 5.340 -4.492 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -2.626 3.846 -5.531 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -0.135 6.766 -7.372 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -0.564 4.241 -7.144 1.00 0.00 H new ATOM 123 N HIS A 9 -4.655 7.780 -7.896 1.00 0.00 N ATOM 124 CA HIS A 9 -4.413 7.630 -9.334 1.00 0.00 C ATOM 125 C HIS A 9 -3.629 8.864 -9.800 1.00 0.00 C ATOM 126 O HIS A 9 -3.654 9.879 -9.099 1.00 0.00 O ATOM 127 CB HIS A 9 -5.771 7.527 -10.051 1.00 0.00 C ATOM 128 CG HIS A 9 -5.753 7.169 -11.518 1.00 0.00 C ATOM 129 ND1 HIS A 9 -4.915 6.275 -12.157 1.00 0.00 N ATOM 130 CD2 HIS A 9 -6.690 7.580 -12.429 1.00 0.00 C ATOM 131 CE1 HIS A 9 -5.339 6.164 -13.429 1.00 0.00 C ATOM 132 NE2 HIS A 9 -6.424 6.930 -13.637 1.00 0.00 N ATOM 0 H HIS A 9 -4.577 8.750 -7.591 1.00 0.00 H new ATOM 0 HA HIS A 9 -3.839 6.732 -9.560 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -6.373 6.783 -9.529 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -6.283 8.483 -9.943 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -7.491 8.281 -12.246 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -4.872 5.544 -14.180 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -6.950 7.019 -14.506 1.00 0.00 H new ATOM 140 N HIS A 10 -3.020 8.831 -10.990 1.00 0.00 N ATOM 141 CA HIS A 10 -2.221 9.924 -11.545 1.00 0.00 C ATOM 142 C HIS A 10 -0.999 10.293 -10.691 1.00 0.00 C ATOM 143 O HIS A 10 -0.717 9.694 -9.651 1.00 0.00 O ATOM 144 CB HIS A 10 -3.128 11.131 -11.893 1.00 0.00 C ATOM 145 CG HIS A 10 -3.428 11.238 -13.352 1.00 0.00 C ATOM 146 ND1 HIS A 10 -3.012 12.208 -14.236 1.00 0.00 N ATOM 147 CD2 HIS A 10 -4.241 10.378 -14.013 1.00 0.00 C ATOM 148 CE1 HIS A 10 -3.581 11.929 -15.420 1.00 0.00 C ATOM 149 NE2 HIS A 10 -4.318 10.806 -15.340 1.00 0.00 N ATOM 0 H HIS A 10 -3.072 8.021 -11.608 1.00 0.00 H new ATOM 0 HA HIS A 10 -1.781 9.567 -12.476 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -4.064 11.045 -11.341 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -2.644 12.049 -11.559 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -4.739 9.518 -13.590 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -3.463 12.524 -16.314 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -4.831 10.356 -16.098 1.00 0.00 H new ATOM 157 N HIS A 11 -0.245 11.279 -11.182 1.00 0.00 N ATOM 158 CA HIS A 11 0.920 11.891 -10.553 1.00 0.00 C ATOM 159 C HIS A 11 2.065 10.914 -10.229 1.00 0.00 C ATOM 160 O HIS A 11 2.867 11.161 -9.323 1.00 0.00 O ATOM 161 CB HIS A 11 0.477 12.786 -9.385 1.00 0.00 C ATOM 162 CG HIS A 11 1.476 13.878 -9.100 1.00 0.00 C ATOM 163 ND1 HIS A 11 1.845 14.887 -9.960 1.00 0.00 N ATOM 164 CD2 HIS A 11 2.247 13.989 -7.979 1.00 0.00 C ATOM 165 CE1 HIS A 11 2.823 15.591 -9.366 1.00 0.00 C ATOM 166 NE2 HIS A 11 3.132 15.057 -8.169 1.00 0.00 N ATOM 0 H HIS A 11 -0.449 11.696 -12.090 1.00 0.00 H new ATOM 0 HA HIS A 11 1.391 12.538 -11.293 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -0.491 13.231 -9.616 1.00 0.00 H new ATOM 0 HB3 HIS A 11 0.342 12.176 -8.492 1.00 0.00 H new ATOM 0 HD2 HIS A 11 2.185 13.363 -7.101 1.00 0.00 H new ATOM 0 HE1 HIS A 11 3.296 16.464 -9.790 1.00 0.00 H new ATOM 0 HE2 HIS A 11 3.863 15.368 -7.530 1.00 0.00 H new ATOM 174 N HIS A 12 2.195 9.834 -11.002 1.00 0.00 N ATOM 175 CA HIS A 12 3.406 9.018 -11.020 1.00 0.00 C ATOM 176 C HIS A 12 4.473 9.705 -11.894 1.00 0.00 C ATOM 177 O HIS A 12 4.144 10.241 -12.960 1.00 0.00 O ATOM 178 CB HIS A 12 3.086 7.634 -11.596 1.00 0.00 C ATOM 179 CG HIS A 12 2.076 6.813 -10.822 1.00 0.00 C ATOM 180 ND1 HIS A 12 2.280 6.168 -9.620 1.00 0.00 N ATOM 181 CD2 HIS A 12 0.827 6.467 -11.261 1.00 0.00 C ATOM 182 CE1 HIS A 12 1.189 5.423 -9.367 1.00 0.00 C ATOM 183 NE2 HIS A 12 0.280 5.553 -10.353 1.00 0.00 N ATOM 0 H HIS A 12 1.464 9.503 -11.631 1.00 0.00 H new ATOM 0 HA HIS A 12 3.783 8.907 -10.003 1.00 0.00 H new ATOM 0 HB2 HIS A 12 2.718 7.762 -12.614 1.00 0.00 H new ATOM 0 HB3 HIS A 12 4.014 7.066 -11.661 1.00 0.00 H new ATOM 0 HD2 HIS A 12 0.346 6.836 -12.155 1.00 0.00 H new ATOM 0 HE1 HIS A 12 1.059 4.804 -8.492 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -0.622 5.082 -10.423 1.00 0.00 H new ATOM 191 N MET A 13 5.745 9.629 -11.497 1.00 0.00 N ATOM 192 CA MET A 13 6.923 10.121 -12.212 1.00 0.00 C ATOM 193 C MET A 13 8.063 9.137 -11.980 1.00 0.00 C ATOM 194 O MET A 13 8.654 9.114 -10.901 1.00 0.00 O ATOM 195 CB MET A 13 7.316 11.527 -11.725 1.00 0.00 C ATOM 196 CG MET A 13 6.766 12.595 -12.667 1.00 0.00 C ATOM 197 SD MET A 13 7.674 12.791 -14.226 1.00 0.00 S ATOM 198 CE MET A 13 9.072 13.797 -13.655 1.00 0.00 C ATOM 0 H MET A 13 5.995 9.193 -10.609 1.00 0.00 H new ATOM 0 HA MET A 13 6.702 10.197 -13.277 1.00 0.00 H new ATOM 0 HB2 MET A 13 6.932 11.690 -10.718 1.00 0.00 H new ATOM 0 HB3 MET A 13 8.402 11.608 -11.669 1.00 0.00 H new ATOM 0 HG2 MET A 13 5.728 12.354 -12.897 1.00 0.00 H new ATOM 0 HG3 MET A 13 6.763 13.551 -12.144 1.00 0.00 H new ATOM 0 HE1 MET A 13 9.734 14.010 -14.494 1.00 0.00 H new ATOM 0 HE2 MET A 13 8.700 14.733 -13.239 1.00 0.00 H new ATOM 0 HE3 MET A 13 9.623 13.253 -12.888 1.00 0.00 H new ATOM 208 N PHE A 14 8.372 8.332 -12.997 1.00 0.00 N ATOM 209 CA PHE A 14 9.275 7.196 -12.977 1.00 0.00 C ATOM 210 C PHE A 14 9.206 6.410 -11.655 1.00 0.00 C ATOM 211 O PHE A 14 10.206 6.342 -10.934 1.00 0.00 O ATOM 212 CB PHE A 14 10.687 7.673 -13.313 1.00 0.00 C ATOM 213 CG PHE A 14 10.824 8.587 -14.512 1.00 0.00 C ATOM 214 CD1 PHE A 14 10.936 8.039 -15.803 1.00 0.00 C ATOM 215 CD2 PHE A 14 10.934 9.978 -14.324 1.00 0.00 C ATOM 216 CE1 PHE A 14 11.231 8.873 -16.894 1.00 0.00 C ATOM 217 CE2 PHE A 14 11.218 10.811 -15.417 1.00 0.00 C ATOM 218 CZ PHE A 14 11.398 10.253 -16.695 1.00 0.00 C ATOM 0 H PHE A 14 7.964 8.473 -13.921 1.00 0.00 H new ATOM 0 HA PHE A 14 8.961 6.483 -13.739 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.089 8.191 -12.442 1.00 0.00 H new ATOM 0 HB3 PHE A 14 11.313 6.796 -13.479 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.795 6.979 -15.955 1.00 0.00 H new ATOM 0 HD2 PHE A 14 10.800 10.403 -13.340 1.00 0.00 H new ATOM 0 HE1 PHE A 14 11.329 8.454 -17.884 1.00 0.00 H new ATOM 0 HE2 PHE A 14 11.298 11.879 -15.277 1.00 0.00 H new ATOM 0 HZ PHE A 14 11.666 10.888 -17.527 1.00 0.00 H new ATOM 228 N PRO A 15 8.042 5.823 -11.320 1.00 0.00 N ATOM 229 CA PRO A 15 7.857 5.081 -10.082 1.00 0.00 C ATOM 230 C PRO A 15 8.554 3.715 -10.171 1.00 0.00 C ATOM 231 O PRO A 15 9.421 3.483 -11.024 1.00 0.00 O ATOM 232 CB PRO A 15 6.338 4.957 -9.934 1.00 0.00 C ATOM 233 CG PRO A 15 5.906 4.764 -11.386 1.00 0.00 C ATOM 234 CD PRO A 15 6.822 5.750 -12.117 1.00 0.00 C ATOM 0 HA PRO A 15 8.296 5.573 -9.214 1.00 0.00 H new ATOM 0 HB2 PRO A 15 6.055 4.112 -9.306 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.895 5.848 -9.489 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.055 3.739 -11.725 1.00 0.00 H new ATOM 0 HG3 PRO A 15 4.852 4.998 -11.534 1.00 0.00 H new ATOM 0 HD2 PRO A 15 7.036 5.408 -13.130 1.00 0.00 H new ATOM 0 HD3 PRO A 15 6.352 6.730 -12.204 1.00 0.00 H new ATOM 242 N TYR A 16 8.174 2.809 -9.270 1.00 0.00 N ATOM 243 CA TYR A 16 8.772 1.499 -9.131 1.00 0.00 C ATOM 244 C TYR A 16 8.712 0.659 -10.412 1.00 0.00 C ATOM 245 O TYR A 16 7.934 0.941 -11.331 1.00 0.00 O ATOM 246 CB TYR A 16 8.156 0.783 -7.918 1.00 0.00 C ATOM 247 CG TYR A 16 6.949 -0.088 -8.148 1.00 0.00 C ATOM 248 CD1 TYR A 16 7.131 -1.451 -8.455 1.00 0.00 C ATOM 249 CD2 TYR A 16 5.658 0.430 -7.952 1.00 0.00 C ATOM 250 CE1 TYR A 16 6.017 -2.283 -8.603 1.00 0.00 C ATOM 251 CE2 TYR A 16 4.546 -0.421 -8.036 1.00 0.00 C ATOM 252 CZ TYR A 16 4.724 -1.783 -8.363 1.00 0.00 C ATOM 253 OH TYR A 16 3.672 -2.640 -8.443 1.00 0.00 O ATOM 0 H TYR A 16 7.421 2.979 -8.603 1.00 0.00 H new ATOM 0 HA TYR A 16 9.839 1.634 -8.953 1.00 0.00 H new ATOM 0 HB2 TYR A 16 8.932 0.165 -7.466 1.00 0.00 H new ATOM 0 HB3 TYR A 16 7.885 1.542 -7.185 1.00 0.00 H new ATOM 0 HD1 TYR A 16 8.127 -1.851 -8.576 1.00 0.00 H new ATOM 0 HD2 TYR A 16 5.522 1.480 -7.737 1.00 0.00 H new ATOM 0 HE1 TYR A 16 6.149 -3.312 -8.902 1.00 0.00 H new ATOM 0 HE2 TYR A 16 3.555 -0.035 -7.851 1.00 0.00 H new ATOM 0 HH TYR A 16 2.893 -2.244 -7.999 1.00 0.00 H new ATOM 263 N LYS A 17 9.517 -0.406 -10.461 1.00 0.00 N ATOM 264 CA LYS A 17 9.529 -1.393 -11.543 1.00 0.00 C ATOM 265 C LYS A 17 9.758 -2.781 -10.941 1.00 0.00 C ATOM 266 O LYS A 17 10.062 -2.892 -9.751 1.00 0.00 O ATOM 267 CB LYS A 17 10.567 -1.006 -12.619 1.00 0.00 C ATOM 268 CG LYS A 17 12.016 -1.259 -12.201 1.00 0.00 C ATOM 269 CD LYS A 17 13.067 -1.076 -13.295 1.00 0.00 C ATOM 270 CE LYS A 17 13.442 0.397 -13.477 1.00 0.00 C ATOM 271 NZ LYS A 17 13.124 0.875 -14.832 1.00 0.00 N ATOM 0 H LYS A 17 10.197 -0.611 -9.729 1.00 0.00 H new ATOM 0 HA LYS A 17 8.568 -1.414 -12.057 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.358 -1.568 -13.530 1.00 0.00 H new ATOM 0 HB3 LYS A 17 10.448 0.050 -12.861 1.00 0.00 H new ATOM 0 HG2 LYS A 17 12.258 -0.589 -11.376 1.00 0.00 H new ATOM 0 HG3 LYS A 17 12.091 -2.277 -11.818 1.00 0.00 H new ATOM 0 HD2 LYS A 17 13.959 -1.650 -13.043 1.00 0.00 H new ATOM 0 HD3 LYS A 17 12.687 -1.474 -14.236 1.00 0.00 H new ATOM 0 HE2 LYS A 17 12.909 1.002 -12.743 1.00 0.00 H new ATOM 0 HE3 LYS A 17 14.507 0.528 -13.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 13.392 1.876 -14.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 13.652 0.314 -15.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 12.104 0.773 -15.006 1.00 0.00 H new ATOM 285 N ILE A 18 9.671 -3.834 -11.749 1.00 0.00 N ATOM 286 CA ILE A 18 9.979 -5.206 -11.353 1.00 0.00 C ATOM 287 C ILE A 18 10.858 -5.770 -12.468 1.00 0.00 C ATOM 288 O ILE A 18 10.380 -6.011 -13.579 1.00 0.00 O ATOM 289 CB ILE A 18 8.677 -6.010 -11.098 1.00 0.00 C ATOM 290 CG1 ILE A 18 7.896 -5.461 -9.884 1.00 0.00 C ATOM 291 CG2 ILE A 18 8.985 -7.503 -10.890 1.00 0.00 C ATOM 292 CD1 ILE A 18 6.574 -6.197 -9.615 1.00 0.00 C ATOM 0 H ILE A 18 9.377 -3.755 -12.722 1.00 0.00 H new ATOM 0 HA ILE A 18 10.516 -5.265 -10.406 1.00 0.00 H new ATOM 0 HB ILE A 18 8.052 -5.897 -11.984 1.00 0.00 H new ATOM 0 HG12 ILE A 18 8.526 -5.529 -8.997 1.00 0.00 H new ATOM 0 HG13 ILE A 18 7.686 -4.404 -10.046 1.00 0.00 H new ATOM 0 HG21 ILE A 18 8.056 -8.045 -10.713 1.00 0.00 H new ATOM 0 HG22 ILE A 18 9.474 -7.901 -11.779 1.00 0.00 H new ATOM 0 HG23 ILE A 18 9.644 -7.622 -10.030 1.00 0.00 H new ATOM 0 HD11 ILE A 18 6.082 -5.756 -8.748 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.924 -6.108 -10.486 1.00 0.00 H new ATOM 0 HD13 ILE A 18 6.777 -7.250 -9.420 1.00 0.00 H new ATOM 304 N VAL A 19 12.164 -5.885 -12.241 1.00 0.00 N ATOM 305 CA VAL A 19 13.045 -6.666 -13.097 1.00 0.00 C ATOM 306 C VAL A 19 12.840 -8.156 -12.741 1.00 0.00 C ATOM 307 O VAL A 19 11.897 -8.481 -12.020 1.00 0.00 O ATOM 308 CB VAL A 19 14.488 -6.128 -12.970 1.00 0.00 C ATOM 309 CG1 VAL A 19 14.576 -4.627 -13.319 1.00 0.00 C ATOM 310 CG2 VAL A 19 15.123 -6.328 -11.590 1.00 0.00 C ATOM 0 H VAL A 19 12.639 -5.438 -11.457 1.00 0.00 H new ATOM 0 HA VAL A 19 12.814 -6.573 -14.158 1.00 0.00 H new ATOM 0 HB VAL A 19 15.049 -6.727 -13.688 1.00 0.00 H new ATOM 0 HG11 VAL A 19 15.607 -4.290 -13.217 1.00 0.00 H new ATOM 0 HG12 VAL A 19 14.244 -4.472 -14.345 1.00 0.00 H new ATOM 0 HG13 VAL A 19 13.939 -4.058 -12.642 1.00 0.00 H new ATOM 0 HG21 VAL A 19 16.134 -5.921 -11.592 1.00 0.00 H new ATOM 0 HG22 VAL A 19 14.526 -5.813 -10.837 1.00 0.00 H new ATOM 0 HG23 VAL A 19 15.161 -7.392 -11.358 1.00 0.00 H new ATOM 320 N ASP A 20 13.657 -9.063 -13.277 1.00 0.00 N ATOM 321 CA ASP A 20 13.518 -10.532 -13.305 1.00 0.00 C ATOM 322 C ASP A 20 12.658 -11.129 -12.190 1.00 0.00 C ATOM 323 O ASP A 20 11.547 -11.612 -12.424 1.00 0.00 O ATOM 324 CB ASP A 20 14.923 -11.161 -13.285 1.00 0.00 C ATOM 325 CG ASP A 20 15.143 -12.030 -14.500 1.00 0.00 C ATOM 326 OD1 ASP A 20 14.736 -13.211 -14.482 1.00 0.00 O ATOM 327 OD2 ASP A 20 15.805 -11.537 -15.442 1.00 0.00 O ATOM 0 H ASP A 20 14.513 -8.769 -13.747 1.00 0.00 H new ATOM 0 HA ASP A 20 12.981 -10.769 -14.224 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.677 -10.375 -13.254 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.046 -11.756 -12.380 1.00 0.00 H new ATOM 332 N ASP A 21 13.175 -11.046 -10.972 1.00 0.00 N ATOM 333 CA ASP A 21 12.591 -11.476 -9.718 1.00 0.00 C ATOM 334 C ASP A 21 12.944 -10.476 -8.614 1.00 0.00 C ATOM 335 O ASP A 21 12.825 -10.795 -7.432 1.00 0.00 O ATOM 336 CB ASP A 21 13.063 -12.897 -9.374 1.00 0.00 C ATOM 337 CG ASP A 21 14.570 -13.036 -9.100 1.00 0.00 C ATOM 338 OD1 ASP A 21 15.350 -12.133 -9.470 1.00 0.00 O ATOM 339 OD2 ASP A 21 14.980 -14.131 -8.642 1.00 0.00 O ATOM 0 H ASP A 21 14.099 -10.638 -10.828 1.00 0.00 H new ATOM 0 HA ASP A 21 11.505 -11.505 -9.810 1.00 0.00 H new ATOM 0 HB2 ASP A 21 12.517 -13.242 -8.496 1.00 0.00 H new ATOM 0 HB3 ASP A 21 12.796 -13.561 -10.197 1.00 0.00 H new ATOM 344 N VAL A 22 13.339 -9.250 -8.980 1.00 0.00 N ATOM 345 CA VAL A 22 13.707 -8.190 -8.048 1.00 0.00 C ATOM 346 C VAL A 22 12.924 -6.955 -8.387 1.00 0.00 C ATOM 347 O VAL A 22 12.732 -6.563 -9.538 1.00 0.00 O ATOM 348 CB VAL A 22 15.247 -7.964 -7.968 1.00 0.00 C ATOM 349 CG1 VAL A 22 15.607 -7.102 -6.763 1.00 0.00 C ATOM 350 CG2 VAL A 22 16.022 -9.291 -7.874 1.00 0.00 C ATOM 0 H VAL A 22 13.411 -8.966 -9.957 1.00 0.00 H new ATOM 0 HA VAL A 22 13.440 -8.490 -7.035 1.00 0.00 H new ATOM 0 HB VAL A 22 15.533 -7.456 -8.889 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.687 -6.958 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 22 15.114 -6.133 -6.848 1.00 0.00 H new ATOM 0 HG13 VAL A 22 15.277 -7.597 -5.850 1.00 0.00 H new ATOM 0 HG21 VAL A 22 17.091 -9.085 -7.820 1.00 0.00 H new ATOM 0 HG22 VAL A 22 15.711 -9.831 -6.980 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.813 -9.898 -8.755 1.00 0.00 H new ATOM 360 N VAL A 23 12.394 -6.394 -7.319 1.00 0.00 N ATOM 361 CA VAL A 23 11.523 -5.266 -7.339 1.00 0.00 C ATOM 362 C VAL A 23 12.387 -4.036 -7.176 1.00 0.00 C ATOM 363 O VAL A 23 13.435 -4.127 -6.550 1.00 0.00 O ATOM 364 CB VAL A 23 10.501 -5.458 -6.217 1.00 0.00 C ATOM 365 CG1 VAL A 23 10.067 -6.894 -5.859 1.00 0.00 C ATOM 366 CG2 VAL A 23 10.290 -4.279 -5.274 1.00 0.00 C ATOM 0 H VAL A 23 12.576 -6.738 -6.376 1.00 0.00 H new ATOM 0 HA VAL A 23 10.964 -5.154 -8.268 1.00 0.00 H new ATOM 0 HB VAL A 23 9.522 -5.331 -6.679 1.00 0.00 H new ATOM 0 HG11 VAL A 23 9.341 -6.863 -5.047 1.00 0.00 H new ATOM 0 HG12 VAL A 23 9.616 -7.366 -6.732 1.00 0.00 H new ATOM 0 HG13 VAL A 23 10.938 -7.470 -5.545 1.00 0.00 H new ATOM 0 HG21 VAL A 23 9.543 -4.541 -4.525 1.00 0.00 H new ATOM 0 HG22 VAL A 23 11.230 -4.036 -4.779 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.946 -3.415 -5.843 1.00 0.00 H new ATOM 376 N ILE A 24 11.955 -2.881 -7.665 1.00 0.00 N ATOM 377 CA ILE A 24 12.723 -1.659 -7.550 1.00 0.00 C ATOM 378 C ILE A 24 11.759 -0.530 -7.195 1.00 0.00 C ATOM 379 O ILE A 24 11.186 0.054 -8.107 1.00 0.00 O ATOM 380 CB ILE A 24 13.488 -1.378 -8.871 1.00 0.00 C ATOM 381 CG1 ILE A 24 13.944 -2.571 -9.745 1.00 0.00 C ATOM 382 CG2 ILE A 24 14.655 -0.449 -8.555 1.00 0.00 C ATOM 383 CD1 ILE A 24 14.918 -3.559 -9.125 1.00 0.00 C ATOM 0 H ILE A 24 11.065 -2.770 -8.150 1.00 0.00 H new ATOM 0 HA ILE A 24 13.475 -1.745 -6.766 1.00 0.00 H new ATOM 0 HB ILE A 24 12.740 -0.926 -9.522 1.00 0.00 H new ATOM 0 HG12 ILE A 24 13.055 -3.122 -10.053 1.00 0.00 H new ATOM 0 HG13 ILE A 24 14.401 -2.171 -10.650 1.00 0.00 H new ATOM 0 HG21 ILE A 24 15.209 -0.237 -9.469 1.00 0.00 H new ATOM 0 HG22 ILE A 24 14.275 0.483 -8.136 1.00 0.00 H new ATOM 0 HG23 ILE A 24 15.316 -0.928 -7.833 1.00 0.00 H new ATOM 0 HD11 ILE A 24 15.151 -4.342 -9.847 1.00 0.00 H new ATOM 0 HD12 ILE A 24 15.834 -3.039 -8.844 1.00 0.00 H new ATOM 0 HD13 ILE A 24 14.468 -4.006 -8.238 1.00 0.00 H new ATOM 395 N LEU A 25 11.521 -0.224 -5.915 1.00 0.00 N ATOM 396 CA LEU A 25 10.876 1.024 -5.526 1.00 0.00 C ATOM 397 C LEU A 25 11.835 2.152 -5.884 1.00 0.00 C ATOM 398 O LEU A 25 12.950 2.149 -5.375 1.00 0.00 O ATOM 399 CB LEU A 25 10.517 1.047 -4.036 1.00 0.00 C ATOM 400 CG LEU A 25 9.463 0.012 -3.595 1.00 0.00 C ATOM 401 CD1 LEU A 25 8.430 -0.376 -4.658 1.00 0.00 C ATOM 402 CD2 LEU A 25 10.078 -1.283 -3.096 1.00 0.00 C ATOM 0 H LEU A 25 11.768 -0.829 -5.132 1.00 0.00 H new ATOM 0 HA LEU A 25 9.931 1.138 -6.057 1.00 0.00 H new ATOM 0 HB2 LEU A 25 11.426 0.884 -3.458 1.00 0.00 H new ATOM 0 HB3 LEU A 25 10.153 2.043 -3.783 1.00 0.00 H new ATOM 0 HG LEU A 25 8.953 0.547 -2.794 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.738 -1.108 -4.243 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.877 0.510 -4.969 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.939 -0.806 -5.520 1.00 0.00 H new ATOM 0 HD21 LEU A 25 9.286 -1.971 -2.800 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.672 -1.734 -3.891 1.00 0.00 H new ATOM 0 HD23 LEU A 25 10.717 -1.075 -2.238 1.00 0.00 H new ATOM 414 N MET A 26 11.455 3.078 -6.762 1.00 0.00 N ATOM 415 CA MET A 26 12.310 4.164 -7.248 1.00 0.00 C ATOM 416 C MET A 26 11.620 5.459 -6.761 1.00 0.00 C ATOM 417 O MET A 26 10.817 6.034 -7.500 1.00 0.00 O ATOM 418 CB MET A 26 12.385 4.100 -8.788 1.00 0.00 C ATOM 419 CG MET A 26 12.747 2.711 -9.331 1.00 0.00 C ATOM 420 SD MET A 26 13.879 2.686 -10.743 1.00 0.00 S ATOM 421 CE MET A 26 12.851 3.610 -11.901 1.00 0.00 C ATOM 0 H MET A 26 10.519 3.096 -7.167 1.00 0.00 H new ATOM 0 HA MET A 26 13.335 4.107 -6.881 1.00 0.00 H new ATOM 0 HB2 MET A 26 11.424 4.403 -9.203 1.00 0.00 H new ATOM 0 HB3 MET A 26 13.124 4.821 -9.137 1.00 0.00 H new ATOM 0 HG2 MET A 26 13.192 2.131 -8.523 1.00 0.00 H new ATOM 0 HG3 MET A 26 11.826 2.203 -9.619 1.00 0.00 H new ATOM 0 HE1 MET A 26 13.316 3.603 -12.887 1.00 0.00 H new ATOM 0 HE2 MET A 26 11.866 3.148 -11.962 1.00 0.00 H new ATOM 0 HE3 MET A 26 12.749 4.639 -11.556 1.00 0.00 H new ATOM 431 N PRO A 27 11.790 5.877 -5.497 1.00 0.00 N ATOM 432 CA PRO A 27 10.995 6.942 -4.892 1.00 0.00 C ATOM 433 C PRO A 27 11.401 8.326 -5.407 1.00 0.00 C ATOM 434 O PRO A 27 12.453 8.494 -6.025 1.00 0.00 O ATOM 435 CB PRO A 27 11.252 6.810 -3.390 1.00 0.00 C ATOM 436 CG PRO A 27 12.689 6.309 -3.341 1.00 0.00 C ATOM 437 CD PRO A 27 12.761 5.377 -4.549 1.00 0.00 C ATOM 0 HA PRO A 27 9.938 6.847 -5.142 1.00 0.00 H new ATOM 0 HB2 PRO A 27 11.137 7.763 -2.874 1.00 0.00 H new ATOM 0 HB3 PRO A 27 10.562 6.109 -2.921 1.00 0.00 H new ATOM 0 HG2 PRO A 27 13.406 7.127 -3.417 1.00 0.00 H new ATOM 0 HG3 PRO A 27 12.903 5.783 -2.411 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.762 5.374 -4.981 1.00 0.00 H new ATOM 0 HD3 PRO A 27 12.534 4.350 -4.263 1.00 0.00 H new ATOM 445 N ASN A 28 10.574 9.331 -5.103 1.00 0.00 N ATOM 446 CA ASN A 28 10.765 10.721 -5.517 1.00 0.00 C ATOM 447 C ASN A 28 10.242 11.644 -4.410 1.00 0.00 C ATOM 448 O ASN A 28 10.817 11.680 -3.326 1.00 0.00 O ATOM 449 CB ASN A 28 10.109 10.955 -6.905 1.00 0.00 C ATOM 450 CG ASN A 28 8.839 10.135 -7.164 1.00 0.00 C ATOM 451 OD1 ASN A 28 8.918 9.032 -7.684 1.00 0.00 O ATOM 452 ND2 ASN A 28 7.647 10.578 -6.782 1.00 0.00 N ATOM 0 H ASN A 28 9.730 9.194 -4.547 1.00 0.00 H new ATOM 0 HA ASN A 28 11.822 10.954 -5.648 1.00 0.00 H new ATOM 0 HB2 ASN A 28 9.867 12.013 -7.003 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.839 10.722 -7.680 1.00 0.00 H new ATOM 0 HD21 ASN A 28 6.819 10.000 -6.925 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.560 11.496 -6.346 1.00 0.00 H new ATOM 459 N LYS A 29 9.094 12.303 -4.596 1.00 0.00 N ATOM 460 CA LYS A 29 8.424 13.135 -3.584 1.00 0.00 C ATOM 461 C LYS A 29 7.219 12.418 -2.977 1.00 0.00 C ATOM 462 O LYS A 29 6.495 12.983 -2.163 1.00 0.00 O ATOM 463 CB LYS A 29 8.027 14.503 -4.176 1.00 0.00 C ATOM 464 CG LYS A 29 9.197 15.499 -4.231 1.00 0.00 C ATOM 465 CD LYS A 29 10.087 15.418 -5.475 1.00 0.00 C ATOM 466 CE LYS A 29 9.316 15.888 -6.714 1.00 0.00 C ATOM 467 NZ LYS A 29 10.187 16.608 -7.663 1.00 0.00 N ATOM 0 H LYS A 29 8.588 12.273 -5.481 1.00 0.00 H new ATOM 0 HA LYS A 29 9.133 13.312 -2.775 1.00 0.00 H new ATOM 0 HB2 LYS A 29 7.635 14.357 -5.182 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.221 14.931 -3.579 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.793 16.509 -4.163 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.821 15.345 -3.351 1.00 0.00 H new ATOM 0 HD2 LYS A 29 10.975 16.035 -5.336 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.430 14.393 -5.619 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.870 15.027 -7.212 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.497 16.539 -6.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.628 16.909 -8.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.593 17.444 -7.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.954 15.979 -7.976 1.00 0.00 H new ATOM 481 N GLU A 30 6.990 11.167 -3.369 1.00 0.00 N ATOM 482 CA GLU A 30 5.823 10.386 -2.979 1.00 0.00 C ATOM 483 C GLU A 30 5.902 9.854 -1.541 1.00 0.00 C ATOM 484 O GLU A 30 4.933 9.253 -1.073 1.00 0.00 O ATOM 485 CB GLU A 30 5.572 9.279 -4.011 1.00 0.00 C ATOM 486 CG GLU A 30 6.745 8.316 -4.222 1.00 0.00 C ATOM 487 CD GLU A 30 6.517 7.400 -5.433 1.00 0.00 C ATOM 488 OE1 GLU A 30 6.100 7.910 -6.499 1.00 0.00 O ATOM 489 OE2 GLU A 30 6.770 6.179 -5.323 1.00 0.00 O ATOM 0 H GLU A 30 7.627 10.658 -3.981 1.00 0.00 H new ATOM 0 HA GLU A 30 4.961 11.053 -2.974 1.00 0.00 H new ATOM 0 HB2 GLU A 30 4.700 8.704 -3.700 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.325 9.742 -4.966 1.00 0.00 H new ATOM 0 HG2 GLU A 30 7.663 8.886 -4.365 1.00 0.00 H new ATOM 0 HG3 GLU A 30 6.883 7.709 -3.327 1.00 0.00 H new ATOM 496 N LEU A 31 6.996 10.106 -0.813 1.00 0.00 N ATOM 497 CA LEU A 31 7.264 9.604 0.542 1.00 0.00 C ATOM 498 C LEU A 31 6.494 10.357 1.644 1.00 0.00 C ATOM 499 O LEU A 31 6.880 10.316 2.815 1.00 0.00 O ATOM 500 CB LEU A 31 8.784 9.578 0.812 1.00 0.00 C ATOM 501 CG LEU A 31 9.630 8.780 -0.200 1.00 0.00 C ATOM 502 CD1 LEU A 31 11.034 8.553 0.375 1.00 0.00 C ATOM 503 CD2 LEU A 31 8.980 7.440 -0.569 1.00 0.00 C ATOM 0 H LEU A 31 7.753 10.691 -1.167 1.00 0.00 H new ATOM 0 HA LEU A 31 6.884 8.583 0.582 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.148 10.605 0.832 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.951 9.161 1.805 1.00 0.00 H new ATOM 0 HG LEU A 31 9.696 9.364 -1.118 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.633 7.989 -0.340 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.509 9.515 0.567 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.959 7.993 1.307 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.612 6.914 -1.284 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.864 6.833 0.329 1.00 0.00 H new ATOM 0 HD23 LEU A 31 8.001 7.621 -1.014 1.00 0.00 H new ATOM 515 N ASN A 32 5.394 11.019 1.268 1.00 0.00 N ATOM 516 CA ASN A 32 4.350 11.569 2.133 1.00 0.00 C ATOM 517 C ASN A 32 4.114 10.620 3.308 1.00 0.00 C ATOM 518 O ASN A 32 3.951 9.425 3.071 1.00 0.00 O ATOM 519 CB ASN A 32 3.015 11.696 1.370 1.00 0.00 C ATOM 520 CG ASN A 32 3.071 12.430 0.037 1.00 0.00 C ATOM 521 OD1 ASN A 32 2.704 13.595 -0.075 1.00 0.00 O ATOM 522 ND2 ASN A 32 3.479 11.762 -1.032 1.00 0.00 N ATOM 0 H ASN A 32 5.198 11.196 0.283 1.00 0.00 H new ATOM 0 HA ASN A 32 4.679 12.551 2.474 1.00 0.00 H new ATOM 0 HB2 ASN A 32 2.624 10.694 1.193 1.00 0.00 H new ATOM 0 HB3 ASN A 32 2.300 12.208 2.014 1.00 0.00 H new ATOM 0 HD21 ASN A 32 3.487 12.217 -1.945 1.00 0.00 H new ATOM 0 HD22 ASN A 32 3.785 10.793 -0.942 1.00 0.00 H new ATOM 529 N ILE A 33 4.033 11.125 4.541 1.00 0.00 N ATOM 530 CA ILE A 33 3.893 10.316 5.760 1.00 0.00 C ATOM 531 C ILE A 33 2.716 9.311 5.658 1.00 0.00 C ATOM 532 O ILE A 33 2.808 8.190 6.152 1.00 0.00 O ATOM 533 CB ILE A 33 3.796 11.276 6.966 1.00 0.00 C ATOM 534 CG1 ILE A 33 4.233 10.571 8.259 1.00 0.00 C ATOM 535 CG2 ILE A 33 2.407 11.896 7.119 1.00 0.00 C ATOM 536 CD1 ILE A 33 4.146 11.472 9.497 1.00 0.00 C ATOM 0 H ILE A 33 4.063 12.127 4.727 1.00 0.00 H new ATOM 0 HA ILE A 33 4.770 9.683 5.898 1.00 0.00 H new ATOM 0 HB ILE A 33 4.482 12.100 6.769 1.00 0.00 H new ATOM 0 HG12 ILE A 33 3.609 9.691 8.414 1.00 0.00 H new ATOM 0 HG13 ILE A 33 5.258 10.219 8.145 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.399 12.561 7.982 1.00 0.00 H new ATOM 0 HG22 ILE A 33 2.161 12.463 6.221 1.00 0.00 H new ATOM 0 HG23 ILE A 33 1.670 11.106 7.262 1.00 0.00 H new ATOM 0 HD11 ILE A 33 4.468 10.914 10.376 1.00 0.00 H new ATOM 0 HD12 ILE A 33 4.791 12.340 9.361 1.00 0.00 H new ATOM 0 HD13 ILE A 33 3.117 11.803 9.634 1.00 0.00 H new ATOM 548 N GLU A 34 1.624 9.680 4.976 1.00 0.00 N ATOM 549 CA GLU A 34 0.444 8.830 4.810 1.00 0.00 C ATOM 550 C GLU A 34 0.717 7.641 3.887 1.00 0.00 C ATOM 551 O GLU A 34 0.205 6.545 4.137 1.00 0.00 O ATOM 552 CB GLU A 34 -0.711 9.648 4.223 1.00 0.00 C ATOM 553 CG GLU A 34 -1.236 10.690 5.213 1.00 0.00 C ATOM 554 CD GLU A 34 -2.432 11.425 4.617 1.00 0.00 C ATOM 555 OE1 GLU A 34 -3.538 10.825 4.553 1.00 0.00 O ATOM 556 OE2 GLU A 34 -2.219 12.565 4.141 1.00 0.00 O ATOM 0 H GLU A 34 1.537 10.588 4.520 1.00 0.00 H new ATOM 0 HA GLU A 34 0.183 8.449 5.797 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -0.376 10.148 3.314 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -1.522 8.978 3.938 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -1.526 10.204 6.145 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -0.447 11.401 5.457 1.00 0.00 H new ATOM 563 N ASN A 35 1.509 7.856 2.828 1.00 0.00 N ATOM 564 CA ASN A 35 2.047 6.779 2.005 1.00 0.00 C ATOM 565 C ASN A 35 3.029 5.988 2.851 1.00 0.00 C ATOM 566 O ASN A 35 2.925 4.774 2.891 1.00 0.00 O ATOM 567 CB ASN A 35 2.717 7.297 0.722 1.00 0.00 C ATOM 568 CG ASN A 35 3.427 6.182 -0.052 1.00 0.00 C ATOM 569 OD1 ASN A 35 2.923 5.071 -0.200 1.00 0.00 O ATOM 570 ND2 ASN A 35 4.599 6.452 -0.603 1.00 0.00 N ATOM 0 H ASN A 35 1.792 8.787 2.522 1.00 0.00 H new ATOM 0 HA ASN A 35 1.227 6.142 1.675 1.00 0.00 H new ATOM 0 HB2 ASN A 35 1.965 7.758 0.082 1.00 0.00 H new ATOM 0 HB3 ASN A 35 3.437 8.074 0.979 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.082 5.739 -1.149 1.00 0.00 H new ATOM 0 HD22 ASN A 35 5.019 7.373 -0.482 1.00 0.00 H new ATOM 577 N ALA A 36 3.933 6.648 3.580 1.00 0.00 N ATOM 578 CA ALA A 36 4.931 5.991 4.411 1.00 0.00 C ATOM 579 C ALA A 36 4.305 4.984 5.379 1.00 0.00 C ATOM 580 O ALA A 36 4.822 3.876 5.496 1.00 0.00 O ATOM 581 CB ALA A 36 5.778 7.009 5.165 1.00 0.00 C ATOM 0 H ALA A 36 3.988 7.666 3.606 1.00 0.00 H new ATOM 0 HA ALA A 36 5.583 5.433 3.739 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.514 6.488 5.777 1.00 0.00 H new ATOM 0 HB2 ALA A 36 6.291 7.655 4.452 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.136 7.613 5.806 1.00 0.00 H new ATOM 587 N HIS A 37 3.197 5.309 6.057 1.00 0.00 N ATOM 588 CA HIS A 37 2.593 4.330 6.958 1.00 0.00 C ATOM 589 C HIS A 37 2.064 3.122 6.185 1.00 0.00 C ATOM 590 O HIS A 37 2.229 1.983 6.634 1.00 0.00 O ATOM 591 CB HIS A 37 1.472 4.923 7.827 1.00 0.00 C ATOM 592 CG HIS A 37 1.020 3.976 8.923 1.00 0.00 C ATOM 593 ND1 HIS A 37 -0.242 3.926 9.466 1.00 0.00 N ATOM 594 CD2 HIS A 37 1.763 2.998 9.536 1.00 0.00 C ATOM 595 CE1 HIS A 37 -0.270 2.942 10.376 1.00 0.00 C ATOM 596 NE2 HIS A 37 0.917 2.308 10.415 1.00 0.00 N ATOM 0 H HIS A 37 2.718 6.208 6.001 1.00 0.00 H new ATOM 0 HA HIS A 37 3.390 4.010 7.629 1.00 0.00 H new ATOM 0 HB2 HIS A 37 1.819 5.853 8.276 1.00 0.00 H new ATOM 0 HB3 HIS A 37 0.621 5.173 7.194 1.00 0.00 H new ATOM 0 HD2 HIS A 37 2.811 2.796 9.371 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -1.123 2.693 10.990 1.00 0.00 H new ATOM 0 HE2 HIS A 37 1.154 1.488 10.974 1.00 0.00 H new ATOM 604 N LEU A 38 1.392 3.336 5.051 1.00 0.00 N ATOM 605 CA LEU A 38 0.827 2.243 4.283 1.00 0.00 C ATOM 606 C LEU A 38 1.925 1.527 3.485 1.00 0.00 C ATOM 607 O LEU A 38 1.720 0.392 3.092 1.00 0.00 O ATOM 608 CB LEU A 38 -0.372 2.763 3.466 1.00 0.00 C ATOM 609 CG LEU A 38 -0.074 3.177 2.014 1.00 0.00 C ATOM 610 CD1 LEU A 38 -0.309 1.986 1.091 1.00 0.00 C ATOM 611 CD2 LEU A 38 -0.985 4.326 1.577 1.00 0.00 C ATOM 0 H LEU A 38 1.230 4.260 4.651 1.00 0.00 H new ATOM 0 HA LEU A 38 0.420 1.466 4.931 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -1.139 1.988 3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -0.796 3.621 3.987 1.00 0.00 H new ATOM 0 HG LEU A 38 0.964 3.506 1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.099 2.276 0.062 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.350 1.167 1.379 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.347 1.662 1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.756 4.601 0.548 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.026 4.011 1.645 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -0.823 5.186 2.227 1.00 0.00 H new ATOM 623 N PHE A 39 3.116 2.111 3.327 1.00 0.00 N ATOM 624 CA PHE A 39 4.224 1.646 2.495 1.00 0.00 C ATOM 625 C PHE A 39 4.536 0.183 2.770 1.00 0.00 C ATOM 626 O PHE A 39 4.713 -0.602 1.848 1.00 0.00 O ATOM 627 CB PHE A 39 5.457 2.514 2.787 1.00 0.00 C ATOM 628 CG PHE A 39 6.532 2.630 1.728 1.00 0.00 C ATOM 629 CD1 PHE A 39 6.322 3.503 0.644 1.00 0.00 C ATOM 630 CD2 PHE A 39 7.790 2.017 1.901 1.00 0.00 C ATOM 631 CE1 PHE A 39 7.370 3.835 -0.228 1.00 0.00 C ATOM 632 CE2 PHE A 39 8.826 2.300 0.988 1.00 0.00 C ATOM 633 CZ PHE A 39 8.626 3.222 -0.060 1.00 0.00 C ATOM 0 H PHE A 39 3.345 2.980 3.810 1.00 0.00 H new ATOM 0 HA PHE A 39 3.945 1.734 1.445 1.00 0.00 H new ATOM 0 HB2 PHE A 39 5.106 3.521 3.013 1.00 0.00 H new ATOM 0 HB3 PHE A 39 5.925 2.129 3.693 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.341 3.923 0.481 1.00 0.00 H new ATOM 0 HD2 PHE A 39 7.958 1.338 2.724 1.00 0.00 H new ATOM 0 HE1 PHE A 39 7.215 4.553 -1.020 1.00 0.00 H new ATOM 0 HE2 PHE A 39 9.781 1.806 1.092 1.00 0.00 H new ATOM 0 HZ PHE A 39 9.436 3.458 -0.734 1.00 0.00 H new ATOM 643 N LYS A 40 4.576 -0.200 4.048 1.00 0.00 N ATOM 644 CA LYS A 40 4.780 -1.583 4.448 1.00 0.00 C ATOM 645 C LYS A 40 3.586 -2.457 4.054 1.00 0.00 C ATOM 646 O LYS A 40 3.818 -3.560 3.579 1.00 0.00 O ATOM 647 CB LYS A 40 5.129 -1.599 5.941 1.00 0.00 C ATOM 648 CG LYS A 40 5.352 -2.987 6.558 1.00 0.00 C ATOM 649 CD LYS A 40 4.043 -3.627 7.055 1.00 0.00 C ATOM 650 CE LYS A 40 4.250 -4.531 8.275 1.00 0.00 C ATOM 651 NZ LYS A 40 4.660 -3.783 9.483 1.00 0.00 N ATOM 0 H LYS A 40 4.467 0.445 4.831 1.00 0.00 H new ATOM 0 HA LYS A 40 5.618 -2.031 3.914 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.031 -1.006 6.091 1.00 0.00 H new ATOM 0 HB3 LYS A 40 4.327 -1.103 6.488 1.00 0.00 H new ATOM 0 HG2 LYS A 40 5.814 -3.640 5.818 1.00 0.00 H new ATOM 0 HG3 LYS A 40 6.051 -2.903 7.390 1.00 0.00 H new ATOM 0 HD2 LYS A 40 3.332 -2.840 7.308 1.00 0.00 H new ATOM 0 HD3 LYS A 40 3.599 -4.210 6.248 1.00 0.00 H new ATOM 0 HE2 LYS A 40 3.325 -5.069 8.483 1.00 0.00 H new ATOM 0 HE3 LYS A 40 5.008 -5.279 8.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 4.369 -4.309 10.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 5.693 -3.666 9.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.206 -2.847 9.483 1.00 0.00 H new ATOM 665 N LYS A 41 2.336 -2.006 4.215 1.00 0.00 N ATOM 666 CA LYS A 41 1.152 -2.739 3.756 1.00 0.00 C ATOM 667 C LYS A 41 1.227 -2.979 2.250 1.00 0.00 C ATOM 668 O LYS A 41 1.015 -4.111 1.820 1.00 0.00 O ATOM 669 CB LYS A 41 -0.157 -1.989 4.091 1.00 0.00 C ATOM 670 CG LYS A 41 -1.338 -2.972 4.009 1.00 0.00 C ATOM 671 CD LYS A 41 -2.703 -2.341 4.307 1.00 0.00 C ATOM 672 CE LYS A 41 -3.851 -3.161 3.693 1.00 0.00 C ATOM 673 NZ LYS A 41 -3.899 -4.580 4.115 1.00 0.00 N ATOM 0 H LYS A 41 2.118 -1.119 4.669 1.00 0.00 H new ATOM 0 HA LYS A 41 1.141 -3.693 4.282 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -0.097 -1.556 5.090 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -0.306 -1.164 3.395 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -1.363 -3.410 3.011 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -1.166 -3.788 4.711 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -2.843 -2.268 5.385 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.729 -1.325 3.913 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -4.797 -2.687 3.955 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -3.765 -3.123 2.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -4.712 -5.048 3.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -3.021 -5.058 3.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -3.997 -4.632 5.149 1.00 0.00 H new ATOM 687 N TRP A 42 1.526 -1.933 1.477 1.00 0.00 N ATOM 688 CA TRP A 42 1.686 -1.995 0.036 1.00 0.00 C ATOM 689 C TRP A 42 2.791 -2.984 -0.275 1.00 0.00 C ATOM 690 O TRP A 42 2.489 -4.003 -0.874 1.00 0.00 O ATOM 691 CB TRP A 42 1.917 -0.595 -0.543 1.00 0.00 C ATOM 692 CG TRP A 42 2.573 -0.485 -1.893 1.00 0.00 C ATOM 693 CD1 TRP A 42 2.120 -0.939 -3.086 1.00 0.00 C ATOM 694 CD2 TRP A 42 3.832 0.171 -2.191 1.00 0.00 C ATOM 695 NE1 TRP A 42 2.986 -0.554 -4.094 1.00 0.00 N ATOM 696 CE2 TRP A 42 4.073 0.130 -3.595 1.00 0.00 C ATOM 697 CE3 TRP A 42 4.806 0.783 -1.388 1.00 0.00 C ATOM 698 CZ2 TRP A 42 5.212 0.722 -4.170 1.00 0.00 C ATOM 699 CZ3 TRP A 42 5.961 1.338 -1.946 1.00 0.00 C ATOM 700 CH2 TRP A 42 6.142 1.361 -3.335 1.00 0.00 C ATOM 0 H TRP A 42 1.666 -0.996 1.854 1.00 0.00 H new ATOM 0 HA TRP A 42 0.777 -2.353 -0.448 1.00 0.00 H new ATOM 0 HB2 TRP A 42 0.950 -0.094 -0.600 1.00 0.00 H new ATOM 0 HB3 TRP A 42 2.524 -0.036 0.169 1.00 0.00 H new ATOM 0 HD1 TRP A 42 1.218 -1.515 -3.229 1.00 0.00 H new ATOM 0 HE1 TRP A 42 2.838 -0.752 -5.084 1.00 0.00 H new ATOM 0 HE3 TRP A 42 4.661 0.826 -0.319 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 5.369 0.685 -5.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 6.721 1.753 -1.300 1.00 0.00 H new ATOM 0 HH2 TRP A 42 6.994 1.869 -3.762 1.00 0.00 H new ATOM 711 N VAL A 43 4.032 -2.760 0.170 1.00 0.00 N ATOM 712 CA VAL A 43 5.130 -3.671 -0.136 1.00 0.00 C ATOM 713 C VAL A 43 4.784 -5.124 0.239 1.00 0.00 C ATOM 714 O VAL A 43 5.150 -6.041 -0.504 1.00 0.00 O ATOM 715 CB VAL A 43 6.456 -3.159 0.476 1.00 0.00 C ATOM 716 CG1 VAL A 43 7.608 -4.180 0.424 1.00 0.00 C ATOM 717 CG2 VAL A 43 6.934 -1.901 -0.267 1.00 0.00 C ATOM 0 H VAL A 43 4.296 -1.957 0.741 1.00 0.00 H new ATOM 0 HA VAL A 43 5.283 -3.686 -1.215 1.00 0.00 H new ATOM 0 HB VAL A 43 6.224 -2.958 1.522 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.501 -3.744 0.872 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.325 -5.076 0.976 1.00 0.00 H new ATOM 0 HG13 VAL A 43 7.814 -4.443 -0.613 1.00 0.00 H new ATOM 0 HG21 VAL A 43 7.868 -1.551 0.173 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.095 -2.139 -1.318 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.178 -1.120 -0.184 1.00 0.00 H new ATOM 727 N PHE A 44 4.069 -5.353 1.347 1.00 0.00 N ATOM 728 CA PHE A 44 3.595 -6.664 1.738 1.00 0.00 C ATOM 729 C PHE A 44 2.687 -7.247 0.654 1.00 0.00 C ATOM 730 O PHE A 44 3.015 -8.262 0.058 1.00 0.00 O ATOM 731 CB PHE A 44 2.891 -6.606 3.103 1.00 0.00 C ATOM 732 CG PHE A 44 3.761 -6.853 4.325 1.00 0.00 C ATOM 733 CD1 PHE A 44 5.006 -6.207 4.491 1.00 0.00 C ATOM 734 CD2 PHE A 44 3.296 -7.723 5.330 1.00 0.00 C ATOM 735 CE1 PHE A 44 5.774 -6.436 5.647 1.00 0.00 C ATOM 736 CE2 PHE A 44 4.063 -7.948 6.484 1.00 0.00 C ATOM 737 CZ PHE A 44 5.300 -7.306 6.643 1.00 0.00 C ATOM 0 H PHE A 44 3.805 -4.614 1.999 1.00 0.00 H new ATOM 0 HA PHE A 44 4.452 -7.329 1.845 1.00 0.00 H new ATOM 0 HB2 PHE A 44 2.428 -5.625 3.207 1.00 0.00 H new ATOM 0 HB3 PHE A 44 2.086 -7.341 3.103 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.370 -5.535 3.728 1.00 0.00 H new ATOM 0 HD2 PHE A 44 2.344 -8.220 5.212 1.00 0.00 H new ATOM 0 HE1 PHE A 44 6.727 -5.943 5.769 1.00 0.00 H new ATOM 0 HE2 PHE A 44 3.700 -8.617 7.251 1.00 0.00 H new ATOM 0 HZ PHE A 44 5.888 -7.481 7.532 1.00 0.00 H new ATOM 747 N ASP A 45 1.541 -6.624 0.429 1.00 0.00 N ATOM 748 CA ASP A 45 0.465 -7.072 -0.459 1.00 0.00 C ATOM 749 C ASP A 45 0.955 -7.188 -1.908 1.00 0.00 C ATOM 750 O ASP A 45 0.804 -8.228 -2.551 1.00 0.00 O ATOM 751 CB ASP A 45 -0.715 -6.090 -0.325 1.00 0.00 C ATOM 752 CG ASP A 45 -2.025 -6.576 -0.953 1.00 0.00 C ATOM 753 OD1 ASP A 45 -2.034 -7.033 -2.113 1.00 0.00 O ATOM 754 OD2 ASP A 45 -3.073 -6.427 -0.277 1.00 0.00 O ATOM 0 H ASP A 45 1.318 -5.739 0.885 1.00 0.00 H new ATOM 0 HA ASP A 45 0.134 -8.069 -0.170 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.887 -5.891 0.733 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.436 -5.143 -0.786 1.00 0.00 H new ATOM 759 N GLU A 46 1.586 -6.122 -2.388 1.00 0.00 N ATOM 760 CA GLU A 46 2.056 -5.901 -3.745 1.00 0.00 C ATOM 761 C GLU A 46 3.199 -6.859 -4.098 1.00 0.00 C ATOM 762 O GLU A 46 3.243 -7.324 -5.236 1.00 0.00 O ATOM 763 CB GLU A 46 2.504 -4.430 -3.839 1.00 0.00 C ATOM 764 CG GLU A 46 2.707 -3.860 -5.248 1.00 0.00 C ATOM 765 CD GLU A 46 1.502 -3.118 -5.842 1.00 0.00 C ATOM 766 OE1 GLU A 46 0.340 -3.279 -5.403 1.00 0.00 O ATOM 767 OE2 GLU A 46 1.750 -2.298 -6.757 1.00 0.00 O ATOM 0 H GLU A 46 1.798 -5.326 -1.786 1.00 0.00 H new ATOM 0 HA GLU A 46 1.260 -6.099 -4.462 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.764 -3.816 -3.327 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.440 -4.324 -3.291 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.557 -3.177 -5.226 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.973 -4.678 -5.917 1.00 0.00 H new ATOM 774 N PHE A 47 4.101 -7.192 -3.154 1.00 0.00 N ATOM 775 CA PHE A 47 5.274 -8.010 -3.454 1.00 0.00 C ATOM 776 C PHE A 47 5.417 -9.188 -2.496 1.00 0.00 C ATOM 777 O PHE A 47 5.452 -10.340 -2.928 1.00 0.00 O ATOM 778 CB PHE A 47 6.579 -7.202 -3.464 1.00 0.00 C ATOM 779 CG PHE A 47 6.559 -5.876 -4.186 1.00 0.00 C ATOM 780 CD1 PHE A 47 6.734 -5.804 -5.577 1.00 0.00 C ATOM 781 CD2 PHE A 47 6.426 -4.697 -3.440 1.00 0.00 C ATOM 782 CE1 PHE A 47 6.781 -4.547 -6.199 1.00 0.00 C ATOM 783 CE2 PHE A 47 6.405 -3.442 -4.069 1.00 0.00 C ATOM 784 CZ PHE A 47 6.593 -3.368 -5.456 1.00 0.00 C ATOM 0 H PHE A 47 4.032 -6.903 -2.178 1.00 0.00 H new ATOM 0 HA PHE A 47 5.102 -8.392 -4.460 1.00 0.00 H new ATOM 0 HB2 PHE A 47 6.873 -7.020 -2.430 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.357 -7.820 -3.912 1.00 0.00 H new ATOM 0 HD1 PHE A 47 6.831 -6.706 -6.162 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.338 -4.755 -2.365 1.00 0.00 H new ATOM 0 HE1 PHE A 47 6.964 -4.484 -7.262 1.00 0.00 H new ATOM 0 HE2 PHE A 47 6.246 -2.544 -3.491 1.00 0.00 H new ATOM 0 HZ PHE A 47 6.593 -2.409 -5.952 1.00 0.00 H new ATOM 794 N LEU A 48 5.557 -8.925 -1.194 1.00 0.00 N ATOM 795 CA LEU A 48 6.002 -9.946 -0.240 1.00 0.00 C ATOM 796 C LEU A 48 5.019 -11.110 -0.115 1.00 0.00 C ATOM 797 O LEU A 48 5.407 -12.203 0.297 1.00 0.00 O ATOM 798 CB LEU A 48 6.210 -9.369 1.165 1.00 0.00 C ATOM 799 CG LEU A 48 7.140 -8.153 1.300 1.00 0.00 C ATOM 800 CD1 LEU A 48 7.564 -8.000 2.766 1.00 0.00 C ATOM 801 CD2 LEU A 48 8.390 -8.186 0.417 1.00 0.00 C ATOM 0 H LEU A 48 5.369 -8.014 -0.776 1.00 0.00 H new ATOM 0 HA LEU A 48 6.947 -10.309 -0.645 1.00 0.00 H new ATOM 0 HB2 LEU A 48 5.234 -9.092 1.563 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.600 -10.164 1.801 1.00 0.00 H new ATOM 0 HG LEU A 48 6.557 -7.301 0.952 1.00 0.00 H new ATOM 0 HD11 LEU A 48 8.224 -7.138 2.866 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.680 -7.854 3.387 1.00 0.00 H new ATOM 0 HD13 LEU A 48 8.090 -8.899 3.088 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.979 -7.285 0.586 1.00 0.00 H new ATOM 0 HD22 LEU A 48 8.988 -9.062 0.666 1.00 0.00 H new ATOM 0 HD23 LEU A 48 8.094 -8.234 -0.631 1.00 0.00 H new ATOM 813 N ASN A 49 3.752 -10.849 -0.415 1.00 0.00 N ATOM 814 CA ASN A 49 2.636 -11.784 -0.419 1.00 0.00 C ATOM 815 C ASN A 49 2.314 -12.264 -1.825 1.00 0.00 C ATOM 816 O ASN A 49 1.611 -13.261 -1.966 1.00 0.00 O ATOM 817 CB ASN A 49 1.384 -11.093 0.125 1.00 0.00 C ATOM 818 CG ASN A 49 1.442 -10.807 1.617 1.00 0.00 C ATOM 819 OD1 ASN A 49 2.134 -11.486 2.374 1.00 0.00 O ATOM 820 ND2 ASN A 49 0.704 -9.817 2.079 1.00 0.00 N ATOM 0 H ASN A 49 3.458 -9.909 -0.681 1.00 0.00 H new ATOM 0 HA ASN A 49 2.924 -12.634 0.200 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.236 -10.155 -0.410 1.00 0.00 H new ATOM 0 HB3 ASN A 49 0.516 -11.718 -0.082 1.00 0.00 H new ATOM 0 HD21 ASN A 49 0.702 -9.605 3.077 1.00 0.00 H new ATOM 0 HD22 ASN A 49 0.135 -9.263 1.439 1.00 0.00 H new ATOM 827 N LYS A 50 2.822 -11.572 -2.848 1.00 0.00 N ATOM 828 CA LYS A 50 2.897 -12.062 -4.217 1.00 0.00 C ATOM 829 C LYS A 50 3.930 -13.187 -4.339 1.00 0.00 C ATOM 830 O LYS A 50 3.906 -13.907 -5.333 1.00 0.00 O ATOM 831 CB LYS A 50 3.265 -10.891 -5.156 1.00 0.00 C ATOM 832 CG LYS A 50 2.104 -10.466 -6.059 1.00 0.00 C ATOM 833 CD LYS A 50 2.634 -9.858 -7.363 1.00 0.00 C ATOM 834 CE LYS A 50 1.487 -9.437 -8.279 1.00 0.00 C ATOM 835 NZ LYS A 50 1.983 -8.922 -9.569 1.00 0.00 N ATOM 0 H LYS A 50 3.201 -10.631 -2.739 1.00 0.00 H new ATOM 0 HA LYS A 50 1.926 -12.468 -4.502 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.584 -10.038 -4.557 1.00 0.00 H new ATOM 0 HB3 LYS A 50 4.114 -11.181 -5.776 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.474 -11.327 -6.282 1.00 0.00 H new ATOM 0 HG3 LYS A 50 1.479 -9.740 -5.540 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.259 -8.994 -7.137 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.266 -10.583 -7.876 1.00 0.00 H new ATOM 0 HE2 LYS A 50 0.830 -10.289 -8.455 1.00 0.00 H new ATOM 0 HE3 LYS A 50 0.890 -8.670 -7.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 1.177 -8.646 -10.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.590 -8.094 -9.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.532 -9.662 -10.050 1.00 0.00 H new ATOM 849 N GLY A 51 4.825 -13.331 -3.356 1.00 0.00 N ATOM 850 CA GLY A 51 5.865 -14.350 -3.298 1.00 0.00 C ATOM 851 C GLY A 51 7.268 -13.785 -3.537 1.00 0.00 C ATOM 852 O GLY A 51 8.232 -14.556 -3.552 1.00 0.00 O ATOM 0 H GLY A 51 4.840 -12.711 -2.546 1.00 0.00 H new ATOM 0 HA2 GLY A 51 5.836 -14.836 -2.323 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.656 -15.118 -4.043 1.00 0.00 H new ATOM 856 N TYR A 52 7.414 -12.472 -3.733 1.00 0.00 N ATOM 857 CA TYR A 52 8.705 -11.840 -3.960 1.00 0.00 C ATOM 858 C TYR A 52 9.522 -11.804 -2.664 1.00 0.00 C ATOM 859 O TYR A 52 8.975 -11.608 -1.573 1.00 0.00 O ATOM 860 CB TYR A 52 8.482 -10.429 -4.507 1.00 0.00 C ATOM 861 CG TYR A 52 8.088 -10.375 -5.973 1.00 0.00 C ATOM 862 CD1 TYR A 52 9.021 -10.704 -6.973 1.00 0.00 C ATOM 863 CD2 TYR A 52 6.788 -9.997 -6.346 1.00 0.00 C ATOM 864 CE1 TYR A 52 8.668 -10.642 -8.330 1.00 0.00 C ATOM 865 CE2 TYR A 52 6.421 -9.935 -7.700 1.00 0.00 C ATOM 866 CZ TYR A 52 7.354 -10.280 -8.703 1.00 0.00 C ATOM 867 OH TYR A 52 6.980 -10.280 -10.009 1.00 0.00 O ATOM 0 H TYR A 52 6.631 -11.818 -3.738 1.00 0.00 H new ATOM 0 HA TYR A 52 9.271 -12.419 -4.689 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.705 -9.943 -3.917 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.396 -9.851 -4.368 1.00 0.00 H new ATOM 0 HD1 TYR A 52 10.019 -11.007 -6.694 1.00 0.00 H new ATOM 0 HD2 TYR A 52 6.063 -9.752 -5.584 1.00 0.00 H new ATOM 0 HE1 TYR A 52 9.401 -10.871 -9.089 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.424 -9.623 -7.975 1.00 0.00 H new ATOM 0 HH TYR A 52 6.042 -10.006 -10.081 1.00 0.00 H new ATOM 877 N ASN A 53 10.846 -11.942 -2.778 1.00 0.00 N ATOM 878 CA ASN A 53 11.784 -11.985 -1.645 1.00 0.00 C ATOM 879 C ASN A 53 12.925 -10.971 -1.765 1.00 0.00 C ATOM 880 O ASN A 53 13.807 -10.940 -0.909 1.00 0.00 O ATOM 881 CB ASN A 53 12.320 -13.415 -1.405 1.00 0.00 C ATOM 882 CG ASN A 53 11.379 -14.355 -0.647 1.00 0.00 C ATOM 883 OD1 ASN A 53 11.261 -15.517 -1.007 1.00 0.00 O ATOM 884 ND2 ASN A 53 10.695 -13.934 0.401 1.00 0.00 N ATOM 0 H ASN A 53 11.310 -12.029 -3.682 1.00 0.00 H new ATOM 0 HA ASN A 53 11.209 -11.689 -0.768 1.00 0.00 H new ATOM 0 HB2 ASN A 53 12.552 -13.864 -2.371 1.00 0.00 H new ATOM 0 HB3 ASN A 53 13.257 -13.345 -0.853 1.00 0.00 H new ATOM 0 HD21 ASN A 53 10.078 -14.576 0.899 1.00 0.00 H new ATOM 0 HD22 ASN A 53 10.784 -12.967 0.713 1.00 0.00 H new ATOM 891 N LYS A 54 12.952 -10.103 -2.768 1.00 0.00 N ATOM 892 CA LYS A 54 14.107 -9.284 -3.137 1.00 0.00 C ATOM 893 C LYS A 54 13.572 -7.961 -3.643 1.00 0.00 C ATOM 894 O LYS A 54 13.116 -7.864 -4.779 1.00 0.00 O ATOM 895 CB LYS A 54 14.973 -10.024 -4.161 1.00 0.00 C ATOM 896 CG LYS A 54 16.092 -10.765 -3.414 1.00 0.00 C ATOM 897 CD LYS A 54 16.453 -12.118 -4.024 1.00 0.00 C ATOM 898 CE LYS A 54 15.264 -13.077 -3.888 1.00 0.00 C ATOM 899 NZ LYS A 54 15.658 -14.476 -4.142 1.00 0.00 N ATOM 0 H LYS A 54 12.144 -9.942 -3.370 1.00 0.00 H new ATOM 0 HA LYS A 54 14.761 -9.092 -2.286 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.367 -10.729 -4.730 1.00 0.00 H new ATOM 0 HB3 LYS A 54 15.398 -9.320 -4.876 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.982 -10.136 -3.397 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.787 -10.914 -2.378 1.00 0.00 H new ATOM 0 HD2 LYS A 54 16.716 -11.996 -5.075 1.00 0.00 H new ATOM 0 HD3 LYS A 54 17.327 -12.533 -3.522 1.00 0.00 H new ATOM 0 HE2 LYS A 54 14.843 -12.994 -2.886 1.00 0.00 H new ATOM 0 HE3 LYS A 54 14.481 -12.787 -4.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 14.828 -15.094 -4.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 16.037 -14.560 -5.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 16.387 -14.761 -3.458 1.00 0.00 H new ATOM 913 N ILE A 55 13.504 -6.972 -2.771 1.00 0.00 N ATOM 914 CA ILE A 55 13.002 -5.643 -3.072 1.00 0.00 C ATOM 915 C ILE A 55 14.246 -4.777 -3.237 1.00 0.00 C ATOM 916 O ILE A 55 15.261 -5.056 -2.594 1.00 0.00 O ATOM 917 CB ILE A 55 12.085 -5.186 -1.901 1.00 0.00 C ATOM 918 CG1 ILE A 55 10.678 -5.837 -1.860 1.00 0.00 C ATOM 919 CG2 ILE A 55 11.808 -3.679 -1.949 1.00 0.00 C ATOM 920 CD1 ILE A 55 10.552 -7.258 -2.377 1.00 0.00 C ATOM 0 H ILE A 55 13.806 -7.075 -1.802 1.00 0.00 H new ATOM 0 HA ILE A 55 12.395 -5.586 -3.976 1.00 0.00 H new ATOM 0 HB ILE A 55 12.659 -5.497 -1.028 1.00 0.00 H new ATOM 0 HG12 ILE A 55 10.330 -5.822 -0.827 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.999 -5.208 -2.435 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.164 -3.401 -1.115 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.749 -3.134 -1.879 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.313 -3.430 -2.888 1.00 0.00 H new ATOM 0 HD11 ILE A 55 9.516 -7.587 -2.289 1.00 0.00 H new ATOM 0 HD12 ILE A 55 10.856 -7.293 -3.423 1.00 0.00 H new ATOM 0 HD13 ILE A 55 11.193 -7.917 -1.791 1.00 0.00 H new ATOM 932 N PHE A 56 14.153 -3.691 -4.003 1.00 0.00 N ATOM 933 CA PHE A 56 15.151 -2.608 -3.959 1.00 0.00 C ATOM 934 C PHE A 56 14.497 -1.263 -3.666 1.00 0.00 C ATOM 935 O PHE A 56 13.311 -1.094 -3.941 1.00 0.00 O ATOM 936 CB PHE A 56 16.020 -2.554 -5.237 1.00 0.00 C ATOM 937 CG PHE A 56 17.024 -3.682 -5.440 1.00 0.00 C ATOM 938 CD1 PHE A 56 17.565 -4.383 -4.344 1.00 0.00 C ATOM 939 CD2 PHE A 56 17.406 -4.058 -6.747 1.00 0.00 C ATOM 940 CE1 PHE A 56 18.439 -5.458 -4.571 1.00 0.00 C ATOM 941 CE2 PHE A 56 18.189 -5.194 -6.980 1.00 0.00 C ATOM 942 CZ PHE A 56 18.737 -5.869 -5.881 1.00 0.00 C ATOM 0 H PHE A 56 13.395 -3.532 -4.667 1.00 0.00 H new ATOM 0 HA PHE A 56 15.827 -2.834 -3.135 1.00 0.00 H new ATOM 0 HB2 PHE A 56 15.353 -2.535 -6.099 1.00 0.00 H new ATOM 0 HB3 PHE A 56 16.566 -1.611 -5.235 1.00 0.00 H new ATOM 0 HD1 PHE A 56 17.309 -4.095 -3.335 1.00 0.00 H new ATOM 0 HD2 PHE A 56 17.087 -3.456 -7.585 1.00 0.00 H new ATOM 0 HE1 PHE A 56 18.885 -5.973 -3.733 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.367 -5.543 -7.986 1.00 0.00 H new ATOM 0 HZ PHE A 56 19.393 -6.711 -6.042 1.00 0.00 H new ATOM 952 N LEU A 57 15.266 -0.308 -3.122 1.00 0.00 N ATOM 953 CA LEU A 57 14.836 1.066 -2.863 1.00 0.00 C ATOM 954 C LEU A 57 15.879 2.014 -3.440 1.00 0.00 C ATOM 955 O LEU A 57 16.995 2.079 -2.934 1.00 0.00 O ATOM 956 CB LEU A 57 14.669 1.273 -1.351 1.00 0.00 C ATOM 957 CG LEU A 57 14.316 2.707 -0.915 1.00 0.00 C ATOM 958 CD1 LEU A 57 12.865 3.044 -1.281 1.00 0.00 C ATOM 959 CD2 LEU A 57 14.503 2.801 0.603 1.00 0.00 C ATOM 0 H LEU A 57 16.232 -0.480 -2.843 1.00 0.00 H new ATOM 0 HA LEU A 57 13.875 1.267 -3.337 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.889 0.600 -0.993 1.00 0.00 H new ATOM 0 HB3 LEU A 57 15.595 0.979 -0.857 1.00 0.00 H new ATOM 0 HG LEU A 57 14.965 3.417 -1.427 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.637 4.062 -0.964 1.00 0.00 H new ATOM 0 HD12 LEU A 57 12.733 2.962 -2.360 1.00 0.00 H new ATOM 0 HD13 LEU A 57 12.192 2.348 -0.780 1.00 0.00 H new ATOM 0 HD21 LEU A 57 14.259 3.809 0.938 1.00 0.00 H new ATOM 0 HD22 LEU A 57 13.845 2.086 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.539 2.575 0.857 1.00 0.00 H new ATOM 971 N VAL A 58 15.561 2.688 -4.536 1.00 0.00 N ATOM 972 CA VAL A 58 16.441 3.676 -5.124 1.00 0.00 C ATOM 973 C VAL A 58 16.416 4.969 -4.314 1.00 0.00 C ATOM 974 O VAL A 58 15.530 5.191 -3.488 1.00 0.00 O ATOM 975 CB VAL A 58 16.194 3.804 -6.645 1.00 0.00 C ATOM 976 CG1 VAL A 58 15.670 2.539 -7.325 1.00 0.00 C ATOM 977 CG2 VAL A 58 15.679 5.115 -7.228 1.00 0.00 C ATOM 0 H VAL A 58 14.683 2.562 -5.040 1.00 0.00 H new ATOM 0 HA VAL A 58 17.479 3.348 -5.062 1.00 0.00 H new ATOM 0 HB VAL A 58 17.234 3.904 -6.957 1.00 0.00 H new ATOM 0 HG11 VAL A 58 15.529 2.730 -8.389 1.00 0.00 H new ATOM 0 HG12 VAL A 58 16.389 1.731 -7.194 1.00 0.00 H new ATOM 0 HG13 VAL A 58 14.718 2.254 -6.878 1.00 0.00 H new ATOM 0 HG21 VAL A 58 15.568 5.014 -8.308 1.00 0.00 H new ATOM 0 HG22 VAL A 58 14.713 5.356 -6.784 1.00 0.00 H new ATOM 0 HG23 VAL A 58 16.388 5.914 -7.009 1.00 0.00 H new ATOM 987 N LEU A 59 17.429 5.803 -4.515 1.00 0.00 N ATOM 988 CA LEU A 59 17.664 7.027 -3.761 1.00 0.00 C ATOM 989 C LEU A 59 18.133 8.142 -4.715 1.00 0.00 C ATOM 990 O LEU A 59 18.587 9.190 -4.264 1.00 0.00 O ATOM 991 CB LEU A 59 18.675 6.719 -2.635 1.00 0.00 C ATOM 992 CG LEU A 59 18.168 5.715 -1.575 1.00 0.00 C ATOM 993 CD1 LEU A 59 19.320 5.086 -0.795 1.00 0.00 C ATOM 994 CD2 LEU A 59 17.188 6.375 -0.606 1.00 0.00 C ATOM 0 H LEU A 59 18.134 5.639 -5.233 1.00 0.00 H new ATOM 0 HA LEU A 59 16.749 7.389 -3.293 1.00 0.00 H new ATOM 0 HB2 LEU A 59 19.588 6.326 -3.082 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.940 7.652 -2.137 1.00 0.00 H new ATOM 0 HG LEU A 59 17.648 4.925 -2.117 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.922 4.386 -0.060 1.00 0.00 H new ATOM 0 HD12 LEU A 59 19.978 4.555 -1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 59 19.883 5.867 -0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 59 16.851 5.641 0.126 1.00 0.00 H new ATOM 0 HD22 LEU A 59 17.683 7.199 -0.093 1.00 0.00 H new ATOM 0 HD23 LEU A 59 16.330 6.756 -1.160 1.00 0.00 H new ATOM 1006 N SER A 60 18.005 7.927 -6.034 1.00 0.00 N ATOM 1007 CA SER A 60 18.461 8.834 -7.072 1.00 0.00 C ATOM 1008 C SER A 60 17.658 10.133 -7.040 1.00 0.00 C ATOM 1009 O SER A 60 18.216 11.204 -6.815 1.00 0.00 O ATOM 1010 CB SER A 60 18.338 8.162 -8.448 1.00 0.00 C ATOM 1011 OG SER A 60 19.151 7.007 -8.537 1.00 0.00 O ATOM 0 H SER A 60 17.565 7.086 -6.408 1.00 0.00 H new ATOM 0 HA SER A 60 19.508 9.075 -6.890 1.00 0.00 H new ATOM 0 HB2 SER A 60 17.298 7.891 -8.630 1.00 0.00 H new ATOM 0 HB3 SER A 60 18.623 8.870 -9.226 1.00 0.00 H new ATOM 0 HG SER A 60 19.048 6.602 -9.424 1.00 0.00 H new ATOM 1017 N ASP A 61 16.352 10.056 -7.311 1.00 0.00 N ATOM 1018 CA ASP A 61 15.552 11.257 -7.527 1.00 0.00 C ATOM 1019 C ASP A 61 15.368 12.051 -6.238 1.00 0.00 C ATOM 1020 O ASP A 61 15.424 13.283 -6.238 1.00 0.00 O ATOM 1021 CB ASP A 61 14.173 10.887 -8.072 1.00 0.00 C ATOM 1022 CG ASP A 61 13.425 12.166 -8.437 1.00 0.00 C ATOM 1023 OD1 ASP A 61 13.669 12.694 -9.546 1.00 0.00 O ATOM 1024 OD2 ASP A 61 12.676 12.737 -7.610 1.00 0.00 O ATOM 0 H ASP A 61 15.833 9.181 -7.385 1.00 0.00 H new ATOM 0 HA ASP A 61 16.089 11.873 -8.248 1.00 0.00 H new ATOM 0 HB2 ASP A 61 14.274 10.246 -8.948 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.613 10.322 -7.327 1.00 0.00 H new ATOM 1029 N VAL A 62 15.082 11.328 -5.160 1.00 0.00 N ATOM 1030 CA VAL A 62 14.806 11.836 -3.829 1.00 0.00 C ATOM 1031 C VAL A 62 16.071 12.461 -3.212 1.00 0.00 C ATOM 1032 O VAL A 62 17.188 12.194 -3.649 1.00 0.00 O ATOM 1033 CB VAL A 62 14.206 10.657 -3.032 1.00 0.00 C ATOM 1034 CG1 VAL A 62 15.197 9.509 -2.805 1.00 0.00 C ATOM 1035 CG2 VAL A 62 13.585 11.105 -1.710 1.00 0.00 C ATOM 0 H VAL A 62 15.035 10.310 -5.199 1.00 0.00 H new ATOM 0 HA VAL A 62 14.086 12.654 -3.828 1.00 0.00 H new ATOM 0 HB VAL A 62 13.408 10.266 -3.663 1.00 0.00 H new ATOM 0 HG11 VAL A 62 14.710 8.715 -2.239 1.00 0.00 H new ATOM 0 HG12 VAL A 62 15.528 9.119 -3.767 1.00 0.00 H new ATOM 0 HG13 VAL A 62 16.058 9.877 -2.247 1.00 0.00 H new ATOM 0 HG21 VAL A 62 13.177 10.239 -1.188 1.00 0.00 H new ATOM 0 HG22 VAL A 62 14.348 11.576 -1.091 1.00 0.00 H new ATOM 0 HG23 VAL A 62 12.786 11.819 -1.907 1.00 0.00 H new ATOM 1045 N GLU A 63 15.894 13.299 -2.188 1.00 0.00 N ATOM 1046 CA GLU A 63 16.985 13.883 -1.422 1.00 0.00 C ATOM 1047 C GLU A 63 17.237 13.038 -0.179 1.00 0.00 C ATOM 1048 O GLU A 63 18.367 12.615 0.052 1.00 0.00 O ATOM 1049 CB GLU A 63 16.617 15.320 -1.040 1.00 0.00 C ATOM 1050 CG GLU A 63 17.708 16.028 -0.215 1.00 0.00 C ATOM 1051 CD GLU A 63 18.794 16.594 -1.122 1.00 0.00 C ATOM 1052 OE1 GLU A 63 19.662 15.827 -1.598 1.00 0.00 O ATOM 1053 OE2 GLU A 63 18.751 17.824 -1.363 1.00 0.00 O ATOM 0 H GLU A 63 14.971 13.592 -1.867 1.00 0.00 H new ATOM 0 HA GLU A 63 17.897 13.902 -2.018 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.428 15.893 -1.948 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.688 15.311 -0.470 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.262 16.832 0.371 1.00 0.00 H new ATOM 0 HG3 GLU A 63 18.149 15.325 0.492 1.00 0.00 H new ATOM 1060 N SER A 64 16.208 12.832 0.651 1.00 0.00 N ATOM 1061 CA SER A 64 16.325 12.108 1.903 1.00 0.00 C ATOM 1062 C SER A 64 14.970 11.537 2.326 1.00 0.00 C ATOM 1063 O SER A 64 14.066 11.421 1.496 1.00 0.00 O ATOM 1064 CB SER A 64 16.997 13.016 2.939 1.00 0.00 C ATOM 1065 OG SER A 64 16.179 14.022 3.507 1.00 0.00 O ATOM 0 H SER A 64 15.265 13.170 0.462 1.00 0.00 H new ATOM 0 HA SER A 64 16.967 11.234 1.794 1.00 0.00 H new ATOM 0 HB2 SER A 64 17.382 12.391 3.745 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.856 13.496 2.469 1.00 0.00 H new ATOM 0 HG SER A 64 16.734 14.639 4.029 1.00 0.00 H new ATOM 1071 N ILE A 65 14.844 11.109 3.579 1.00 0.00 N ATOM 1072 CA ILE A 65 13.673 10.494 4.146 1.00 0.00 C ATOM 1073 C ILE A 65 13.513 11.060 5.561 1.00 0.00 C ATOM 1074 O ILE A 65 14.508 11.349 6.241 1.00 0.00 O ATOM 1075 CB ILE A 65 13.887 8.967 4.078 1.00 0.00 C ATOM 1076 CG1 ILE A 65 12.564 8.247 4.304 1.00 0.00 C ATOM 1077 CG2 ILE A 65 14.932 8.452 5.060 1.00 0.00 C ATOM 1078 CD1 ILE A 65 12.625 6.755 3.952 1.00 0.00 C ATOM 0 H ILE A 65 15.605 11.192 4.254 1.00 0.00 H new ATOM 0 HA ILE A 65 12.745 10.705 3.615 1.00 0.00 H new ATOM 0 HB ILE A 65 14.270 8.754 3.080 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.271 8.356 5.348 1.00 0.00 H new ATOM 0 HG13 ILE A 65 11.790 8.725 3.704 1.00 0.00 H new ATOM 0 HG21 ILE A 65 15.028 7.371 4.955 1.00 0.00 H new ATOM 0 HG22 ILE A 65 15.892 8.924 4.851 1.00 0.00 H new ATOM 0 HG23 ILE A 65 14.624 8.692 6.078 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.652 6.298 4.134 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.889 6.640 2.901 1.00 0.00 H new ATOM 0 HD13 ILE A 65 13.377 6.266 4.571 1.00 0.00 H new ATOM 1090 N ASP A 66 12.276 11.247 6.007 1.00 0.00 N ATOM 1091 CA ASP A 66 11.971 11.683 7.368 1.00 0.00 C ATOM 1092 C ASP A 66 11.985 10.480 8.312 1.00 0.00 C ATOM 1093 O ASP A 66 11.852 9.338 7.868 1.00 0.00 O ATOM 1094 CB ASP A 66 10.607 12.375 7.401 1.00 0.00 C ATOM 1095 CG ASP A 66 10.286 12.998 8.761 1.00 0.00 C ATOM 1096 OD1 ASP A 66 11.212 13.386 9.513 1.00 0.00 O ATOM 1097 OD2 ASP A 66 9.083 13.058 9.096 1.00 0.00 O ATOM 0 H ASP A 66 11.448 11.099 5.430 1.00 0.00 H new ATOM 0 HA ASP A 66 12.729 12.394 7.697 1.00 0.00 H new ATOM 0 HB2 ASP A 66 10.581 13.152 6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.832 11.652 7.147 1.00 0.00 H new ATOM 1102 N SER A 67 12.091 10.725 9.619 1.00 0.00 N ATOM 1103 CA SER A 67 12.149 9.705 10.657 1.00 0.00 C ATOM 1104 C SER A 67 10.977 8.726 10.593 1.00 0.00 C ATOM 1105 O SER A 67 11.164 7.571 10.976 1.00 0.00 O ATOM 1106 CB SER A 67 12.159 10.375 12.029 1.00 0.00 C ATOM 1107 OG SER A 67 13.154 11.380 12.114 1.00 0.00 O ATOM 0 H SER A 67 12.140 11.673 9.993 1.00 0.00 H new ATOM 0 HA SER A 67 13.063 9.135 10.492 1.00 0.00 H new ATOM 0 HB2 SER A 67 11.181 10.814 12.227 1.00 0.00 H new ATOM 0 HB3 SER A 67 12.333 9.624 12.800 1.00 0.00 H new ATOM 0 HG SER A 67 13.131 11.789 13.004 1.00 0.00 H new ATOM 1113 N PHE A 68 9.805 9.167 10.105 1.00 0.00 N ATOM 1114 CA PHE A 68 8.641 8.306 9.978 1.00 0.00 C ATOM 1115 C PHE A 68 8.999 7.091 9.119 1.00 0.00 C ATOM 1116 O PHE A 68 8.994 5.960 9.610 1.00 0.00 O ATOM 1117 CB PHE A 68 7.410 9.039 9.404 1.00 0.00 C ATOM 1118 CG PHE A 68 6.134 8.333 9.794 1.00 0.00 C ATOM 1119 CD1 PHE A 68 5.493 8.640 11.010 1.00 0.00 C ATOM 1120 CD2 PHE A 68 5.563 7.398 8.919 1.00 0.00 C ATOM 1121 CE1 PHE A 68 4.242 8.073 11.311 1.00 0.00 C ATOM 1122 CE2 PHE A 68 4.329 6.817 9.234 1.00 0.00 C ATOM 1123 CZ PHE A 68 3.644 7.181 10.406 1.00 0.00 C ATOM 0 H PHE A 68 9.649 10.125 9.792 1.00 0.00 H new ATOM 0 HA PHE A 68 8.360 7.982 10.980 1.00 0.00 H new ATOM 0 HB2 PHE A 68 7.389 10.065 9.770 1.00 0.00 H new ATOM 0 HB3 PHE A 68 7.485 9.090 8.318 1.00 0.00 H new ATOM 0 HD1 PHE A 68 5.963 9.312 11.713 1.00 0.00 H new ATOM 0 HD2 PHE A 68 6.073 7.127 8.006 1.00 0.00 H new ATOM 0 HE1 PHE A 68 3.742 8.323 12.235 1.00 0.00 H new ATOM 0 HE2 PHE A 68 3.899 6.082 8.570 1.00 0.00 H new ATOM 0 HZ PHE A 68 2.663 6.777 10.609 1.00 0.00 H new ATOM 1133 N SER A 69 9.322 7.316 7.840 1.00 0.00 N ATOM 1134 CA SER A 69 9.603 6.214 6.936 1.00 0.00 C ATOM 1135 C SER A 69 10.999 5.640 7.167 1.00 0.00 C ATOM 1136 O SER A 69 11.202 4.459 6.912 1.00 0.00 O ATOM 1137 CB SER A 69 9.365 6.609 5.482 1.00 0.00 C ATOM 1138 OG SER A 69 9.263 5.432 4.711 1.00 0.00 O ATOM 0 H SER A 69 9.393 8.242 7.419 1.00 0.00 H new ATOM 0 HA SER A 69 8.898 5.413 7.160 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.453 7.200 5.394 1.00 0.00 H new ATOM 0 HB3 SER A 69 10.184 7.230 5.119 1.00 0.00 H new ATOM 0 HG SER A 69 9.108 5.668 3.773 1.00 0.00 H new ATOM 1144 N LEU A 70 11.938 6.386 7.755 1.00 0.00 N ATOM 1145 CA LEU A 70 13.252 5.851 8.123 1.00 0.00 C ATOM 1146 C LEU A 70 13.134 4.608 9.019 1.00 0.00 C ATOM 1147 O LEU A 70 13.997 3.734 8.994 1.00 0.00 O ATOM 1148 CB LEU A 70 14.032 6.971 8.830 1.00 0.00 C ATOM 1149 CG LEU A 70 15.532 6.723 9.050 1.00 0.00 C ATOM 1150 CD1 LEU A 70 16.296 6.720 7.726 1.00 0.00 C ATOM 1151 CD2 LEU A 70 16.071 7.874 9.908 1.00 0.00 C ATOM 0 H LEU A 70 11.811 7.371 7.988 1.00 0.00 H new ATOM 0 HA LEU A 70 13.780 5.528 7.226 1.00 0.00 H new ATOM 0 HB2 LEU A 70 13.918 7.886 8.249 1.00 0.00 H new ATOM 0 HB3 LEU A 70 13.569 7.150 9.800 1.00 0.00 H new ATOM 0 HG LEU A 70 15.665 5.753 9.529 1.00 0.00 H new ATOM 0 HD11 LEU A 70 17.354 6.542 7.917 1.00 0.00 H new ATOM 0 HD12 LEU A 70 15.906 5.932 7.083 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.174 7.684 7.233 1.00 0.00 H new ATOM 0 HD21 LEU A 70 17.137 7.729 10.084 1.00 0.00 H new ATOM 0 HD22 LEU A 70 15.915 8.819 9.388 1.00 0.00 H new ATOM 0 HD23 LEU A 70 15.545 7.893 10.863 1.00 0.00 H new ATOM 1163 N GLY A 71 12.039 4.506 9.775 1.00 0.00 N ATOM 1164 CA GLY A 71 11.685 3.321 10.548 1.00 0.00 C ATOM 1165 C GLY A 71 10.953 2.266 9.717 1.00 0.00 C ATOM 1166 O GLY A 71 11.166 1.071 9.921 1.00 0.00 O ATOM 0 H GLY A 71 11.361 5.263 9.867 1.00 0.00 H new ATOM 0 HA2 GLY A 71 12.591 2.882 10.967 1.00 0.00 H new ATOM 0 HA3 GLY A 71 11.056 3.616 11.388 1.00 0.00 H new ATOM 1170 N VAL A 72 10.107 2.676 8.767 1.00 0.00 N ATOM 1171 CA VAL A 72 9.322 1.774 7.921 1.00 0.00 C ATOM 1172 C VAL A 72 10.259 1.008 6.986 1.00 0.00 C ATOM 1173 O VAL A 72 10.100 -0.196 6.808 1.00 0.00 O ATOM 1174 CB VAL A 72 8.247 2.546 7.120 1.00 0.00 C ATOM 1175 CG1 VAL A 72 7.382 1.569 6.313 1.00 0.00 C ATOM 1176 CG2 VAL A 72 7.304 3.332 8.037 1.00 0.00 C ATOM 0 H VAL A 72 9.946 3.662 8.561 1.00 0.00 H new ATOM 0 HA VAL A 72 8.797 1.063 8.559 1.00 0.00 H new ATOM 0 HB VAL A 72 8.783 3.235 6.467 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.630 2.125 5.754 1.00 0.00 H new ATOM 0 HG12 VAL A 72 8.012 1.013 5.619 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.889 0.873 6.992 1.00 0.00 H new ATOM 0 HG21 VAL A 72 6.565 3.859 7.433 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.796 2.644 8.713 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.879 4.053 8.618 1.00 0.00 H new ATOM 1186 N ILE A 73 11.254 1.683 6.413 1.00 0.00 N ATOM 1187 CA ILE A 73 12.272 1.078 5.564 1.00 0.00 C ATOM 1188 C ILE A 73 12.947 -0.075 6.322 1.00 0.00 C ATOM 1189 O ILE A 73 13.015 -1.193 5.809 1.00 0.00 O ATOM 1190 CB ILE A 73 13.240 2.183 5.070 1.00 0.00 C ATOM 1191 CG1 ILE A 73 12.571 3.212 4.124 1.00 0.00 C ATOM 1192 CG2 ILE A 73 14.475 1.612 4.363 1.00 0.00 C ATOM 1193 CD1 ILE A 73 11.661 2.640 3.030 1.00 0.00 C ATOM 0 H ILE A 73 11.375 2.689 6.531 1.00 0.00 H new ATOM 0 HA ILE A 73 11.840 0.632 4.668 1.00 0.00 H new ATOM 0 HB ILE A 73 13.544 2.694 5.983 1.00 0.00 H new ATOM 0 HG12 ILE A 73 11.985 3.903 4.730 1.00 0.00 H new ATOM 0 HG13 ILE A 73 13.356 3.796 3.644 1.00 0.00 H new ATOM 0 HG21 ILE A 73 15.119 2.429 4.038 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.024 0.970 5.052 1.00 0.00 H new ATOM 0 HG23 ILE A 73 14.162 1.030 3.496 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.252 3.456 2.434 1.00 0.00 H new ATOM 0 HD12 ILE A 73 12.238 1.975 2.388 1.00 0.00 H new ATOM 0 HD13 ILE A 73 10.845 2.083 3.490 1.00 0.00 H new ATOM 1205 N VAL A 74 13.391 0.150 7.561 1.00 0.00 N ATOM 1206 CA VAL A 74 13.938 -0.920 8.389 1.00 0.00 C ATOM 1207 C VAL A 74 12.868 -1.986 8.662 1.00 0.00 C ATOM 1208 O VAL A 74 13.174 -3.171 8.576 1.00 0.00 O ATOM 1209 CB VAL A 74 14.509 -0.314 9.692 1.00 0.00 C ATOM 1210 CG1 VAL A 74 14.792 -1.374 10.766 1.00 0.00 C ATOM 1211 CG2 VAL A 74 15.792 0.471 9.390 1.00 0.00 C ATOM 0 H VAL A 74 13.381 1.066 8.011 1.00 0.00 H new ATOM 0 HA VAL A 74 14.752 -1.419 7.864 1.00 0.00 H new ATOM 0 HB VAL A 74 13.746 0.355 10.090 1.00 0.00 H new ATOM 0 HG11 VAL A 74 15.191 -0.891 11.658 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.867 -1.893 11.018 1.00 0.00 H new ATOM 0 HG13 VAL A 74 15.519 -2.092 10.386 1.00 0.00 H new ATOM 0 HG21 VAL A 74 16.186 0.894 10.314 1.00 0.00 H new ATOM 0 HG22 VAL A 74 16.533 -0.198 8.952 1.00 0.00 H new ATOM 0 HG23 VAL A 74 15.570 1.276 8.689 1.00 0.00 H new ATOM 1221 N ASN A 75 11.620 -1.621 8.961 1.00 0.00 N ATOM 1222 CA ASN A 75 10.527 -2.563 9.208 1.00 0.00 C ATOM 1223 C ASN A 75 10.369 -3.574 8.076 1.00 0.00 C ATOM 1224 O ASN A 75 10.185 -4.772 8.303 1.00 0.00 O ATOM 1225 CB ASN A 75 9.216 -1.778 9.308 1.00 0.00 C ATOM 1226 CG ASN A 75 8.236 -2.462 10.223 1.00 0.00 C ATOM 1227 OD1 ASN A 75 7.442 -3.309 9.820 1.00 0.00 O ATOM 1228 ND2 ASN A 75 8.302 -2.108 11.487 1.00 0.00 N ATOM 0 H ASN A 75 11.335 -0.645 9.040 1.00 0.00 H new ATOM 0 HA ASN A 75 10.759 -3.100 10.128 1.00 0.00 H new ATOM 0 HB2 ASN A 75 9.419 -0.772 9.676 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.777 -1.672 8.316 1.00 0.00 H new ATOM 0 HD21 ASN A 75 7.681 -2.540 12.171 1.00 0.00 H new ATOM 0 HD22 ASN A 75 8.974 -1.401 11.784 1.00 0.00 H new ATOM 1235 N ILE A 76 10.436 -3.080 6.839 1.00 0.00 N ATOM 1236 CA ILE A 76 10.382 -3.889 5.638 1.00 0.00 C ATOM 1237 C ILE A 76 11.568 -4.870 5.651 1.00 0.00 C ATOM 1238 O ILE A 76 11.370 -6.036 5.312 1.00 0.00 O ATOM 1239 CB ILE A 76 10.290 -2.959 4.397 1.00 0.00 C ATOM 1240 CG1 ILE A 76 8.902 -2.257 4.367 1.00 0.00 C ATOM 1241 CG2 ILE A 76 10.526 -3.738 3.091 1.00 0.00 C ATOM 1242 CD1 ILE A 76 8.685 -1.287 3.213 1.00 0.00 C ATOM 0 H ILE A 76 10.531 -2.082 6.649 1.00 0.00 H new ATOM 0 HA ILE A 76 9.487 -4.510 5.592 1.00 0.00 H new ATOM 0 HB ILE A 76 11.074 -2.205 4.477 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.127 -3.023 4.326 1.00 0.00 H new ATOM 0 HG13 ILE A 76 8.767 -1.717 5.304 1.00 0.00 H new ATOM 0 HG21 ILE A 76 10.454 -3.057 2.243 1.00 0.00 H new ATOM 0 HG22 ILE A 76 11.518 -4.190 3.111 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.773 -4.520 2.993 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.688 -0.853 3.285 1.00 0.00 H new ATOM 0 HD12 ILE A 76 9.431 -0.493 3.260 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.781 -1.820 2.267 1.00 0.00 H new ATOM 1254 N LEU A 77 12.763 -4.471 6.109 1.00 0.00 N ATOM 1255 CA LEU A 77 13.918 -5.363 6.185 1.00 0.00 C ATOM 1256 C LEU A 77 13.663 -6.434 7.234 1.00 0.00 C ATOM 1257 O LEU A 77 13.839 -7.610 6.934 1.00 0.00 O ATOM 1258 CB LEU A 77 15.210 -4.570 6.469 1.00 0.00 C ATOM 1259 CG LEU A 77 16.527 -5.373 6.464 1.00 0.00 C ATOM 1260 CD1 LEU A 77 16.754 -6.210 7.726 1.00 0.00 C ATOM 1261 CD2 LEU A 77 16.716 -6.240 5.213 1.00 0.00 C ATOM 0 H LEU A 77 12.951 -3.523 6.435 1.00 0.00 H new ATOM 0 HA LEU A 77 14.059 -5.855 5.223 1.00 0.00 H new ATOM 0 HB2 LEU A 77 15.292 -3.775 5.727 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.108 -4.089 7.442 1.00 0.00 H new ATOM 0 HG LEU A 77 17.292 -4.596 6.449 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.701 -6.744 7.643 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.781 -5.555 8.597 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.941 -6.928 7.837 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.663 -6.775 5.281 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.899 -6.958 5.141 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.720 -5.605 4.327 1.00 0.00 H new ATOM 1273 N LYS A 78 13.230 -6.057 8.442 1.00 0.00 N ATOM 1274 CA LYS A 78 12.938 -7.004 9.522 1.00 0.00 C ATOM 1275 C LYS A 78 11.981 -8.084 9.027 1.00 0.00 C ATOM 1276 O LYS A 78 12.257 -9.272 9.192 1.00 0.00 O ATOM 1277 CB LYS A 78 12.358 -6.284 10.753 1.00 0.00 C ATOM 1278 CG LYS A 78 13.316 -5.240 11.339 1.00 0.00 C ATOM 1279 CD LYS A 78 12.785 -4.662 12.661 1.00 0.00 C ATOM 1280 CE LYS A 78 13.861 -3.819 13.368 1.00 0.00 C ATOM 1281 NZ LYS A 78 14.429 -4.481 14.567 1.00 0.00 N ATOM 0 H LYS A 78 13.072 -5.082 8.698 1.00 0.00 H new ATOM 0 HA LYS A 78 13.873 -7.475 9.826 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.423 -5.797 10.476 1.00 0.00 H new ATOM 0 HB3 LYS A 78 12.119 -7.021 11.520 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.292 -5.695 11.506 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.459 -4.433 10.620 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.907 -4.047 12.466 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.467 -5.474 13.315 1.00 0.00 H new ATOM 0 HE2 LYS A 78 14.665 -3.605 12.664 1.00 0.00 H new ATOM 0 HE3 LYS A 78 13.429 -2.862 13.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 15.147 -3.863 14.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.671 -4.663 15.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.869 -5.382 14.291 1.00 0.00 H new ATOM 1295 N SER A 79 10.905 -7.660 8.369 1.00 0.00 N ATOM 1296 CA SER A 79 9.898 -8.536 7.800 1.00 0.00 C ATOM 1297 C SER A 79 10.521 -9.474 6.758 1.00 0.00 C ATOM 1298 O SER A 79 10.404 -10.690 6.868 1.00 0.00 O ATOM 1299 CB SER A 79 8.776 -7.681 7.206 1.00 0.00 C ATOM 1300 OG SER A 79 8.316 -6.706 8.139 1.00 0.00 O ATOM 0 H SER A 79 10.709 -6.671 8.216 1.00 0.00 H new ATOM 0 HA SER A 79 9.475 -9.171 8.578 1.00 0.00 H new ATOM 0 HB2 SER A 79 9.134 -7.184 6.304 1.00 0.00 H new ATOM 0 HB3 SER A 79 7.946 -8.322 6.909 1.00 0.00 H new ATOM 0 HG SER A 79 8.815 -5.872 8.013 1.00 0.00 H new ATOM 1306 N ILE A 80 11.213 -8.930 5.756 1.00 0.00 N ATOM 1307 CA ILE A 80 11.816 -9.690 4.662 1.00 0.00 C ATOM 1308 C ILE A 80 12.838 -10.693 5.201 1.00 0.00 C ATOM 1309 O ILE A 80 12.837 -11.848 4.783 1.00 0.00 O ATOM 1310 CB ILE A 80 12.394 -8.679 3.647 1.00 0.00 C ATOM 1311 CG1 ILE A 80 11.198 -8.074 2.881 1.00 0.00 C ATOM 1312 CG2 ILE A 80 13.434 -9.250 2.669 1.00 0.00 C ATOM 1313 CD1 ILE A 80 11.598 -6.950 1.934 1.00 0.00 C ATOM 0 H ILE A 80 11.373 -7.925 5.682 1.00 0.00 H new ATOM 0 HA ILE A 80 11.077 -10.299 4.141 1.00 0.00 H new ATOM 0 HB ILE A 80 12.952 -7.930 4.209 1.00 0.00 H new ATOM 0 HG12 ILE A 80 10.704 -8.861 2.312 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.470 -7.694 3.598 1.00 0.00 H new ATOM 0 HG21 ILE A 80 13.776 -8.460 2.000 1.00 0.00 H new ATOM 0 HG22 ILE A 80 14.282 -9.644 3.229 1.00 0.00 H new ATOM 0 HG23 ILE A 80 12.982 -10.051 2.084 1.00 0.00 H new ATOM 0 HD11 ILE A 80 10.712 -6.569 1.427 1.00 0.00 H new ATOM 0 HD12 ILE A 80 12.066 -6.145 2.501 1.00 0.00 H new ATOM 0 HD13 ILE A 80 12.303 -7.330 1.195 1.00 0.00 H new ATOM 1325 N SER A 81 13.679 -10.281 6.145 1.00 0.00 N ATOM 1326 CA SER A 81 14.678 -11.124 6.779 1.00 0.00 C ATOM 1327 C SER A 81 14.039 -12.174 7.701 1.00 0.00 C ATOM 1328 O SER A 81 14.740 -13.093 8.113 1.00 0.00 O ATOM 1329 CB SER A 81 15.644 -10.206 7.537 1.00 0.00 C ATOM 1330 OG SER A 81 16.804 -10.888 7.974 1.00 0.00 O ATOM 0 H SER A 81 13.681 -9.324 6.497 1.00 0.00 H new ATOM 0 HA SER A 81 15.221 -11.693 6.024 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.935 -9.377 6.892 1.00 0.00 H new ATOM 0 HB3 SER A 81 15.132 -9.776 8.398 1.00 0.00 H new ATOM 0 HG SER A 81 16.582 -11.824 8.161 1.00 0.00 H new ATOM 1336 N SER A 82 12.747 -12.058 8.025 1.00 0.00 N ATOM 1337 CA SER A 82 11.978 -13.109 8.671 1.00 0.00 C ATOM 1338 C SER A 82 11.476 -14.075 7.598 1.00 0.00 C ATOM 1339 O SER A 82 11.602 -15.291 7.757 1.00 0.00 O ATOM 1340 CB SER A 82 10.806 -12.480 9.428 1.00 0.00 C ATOM 1341 OG SER A 82 10.314 -13.342 10.429 1.00 0.00 O ATOM 0 H SER A 82 12.204 -11.215 7.840 1.00 0.00 H new ATOM 0 HA SER A 82 12.595 -13.657 9.383 1.00 0.00 H new ATOM 0 HB2 SER A 82 11.126 -11.541 9.880 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.006 -12.240 8.728 1.00 0.00 H new ATOM 0 HG SER A 82 9.568 -12.910 10.895 1.00 0.00 H new ATOM 1347 N SER A 83 10.916 -13.556 6.498 1.00 0.00 N ATOM 1348 CA SER A 83 10.449 -14.365 5.384 1.00 0.00 C ATOM 1349 C SER A 83 11.567 -15.278 4.883 1.00 0.00 C ATOM 1350 O SER A 83 11.356 -16.489 4.801 1.00 0.00 O ATOM 1351 CB SER A 83 9.939 -13.478 4.245 1.00 0.00 C ATOM 1352 OG SER A 83 8.799 -12.735 4.642 1.00 0.00 O ATOM 0 H SER A 83 10.777 -12.555 6.363 1.00 0.00 H new ATOM 0 HA SER A 83 9.623 -14.983 5.735 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.729 -12.796 3.931 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.690 -14.097 3.383 1.00 0.00 H new ATOM 0 HG SER A 83 8.496 -12.177 3.896 1.00 0.00 H new ATOM 1358 N GLY A 84 12.730 -14.711 4.559 1.00 0.00 N ATOM 1359 CA GLY A 84 13.789 -15.403 3.842 1.00 0.00 C ATOM 1360 C GLY A 84 14.354 -14.576 2.688 1.00 0.00 C ATOM 1361 O GLY A 84 14.937 -15.149 1.767 1.00 0.00 O ATOM 0 H GLY A 84 12.961 -13.745 4.793 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.593 -15.648 4.536 1.00 0.00 H new ATOM 0 HA3 GLY A 84 13.404 -16.346 3.454 1.00 0.00 H new ATOM 1365 N GLY A 85 14.143 -13.255 2.650 1.00 0.00 N ATOM 1366 CA GLY A 85 14.526 -12.414 1.545 1.00 0.00 C ATOM 1367 C GLY A 85 15.689 -11.495 1.886 1.00 0.00 C ATOM 1368 O GLY A 85 16.180 -11.448 3.013 1.00 0.00 O ATOM 0 H GLY A 85 13.691 -12.745 3.409 1.00 0.00 H new ATOM 0 HA2 GLY A 85 14.799 -13.039 0.695 1.00 0.00 H new ATOM 0 HA3 GLY A 85 13.671 -11.813 1.237 1.00 0.00 H new ATOM 1372 N PHE A 86 16.080 -10.713 0.887 1.00 0.00 N ATOM 1373 CA PHE A 86 17.246 -9.840 0.864 1.00 0.00 C ATOM 1374 C PHE A 86 16.883 -8.554 0.130 1.00 0.00 C ATOM 1375 O PHE A 86 16.687 -8.560 -1.082 1.00 0.00 O ATOM 1376 CB PHE A 86 18.425 -10.543 0.178 1.00 0.00 C ATOM 1377 CG PHE A 86 19.479 -11.023 1.162 1.00 0.00 C ATOM 1378 CD1 PHE A 86 19.211 -12.081 2.047 1.00 0.00 C ATOM 1379 CD2 PHE A 86 20.703 -10.334 1.262 1.00 0.00 C ATOM 1380 CE1 PHE A 86 20.149 -12.432 3.033 1.00 0.00 C ATOM 1381 CE2 PHE A 86 21.623 -10.656 2.275 1.00 0.00 C ATOM 1382 CZ PHE A 86 21.349 -11.714 3.154 1.00 0.00 C ATOM 0 H PHE A 86 15.555 -10.670 0.013 1.00 0.00 H new ATOM 0 HA PHE A 86 17.548 -9.601 1.884 1.00 0.00 H new ATOM 0 HB2 PHE A 86 18.053 -11.394 -0.392 1.00 0.00 H new ATOM 0 HB3 PHE A 86 18.885 -9.859 -0.535 1.00 0.00 H new ATOM 0 HD1 PHE A 86 18.282 -12.626 1.969 1.00 0.00 H new ATOM 0 HD2 PHE A 86 20.937 -9.552 0.555 1.00 0.00 H new ATOM 0 HE1 PHE A 86 19.946 -13.257 3.700 1.00 0.00 H new ATOM 0 HE2 PHE A 86 22.538 -10.091 2.376 1.00 0.00 H new ATOM 0 HZ PHE A 86 22.061 -11.976 3.923 1.00 0.00 H new ATOM 1392 N PHE A 87 16.763 -7.459 0.873 1.00 0.00 N ATOM 1393 CA PHE A 87 16.362 -6.152 0.368 1.00 0.00 C ATOM 1394 C PHE A 87 17.604 -5.260 0.341 1.00 0.00 C ATOM 1395 O PHE A 87 18.425 -5.346 1.256 1.00 0.00 O ATOM 1396 CB PHE A 87 15.234 -5.637 1.280 1.00 0.00 C ATOM 1397 CG PHE A 87 15.054 -4.139 1.396 1.00 0.00 C ATOM 1398 CD1 PHE A 87 15.030 -3.322 0.251 1.00 0.00 C ATOM 1399 CD2 PHE A 87 14.891 -3.567 2.675 1.00 0.00 C ATOM 1400 CE1 PHE A 87 14.865 -1.938 0.402 1.00 0.00 C ATOM 1401 CE2 PHE A 87 14.730 -2.179 2.827 1.00 0.00 C ATOM 1402 CZ PHE A 87 14.720 -1.365 1.679 1.00 0.00 C ATOM 0 H PHE A 87 16.948 -7.457 1.876 1.00 0.00 H new ATOM 0 HA PHE A 87 15.971 -6.175 -0.649 1.00 0.00 H new ATOM 0 HB2 PHE A 87 14.295 -6.061 0.925 1.00 0.00 H new ATOM 0 HB3 PHE A 87 15.404 -6.033 2.281 1.00 0.00 H new ATOM 0 HD1 PHE A 87 15.137 -3.756 -0.732 1.00 0.00 H new ATOM 0 HD2 PHE A 87 14.890 -4.203 3.548 1.00 0.00 H new ATOM 0 HE1 PHE A 87 14.849 -1.304 -0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.616 -1.744 3.809 1.00 0.00 H new ATOM 0 HZ PHE A 87 14.601 -0.296 1.779 1.00 0.00 H new ATOM 1412 N ALA A 88 17.790 -4.434 -0.693 1.00 0.00 N ATOM 1413 CA ALA A 88 18.935 -3.528 -0.816 1.00 0.00 C ATOM 1414 C ALA A 88 18.517 -2.147 -1.332 1.00 0.00 C ATOM 1415 O ALA A 88 17.358 -1.954 -1.701 1.00 0.00 O ATOM 1416 CB ALA A 88 20.004 -4.154 -1.711 1.00 0.00 C ATOM 0 H ALA A 88 17.141 -4.375 -1.478 1.00 0.00 H new ATOM 0 HA ALA A 88 19.356 -3.378 0.178 1.00 0.00 H new ATOM 0 HB1 ALA A 88 20.851 -3.473 -1.797 1.00 0.00 H new ATOM 0 HB2 ALA A 88 20.338 -5.096 -1.275 1.00 0.00 H new ATOM 0 HB3 ALA A 88 19.587 -4.340 -2.701 1.00 0.00 H new ATOM 1422 N LEU A 89 19.439 -1.179 -1.345 1.00 0.00 N ATOM 1423 CA LEU A 89 19.173 0.189 -1.804 1.00 0.00 C ATOM 1424 C LEU A 89 20.117 0.546 -2.944 1.00 0.00 C ATOM 1425 O LEU A 89 21.090 -0.172 -3.157 1.00 0.00 O ATOM 1426 CB LEU A 89 19.265 1.262 -0.698 1.00 0.00 C ATOM 1427 CG LEU A 89 19.154 0.830 0.769 1.00 0.00 C ATOM 1428 CD1 LEU A 89 19.180 2.075 1.658 1.00 0.00 C ATOM 1429 CD2 LEU A 89 17.918 0.007 1.112 1.00 0.00 C ATOM 0 H LEU A 89 20.400 -1.324 -1.034 1.00 0.00 H new ATOM 0 HA LEU A 89 18.137 0.192 -2.142 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.218 1.777 -0.818 1.00 0.00 H new ATOM 0 HB3 LEU A 89 18.481 1.995 -0.885 1.00 0.00 H new ATOM 0 HG LEU A 89 20.006 0.174 0.947 1.00 0.00 H new ATOM 0 HD11 LEU A 89 19.101 1.777 2.704 1.00 0.00 H new ATOM 0 HD12 LEU A 89 20.115 2.613 1.503 1.00 0.00 H new ATOM 0 HD13 LEU A 89 18.342 2.723 1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 89 17.933 -0.248 2.172 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.022 0.587 0.891 1.00 0.00 H new ATOM 0 HD23 LEU A 89 17.914 -0.907 0.519 1.00 0.00 H new ATOM 1441 N VAL A 90 19.845 1.645 -3.652 1.00 0.00 N ATOM 1442 CA VAL A 90 20.508 1.974 -4.908 1.00 0.00 C ATOM 1443 C VAL A 90 20.747 3.478 -4.997 1.00 0.00 C ATOM 1444 O VAL A 90 19.826 4.248 -4.718 1.00 0.00 O ATOM 1445 CB VAL A 90 19.610 1.527 -6.077 1.00 0.00 C ATOM 1446 CG1 VAL A 90 20.201 1.944 -7.430 1.00 0.00 C ATOM 1447 CG2 VAL A 90 19.230 0.042 -6.030 1.00 0.00 C ATOM 0 H VAL A 90 19.152 2.335 -3.364 1.00 0.00 H new ATOM 0 HA VAL A 90 21.469 1.461 -4.956 1.00 0.00 H new ATOM 0 HB VAL A 90 18.666 2.059 -5.956 1.00 0.00 H new ATOM 0 HG11 VAL A 90 19.542 1.613 -8.233 1.00 0.00 H new ATOM 0 HG12 VAL A 90 20.299 3.029 -7.465 1.00 0.00 H new ATOM 0 HG13 VAL A 90 21.183 1.487 -7.555 1.00 0.00 H new ATOM 0 HG21 VAL A 90 18.597 -0.199 -6.884 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.134 -0.566 -6.065 1.00 0.00 H new ATOM 0 HG23 VAL A 90 18.688 -0.166 -5.107 1.00 0.00 H new ATOM 1457 N SER A 91 21.921 3.867 -5.497 1.00 0.00 N ATOM 1458 CA SER A 91 22.404 5.238 -5.598 1.00 0.00 C ATOM 1459 C SER A 91 22.180 6.006 -4.280 1.00 0.00 C ATOM 1460 O SER A 91 21.541 7.060 -4.282 1.00 0.00 O ATOM 1461 CB SER A 91 21.748 5.890 -6.827 1.00 0.00 C ATOM 1462 OG SER A 91 22.550 6.919 -7.376 1.00 0.00 O ATOM 0 H SER A 91 22.595 3.194 -5.862 1.00 0.00 H new ATOM 0 HA SER A 91 23.483 5.261 -5.748 1.00 0.00 H new ATOM 0 HB2 SER A 91 21.565 5.129 -7.586 1.00 0.00 H new ATOM 0 HB3 SER A 91 20.778 6.299 -6.545 1.00 0.00 H new ATOM 0 HG SER A 91 22.098 7.306 -8.155 1.00 0.00 H new ATOM 1468 N PRO A 92 22.669 5.485 -3.136 1.00 0.00 N ATOM 1469 CA PRO A 92 22.520 6.127 -1.846 1.00 0.00 C ATOM 1470 C PRO A 92 23.384 7.381 -1.820 1.00 0.00 C ATOM 1471 O PRO A 92 24.597 7.312 -1.631 1.00 0.00 O ATOM 1472 CB PRO A 92 22.927 5.076 -0.811 1.00 0.00 C ATOM 1473 CG PRO A 92 23.984 4.264 -1.558 1.00 0.00 C ATOM 1474 CD PRO A 92 23.495 4.295 -2.999 1.00 0.00 C ATOM 0 HA PRO A 92 21.504 6.460 -1.632 1.00 0.00 H new ATOM 0 HB2 PRO A 92 23.330 5.532 0.093 1.00 0.00 H new ATOM 0 HB3 PRO A 92 22.082 4.459 -0.506 1.00 0.00 H new ATOM 0 HG2 PRO A 92 24.975 4.707 -1.460 1.00 0.00 H new ATOM 0 HG3 PRO A 92 24.051 3.245 -1.178 1.00 0.00 H new ATOM 0 HD2 PRO A 92 24.336 4.326 -3.692 1.00 0.00 H new ATOM 0 HD3 PRO A 92 22.922 3.398 -3.232 1.00 0.00 H new ATOM 1482 N ASN A 93 22.752 8.532 -2.036 1.00 0.00 N ATOM 1483 CA ASN A 93 23.458 9.794 -1.996 1.00 0.00 C ATOM 1484 C ASN A 93 24.037 10.049 -0.615 1.00 0.00 C ATOM 1485 O ASN A 93 23.548 9.554 0.402 1.00 0.00 O ATOM 1486 CB ASN A 93 22.577 10.968 -2.443 1.00 0.00 C ATOM 1487 CG ASN A 93 21.349 11.254 -1.575 1.00 0.00 C ATOM 1488 OD1 ASN A 93 20.794 10.379 -0.931 1.00 0.00 O ATOM 1489 ND2 ASN A 93 20.879 12.488 -1.529 1.00 0.00 N ATOM 0 H ASN A 93 21.755 8.609 -2.239 1.00 0.00 H new ATOM 0 HA ASN A 93 24.280 9.721 -2.708 1.00 0.00 H new ATOM 0 HB2 ASN A 93 23.193 11.867 -2.474 1.00 0.00 H new ATOM 0 HB3 ASN A 93 22.240 10.777 -3.462 1.00 0.00 H new ATOM 0 HD21 ASN A 93 20.060 12.701 -0.959 1.00 0.00 H new ATOM 0 HD22 ASN A 93 21.335 13.228 -2.063 1.00 0.00 H new ATOM 1496 N GLU A 94 25.048 10.909 -0.576 1.00 0.00 N ATOM 1497 CA GLU A 94 25.859 11.150 0.610 1.00 0.00 C ATOM 1498 C GLU A 94 25.001 11.649 1.776 1.00 0.00 C ATOM 1499 O GLU A 94 25.219 11.270 2.924 1.00 0.00 O ATOM 1500 CB GLU A 94 26.970 12.140 0.228 1.00 0.00 C ATOM 1501 CG GLU A 94 27.966 12.417 1.361 1.00 0.00 C ATOM 1502 CD GLU A 94 29.125 13.330 0.924 1.00 0.00 C ATOM 1503 OE1 GLU A 94 28.887 14.275 0.131 1.00 0.00 O ATOM 1504 OE2 GLU A 94 30.273 13.155 1.401 1.00 0.00 O ATOM 0 H GLU A 94 25.331 11.467 -1.381 1.00 0.00 H new ATOM 0 HA GLU A 94 26.313 10.222 0.957 1.00 0.00 H new ATOM 0 HB2 GLU A 94 27.512 11.749 -0.633 1.00 0.00 H new ATOM 0 HB3 GLU A 94 26.515 13.081 -0.082 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.440 12.879 2.196 1.00 0.00 H new ATOM 0 HG3 GLU A 94 28.370 11.472 1.723 1.00 0.00 H new ATOM 1511 N LYS A 95 23.964 12.438 1.484 1.00 0.00 N ATOM 1512 CA LYS A 95 22.983 12.926 2.439 1.00 0.00 C ATOM 1513 C LYS A 95 22.305 11.750 3.116 1.00 0.00 C ATOM 1514 O LYS A 95 22.101 11.797 4.335 1.00 0.00 O ATOM 1515 CB LYS A 95 22.017 13.858 1.666 1.00 0.00 C ATOM 1516 CG LYS A 95 20.541 13.928 2.094 1.00 0.00 C ATOM 1517 CD LYS A 95 20.289 14.624 3.440 1.00 0.00 C ATOM 1518 CE LYS A 95 19.676 13.714 4.498 1.00 0.00 C ATOM 1519 NZ LYS A 95 20.514 13.554 5.700 1.00 0.00 N ATOM 0 H LYS A 95 23.783 12.764 0.535 1.00 0.00 H new ATOM 0 HA LYS A 95 23.433 13.505 3.246 1.00 0.00 H new ATOM 0 HB2 LYS A 95 22.423 14.868 1.719 1.00 0.00 H new ATOM 0 HB3 LYS A 95 22.041 13.560 0.618 1.00 0.00 H new ATOM 0 HG2 LYS A 95 19.978 14.451 1.321 1.00 0.00 H new ATOM 0 HG3 LYS A 95 20.145 12.914 2.146 1.00 0.00 H new ATOM 0 HD2 LYS A 95 21.233 15.019 3.816 1.00 0.00 H new ATOM 0 HD3 LYS A 95 19.628 15.476 3.280 1.00 0.00 H new ATOM 0 HE2 LYS A 95 18.707 14.116 4.793 1.00 0.00 H new ATOM 0 HE3 LYS A 95 19.494 12.733 4.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 19.929 13.208 6.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 21.273 12.870 5.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 20.932 14.471 5.956 1.00 0.00 H new ATOM 1533 N VAL A 96 21.907 10.732 2.362 1.00 0.00 N ATOM 1534 CA VAL A 96 21.264 9.576 2.932 1.00 0.00 C ATOM 1535 C VAL A 96 22.294 8.716 3.650 1.00 0.00 C ATOM 1536 O VAL A 96 22.038 8.378 4.799 1.00 0.00 O ATOM 1537 CB VAL A 96 20.460 8.830 1.843 1.00 0.00 C ATOM 1538 CG1 VAL A 96 20.105 7.386 2.177 1.00 0.00 C ATOM 1539 CG2 VAL A 96 19.120 9.537 1.634 1.00 0.00 C ATOM 0 H VAL A 96 22.024 10.693 1.349 1.00 0.00 H new ATOM 0 HA VAL A 96 20.538 9.871 3.689 1.00 0.00 H new ATOM 0 HB VAL A 96 21.113 8.833 0.970 1.00 0.00 H new ATOM 0 HG11 VAL A 96 19.542 6.950 1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 96 21.019 6.814 2.335 1.00 0.00 H new ATOM 0 HG13 VAL A 96 19.499 7.360 3.083 1.00 0.00 H new ATOM 0 HG21 VAL A 96 18.549 9.015 0.867 1.00 0.00 H new ATOM 0 HG22 VAL A 96 18.558 9.536 2.568 1.00 0.00 H new ATOM 0 HG23 VAL A 96 19.296 10.565 1.318 1.00 0.00 H new ATOM 1549 N GLU A 97 23.457 8.401 3.077 1.00 0.00 N ATOM 1550 CA GLU A 97 24.433 7.512 3.710 1.00 0.00 C ATOM 1551 C GLU A 97 24.783 8.020 5.101 1.00 0.00 C ATOM 1552 O GLU A 97 24.961 7.227 6.024 1.00 0.00 O ATOM 1553 CB GLU A 97 25.716 7.365 2.881 1.00 0.00 C ATOM 1554 CG GLU A 97 25.538 6.417 1.693 1.00 0.00 C ATOM 1555 CD GLU A 97 26.900 5.943 1.190 1.00 0.00 C ATOM 1556 OE1 GLU A 97 27.599 6.708 0.490 1.00 0.00 O ATOM 1557 OE2 GLU A 97 27.342 4.840 1.586 1.00 0.00 O ATOM 0 H GLU A 97 23.748 8.753 2.165 1.00 0.00 H new ATOM 0 HA GLU A 97 23.968 6.528 3.778 1.00 0.00 H new ATOM 0 HB2 GLU A 97 26.024 8.345 2.517 1.00 0.00 H new ATOM 0 HB3 GLU A 97 26.518 6.995 3.520 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.933 5.560 1.989 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.002 6.924 0.891 1.00 0.00 H new ATOM 1564 N ARG A 98 24.764 9.341 5.300 1.00 0.00 N ATOM 1565 CA ARG A 98 24.974 9.943 6.572 1.00 0.00 C ATOM 1566 C ARG A 98 23.996 9.428 7.603 1.00 0.00 C ATOM 1567 O ARG A 98 24.337 8.864 8.633 1.00 0.00 O ATOM 1568 CB ARG A 98 24.753 11.417 6.292 1.00 0.00 C ATOM 1569 CG ARG A 98 25.660 12.301 7.064 1.00 0.00 C ATOM 1570 CD ARG A 98 25.194 12.699 8.467 1.00 0.00 C ATOM 1571 NE ARG A 98 25.456 14.130 8.677 1.00 0.00 N ATOM 1572 CZ ARG A 98 24.606 15.031 9.175 1.00 0.00 C ATOM 1573 NH1 ARG A 98 23.579 14.641 9.922 1.00 0.00 N ATOM 1574 NH2 ARG A 98 24.760 16.318 8.898 1.00 0.00 N ATOM 0 H ARG A 98 24.597 10.014 4.552 1.00 0.00 H new ATOM 0 HA ARG A 98 25.958 9.725 6.987 1.00 0.00 H new ATOM 0 HB2 ARG A 98 24.894 11.603 5.227 1.00 0.00 H new ATOM 0 HB3 ARG A 98 23.720 11.674 6.526 1.00 0.00 H new ATOM 0 HG2 ARG A 98 26.626 11.804 7.153 1.00 0.00 H new ATOM 0 HG3 ARG A 98 25.822 13.211 6.487 1.00 0.00 H new ATOM 0 HD2 ARG A 98 24.130 12.491 8.582 1.00 0.00 H new ATOM 0 HD3 ARG A 98 25.717 12.107 9.218 1.00 0.00 H new ATOM 0 HE ARG A 98 26.382 14.469 8.416 1.00 0.00 H new ATOM 0 HH11 ARG A 98 23.438 13.650 10.117 1.00 0.00 H new ATOM 0 HH12 ARG A 98 22.932 15.333 10.301 1.00 0.00 H new ATOM 0 HH21 ARG A 98 25.530 16.623 8.303 1.00 0.00 H new ATOM 0 HH22 ARG A 98 24.109 17.003 9.280 1.00 0.00 H new ATOM 1588 N VAL A 99 22.735 9.699 7.328 1.00 0.00 N ATOM 1589 CA VAL A 99 21.642 9.441 8.216 1.00 0.00 C ATOM 1590 C VAL A 99 21.507 7.928 8.356 1.00 0.00 C ATOM 1591 O VAL A 99 21.246 7.464 9.457 1.00 0.00 O ATOM 1592 CB VAL A 99 20.373 10.202 7.745 1.00 0.00 C ATOM 1593 CG1 VAL A 99 19.607 9.622 6.565 1.00 0.00 C ATOM 1594 CG2 VAL A 99 19.367 10.365 8.892 1.00 0.00 C ATOM 0 H VAL A 99 22.444 10.120 6.446 1.00 0.00 H new ATOM 0 HA VAL A 99 21.814 9.829 9.220 1.00 0.00 H new ATOM 0 HB VAL A 99 20.795 11.147 7.405 1.00 0.00 H new ATOM 0 HG11 VAL A 99 18.746 10.253 6.344 1.00 0.00 H new ATOM 0 HG12 VAL A 99 20.259 9.580 5.693 1.00 0.00 H new ATOM 0 HG13 VAL A 99 19.266 8.616 6.811 1.00 0.00 H new ATOM 0 HG21 VAL A 99 18.489 10.901 8.532 1.00 0.00 H new ATOM 0 HG22 VAL A 99 19.068 9.382 9.256 1.00 0.00 H new ATOM 0 HG23 VAL A 99 19.829 10.928 9.704 1.00 0.00 H new ATOM 1604 N LEU A 100 21.778 7.154 7.297 1.00 0.00 N ATOM 1605 CA LEU A 100 21.746 5.702 7.325 1.00 0.00 C ATOM 1606 C LEU A 100 22.791 5.143 8.279 1.00 0.00 C ATOM 1607 O LEU A 100 22.574 4.059 8.806 1.00 0.00 O ATOM 1608 CB LEU A 100 21.924 5.074 5.932 1.00 0.00 C ATOM 1609 CG LEU A 100 20.872 5.423 4.864 1.00 0.00 C ATOM 1610 CD1 LEU A 100 20.615 4.276 3.903 1.00 0.00 C ATOM 1611 CD2 LEU A 100 19.512 5.896 5.389 1.00 0.00 C ATOM 0 H LEU A 100 22.029 7.535 6.385 1.00 0.00 H new ATOM 0 HA LEU A 100 20.753 5.432 7.684 1.00 0.00 H new ATOM 0 HB2 LEU A 100 22.902 5.368 5.551 1.00 0.00 H new ATOM 0 HB3 LEU A 100 21.940 3.990 6.049 1.00 0.00 H new ATOM 0 HG LEU A 100 21.340 6.268 4.358 1.00 0.00 H new ATOM 0 HD11 LEU A 100 19.865 4.576 3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 100 21.541 4.017 3.389 1.00 0.00 H new ATOM 0 HD13 LEU A 100 20.254 3.410 4.458 1.00 0.00 H new ATOM 0 HD21 LEU A 100 18.853 6.113 4.548 1.00 0.00 H new ATOM 0 HD22 LEU A 100 19.068 5.115 6.006 1.00 0.00 H new ATOM 0 HD23 LEU A 100 19.646 6.798 5.987 1.00 0.00 H new ATOM 1623 N SER A 101 23.865 5.860 8.584 1.00 0.00 N ATOM 1624 CA SER A 101 24.762 5.443 9.640 1.00 0.00 C ATOM 1625 C SER A 101 24.125 5.828 10.974 1.00 0.00 C ATOM 1626 O SER A 101 23.922 4.984 11.845 1.00 0.00 O ATOM 1627 CB SER A 101 26.100 6.113 9.362 1.00 0.00 C ATOM 1628 OG SER A 101 26.837 5.352 8.422 1.00 0.00 O ATOM 0 H SER A 101 24.130 6.726 8.116 1.00 0.00 H new ATOM 0 HA SER A 101 24.935 4.368 9.683 1.00 0.00 H new ATOM 0 HB2 SER A 101 25.939 7.121 8.980 1.00 0.00 H new ATOM 0 HB3 SER A 101 26.667 6.210 10.288 1.00 0.00 H new ATOM 0 HG SER A 101 26.221 4.815 7.881 1.00 0.00 H new ATOM 1634 N LEU A 102 23.687 7.083 11.078 1.00 0.00 N ATOM 1635 CA LEU A 102 23.139 7.732 12.266 1.00 0.00 C ATOM 1636 C LEU A 102 21.851 7.069 12.792 1.00 0.00 C ATOM 1637 O LEU A 102 21.420 7.369 13.908 1.00 0.00 O ATOM 1638 CB LEU A 102 22.851 9.197 11.939 1.00 0.00 C ATOM 1639 CG LEU A 102 24.018 10.116 11.499 1.00 0.00 C ATOM 1640 CD1 LEU A 102 24.113 11.257 12.493 1.00 0.00 C ATOM 1641 CD2 LEU A 102 25.425 9.513 11.495 1.00 0.00 C ATOM 0 H LEU A 102 23.708 7.715 10.278 1.00 0.00 H new ATOM 0 HA LEU A 102 23.885 7.636 13.055 1.00 0.00 H new ATOM 0 HB2 LEU A 102 22.102 9.215 11.147 1.00 0.00 H new ATOM 0 HB3 LEU A 102 22.394 9.646 12.821 1.00 0.00 H new ATOM 0 HG LEU A 102 23.767 10.374 10.470 1.00 0.00 H new ATOM 0 HD11 LEU A 102 24.928 11.922 12.207 1.00 0.00 H new ATOM 0 HD12 LEU A 102 23.176 11.814 12.498 1.00 0.00 H new ATOM 0 HD13 LEU A 102 24.303 10.857 13.489 1.00 0.00 H new ATOM 0 HD21 LEU A 102 26.142 10.265 11.167 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.682 9.181 12.501 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.454 8.662 10.814 1.00 0.00 H new ATOM 1653 N THR A 103 21.197 6.222 11.995 1.00 0.00 N ATOM 1654 CA THR A 103 19.976 5.479 12.314 1.00 0.00 C ATOM 1655 C THR A 103 20.195 3.965 12.204 1.00 0.00 C ATOM 1656 O THR A 103 19.269 3.196 12.443 1.00 0.00 O ATOM 1657 CB THR A 103 18.832 5.974 11.402 1.00 0.00 C ATOM 1658 OG1 THR A 103 17.560 5.524 11.865 1.00 0.00 O ATOM 1659 CG2 THR A 103 19.034 5.618 9.912 1.00 0.00 C ATOM 0 H THR A 103 21.526 6.024 11.050 1.00 0.00 H new ATOM 0 HA THR A 103 19.698 5.667 13.351 1.00 0.00 H new ATOM 0 HB THR A 103 18.857 7.062 11.464 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.668 4.677 12.346 1.00 0.00 H new ATOM 0 HG21 THR A 103 18.193 5.996 9.330 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.958 6.071 9.552 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.094 4.535 9.801 1.00 0.00 H new ATOM 1667 N ASN A 104 21.399 3.523 11.848 1.00 0.00 N ATOM 1668 CA ASN A 104 21.762 2.167 11.465 1.00 0.00 C ATOM 1669 C ASN A 104 20.804 1.560 10.432 1.00 0.00 C ATOM 1670 O ASN A 104 20.067 0.622 10.722 1.00 0.00 O ATOM 1671 CB ASN A 104 21.975 1.218 12.663 1.00 0.00 C ATOM 1672 CG ASN A 104 22.832 1.809 13.768 1.00 0.00 C ATOM 1673 OD1 ASN A 104 24.038 1.603 13.788 1.00 0.00 O ATOM 1674 ND2 ASN A 104 22.261 2.561 14.694 1.00 0.00 N ATOM 0 H ASN A 104 22.202 4.151 11.819 1.00 0.00 H new ATOM 0 HA ASN A 104 22.733 2.271 10.982 1.00 0.00 H new ATOM 0 HB2 ASN A 104 21.004 0.945 13.076 1.00 0.00 H new ATOM 0 HB3 ASN A 104 22.440 0.298 12.308 1.00 0.00 H new ATOM 0 HD21 ASN A 104 22.827 2.976 15.434 1.00 0.00 H new ATOM 0 HD22 ASN A 104 21.255 2.726 14.668 1.00 0.00 H new ATOM 1681 N LEU A 105 20.820 2.070 9.207 1.00 0.00 N ATOM 1682 CA LEU A 105 20.218 1.486 8.025 1.00 0.00 C ATOM 1683 C LEU A 105 21.300 0.870 7.133 1.00 0.00 C ATOM 1684 O LEU A 105 21.176 -0.298 6.781 1.00 0.00 O ATOM 1685 CB LEU A 105 19.412 2.561 7.280 1.00 0.00 C ATOM 1686 CG LEU A 105 18.051 2.042 6.783 1.00 0.00 C ATOM 1687 CD1 LEU A 105 16.994 3.124 6.998 1.00 0.00 C ATOM 1688 CD2 LEU A 105 18.104 1.630 5.313 1.00 0.00 C ATOM 0 H LEU A 105 21.283 2.956 9.005 1.00 0.00 H new ATOM 0 HA LEU A 105 19.536 0.686 8.313 1.00 0.00 H new ATOM 0 HB2 LEU A 105 19.252 3.413 7.941 1.00 0.00 H new ATOM 0 HB3 LEU A 105 19.992 2.921 6.430 1.00 0.00 H new ATOM 0 HG LEU A 105 17.790 1.152 7.355 1.00 0.00 H new ATOM 0 HD11 LEU A 105 16.027 2.763 6.648 1.00 0.00 H new ATOM 0 HD12 LEU A 105 16.929 3.364 8.059 1.00 0.00 H new ATOM 0 HD13 LEU A 105 17.271 4.019 6.440 1.00 0.00 H new ATOM 0 HD21 LEU A 105 17.124 1.269 5.001 1.00 0.00 H new ATOM 0 HD22 LEU A 105 18.386 2.489 4.704 1.00 0.00 H new ATOM 0 HD23 LEU A 105 18.840 0.837 5.184 1.00 0.00 H new ATOM 1700 N ASP A 106 22.389 1.591 6.818 1.00 0.00 N ATOM 1701 CA ASP A 106 23.456 1.096 5.915 1.00 0.00 C ATOM 1702 C ASP A 106 24.212 -0.101 6.494 1.00 0.00 C ATOM 1703 O ASP A 106 24.950 -0.788 5.795 1.00 0.00 O ATOM 1704 CB ASP A 106 24.470 2.195 5.532 1.00 0.00 C ATOM 1705 CG ASP A 106 25.525 2.491 6.607 1.00 0.00 C ATOM 1706 OD1 ASP A 106 26.570 1.804 6.670 1.00 0.00 O ATOM 1707 OD2 ASP A 106 25.316 3.439 7.389 1.00 0.00 O ATOM 0 H ASP A 106 22.560 2.530 7.177 1.00 0.00 H new ATOM 0 HA ASP A 106 22.931 0.776 5.015 1.00 0.00 H new ATOM 0 HB2 ASP A 106 24.978 1.899 4.614 1.00 0.00 H new ATOM 0 HB3 ASP A 106 23.926 3.113 5.313 1.00 0.00 H new ATOM 1712 N ARG A 107 23.994 -0.355 7.780 1.00 0.00 N ATOM 1713 CA ARG A 107 24.661 -1.344 8.605 1.00 0.00 C ATOM 1714 C ARG A 107 23.726 -2.517 8.923 1.00 0.00 C ATOM 1715 O ARG A 107 24.097 -3.383 9.719 1.00 0.00 O ATOM 1716 CB ARG A 107 25.288 -0.665 9.850 1.00 0.00 C ATOM 1717 CG ARG A 107 24.903 0.799 10.145 1.00 0.00 C ATOM 1718 CD ARG A 107 25.826 1.588 11.087 1.00 0.00 C ATOM 1719 NE ARG A 107 26.249 0.828 12.273 1.00 0.00 N ATOM 1720 CZ ARG A 107 27.435 0.232 12.438 1.00 0.00 C ATOM 1721 NH1 ARG A 107 28.307 0.177 11.439 1.00 0.00 N ATOM 1722 NH2 ARG A 107 27.735 -0.328 13.602 1.00 0.00 N ATOM 0 H ARG A 107 23.294 0.166 8.308 1.00 0.00 H new ATOM 0 HA ARG A 107 25.491 -1.787 8.054 1.00 0.00 H new ATOM 0 HB2 ARG A 107 25.026 -1.262 10.724 1.00 0.00 H new ATOM 0 HB3 ARG A 107 26.372 -0.711 9.746 1.00 0.00 H new ATOM 0 HG2 ARG A 107 24.851 1.333 9.196 1.00 0.00 H new ATOM 0 HG3 ARG A 107 23.899 0.806 10.570 1.00 0.00 H new ATOM 0 HD2 ARG A 107 26.711 1.904 10.534 1.00 0.00 H new ATOM 0 HD3 ARG A 107 25.312 2.493 11.411 1.00 0.00 H new ATOM 0 HE ARG A 107 25.578 0.748 13.037 1.00 0.00 H new ATOM 0 HH11 ARG A 107 28.075 0.591 10.536 1.00 0.00 H new ATOM 0 HH12 ARG A 107 29.209 -0.280 11.574 1.00 0.00 H new ATOM 0 HH21 ARG A 107 27.062 -0.303 14.368 1.00 0.00 H new ATOM 0 HH22 ARG A 107 28.639 -0.783 13.731 1.00 0.00 H new ATOM 1736 N ILE A 108 22.522 -2.529 8.343 1.00 0.00 N ATOM 1737 CA ILE A 108 21.484 -3.541 8.452 1.00 0.00 C ATOM 1738 C ILE A 108 21.078 -4.011 7.055 1.00 0.00 C ATOM 1739 O ILE A 108 20.908 -5.209 6.840 1.00 0.00 O ATOM 1740 CB ILE A 108 20.277 -2.962 9.229 1.00 0.00 C ATOM 1741 CG1 ILE A 108 20.766 -2.493 10.611 1.00 0.00 C ATOM 1742 CG2 ILE A 108 19.160 -4.011 9.344 1.00 0.00 C ATOM 1743 CD1 ILE A 108 19.661 -2.231 11.637 1.00 0.00 C ATOM 0 H ILE A 108 22.231 -1.763 7.735 1.00 0.00 H new ATOM 0 HA ILE A 108 21.859 -4.404 9.003 1.00 0.00 H new ATOM 0 HB ILE A 108 19.857 -2.109 8.695 1.00 0.00 H new ATOM 0 HG12 ILE A 108 21.443 -3.246 11.014 1.00 0.00 H new ATOM 0 HG13 ILE A 108 21.345 -1.579 10.483 1.00 0.00 H new ATOM 0 HG21 ILE A 108 18.319 -3.588 9.893 1.00 0.00 H new ATOM 0 HG22 ILE A 108 18.832 -4.304 8.347 1.00 0.00 H new ATOM 0 HG23 ILE A 108 19.536 -4.886 9.874 1.00 0.00 H new ATOM 0 HD11 ILE A 108 20.107 -1.905 12.577 1.00 0.00 H new ATOM 0 HD12 ILE A 108 18.994 -1.454 11.263 1.00 0.00 H new ATOM 0 HD13 ILE A 108 19.094 -3.147 11.803 1.00 0.00 H new ATOM 1755 N VAL A 109 20.873 -3.078 6.126 1.00 0.00 N ATOM 1756 CA VAL A 109 20.498 -3.351 4.748 1.00 0.00 C ATOM 1757 C VAL A 109 21.780 -3.372 3.909 1.00 0.00 C ATOM 1758 O VAL A 109 22.851 -2.998 4.388 1.00 0.00 O ATOM 1759 CB VAL A 109 19.440 -2.311 4.281 1.00 0.00 C ATOM 1760 CG1 VAL A 109 18.581 -2.898 3.157 1.00 0.00 C ATOM 1761 CG2 VAL A 109 18.447 -1.872 5.379 1.00 0.00 C ATOM 0 H VAL A 109 20.967 -2.082 6.323 1.00 0.00 H new ATOM 0 HA VAL A 109 20.020 -4.324 4.633 1.00 0.00 H new ATOM 0 HB VAL A 109 20.029 -1.448 3.969 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.844 -2.160 2.839 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.218 -3.162 2.313 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.069 -3.790 3.518 1.00 0.00 H new ATOM 0 HG21 VAL A 109 17.746 -1.147 4.966 1.00 0.00 H new ATOM 0 HG22 VAL A 109 17.898 -2.741 5.742 1.00 0.00 H new ATOM 0 HG23 VAL A 109 18.995 -1.418 6.205 1.00 0.00 H new ATOM 1771 N LYS A 110 21.700 -3.864 2.675 1.00 0.00 N ATOM 1772 CA LYS A 110 22.758 -3.738 1.685 1.00 0.00 C ATOM 1773 C LYS A 110 22.473 -2.541 0.790 1.00 0.00 C ATOM 1774 O LYS A 110 21.371 -1.986 0.823 1.00 0.00 O ATOM 1775 CB LYS A 110 22.788 -5.002 0.849 1.00 0.00 C ATOM 1776 CG LYS A 110 23.496 -6.180 1.528 1.00 0.00 C ATOM 1777 CD LYS A 110 24.222 -7.088 0.528 1.00 0.00 C ATOM 1778 CE LYS A 110 23.401 -7.928 -0.438 1.00 0.00 C ATOM 1779 NZ LYS A 110 22.351 -7.216 -1.166 1.00 0.00 N ATOM 0 H LYS A 110 20.883 -4.369 2.333 1.00 0.00 H new ATOM 0 HA LYS A 110 23.719 -3.594 2.178 1.00 0.00 H new ATOM 0 HB2 LYS A 110 21.765 -5.294 0.612 1.00 0.00 H new ATOM 0 HB3 LYS A 110 23.286 -4.788 -0.097 1.00 0.00 H new ATOM 0 HG2 LYS A 110 24.214 -5.798 2.254 1.00 0.00 H new ATOM 0 HG3 LYS A 110 22.765 -6.768 2.082 1.00 0.00 H new ATOM 0 HD2 LYS A 110 24.886 -6.459 -0.065 1.00 0.00 H new ATOM 0 HD3 LYS A 110 24.854 -7.768 1.100 1.00 0.00 H new ATOM 0 HE2 LYS A 110 24.078 -8.379 -1.163 1.00 0.00 H new ATOM 0 HE3 LYS A 110 22.941 -8.744 0.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 21.956 -7.837 -1.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 21.597 -6.939 -0.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 22.752 -6.365 -1.610 1.00 0.00 H new ATOM 1793 N ILE A 111 23.423 -2.201 -0.070 1.00 0.00 N ATOM 1794 CA ILE A 111 23.462 -0.899 -0.730 1.00 0.00 C ATOM 1795 C ILE A 111 24.306 -1.061 -2.000 1.00 0.00 C ATOM 1796 O ILE A 111 25.211 -1.897 -2.001 1.00 0.00 O ATOM 1797 CB ILE A 111 24.012 0.128 0.306 1.00 0.00 C ATOM 1798 CG1 ILE A 111 22.962 1.181 0.730 1.00 0.00 C ATOM 1799 CG2 ILE A 111 25.313 0.825 -0.100 1.00 0.00 C ATOM 1800 CD1 ILE A 111 22.660 1.102 2.227 1.00 0.00 C ATOM 0 H ILE A 111 24.191 -2.820 -0.332 1.00 0.00 H new ATOM 0 HA ILE A 111 22.490 -0.524 -1.050 1.00 0.00 H new ATOM 0 HB ILE A 111 24.251 -0.498 1.166 1.00 0.00 H new ATOM 0 HG12 ILE A 111 23.326 2.178 0.484 1.00 0.00 H new ATOM 0 HG13 ILE A 111 22.043 1.028 0.164 1.00 0.00 H new ATOM 0 HG21 ILE A 111 25.614 1.519 0.685 1.00 0.00 H new ATOM 0 HG22 ILE A 111 26.095 0.080 -0.245 1.00 0.00 H new ATOM 0 HG23 ILE A 111 25.157 1.373 -1.029 1.00 0.00 H new ATOM 0 HD11 ILE A 111 21.918 1.856 2.489 1.00 0.00 H new ATOM 0 HD12 ILE A 111 22.272 0.112 2.468 1.00 0.00 H new ATOM 0 HD13 ILE A 111 23.574 1.281 2.793 1.00 0.00 H new ATOM 1812 N TYR A 112 23.976 -0.320 -3.064 1.00 0.00 N ATOM 1813 CA TYR A 112 24.518 -0.511 -4.408 1.00 0.00 C ATOM 1814 C TYR A 112 24.616 0.793 -5.187 1.00 0.00 C ATOM 1815 O TYR A 112 23.915 1.762 -4.882 1.00 0.00 O ATOM 1816 CB TYR A 112 23.608 -1.458 -5.194 1.00 0.00 C ATOM 1817 CG TYR A 112 23.705 -2.874 -4.701 1.00 0.00 C ATOM 1818 CD1 TYR A 112 22.883 -3.308 -3.647 1.00 0.00 C ATOM 1819 CD2 TYR A 112 24.690 -3.717 -5.244 1.00 0.00 C ATOM 1820 CE1 TYR A 112 23.113 -4.568 -3.076 1.00 0.00 C ATOM 1821 CE2 TYR A 112 24.884 -4.994 -4.707 1.00 0.00 C ATOM 1822 CZ TYR A 112 24.129 -5.397 -3.592 1.00 0.00 C ATOM 1823 OH TYR A 112 24.406 -6.573 -2.977 1.00 0.00 O ATOM 0 H TYR A 112 23.307 0.448 -3.009 1.00 0.00 H new ATOM 0 HA TYR A 112 25.521 -0.921 -4.290 1.00 0.00 H new ATOM 0 HB2 TYR A 112 22.576 -1.117 -5.115 1.00 0.00 H new ATOM 0 HB3 TYR A 112 23.875 -1.423 -6.250 1.00 0.00 H new ATOM 0 HD1 TYR A 112 22.085 -2.679 -3.281 1.00 0.00 H new ATOM 0 HD2 TYR A 112 25.295 -3.380 -6.073 1.00 0.00 H new ATOM 0 HE1 TYR A 112 22.513 -4.902 -2.243 1.00 0.00 H new ATOM 0 HE2 TYR A 112 25.608 -5.665 -5.146 1.00 0.00 H new ATOM 0 HH TYR A 112 25.356 -6.601 -2.737 1.00 0.00 H new ATOM 1833 N ASP A 113 25.410 0.776 -6.263 1.00 0.00 N ATOM 1834 CA ASP A 113 25.638 1.953 -7.091 1.00 0.00 C ATOM 1835 C ASP A 113 24.542 2.002 -8.127 1.00 0.00 C ATOM 1836 O ASP A 113 23.788 2.975 -8.186 1.00 0.00 O ATOM 1837 CB ASP A 113 27.024 1.918 -7.776 1.00 0.00 C ATOM 1838 CG ASP A 113 27.904 3.108 -7.398 1.00 0.00 C ATOM 1839 OD1 ASP A 113 28.653 2.999 -6.397 1.00 0.00 O ATOM 1840 OD2 ASP A 113 27.865 4.119 -8.140 1.00 0.00 O ATOM 0 H ASP A 113 25.909 -0.055 -6.579 1.00 0.00 H new ATOM 0 HA ASP A 113 25.623 2.844 -6.464 1.00 0.00 H new ATOM 0 HB2 ASP A 113 27.535 0.994 -7.504 1.00 0.00 H new ATOM 0 HB3 ASP A 113 26.889 1.901 -8.857 1.00 0.00 H new ATOM 1845 N THR A 114 24.435 0.943 -8.929 1.00 0.00 N ATOM 1846 CA THR A 114 23.444 0.877 -9.986 1.00 0.00 C ATOM 1847 C THR A 114 22.310 -0.019 -9.526 1.00 0.00 C ATOM 1848 O THR A 114 22.162 -0.309 -8.333 1.00 0.00 O ATOM 1849 CB THR A 114 24.145 0.500 -11.303 1.00 0.00 C ATOM 1850 OG1 THR A 114 24.733 -0.787 -11.312 1.00 0.00 O ATOM 1851 CG2 THR A 114 25.197 1.550 -11.667 1.00 0.00 C ATOM 0 H THR A 114 25.030 0.117 -8.860 1.00 0.00 H new ATOM 0 HA THR A 114 22.970 1.835 -10.200 1.00 0.00 H new ATOM 0 HB THR A 114 23.353 0.474 -12.051 1.00 0.00 H new ATOM 0 HG1 THR A 114 25.462 -0.818 -10.658 1.00 0.00 H new ATOM 0 HG21 THR A 114 25.684 1.269 -12.601 1.00 0.00 H new ATOM 0 HG22 THR A 114 24.716 2.521 -11.786 1.00 0.00 H new ATOM 0 HG23 THR A 114 25.942 1.609 -10.873 1.00 0.00 H new ATOM 1859 N ILE A 115 21.505 -0.480 -10.466 1.00 0.00 N ATOM 1860 CA ILE A 115 20.726 -1.682 -10.275 1.00 0.00 C ATOM 1861 C ILE A 115 21.540 -2.923 -10.613 1.00 0.00 C ATOM 1862 O ILE A 115 21.286 -3.968 -10.026 1.00 0.00 O ATOM 1863 CB ILE A 115 19.486 -1.565 -11.172 1.00 0.00 C ATOM 1864 CG1 ILE A 115 18.491 -0.569 -10.564 1.00 0.00 C ATOM 1865 CG2 ILE A 115 18.809 -2.921 -11.451 1.00 0.00 C ATOM 1866 CD1 ILE A 115 17.824 -1.044 -9.275 1.00 0.00 C ATOM 0 H ILE A 115 21.376 -0.034 -11.374 1.00 0.00 H new ATOM 0 HA ILE A 115 20.430 -1.785 -9.231 1.00 0.00 H new ATOM 0 HB ILE A 115 19.825 -1.194 -12.139 1.00 0.00 H new ATOM 0 HG12 ILE A 115 19.011 0.368 -10.365 1.00 0.00 H new ATOM 0 HG13 ILE A 115 17.717 -0.354 -11.300 1.00 0.00 H new ATOM 0 HG21 ILE A 115 17.939 -2.769 -12.090 1.00 0.00 H new ATOM 0 HG22 ILE A 115 19.515 -3.584 -11.951 1.00 0.00 H new ATOM 0 HG23 ILE A 115 18.493 -3.370 -10.510 1.00 0.00 H new ATOM 0 HD11 ILE A 115 17.137 -0.277 -8.917 1.00 0.00 H new ATOM 0 HD12 ILE A 115 17.272 -1.964 -9.469 1.00 0.00 H new ATOM 0 HD13 ILE A 115 18.586 -1.231 -8.518 1.00 0.00 H new ATOM 1878 N SER A 116 22.436 -2.858 -11.596 1.00 0.00 N ATOM 1879 CA SER A 116 22.864 -4.052 -12.298 1.00 0.00 C ATOM 1880 C SER A 116 23.711 -4.933 -11.417 1.00 0.00 C ATOM 1881 O SER A 116 23.540 -6.150 -11.474 1.00 0.00 O ATOM 1882 CB SER A 116 23.623 -3.662 -13.557 1.00 0.00 C ATOM 1883 OG SER A 116 23.499 -4.620 -14.597 1.00 0.00 O ATOM 0 H SER A 116 22.873 -1.995 -11.918 1.00 0.00 H new ATOM 0 HA SER A 116 21.979 -4.624 -12.577 1.00 0.00 H new ATOM 0 HB2 SER A 116 23.257 -2.699 -13.912 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.678 -3.532 -13.314 1.00 0.00 H new ATOM 0 HG SER A 116 24.004 -4.319 -15.381 1.00 0.00 H new ATOM 1889 N GLU A 117 24.557 -4.340 -10.574 1.00 0.00 N ATOM 1890 CA GLU A 117 25.318 -5.157 -9.663 1.00 0.00 C ATOM 1891 C GLU A 117 24.339 -5.782 -8.669 1.00 0.00 C ATOM 1892 O GLU A 117 24.434 -6.966 -8.358 1.00 0.00 O ATOM 1893 CB GLU A 117 26.318 -4.276 -8.927 1.00 0.00 C ATOM 1894 CG GLU A 117 27.408 -3.639 -9.789 1.00 0.00 C ATOM 1895 CD GLU A 117 27.704 -2.280 -9.168 1.00 0.00 C ATOM 1896 OE1 GLU A 117 28.519 -2.250 -8.218 1.00 0.00 O ATOM 1897 OE2 GLU A 117 26.984 -1.311 -9.532 1.00 0.00 O ATOM 0 H GLU A 117 24.721 -3.335 -10.511 1.00 0.00 H new ATOM 0 HA GLU A 117 25.861 -5.938 -10.195 1.00 0.00 H new ATOM 0 HB2 GLU A 117 25.770 -3.480 -8.423 1.00 0.00 H new ATOM 0 HB3 GLU A 117 26.798 -4.874 -8.152 1.00 0.00 H new ATOM 0 HG2 GLU A 117 28.303 -4.261 -9.807 1.00 0.00 H new ATOM 0 HG3 GLU A 117 27.074 -3.531 -10.821 1.00 0.00 H new ATOM 1904 N ALA A 118 23.339 -5.018 -8.215 1.00 0.00 N ATOM 1905 CA ALA A 118 22.449 -5.405 -7.138 1.00 0.00 C ATOM 1906 C ALA A 118 21.659 -6.609 -7.603 1.00 0.00 C ATOM 1907 O ALA A 118 21.478 -7.573 -6.862 1.00 0.00 O ATOM 1908 CB ALA A 118 21.524 -4.235 -6.772 1.00 0.00 C ATOM 0 H ALA A 118 23.130 -4.097 -8.600 1.00 0.00 H new ATOM 0 HA ALA A 118 23.013 -5.663 -6.241 1.00 0.00 H new ATOM 0 HB1 ALA A 118 20.860 -4.536 -5.962 1.00 0.00 H new ATOM 0 HB2 ALA A 118 22.124 -3.383 -6.451 1.00 0.00 H new ATOM 0 HB3 ALA A 118 20.931 -3.954 -7.642 1.00 0.00 H new ATOM 1914 N MET A 119 21.239 -6.542 -8.862 1.00 0.00 N ATOM 1915 CA MET A 119 20.393 -7.457 -9.552 1.00 0.00 C ATOM 1916 C MET A 119 20.909 -8.882 -9.411 1.00 0.00 C ATOM 1917 O MET A 119 20.113 -9.793 -9.211 1.00 0.00 O ATOM 1918 CB MET A 119 20.363 -7.020 -11.025 1.00 0.00 C ATOM 1919 CG MET A 119 19.039 -7.496 -11.596 1.00 0.00 C ATOM 1920 SD MET A 119 18.872 -7.269 -13.379 1.00 0.00 S ATOM 1921 CE MET A 119 17.419 -8.309 -13.654 1.00 0.00 C ATOM 0 H MET A 119 21.519 -5.767 -9.464 1.00 0.00 H new ATOM 0 HA MET A 119 19.387 -7.447 -9.132 1.00 0.00 H new ATOM 0 HB2 MET A 119 20.453 -5.937 -11.109 1.00 0.00 H new ATOM 0 HB3 MET A 119 21.199 -7.453 -11.574 1.00 0.00 H new ATOM 0 HG2 MET A 119 18.916 -8.554 -11.363 1.00 0.00 H new ATOM 0 HG3 MET A 119 18.229 -6.964 -11.097 1.00 0.00 H new ATOM 0 HE1 MET A 119 16.848 -7.921 -14.498 1.00 0.00 H new ATOM 0 HE2 MET A 119 17.737 -9.329 -13.870 1.00 0.00 H new ATOM 0 HE3 MET A 119 16.794 -8.305 -12.761 1.00 0.00 H new ATOM 1931 N GLU A 120 22.215 -9.096 -9.549 1.00 0.00 N ATOM 1932 CA GLU A 120 22.853 -10.401 -9.494 1.00 0.00 C ATOM 1933 C GLU A 120 23.593 -10.632 -8.180 1.00 0.00 C ATOM 1934 O GLU A 120 23.882 -11.780 -7.843 1.00 0.00 O ATOM 1935 CB GLU A 120 23.752 -10.537 -10.725 1.00 0.00 C ATOM 1936 CG GLU A 120 24.838 -9.452 -10.859 1.00 0.00 C ATOM 1937 CD GLU A 120 25.945 -9.809 -11.862 1.00 0.00 C ATOM 1938 OE1 GLU A 120 25.801 -10.792 -12.628 1.00 0.00 O ATOM 1939 OE2 GLU A 120 27.000 -9.129 -11.858 1.00 0.00 O ATOM 0 H GLU A 120 22.878 -8.337 -9.707 1.00 0.00 H new ATOM 0 HA GLU A 120 22.097 -11.186 -9.517 1.00 0.00 H new ATOM 0 HB2 GLU A 120 24.236 -11.513 -10.697 1.00 0.00 H new ATOM 0 HB3 GLU A 120 23.127 -10.517 -11.618 1.00 0.00 H new ATOM 0 HG2 GLU A 120 24.369 -8.517 -11.166 1.00 0.00 H new ATOM 0 HG3 GLU A 120 25.288 -9.277 -9.882 1.00 0.00 H new ATOM 1946 N GLU A 121 23.856 -9.589 -7.395 1.00 0.00 N ATOM 1947 CA GLU A 121 24.578 -9.726 -6.146 1.00 0.00 C ATOM 1948 C GLU A 121 23.619 -10.184 -5.067 1.00 0.00 C ATOM 1949 O GLU A 121 23.892 -11.147 -4.379 1.00 0.00 O ATOM 1950 CB GLU A 121 25.233 -8.406 -5.766 1.00 0.00 C ATOM 1951 CG GLU A 121 26.265 -8.650 -4.666 1.00 0.00 C ATOM 1952 CD GLU A 121 27.180 -7.461 -4.430 1.00 0.00 C ATOM 1953 OE1 GLU A 121 28.007 -7.118 -5.297 1.00 0.00 O ATOM 1954 OE2 GLU A 121 27.000 -6.817 -3.376 1.00 0.00 O ATOM 0 H GLU A 121 23.574 -8.633 -7.611 1.00 0.00 H new ATOM 0 HA GLU A 121 25.368 -10.469 -6.259 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.713 -7.961 -6.638 1.00 0.00 H new ATOM 0 HB3 GLU A 121 24.478 -7.699 -5.422 1.00 0.00 H new ATOM 0 HG2 GLU A 121 25.747 -8.892 -3.738 1.00 0.00 H new ATOM 0 HG3 GLU A 121 26.869 -9.518 -4.929 1.00 0.00 H new ATOM 1961 N VAL A 122 22.449 -9.565 -4.949 1.00 0.00 N ATOM 1962 CA VAL A 122 21.392 -9.942 -4.003 1.00 0.00 C ATOM 1963 C VAL A 122 20.944 -11.406 -4.115 1.00 0.00 C ATOM 1964 O VAL A 122 20.330 -11.973 -3.211 1.00 0.00 O ATOM 1965 CB VAL A 122 20.229 -8.975 -4.259 1.00 0.00 C ATOM 1966 CG1 VAL A 122 19.229 -9.372 -5.356 1.00 0.00 C ATOM 1967 CG2 VAL A 122 19.478 -8.736 -2.961 1.00 0.00 C ATOM 0 H VAL A 122 22.197 -8.761 -5.525 1.00 0.00 H new ATOM 0 HA VAL A 122 21.772 -9.865 -2.984 1.00 0.00 H new ATOM 0 HB VAL A 122 20.707 -8.072 -4.639 1.00 0.00 H new ATOM 0 HG11 VAL A 122 18.457 -8.607 -5.438 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.751 -9.464 -6.308 1.00 0.00 H new ATOM 0 HG13 VAL A 122 18.769 -10.326 -5.101 1.00 0.00 H new ATOM 0 HG21 VAL A 122 18.651 -8.049 -3.140 1.00 0.00 H new ATOM 0 HG22 VAL A 122 19.089 -9.683 -2.586 1.00 0.00 H new ATOM 0 HG23 VAL A 122 20.155 -8.305 -2.223 1.00 0.00 H new ATOM 1977 N ARG A 123 21.228 -12.020 -5.257 1.00 0.00 N ATOM 1978 CA ARG A 123 20.997 -13.436 -5.475 1.00 0.00 C ATOM 1979 C ARG A 123 21.982 -14.285 -4.652 1.00 0.00 C ATOM 1980 O ARG A 123 21.626 -15.407 -4.282 1.00 0.00 O ATOM 1981 CB ARG A 123 20.983 -13.730 -6.993 1.00 0.00 C ATOM 1982 CG ARG A 123 19.748 -13.094 -7.664 1.00 0.00 C ATOM 1983 CD ARG A 123 19.494 -13.523 -9.129 1.00 0.00 C ATOM 1984 NE ARG A 123 19.559 -12.357 -10.019 1.00 0.00 N ATOM 1985 CZ ARG A 123 19.458 -12.264 -11.352 1.00 0.00 C ATOM 1986 NH1 ARG A 123 18.990 -13.246 -12.113 1.00 0.00 N ATOM 1987 NH2 ARG A 123 19.855 -11.133 -11.919 1.00 0.00 N ATOM 0 H ARG A 123 21.629 -11.541 -6.063 1.00 0.00 H new ATOM 0 HA ARG A 123 20.014 -13.727 -5.106 1.00 0.00 H new ATOM 0 HB2 ARG A 123 21.892 -13.341 -7.452 1.00 0.00 H new ATOM 0 HB3 ARG A 123 20.978 -14.807 -7.159 1.00 0.00 H new ATOM 0 HG2 ARG A 123 18.866 -13.342 -7.073 1.00 0.00 H new ATOM 0 HG3 ARG A 123 19.857 -12.010 -7.634 1.00 0.00 H new ATOM 0 HD2 ARG A 123 20.235 -14.263 -9.432 1.00 0.00 H new ATOM 0 HD3 ARG A 123 18.517 -13.998 -9.212 1.00 0.00 H new ATOM 0 HE ARG A 123 19.706 -11.467 -9.542 1.00 0.00 H new ATOM 0 HH11 ARG A 123 18.687 -14.122 -11.686 1.00 0.00 H new ATOM 0 HH12 ARG A 123 18.933 -13.125 -13.124 1.00 0.00 H new ATOM 0 HH21 ARG A 123 20.221 -10.375 -11.343 1.00 0.00 H new ATOM 0 HH22 ARG A 123 19.795 -11.021 -12.931 1.00 0.00 H new ATOM 2001 N ARG A 124 23.192 -13.805 -4.327 1.00 0.00 N ATOM 2002 CA ARG A 124 24.243 -14.552 -3.615 1.00 0.00 C ATOM 2003 C ARG A 124 25.367 -13.663 -3.043 1.00 0.00 C ATOM 2004 O ARG A 124 26.540 -13.988 -3.239 1.00 0.00 O ATOM 2005 CB ARG A 124 24.786 -15.684 -4.507 1.00 0.00 C ATOM 2006 CG ARG A 124 25.423 -15.205 -5.817 1.00 0.00 C ATOM 2007 CD ARG A 124 24.426 -15.027 -6.957 1.00 0.00 C ATOM 2008 NE ARG A 124 25.109 -15.032 -8.251 1.00 0.00 N ATOM 2009 CZ ARG A 124 24.496 -15.202 -9.423 1.00 0.00 C ATOM 2010 NH1 ARG A 124 23.215 -15.563 -9.457 1.00 0.00 N ATOM 2011 NH2 ARG A 124 25.159 -15.014 -10.548 1.00 0.00 N ATOM 0 H ARG A 124 23.477 -12.854 -4.560 1.00 0.00 H new ATOM 0 HA ARG A 124 23.776 -14.995 -2.735 1.00 0.00 H new ATOM 0 HB2 ARG A 124 25.526 -16.252 -3.943 1.00 0.00 H new ATOM 0 HB3 ARG A 124 23.971 -16.368 -4.742 1.00 0.00 H new ATOM 0 HG2 ARG A 124 25.930 -14.257 -5.638 1.00 0.00 H new ATOM 0 HG3 ARG A 124 26.186 -15.921 -6.122 1.00 0.00 H new ATOM 0 HD2 ARG A 124 23.687 -15.828 -6.928 1.00 0.00 H new ATOM 0 HD3 ARG A 124 23.885 -14.089 -6.830 1.00 0.00 H new ATOM 0 HE ARG A 124 26.120 -14.897 -8.257 1.00 0.00 H new ATOM 0 HH11 ARG A 124 22.703 -15.709 -8.587 1.00 0.00 H new ATOM 0 HH12 ARG A 124 22.745 -15.693 -10.353 1.00 0.00 H new ATOM 0 HH21 ARG A 124 26.141 -14.739 -10.521 1.00 0.00 H new ATOM 0 HH22 ARG A 124 24.690 -15.144 -11.444 1.00 0.00 H new ATOM 2025 N LYS A 125 25.009 -12.570 -2.362 1.00 0.00 N ATOM 2026 CA LYS A 125 25.931 -11.529 -1.889 1.00 0.00 C ATOM 2027 C LYS A 125 27.118 -12.131 -1.149 1.00 0.00 C ATOM 2028 O LYS A 125 28.220 -11.554 -1.265 1.00 0.00 O ATOM 2029 CB LYS A 125 25.149 -10.465 -1.083 1.00 0.00 C ATOM 2030 CG LYS A 125 24.805 -10.921 0.347 1.00 0.00 C ATOM 2031 CD LYS A 125 25.834 -10.454 1.392 1.00 0.00 C ATOM 2032 CE LYS A 125 26.391 -11.590 2.251 1.00 0.00 C ATOM 2033 NZ LYS A 125 27.521 -11.121 3.074 1.00 0.00 N ATOM 0 H LYS A 125 24.038 -12.378 -2.116 1.00 0.00 H new ATOM 0 HA LYS A 125 26.371 -11.011 -2.741 1.00 0.00 H new ATOM 0 HB2 LYS A 125 25.739 -9.550 -1.034 1.00 0.00 H new ATOM 0 HB3 LYS A 125 24.227 -10.222 -1.612 1.00 0.00 H new ATOM 0 HG2 LYS A 125 23.821 -10.538 0.618 1.00 0.00 H new ATOM 0 HG3 LYS A 125 24.741 -12.009 0.370 1.00 0.00 H new ATOM 0 HD2 LYS A 125 26.659 -9.958 0.881 1.00 0.00 H new ATOM 0 HD3 LYS A 125 25.369 -9.712 2.042 1.00 0.00 H new ATOM 0 HE2 LYS A 125 25.605 -11.983 2.896 1.00 0.00 H new ATOM 0 HE3 LYS A 125 26.718 -12.409 1.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 27.883 -11.909 3.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 28.278 -10.768 2.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 27.200 -10.355 3.700 1.00 0.00 H new TER 2047 LYS A 125