USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1183 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 148 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 150 GLN : amide:sc= 1.21 K(o=1.2,f=-6.4!) USER MOD Set 2.1: A 111 SER OG : rot -21:sc= 1.43 USER MOD Set 2.2: A 145 THR OG1 : rot -49:sc= 0.603 USER MOD Set 3.1: A 106 SER OG : rot -4:sc= 1.22 USER MOD Set 3.2: A 146 LYS NZ :NH3+ 134:sc= 1.92 (180deg=-0.201) USER MOD Set 4.1: A 94 LYS NZ :NH3+ 142:sc= 1.24 (180deg=0) USER MOD Set 4.2: A 95 GLN : amide:sc= 1.05 K(o=2.3,f=-5.4) USER MOD Set 5.1: A 92 ASN : amide:sc= 0.26 K(o=1.3,f=-2.6) USER MOD Set 5.2: A 97 LYS NZ :NH3+ -146:sc= 1.04 (180deg=0.396) USER MOD Set 6.1: A 67 CYS SG : rot 180:sc= 0.649 USER MOD Set 6.2: A 69 SER OG : rot 124:sc= 0.519 USER MOD Set 7.1: A 35 TYR OH : rot 180:sc= 0 USER MOD Set 7.2: A 40 ASN : amide:sc= -0.16 X(o=-0.16,f=0.029) USER MOD Set 8.1: A 4 SER OG : rot -100:sc= 0 USER MOD Set 8.2: A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 172:sc= 0 (180deg=-0.0733) USER MOD Single : A 1 MET N :NH3+ -165:sc= 2.05 (180deg=1.26) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 167:sc= 1.25 (180deg=1.15) USER MOD Single : A 12 GLN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 170:sc= 1.39 (180deg=1.14) USER MOD Single : A 23 THR OG1 : rot 3:sc= 1.16 USER MOD Single : A 25 TYR OH : rot 140:sc= 1.15 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 ASN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ -177:sc= 1.15 (180deg=1.03) USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=-0.00099) USER MOD Single : A 62 HIS : no HD1:sc= 0 X(o=0,f=-0.077) USER MOD Single : A 65 LYS NZ :NH3+ -159:sc= 1.3 (180deg=1.08) USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot 100:sc= -3.29! USER MOD Single : A 72 LYS NZ :NH3+ 155:sc= 2.39 (180deg=0.956) USER MOD Single : A 73 SER OG : rot 74:sc= 1.43 USER MOD Single : A 77 THR OG1 : rot -18:sc= 1.14 USER MOD Single : A 80 GLN : amide:sc= 0.985 K(o=0.98,f=-8.5!) USER MOD Single : A 85 ASN : amide:sc= 0.158 X(o=0.16,f=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 31:sc= 0.931 USER MOD Single : A 104 SER OG : rot 41:sc= 0.933 USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.0838 USER MOD Single : A 110 THR OG1 : rot -130:sc= 0.0208 USER MOD Single : A 114 SER OG : rot -3:sc= 1.18 USER MOD Single : A 117 CYS SG : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 11:sc= -1.82! USER MOD Single : A 124 THR OG1 : rot 179:sc= 0.676 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 GLN : amide:sc= 1.62 K(o=1.6,f=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -26:sc= 0.911 USER MOD Single : A 136 ASN : amide:sc= 0.123 X(o=0.12,f=-0.0034) USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.568 5.747 -1.163 1.00 0.00 N ATOM 2 CA MET A 1 -8.817 5.900 -2.628 1.00 0.00 C ATOM 3 C MET A 1 -10.275 6.413 -2.885 1.00 0.00 C ATOM 4 O MET A 1 -11.158 5.659 -3.300 1.00 0.00 O ATOM 5 CB MET A 1 -8.485 4.534 -3.296 1.00 0.00 C ATOM 6 CG MET A 1 -8.132 4.613 -4.795 1.00 0.00 C ATOM 7 SD MET A 1 -9.504 5.238 -5.792 1.00 0.00 S ATOM 8 CE MET A 1 -8.893 6.881 -6.209 1.00 0.00 C ATOM 0 H1 MET A 1 -7.546 5.657 -0.992 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.931 6.582 -0.660 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.054 4.896 -0.815 1.00 0.00 H new ATOM 0 HA MET A 1 -8.177 6.659 -3.078 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.649 4.080 -2.764 1.00 0.00 H new ATOM 0 HB3 MET A 1 -9.340 3.869 -3.174 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.265 5.260 -4.928 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.848 3.623 -5.152 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.559 7.343 -6.938 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.858 7.495 -5.309 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.892 6.800 -6.633 1.00 0.00 H new ATOM 20 N ARG A 2 -10.502 7.709 -2.602 1.00 0.00 N ATOM 21 CA ARG A 2 -11.808 8.421 -2.749 1.00 0.00 C ATOM 22 C ARG A 2 -11.615 9.811 -2.018 1.00 0.00 C ATOM 23 O ARG A 2 -11.442 9.796 -0.793 1.00 0.00 O ATOM 24 CB ARG A 2 -13.070 7.657 -2.215 1.00 0.00 C ATOM 25 CG ARG A 2 -12.981 6.895 -0.860 1.00 0.00 C ATOM 26 CD ARG A 2 -13.970 7.316 0.241 1.00 0.00 C ATOM 27 NE ARG A 2 -13.592 8.677 0.704 1.00 0.00 N ATOM 28 CZ ARG A 2 -13.479 9.086 1.962 1.00 0.00 C ATOM 29 NH1 ARG A 2 -13.790 8.367 3.010 1.00 0.00 N ATOM 30 NH2 ARG A 2 -13.025 10.281 2.164 1.00 0.00 N ATOM 0 H ARG A 2 -9.764 8.320 -2.252 1.00 0.00 H new ATOM 0 HA ARG A 2 -12.034 8.521 -3.811 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -13.881 8.381 -2.131 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -13.364 6.936 -2.978 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -13.125 5.833 -1.058 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -11.970 7.012 -0.471 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -14.990 7.314 -0.143 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -13.940 6.609 1.070 1.00 0.00 H new ATOM 0 HE ARG A 2 -13.399 9.369 -0.020 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -14.148 7.419 2.890 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -13.674 8.754 3.947 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -12.769 10.870 1.372 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -12.923 10.634 3.116 1.00 0.00 H new ATOM 44 N PRO A 3 -11.681 11.019 -2.667 1.00 0.00 N ATOM 45 CA PRO A 3 -11.421 12.337 -1.993 1.00 0.00 C ATOM 46 C PRO A 3 -12.194 12.733 -0.677 1.00 0.00 C ATOM 47 O PRO A 3 -13.010 11.990 -0.122 1.00 0.00 O ATOM 48 CB PRO A 3 -11.731 13.315 -3.154 1.00 0.00 C ATOM 49 CG PRO A 3 -11.380 12.561 -4.429 1.00 0.00 C ATOM 50 CD PRO A 3 -11.856 11.146 -4.133 1.00 0.00 C ATOM 0 HA PRO A 3 -10.416 12.331 -1.570 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.781 13.609 -3.149 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -11.143 14.229 -3.064 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -11.884 12.983 -5.299 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -10.310 12.592 -4.635 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.896 11.003 -4.426 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -11.268 10.404 -4.673 1.00 0.00 H new ATOM 58 N SER A 4 -11.862 13.923 -0.139 1.00 0.00 N ATOM 59 CA SER A 4 -12.505 14.499 1.080 1.00 0.00 C ATOM 60 C SER A 4 -12.468 16.062 1.026 1.00 0.00 C ATOM 61 O SER A 4 -11.486 16.654 0.562 1.00 0.00 O ATOM 62 CB SER A 4 -11.790 13.970 2.348 1.00 0.00 C ATOM 63 OG SER A 4 -10.424 14.379 2.431 1.00 0.00 O ATOM 0 H SER A 4 -11.137 14.523 -0.533 1.00 0.00 H new ATOM 0 HA SER A 4 -13.549 14.189 1.116 1.00 0.00 H new ATOM 0 HB2 SER A 4 -12.323 14.321 3.232 1.00 0.00 H new ATOM 0 HB3 SER A 4 -11.839 12.881 2.358 1.00 0.00 H new ATOM 0 HG SER A 4 -9.844 13.646 2.137 1.00 0.00 H new ATOM 69 N GLY A 5 -13.534 16.742 1.494 1.00 0.00 N ATOM 70 CA GLY A 5 -13.568 18.235 1.459 1.00 0.00 C ATOM 71 C GLY A 5 -14.824 19.011 1.920 1.00 0.00 C ATOM 72 O GLY A 5 -14.686 20.190 2.257 1.00 0.00 O ATOM 0 H GLY A 5 -14.365 16.305 1.892 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -12.733 18.588 2.065 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -13.366 18.536 0.431 1.00 0.00 H new ATOM 76 N ARG A 6 -16.042 18.452 1.831 1.00 0.00 N ATOM 77 CA ARG A 6 -17.298 19.136 2.271 1.00 0.00 C ATOM 78 C ARG A 6 -17.823 18.468 3.589 1.00 0.00 C ATOM 79 O ARG A 6 -17.896 17.240 3.698 1.00 0.00 O ATOM 80 CB ARG A 6 -18.345 19.079 1.113 1.00 0.00 C ATOM 81 CG ARG A 6 -18.434 20.318 0.175 1.00 0.00 C ATOM 82 CD ARG A 6 -17.326 20.538 -0.881 1.00 0.00 C ATOM 83 NE ARG A 6 -16.088 21.078 -0.255 1.00 0.00 N ATOM 84 CZ ARG A 6 -15.085 21.684 -0.882 1.00 0.00 C ATOM 85 NH1 ARG A 6 -15.099 21.995 -2.154 1.00 0.00 N ATOM 86 NH2 ARG A 6 -14.029 21.982 -0.182 1.00 0.00 N ATOM 0 H ARG A 6 -16.198 17.517 1.455 1.00 0.00 H new ATOM 0 HA ARG A 6 -17.109 20.186 2.493 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -18.123 18.206 0.500 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -19.329 18.917 1.554 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -19.386 20.264 -0.353 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -18.469 21.207 0.805 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -17.103 19.595 -1.380 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -17.681 21.228 -1.646 1.00 0.00 H new ATOM 0 HE ARG A 6 -16.001 20.972 0.756 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -15.914 21.772 -2.725 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -14.294 22.460 -2.574 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -13.993 21.750 0.811 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -13.237 22.448 -0.626 1.00 0.00 H new ATOM 100 N LYS A 7 -18.206 19.300 4.586 1.00 0.00 N ATOM 101 CA LYS A 7 -18.676 18.857 5.949 1.00 0.00 C ATOM 102 C LYS A 7 -17.572 18.040 6.729 1.00 0.00 C ATOM 103 O LYS A 7 -17.798 16.900 7.155 1.00 0.00 O ATOM 104 CB LYS A 7 -20.030 18.076 5.851 1.00 0.00 C ATOM 105 CG LYS A 7 -21.264 18.885 5.381 1.00 0.00 C ATOM 106 CD LYS A 7 -22.537 18.010 5.337 1.00 0.00 C ATOM 107 CE LYS A 7 -23.793 18.797 4.916 1.00 0.00 C ATOM 108 NZ LYS A 7 -24.962 17.877 4.854 1.00 0.00 N ATOM 0 H LYS A 7 -18.202 20.314 4.479 1.00 0.00 H new ATOM 0 HA LYS A 7 -18.858 19.756 6.537 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -19.891 17.238 5.168 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -20.252 17.655 6.831 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -21.425 19.728 6.053 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -21.072 19.299 4.391 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -22.381 17.186 4.641 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -22.703 17.570 6.320 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -23.987 19.600 5.627 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -23.633 19.264 3.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -25.809 18.410 4.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -24.776 17.126 4.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -25.119 17.452 5.790 1.00 0.00 H new ATOM 122 N SER A 8 -16.394 18.671 6.964 1.00 0.00 N ATOM 123 CA SER A 8 -15.187 18.063 7.627 1.00 0.00 C ATOM 124 C SER A 8 -14.555 16.908 6.768 1.00 0.00 C ATOM 125 O SER A 8 -15.256 16.073 6.187 1.00 0.00 O ATOM 126 CB SER A 8 -15.498 17.589 9.073 1.00 0.00 C ATOM 127 OG SER A 8 -15.913 18.682 9.890 1.00 0.00 O ATOM 0 H SER A 8 -16.242 19.643 6.695 1.00 0.00 H new ATOM 0 HA SER A 8 -14.441 18.854 7.696 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.280 16.830 9.051 1.00 0.00 H new ATOM 0 HB3 SER A 8 -14.613 17.123 9.505 1.00 0.00 H new ATOM 0 HG SER A 8 -16.105 18.359 10.795 1.00 0.00 H new ATOM 133 N SER A 9 -13.214 16.826 6.708 1.00 0.00 N ATOM 134 CA SER A 9 -12.512 15.799 5.884 1.00 0.00 C ATOM 135 C SER A 9 -12.232 14.476 6.671 1.00 0.00 C ATOM 136 O SER A 9 -11.465 14.460 7.637 1.00 0.00 O ATOM 137 CB SER A 9 -11.184 16.409 5.372 1.00 0.00 C ATOM 138 OG SER A 9 -11.426 17.430 4.403 1.00 0.00 O ATOM 0 H SER A 9 -12.588 17.452 7.215 1.00 0.00 H new ATOM 0 HA SER A 9 -13.162 15.527 5.052 1.00 0.00 H new ATOM 0 HB2 SER A 9 -10.624 16.824 6.210 1.00 0.00 H new ATOM 0 HB3 SER A 9 -10.566 15.626 4.933 1.00 0.00 H new ATOM 0 HG SER A 9 -10.572 17.800 4.097 1.00 0.00 H new ATOM 144 N LYS A 10 -12.849 13.359 6.238 1.00 0.00 N ATOM 145 CA LYS A 10 -12.611 12.011 6.839 1.00 0.00 C ATOM 146 C LYS A 10 -11.844 11.131 5.791 1.00 0.00 C ATOM 147 O LYS A 10 -12.443 10.422 4.971 1.00 0.00 O ATOM 148 CB LYS A 10 -13.975 11.402 7.287 1.00 0.00 C ATOM 149 CG LYS A 10 -14.497 11.885 8.674 1.00 0.00 C ATOM 150 CD LYS A 10 -15.950 12.414 8.696 1.00 0.00 C ATOM 151 CE LYS A 10 -16.062 13.834 8.115 1.00 0.00 C ATOM 152 NZ LYS A 10 -17.472 14.302 8.057 1.00 0.00 N ATOM 0 H LYS A 10 -13.521 13.354 5.471 1.00 0.00 H new ATOM 0 HA LYS A 10 -11.989 12.068 7.732 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -14.725 11.639 6.532 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.879 10.317 7.311 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -14.420 11.057 9.379 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -13.837 12.674 9.036 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -16.589 11.739 8.126 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -16.319 12.413 9.721 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -15.476 14.522 8.724 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -15.633 13.851 7.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -17.491 15.325 7.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -17.972 13.803 7.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -17.941 14.105 8.964 1.00 0.00 H new ATOM 166 N MET A 11 -10.500 11.214 5.832 1.00 0.00 N ATOM 167 CA MET A 11 -9.571 10.478 4.923 1.00 0.00 C ATOM 168 C MET A 11 -8.152 10.451 5.581 1.00 0.00 C ATOM 169 O MET A 11 -7.640 11.496 6.000 1.00 0.00 O ATOM 170 CB MET A 11 -9.545 11.184 3.534 1.00 0.00 C ATOM 171 CG MET A 11 -8.619 10.586 2.453 1.00 0.00 C ATOM 172 SD MET A 11 -6.916 11.145 2.695 1.00 0.00 S ATOM 173 CE MET A 11 -6.908 12.682 1.753 1.00 0.00 C ATOM 0 H MET A 11 -10.011 11.802 6.507 1.00 0.00 H new ATOM 0 HA MET A 11 -9.905 9.452 4.771 1.00 0.00 H new ATOM 0 HB2 MET A 11 -10.561 11.192 3.141 1.00 0.00 H new ATOM 0 HB3 MET A 11 -9.255 12.223 3.689 1.00 0.00 H new ATOM 0 HG2 MET A 11 -8.660 9.497 2.493 1.00 0.00 H new ATOM 0 HG3 MET A 11 -8.968 10.882 1.463 1.00 0.00 H new ATOM 0 HE1 MET A 11 -5.920 13.139 1.811 1.00 0.00 H new ATOM 0 HE2 MET A 11 -7.149 12.471 0.711 1.00 0.00 H new ATOM 0 HE3 MET A 11 -7.650 13.366 2.166 1.00 0.00 H new ATOM 183 N GLN A 12 -7.509 9.271 5.671 1.00 0.00 N ATOM 184 CA GLN A 12 -6.130 9.160 6.234 1.00 0.00 C ATOM 185 C GLN A 12 -5.042 9.469 5.152 1.00 0.00 C ATOM 186 O GLN A 12 -5.121 8.995 4.013 1.00 0.00 O ATOM 187 CB GLN A 12 -5.884 7.727 6.777 1.00 0.00 C ATOM 188 CG GLN A 12 -6.551 7.392 8.132 1.00 0.00 C ATOM 189 CD GLN A 12 -6.121 6.032 8.694 1.00 0.00 C ATOM 190 OE1 GLN A 12 -6.783 5.014 8.519 1.00 0.00 O ATOM 191 NE2 GLN A 12 -5.001 5.967 9.379 1.00 0.00 N ATOM 0 H GLN A 12 -7.909 8.383 5.367 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.052 9.890 7.039 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -6.238 7.012 6.034 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -4.809 7.577 6.877 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -6.305 8.171 8.854 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -7.634 7.402 8.009 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -4.445 6.809 9.529 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -4.688 5.075 9.761 1.00 0.00 H new ATOM 200 N ALA A 13 -4.056 10.300 5.529 1.00 0.00 N ATOM 201 CA ALA A 13 -2.878 10.619 4.686 1.00 0.00 C ATOM 202 C ALA A 13 -1.718 9.742 5.225 1.00 0.00 C ATOM 203 O ALA A 13 -1.221 9.981 6.327 1.00 0.00 O ATOM 204 CB ALA A 13 -2.598 12.129 4.767 1.00 0.00 C ATOM 0 H ALA A 13 -4.048 10.775 6.432 1.00 0.00 H new ATOM 0 HA ALA A 13 -3.026 10.399 3.629 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -1.733 12.372 4.150 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.467 12.680 4.407 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -2.395 12.406 5.801 1.00 0.00 H new ATOM 210 N PHE A 14 -1.283 8.732 4.456 1.00 0.00 N ATOM 211 CA PHE A 14 -0.365 7.686 4.983 1.00 0.00 C ATOM 212 C PHE A 14 0.807 7.273 4.039 1.00 0.00 C ATOM 213 O PHE A 14 0.666 7.281 2.808 1.00 0.00 O ATOM 214 CB PHE A 14 -1.337 6.500 5.249 1.00 0.00 C ATOM 215 CG PHE A 14 -0.961 5.557 6.378 1.00 0.00 C ATOM 216 CD1 PHE A 14 -0.108 4.481 6.140 1.00 0.00 C ATOM 217 CD2 PHE A 14 -1.503 5.749 7.652 1.00 0.00 C ATOM 218 CE1 PHE A 14 0.238 3.630 7.180 1.00 0.00 C ATOM 219 CE2 PHE A 14 -1.172 4.882 8.689 1.00 0.00 C ATOM 220 CZ PHE A 14 -0.294 3.828 8.454 1.00 0.00 C ATOM 0 H PHE A 14 -1.543 8.609 3.477 1.00 0.00 H new ATOM 0 HA PHE A 14 0.179 8.045 5.857 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.325 6.909 5.461 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -1.423 5.917 4.332 1.00 0.00 H new ATOM 0 HD1 PHE A 14 0.283 4.310 5.148 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.180 6.571 7.832 1.00 0.00 H new ATOM 0 HE1 PHE A 14 0.921 2.812 7.003 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -1.595 5.026 9.672 1.00 0.00 H new ATOM 0 HZ PHE A 14 -0.024 3.162 9.260 1.00 0.00 H new ATOM 230 N ARG A 15 1.945 6.864 4.649 1.00 0.00 N ATOM 231 CA ARG A 15 3.152 6.384 3.919 1.00 0.00 C ATOM 232 C ARG A 15 3.781 5.104 4.585 1.00 0.00 C ATOM 233 O ARG A 15 3.702 4.863 5.801 1.00 0.00 O ATOM 234 CB ARG A 15 4.189 7.552 3.800 1.00 0.00 C ATOM 235 CG ARG A 15 5.169 7.904 4.950 1.00 0.00 C ATOM 236 CD ARG A 15 4.474 8.485 6.189 1.00 0.00 C ATOM 237 NE ARG A 15 5.433 9.138 7.115 1.00 0.00 N ATOM 238 CZ ARG A 15 5.818 10.411 7.068 1.00 0.00 C ATOM 239 NH1 ARG A 15 5.499 11.271 6.128 1.00 0.00 N ATOM 240 NH2 ARG A 15 6.535 10.854 8.050 1.00 0.00 N ATOM 0 H ARG A 15 2.056 6.856 5.663 1.00 0.00 H new ATOM 0 HA ARG A 15 2.851 6.079 2.917 1.00 0.00 H new ATOM 0 HB2 ARG A 15 4.799 7.342 2.921 1.00 0.00 H new ATOM 0 HB3 ARG A 15 3.620 8.456 3.585 1.00 0.00 H new ATOM 0 HG2 ARG A 15 5.717 7.007 5.238 1.00 0.00 H new ATOM 0 HG3 ARG A 15 5.903 8.622 4.584 1.00 0.00 H new ATOM 0 HD2 ARG A 15 3.723 9.210 5.876 1.00 0.00 H new ATOM 0 HD3 ARG A 15 3.948 7.689 6.715 1.00 0.00 H new ATOM 0 HE ARG A 15 5.833 8.559 7.854 1.00 0.00 H new ATOM 0 HH11 ARG A 15 4.908 10.980 5.350 1.00 0.00 H new ATOM 0 HH12 ARG A 15 5.843 12.230 6.176 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.784 10.233 8.820 1.00 0.00 H new ATOM 0 HH22 ARG A 15 6.851 11.824 8.054 1.00 0.00 H new ATOM 254 N ILE A 16 4.452 4.300 3.739 1.00 0.00 N ATOM 255 CA ILE A 16 5.163 3.052 4.154 1.00 0.00 C ATOM 256 C ILE A 16 6.692 3.259 3.859 1.00 0.00 C ATOM 257 O ILE A 16 7.138 3.636 2.765 1.00 0.00 O ATOM 258 CB ILE A 16 4.603 1.738 3.485 1.00 0.00 C ATOM 259 CG1 ILE A 16 4.242 1.805 1.963 1.00 0.00 C ATOM 260 CG2 ILE A 16 3.388 1.238 4.306 1.00 0.00 C ATOM 261 CD1 ILE A 16 2.929 2.472 1.494 1.00 0.00 C ATOM 0 H ILE A 16 4.523 4.490 2.739 1.00 0.00 H new ATOM 0 HA ILE A 16 4.992 2.892 5.219 1.00 0.00 H new ATOM 0 HB ILE A 16 5.438 1.038 3.508 1.00 0.00 H new ATOM 0 HG12 ILE A 16 5.061 2.320 1.461 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.233 0.781 1.590 1.00 0.00 H new ATOM 0 HG21 ILE A 16 2.992 0.329 3.853 1.00 0.00 H new ATOM 0 HG22 ILE A 16 3.702 1.027 5.328 1.00 0.00 H new ATOM 0 HG23 ILE A 16 2.614 2.006 4.315 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.861 2.418 0.407 1.00 0.00 H new ATOM 0 HD12 ILE A 16 2.079 1.953 1.937 1.00 0.00 H new ATOM 0 HD13 ILE A 16 2.920 3.516 1.806 1.00 0.00 H new ATOM 273 N TRP A 17 7.496 3.038 4.910 1.00 0.00 N ATOM 274 CA TRP A 17 8.970 3.274 4.915 1.00 0.00 C ATOM 275 C TRP A 17 9.695 2.321 5.940 1.00 0.00 C ATOM 276 O TRP A 17 9.072 1.351 6.384 1.00 0.00 O ATOM 277 CB TRP A 17 9.119 4.813 5.176 1.00 0.00 C ATOM 278 CG TRP A 17 8.751 5.466 6.525 1.00 0.00 C ATOM 279 CD1 TRP A 17 7.532 5.370 7.241 1.00 0.00 C ATOM 280 CD2 TRP A 17 9.496 6.420 7.201 1.00 0.00 C ATOM 281 NE1 TRP A 17 7.521 6.215 8.367 1.00 0.00 N ATOM 282 CE2 TRP A 17 8.742 6.861 8.316 1.00 0.00 C ATOM 283 CE3 TRP A 17 10.760 7.005 6.913 1.00 0.00 C ATOM 284 CZ2 TRP A 17 9.249 7.875 9.161 1.00 0.00 C ATOM 285 CZ3 TRP A 17 11.240 8.002 7.763 1.00 0.00 C ATOM 286 CH2 TRP A 17 10.495 8.432 8.869 1.00 0.00 C ATOM 0 H TRP A 17 7.146 2.684 5.801 1.00 0.00 H new ATOM 0 HA TRP A 17 9.468 3.022 3.979 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.163 5.062 4.984 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.525 5.317 4.414 1.00 0.00 H new ATOM 0 HD1 TRP A 17 6.712 4.727 6.958 1.00 0.00 H new ATOM 0 HE1 TRP A 17 6.782 6.325 9.061 1.00 0.00 H new ATOM 0 HE3 TRP A 17 11.335 6.685 6.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 8.683 8.212 10.016 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 12.203 8.450 7.565 1.00 0.00 H new ATOM 0 HH2 TRP A 17 10.892 9.208 9.507 1.00 0.00 H new ATOM 297 N ASP A 18 11.003 2.458 6.287 1.00 0.00 N ATOM 298 CA ASP A 18 11.589 1.632 7.393 1.00 0.00 C ATOM 299 C ASP A 18 12.766 2.426 8.063 1.00 0.00 C ATOM 300 O ASP A 18 13.494 3.238 7.460 1.00 0.00 O ATOM 301 CB ASP A 18 11.902 0.147 6.971 1.00 0.00 C ATOM 302 CG ASP A 18 13.280 -0.415 6.608 1.00 0.00 C ATOM 303 OD1 ASP A 18 14.322 0.150 6.985 1.00 0.00 O ATOM 304 OD2 ASP A 18 13.329 -1.484 5.959 1.00 0.00 O ATOM 0 H ASP A 18 11.655 3.104 5.841 1.00 0.00 H new ATOM 0 HA ASP A 18 10.840 1.479 8.170 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.537 -0.474 7.789 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.266 -0.054 6.109 1.00 0.00 H new ATOM 309 N VAL A 19 12.888 2.143 9.377 1.00 0.00 N ATOM 310 CA VAL A 19 13.883 2.761 10.311 1.00 0.00 C ATOM 311 C VAL A 19 15.390 2.505 9.927 1.00 0.00 C ATOM 312 O VAL A 19 16.242 3.279 10.373 1.00 0.00 O ATOM 313 CB VAL A 19 13.526 2.242 11.762 1.00 0.00 C ATOM 314 CG1 VAL A 19 14.478 2.726 12.885 1.00 0.00 C ATOM 315 CG2 VAL A 19 12.102 2.626 12.253 1.00 0.00 C ATOM 0 H VAL A 19 12.287 1.462 9.841 1.00 0.00 H new ATOM 0 HA VAL A 19 13.803 3.846 10.251 1.00 0.00 H new ATOM 0 HB VAL A 19 13.618 1.166 11.613 1.00 0.00 H new ATOM 0 HG11 VAL A 19 14.150 2.317 13.841 1.00 0.00 H new ATOM 0 HG12 VAL A 19 15.492 2.387 12.674 1.00 0.00 H new ATOM 0 HG13 VAL A 19 14.462 3.815 12.931 1.00 0.00 H new ATOM 0 HG21 VAL A 19 11.944 2.229 13.256 1.00 0.00 H new ATOM 0 HG22 VAL A 19 12.004 3.711 12.272 1.00 0.00 H new ATOM 0 HG23 VAL A 19 11.358 2.207 11.575 1.00 0.00 H new ATOM 325 N ASN A 20 15.755 1.479 9.128 1.00 0.00 N ATOM 326 CA ASN A 20 17.159 1.274 8.659 1.00 0.00 C ATOM 327 C ASN A 20 17.521 2.135 7.383 1.00 0.00 C ATOM 328 O ASN A 20 18.377 1.728 6.593 1.00 0.00 O ATOM 329 CB ASN A 20 17.344 -0.253 8.399 1.00 0.00 C ATOM 330 CG ASN A 20 17.294 -1.183 9.616 1.00 0.00 C ATOM 331 OD1 ASN A 20 16.306 -1.857 9.883 1.00 0.00 O ATOM 332 ND2 ASN A 20 18.358 -1.277 10.377 1.00 0.00 N ATOM 0 H ASN A 20 15.101 0.774 8.789 1.00 0.00 H new ATOM 0 HA ASN A 20 17.849 1.620 9.428 1.00 0.00 H new ATOM 0 HB2 ASN A 20 16.572 -0.572 7.698 1.00 0.00 H new ATOM 0 HB3 ASN A 20 18.304 -0.397 7.903 1.00 0.00 H new ATOM 0 HD21 ASN A 20 18.357 -1.906 11.180 1.00 0.00 H new ATOM 0 HD22 ASN A 20 19.187 -0.721 10.166 1.00 0.00 H new ATOM 339 N GLN A 21 16.971 3.371 7.263 1.00 0.00 N ATOM 340 CA GLN A 21 17.199 4.349 6.152 1.00 0.00 C ATOM 341 C GLN A 21 16.466 3.878 4.857 1.00 0.00 C ATOM 342 O GLN A 21 17.087 3.562 3.836 1.00 0.00 O ATOM 343 CB GLN A 21 18.716 4.656 5.932 1.00 0.00 C ATOM 344 CG GLN A 21 19.405 5.391 7.109 1.00 0.00 C ATOM 345 CD GLN A 21 20.834 5.841 6.803 1.00 0.00 C ATOM 346 OE1 GLN A 21 21.075 6.935 6.305 1.00 0.00 O ATOM 347 NE2 GLN A 21 21.822 5.024 7.081 1.00 0.00 N ATOM 0 H GLN A 21 16.327 3.735 7.966 1.00 0.00 H new ATOM 0 HA GLN A 21 16.760 5.304 6.440 1.00 0.00 H new ATOM 0 HB2 GLN A 21 19.240 3.718 5.751 1.00 0.00 H new ATOM 0 HB3 GLN A 21 18.824 5.260 5.031 1.00 0.00 H new ATOM 0 HG2 GLN A 21 18.809 6.263 7.379 1.00 0.00 H new ATOM 0 HG3 GLN A 21 19.419 4.733 7.978 1.00 0.00 H new ATOM 0 HE21 GLN A 21 21.629 4.112 7.495 1.00 0.00 H new ATOM 0 HE22 GLN A 21 22.784 5.301 6.883 1.00 0.00 H new ATOM 356 N LYS A 22 15.117 3.896 4.889 1.00 0.00 N ATOM 357 CA LYS A 22 14.283 3.452 3.770 1.00 0.00 C ATOM 358 C LYS A 22 12.939 4.250 3.720 1.00 0.00 C ATOM 359 O LYS A 22 12.395 4.746 4.706 1.00 0.00 O ATOM 360 CB LYS A 22 13.968 1.934 4.009 1.00 0.00 C ATOM 361 CG LYS A 22 15.080 0.897 3.709 1.00 0.00 C ATOM 362 CD LYS A 22 14.497 -0.428 3.145 1.00 0.00 C ATOM 363 CE LYS A 22 15.418 -1.655 3.223 1.00 0.00 C ATOM 364 NZ LYS A 22 15.540 -2.080 4.644 1.00 0.00 N ATOM 0 H LYS A 22 14.582 4.220 5.695 1.00 0.00 H new ATOM 0 HA LYS A 22 14.806 3.616 2.828 1.00 0.00 H new ATOM 0 HB2 LYS A 22 13.675 1.815 5.052 1.00 0.00 H new ATOM 0 HB3 LYS A 22 13.100 1.675 3.403 1.00 0.00 H new ATOM 0 HG2 LYS A 22 15.785 1.318 2.992 1.00 0.00 H new ATOM 0 HG3 LYS A 22 15.639 0.689 4.622 1.00 0.00 H new ATOM 0 HD2 LYS A 22 13.576 -0.655 3.682 1.00 0.00 H new ATOM 0 HD3 LYS A 22 14.226 -0.268 2.102 1.00 0.00 H new ATOM 0 HE2 LYS A 22 15.014 -2.468 2.620 1.00 0.00 H new ATOM 0 HE3 LYS A 22 16.400 -1.415 2.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 16.019 -3.002 4.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 16.094 -1.375 5.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 14.592 -2.160 5.065 1.00 0.00 H new ATOM 378 N THR A 23 12.419 4.237 2.502 1.00 0.00 N ATOM 379 CA THR A 23 11.157 4.857 2.017 1.00 0.00 C ATOM 380 C THR A 23 10.697 4.019 0.770 1.00 0.00 C ATOM 381 O THR A 23 11.514 3.656 -0.085 1.00 0.00 O ATOM 382 CB THR A 23 11.344 6.359 1.630 1.00 0.00 C ATOM 383 OG1 THR A 23 12.504 6.551 0.824 1.00 0.00 O ATOM 384 CG2 THR A 23 11.512 7.295 2.832 1.00 0.00 C ATOM 0 H THR A 23 12.900 3.752 1.745 1.00 0.00 H new ATOM 0 HA THR A 23 10.409 4.845 2.809 1.00 0.00 H new ATOM 0 HB THR A 23 10.426 6.606 1.097 1.00 0.00 H new ATOM 0 HG1 THR A 23 12.920 5.684 0.638 1.00 0.00 H new ATOM 0 HG21 THR A 23 11.636 8.319 2.481 1.00 0.00 H new ATOM 0 HG22 THR A 23 10.628 7.234 3.467 1.00 0.00 H new ATOM 0 HG23 THR A 23 12.391 6.998 3.404 1.00 0.00 H new ATOM 392 N PHE A 24 9.405 3.671 0.632 1.00 0.00 N ATOM 393 CA PHE A 24 8.929 2.876 -0.549 1.00 0.00 C ATOM 394 C PHE A 24 8.556 3.850 -1.723 1.00 0.00 C ATOM 395 O PHE A 24 7.840 4.829 -1.488 1.00 0.00 O ATOM 396 CB PHE A 24 7.714 2.005 -0.120 1.00 0.00 C ATOM 397 CG PHE A 24 7.881 0.802 0.853 1.00 0.00 C ATOM 398 CD1 PHE A 24 8.863 0.721 1.855 1.00 0.00 C ATOM 399 CD2 PHE A 24 6.916 -0.212 0.782 1.00 0.00 C ATOM 400 CE1 PHE A 24 8.868 -0.332 2.765 1.00 0.00 C ATOM 401 CE2 PHE A 24 6.920 -1.264 1.694 1.00 0.00 C ATOM 402 CZ PHE A 24 7.896 -1.322 2.682 1.00 0.00 C ATOM 0 H PHE A 24 8.674 3.914 1.300 1.00 0.00 H new ATOM 0 HA PHE A 24 9.718 2.213 -0.903 1.00 0.00 H new ATOM 0 HB2 PHE A 24 6.985 2.678 0.330 1.00 0.00 H new ATOM 0 HB3 PHE A 24 7.266 1.614 -1.033 1.00 0.00 H new ATOM 0 HD1 PHE A 24 9.623 1.485 1.920 1.00 0.00 H new ATOM 0 HD2 PHE A 24 6.161 -0.177 0.011 1.00 0.00 H new ATOM 0 HE1 PHE A 24 9.625 -0.380 3.534 1.00 0.00 H new ATOM 0 HE2 PHE A 24 6.165 -2.034 1.634 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.899 -2.139 3.388 1.00 0.00 H new ATOM 412 N TYR A 25 9.028 3.613 -2.972 1.00 0.00 N ATOM 413 CA TYR A 25 8.727 4.526 -4.127 1.00 0.00 C ATOM 414 C TYR A 25 8.957 3.852 -5.529 1.00 0.00 C ATOM 415 O TYR A 25 9.980 3.203 -5.766 1.00 0.00 O ATOM 416 CB TYR A 25 9.544 5.855 -3.989 1.00 0.00 C ATOM 417 CG TYR A 25 11.071 5.834 -3.771 1.00 0.00 C ATOM 418 CD1 TYR A 25 11.949 5.506 -4.810 1.00 0.00 C ATOM 419 CD2 TYR A 25 11.593 6.239 -2.537 1.00 0.00 C ATOM 420 CE1 TYR A 25 13.326 5.568 -4.611 1.00 0.00 C ATOM 421 CE2 TYR A 25 12.970 6.336 -2.354 1.00 0.00 C ATOM 422 CZ TYR A 25 13.830 5.993 -3.388 1.00 0.00 C ATOM 423 OH TYR A 25 15.171 6.181 -3.239 1.00 0.00 O ATOM 0 H TYR A 25 9.611 2.812 -3.214 1.00 0.00 H new ATOM 0 HA TYR A 25 7.662 4.756 -4.084 1.00 0.00 H new ATOM 0 HB2 TYR A 25 9.359 6.438 -4.891 1.00 0.00 H new ATOM 0 HB3 TYR A 25 9.111 6.410 -3.157 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.557 5.204 -5.770 1.00 0.00 H new ATOM 0 HD2 TYR A 25 10.925 6.477 -1.723 1.00 0.00 H new ATOM 0 HE1 TYR A 25 14.001 5.286 -5.406 1.00 0.00 H new ATOM 0 HE2 TYR A 25 13.368 6.677 -1.410 1.00 0.00 H new ATOM 0 HH TYR A 25 15.331 6.982 -2.697 1.00 0.00 H new ATOM 433 N LEU A 26 8.058 4.101 -6.511 1.00 0.00 N ATOM 434 CA LEU A 26 8.140 3.477 -7.864 1.00 0.00 C ATOM 435 C LEU A 26 8.969 4.238 -8.951 1.00 0.00 C ATOM 436 O LEU A 26 9.343 5.406 -8.830 1.00 0.00 O ATOM 437 CB LEU A 26 6.675 3.182 -8.356 1.00 0.00 C ATOM 438 CG LEU A 26 5.736 4.197 -9.081 1.00 0.00 C ATOM 439 CD1 LEU A 26 5.140 5.266 -8.158 1.00 0.00 C ATOM 440 CD2 LEU A 26 6.235 4.873 -10.367 1.00 0.00 C ATOM 0 H LEU A 26 7.264 4.731 -6.396 1.00 0.00 H new ATOM 0 HA LEU A 26 8.721 2.564 -7.736 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.754 2.324 -9.023 1.00 0.00 H new ATOM 0 HB3 LEU A 26 6.128 2.851 -7.474 1.00 0.00 H new ATOM 0 HG LEU A 26 4.966 3.499 -9.410 1.00 0.00 H new ATOM 0 HD11 LEU A 26 4.500 5.931 -8.738 1.00 0.00 H new ATOM 0 HD12 LEU A 26 4.551 4.785 -7.377 1.00 0.00 H new ATOM 0 HD13 LEU A 26 5.945 5.843 -7.702 1.00 0.00 H new ATOM 0 HD21 LEU A 26 5.467 5.547 -10.745 1.00 0.00 H new ATOM 0 HD22 LEU A 26 7.141 5.439 -10.152 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.452 4.113 -11.117 1.00 0.00 H new ATOM 452 N ARG A 27 9.244 3.502 -10.047 1.00 0.00 N ATOM 453 CA ARG A 27 9.919 4.019 -11.270 1.00 0.00 C ATOM 454 C ARG A 27 9.312 3.193 -12.451 1.00 0.00 C ATOM 455 O ARG A 27 9.608 2.005 -12.619 1.00 0.00 O ATOM 456 CB ARG A 27 11.471 3.914 -11.168 1.00 0.00 C ATOM 457 CG ARG A 27 12.095 5.119 -10.423 1.00 0.00 C ATOM 458 CD ARG A 27 13.632 5.156 -10.399 1.00 0.00 C ATOM 459 NE ARG A 27 14.068 6.465 -9.828 1.00 0.00 N ATOM 460 CZ ARG A 27 14.333 7.572 -10.525 1.00 0.00 C ATOM 461 NH1 ARG A 27 14.307 7.636 -11.832 1.00 0.00 N ATOM 462 NH2 ARG A 27 14.632 8.650 -9.862 1.00 0.00 N ATOM 0 H ARG A 27 9.002 2.514 -10.115 1.00 0.00 H new ATOM 0 HA ARG A 27 9.745 5.085 -11.418 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.737 2.992 -10.650 1.00 0.00 H new ATOM 0 HB3 ARG A 27 11.895 3.850 -12.170 1.00 0.00 H new ATOM 0 HG2 ARG A 27 11.734 6.037 -10.886 1.00 0.00 H new ATOM 0 HG3 ARG A 27 11.732 5.116 -9.395 1.00 0.00 H new ATOM 0 HD2 ARG A 27 14.021 4.333 -9.799 1.00 0.00 H new ATOM 0 HD3 ARG A 27 14.029 5.032 -11.406 1.00 0.00 H new ATOM 0 HE ARG A 27 14.173 6.518 -8.815 1.00 0.00 H new ATOM 0 HH11 ARG A 27 14.074 6.807 -12.379 1.00 0.00 H new ATOM 0 HH12 ARG A 27 14.520 8.515 -12.304 1.00 0.00 H new ATOM 0 HH21 ARG A 27 14.658 8.631 -8.843 1.00 0.00 H new ATOM 0 HH22 ARG A 27 14.840 9.515 -10.361 1.00 0.00 H new ATOM 476 N ASN A 28 8.414 3.828 -13.246 1.00 0.00 N ATOM 477 CA ASN A 28 7.629 3.174 -14.352 1.00 0.00 C ATOM 478 C ASN A 28 6.769 1.963 -13.812 1.00 0.00 C ATOM 479 O ASN A 28 6.978 0.805 -14.181 1.00 0.00 O ATOM 480 CB ASN A 28 8.608 2.820 -15.516 1.00 0.00 C ATOM 481 CG ASN A 28 7.935 2.464 -16.844 1.00 0.00 C ATOM 482 OD1 ASN A 28 7.731 1.306 -17.183 1.00 0.00 O ATOM 483 ND2 ASN A 28 7.575 3.436 -17.648 1.00 0.00 N ATOM 0 H ASN A 28 8.204 4.821 -13.145 1.00 0.00 H new ATOM 0 HA ASN A 28 6.886 3.861 -14.759 1.00 0.00 H new ATOM 0 HB2 ASN A 28 9.275 3.667 -15.680 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.230 1.980 -15.205 1.00 0.00 H new ATOM 0 HD21 ASN A 28 7.132 3.221 -18.541 1.00 0.00 H new ATOM 0 HD22 ASN A 28 7.738 4.407 -17.380 1.00 0.00 H new ATOM 490 N ASN A 29 5.818 2.252 -12.892 1.00 0.00 N ATOM 491 CA ASN A 29 4.956 1.248 -12.170 1.00 0.00 C ATOM 492 C ASN A 29 5.707 0.187 -11.258 1.00 0.00 C ATOM 493 O ASN A 29 5.043 -0.491 -10.469 1.00 0.00 O ATOM 494 CB ASN A 29 4.000 0.551 -13.193 1.00 0.00 C ATOM 495 CG ASN A 29 2.640 0.134 -12.606 1.00 0.00 C ATOM 496 OD1 ASN A 29 2.445 -0.969 -12.107 1.00 0.00 O ATOM 497 ND2 ASN A 29 1.659 1.007 -12.636 1.00 0.00 N ATOM 0 H ASN A 29 5.613 3.212 -12.614 1.00 0.00 H new ATOM 0 HA ASN A 29 4.391 1.831 -11.442 1.00 0.00 H new ATOM 0 HB2 ASN A 29 3.829 1.227 -14.031 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.497 -0.333 -13.592 1.00 0.00 H new ATOM 0 HD21 ASN A 29 0.748 0.764 -12.247 1.00 0.00 H new ATOM 0 HD22 ASN A 29 1.808 1.928 -13.048 1.00 0.00 H new ATOM 504 N GLN A 30 7.048 0.051 -11.303 1.00 0.00 N ATOM 505 CA GLN A 30 7.813 -0.939 -10.497 1.00 0.00 C ATOM 506 C GLN A 30 8.219 -0.265 -9.155 1.00 0.00 C ATOM 507 O GLN A 30 8.999 0.689 -9.118 1.00 0.00 O ATOM 508 CB GLN A 30 9.079 -1.393 -11.255 1.00 0.00 C ATOM 509 CG GLN A 30 8.870 -2.036 -12.654 1.00 0.00 C ATOM 510 CD GLN A 30 10.142 -2.115 -13.500 1.00 0.00 C ATOM 511 OE1 GLN A 30 10.835 -3.125 -13.548 1.00 0.00 O ATOM 512 NE2 GLN A 30 10.485 -1.056 -14.196 1.00 0.00 N ATOM 0 H GLN A 30 7.640 0.626 -11.902 1.00 0.00 H new ATOM 0 HA GLN A 30 7.194 -1.817 -10.312 1.00 0.00 H new ATOM 0 HB2 GLN A 30 9.731 -0.528 -11.374 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.610 -2.110 -10.629 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.470 -3.041 -12.524 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.120 -1.462 -13.198 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.911 -0.214 -14.159 1.00 0.00 H new ATOM 0 HE22 GLN A 30 11.325 -1.076 -14.774 1.00 0.00 H new ATOM 521 N LEU A 31 7.671 -0.798 -8.071 1.00 0.00 N ATOM 522 CA LEU A 31 7.820 -0.240 -6.696 1.00 0.00 C ATOM 523 C LEU A 31 9.186 -0.629 -6.035 1.00 0.00 C ATOM 524 O LEU A 31 9.351 -1.734 -5.496 1.00 0.00 O ATOM 525 CB LEU A 31 6.599 -0.746 -5.884 1.00 0.00 C ATOM 526 CG LEU A 31 5.190 -0.230 -6.303 1.00 0.00 C ATOM 527 CD1 LEU A 31 4.141 -1.344 -6.186 1.00 0.00 C ATOM 528 CD2 LEU A 31 4.758 0.972 -5.447 1.00 0.00 C ATOM 0 H LEU A 31 7.099 -1.642 -8.102 1.00 0.00 H new ATOM 0 HA LEU A 31 7.837 0.850 -6.723 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.588 -1.835 -5.938 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.757 -0.480 -4.839 1.00 0.00 H new ATOM 0 HG LEU A 31 5.259 0.088 -7.343 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.166 -0.958 -6.484 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.417 -2.174 -6.836 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.093 -1.692 -5.154 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.771 1.309 -5.764 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.721 0.677 -4.398 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.475 1.783 -5.571 1.00 0.00 H new ATOM 540 N VAL A 32 10.167 0.296 -6.094 1.00 0.00 N ATOM 541 CA VAL A 32 11.542 0.079 -5.546 1.00 0.00 C ATOM 542 C VAL A 32 11.539 0.339 -3.995 1.00 0.00 C ATOM 543 O VAL A 32 10.646 0.993 -3.433 1.00 0.00 O ATOM 544 CB VAL A 32 12.640 0.957 -6.284 1.00 0.00 C ATOM 545 CG1 VAL A 32 13.913 0.117 -6.480 1.00 0.00 C ATOM 546 CG2 VAL A 32 12.307 1.550 -7.681 1.00 0.00 C ATOM 0 H VAL A 32 10.039 1.214 -6.519 1.00 0.00 H new ATOM 0 HA VAL A 32 11.818 -0.959 -5.732 1.00 0.00 H new ATOM 0 HB VAL A 32 12.733 1.812 -5.615 1.00 0.00 H new ATOM 0 HG11 VAL A 32 14.670 0.716 -6.987 1.00 0.00 H new ATOM 0 HG12 VAL A 32 14.292 -0.201 -5.509 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.681 -0.760 -7.084 1.00 0.00 H new ATOM 0 HG21 VAL A 32 13.160 2.122 -8.046 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.088 0.740 -8.377 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.439 2.204 -7.601 1.00 0.00 H new ATOM 556 N ALA A 33 12.535 -0.220 -3.286 1.00 0.00 N ATOM 557 CA ALA A 33 12.596 -0.140 -1.817 1.00 0.00 C ATOM 558 C ALA A 33 13.714 0.752 -1.291 1.00 0.00 C ATOM 559 O ALA A 33 14.900 0.640 -1.630 1.00 0.00 O ATOM 560 CB ALA A 33 12.944 -1.512 -1.206 1.00 0.00 C ATOM 0 H ALA A 33 13.309 -0.733 -3.708 1.00 0.00 H new ATOM 0 HA ALA A 33 11.613 0.244 -1.543 1.00 0.00 H new ATOM 0 HB1 ALA A 33 12.983 -1.427 -0.120 1.00 0.00 H new ATOM 0 HB2 ALA A 33 12.182 -2.239 -1.486 1.00 0.00 H new ATOM 0 HB3 ALA A 33 13.914 -1.841 -1.579 1.00 0.00 H new ATOM 566 N GLY A 34 13.312 1.462 -0.251 1.00 0.00 N ATOM 567 CA GLY A 34 14.259 2.123 0.605 1.00 0.00 C ATOM 568 C GLY A 34 14.813 3.435 0.143 1.00 0.00 C ATOM 569 O GLY A 34 14.210 4.490 0.338 1.00 0.00 O ATOM 0 H GLY A 34 12.335 1.590 0.014 1.00 0.00 H new ATOM 0 HA2 GLY A 34 13.784 2.281 1.573 1.00 0.00 H new ATOM 0 HA3 GLY A 34 15.096 1.444 0.768 1.00 0.00 H new ATOM 573 N TYR A 35 16.048 3.311 -0.296 1.00 0.00 N ATOM 574 CA TYR A 35 16.820 4.498 -0.732 1.00 0.00 C ATOM 575 C TYR A 35 17.601 4.200 -2.065 1.00 0.00 C ATOM 576 O TYR A 35 18.823 4.375 -2.122 1.00 0.00 O ATOM 577 CB TYR A 35 17.750 5.004 0.435 1.00 0.00 C ATOM 578 CG TYR A 35 17.244 6.029 1.490 1.00 0.00 C ATOM 579 CD1 TYR A 35 16.001 6.681 1.442 1.00 0.00 C ATOM 580 CD2 TYR A 35 18.131 6.368 2.520 1.00 0.00 C ATOM 581 CE1 TYR A 35 15.626 7.570 2.443 1.00 0.00 C ATOM 582 CE2 TYR A 35 17.772 7.298 3.497 1.00 0.00 C ATOM 583 CZ TYR A 35 16.511 7.886 3.463 1.00 0.00 C ATOM 584 OH TYR A 35 16.152 8.806 4.412 1.00 0.00 O ATOM 0 H TYR A 35 16.548 2.425 -0.367 1.00 0.00 H new ATOM 0 HA TYR A 35 16.132 5.312 -0.960 1.00 0.00 H new ATOM 0 HB2 TYR A 35 18.079 4.121 0.983 1.00 0.00 H new ATOM 0 HB3 TYR A 35 18.635 5.439 -0.030 1.00 0.00 H new ATOM 0 HD1 TYR A 35 15.329 6.490 0.618 1.00 0.00 H new ATOM 0 HD2 TYR A 35 19.105 5.904 2.559 1.00 0.00 H new ATOM 0 HE1 TYR A 35 14.642 8.016 2.426 1.00 0.00 H new ATOM 0 HE2 TYR A 35 18.471 7.561 4.277 1.00 0.00 H new ATOM 0 HH TYR A 35 16.883 8.913 5.056 1.00 0.00 H new ATOM 594 N LEU A 36 16.912 3.825 -3.172 1.00 0.00 N ATOM 595 CA LEU A 36 17.574 3.674 -4.505 1.00 0.00 C ATOM 596 C LEU A 36 17.758 5.100 -5.149 1.00 0.00 C ATOM 597 O LEU A 36 18.381 5.992 -4.562 1.00 0.00 O ATOM 598 CB LEU A 36 16.732 2.588 -5.264 1.00 0.00 C ATOM 599 CG LEU A 36 17.289 1.905 -6.556 1.00 0.00 C ATOM 600 CD1 LEU A 36 16.765 2.498 -7.877 1.00 0.00 C ATOM 601 CD2 LEU A 36 18.820 1.755 -6.615 1.00 0.00 C ATOM 0 H LEU A 36 15.912 3.623 -3.176 1.00 0.00 H new ATOM 0 HA LEU A 36 18.598 3.301 -4.504 1.00 0.00 H new ATOM 0 HB2 LEU A 36 16.514 1.794 -4.550 1.00 0.00 H new ATOM 0 HB3 LEU A 36 15.780 3.048 -5.529 1.00 0.00 H new ATOM 0 HG LEU A 36 16.876 0.901 -6.459 1.00 0.00 H new ATOM 0 HD11 LEU A 36 17.206 1.961 -8.717 1.00 0.00 H new ATOM 0 HD12 LEU A 36 15.680 2.402 -7.914 1.00 0.00 H new ATOM 0 HD13 LEU A 36 17.038 3.552 -7.936 1.00 0.00 H new ATOM 0 HD21 LEU A 36 19.102 1.270 -7.550 1.00 0.00 H new ATOM 0 HD22 LEU A 36 19.284 2.740 -6.562 1.00 0.00 H new ATOM 0 HD23 LEU A 36 19.159 1.148 -5.775 1.00 0.00 H new ATOM 613 N GLN A 37 17.199 5.343 -6.330 1.00 0.00 N ATOM 614 CA GLN A 37 17.273 6.666 -7.019 1.00 0.00 C ATOM 615 C GLN A 37 16.061 7.559 -6.575 1.00 0.00 C ATOM 616 O GLN A 37 15.015 7.612 -7.237 1.00 0.00 O ATOM 617 CB GLN A 37 17.310 6.426 -8.552 1.00 0.00 C ATOM 618 CG GLN A 37 18.641 5.899 -9.146 1.00 0.00 C ATOM 619 CD GLN A 37 18.585 5.607 -10.655 1.00 0.00 C ATOM 620 OE1 GLN A 37 17.559 5.687 -11.328 1.00 0.00 O ATOM 621 NE2 GLN A 37 19.701 5.248 -11.239 1.00 0.00 N ATOM 0 H GLN A 37 16.677 4.640 -6.853 1.00 0.00 H new ATOM 0 HA GLN A 37 18.181 7.202 -6.742 1.00 0.00 H new ATOM 0 HB2 GLN A 37 16.522 5.717 -8.804 1.00 0.00 H new ATOM 0 HB3 GLN A 37 17.065 7.365 -9.049 1.00 0.00 H new ATOM 0 HG2 GLN A 37 19.425 6.632 -8.958 1.00 0.00 H new ATOM 0 HG3 GLN A 37 18.924 4.987 -8.621 1.00 0.00 H new ATOM 0 HE21 GLN A 37 20.561 5.177 -10.695 1.00 0.00 H new ATOM 0 HE22 GLN A 37 19.710 5.040 -12.237 1.00 0.00 H new ATOM 630 N GLY A 38 16.237 8.298 -5.467 1.00 0.00 N ATOM 631 CA GLY A 38 15.168 9.156 -4.893 1.00 0.00 C ATOM 632 C GLY A 38 15.436 9.516 -3.406 1.00 0.00 C ATOM 633 O GLY A 38 15.467 8.574 -2.607 1.00 0.00 O ATOM 0 H GLY A 38 17.112 8.323 -4.943 1.00 0.00 H new ATOM 0 HA2 GLY A 38 15.088 10.072 -5.478 1.00 0.00 H new ATOM 0 HA3 GLY A 38 14.210 8.642 -4.973 1.00 0.00 H new ATOM 637 N PRO A 39 15.579 10.798 -2.952 1.00 0.00 N ATOM 638 CA PRO A 39 15.836 11.124 -1.512 1.00 0.00 C ATOM 639 C PRO A 39 14.834 10.550 -0.452 1.00 0.00 C ATOM 640 O PRO A 39 15.276 9.944 0.523 1.00 0.00 O ATOM 641 CB PRO A 39 15.881 12.668 -1.532 1.00 0.00 C ATOM 642 CG PRO A 39 16.298 13.034 -2.957 1.00 0.00 C ATOM 643 CD PRO A 39 15.606 11.987 -3.829 1.00 0.00 C ATOM 0 HA PRO A 39 16.748 10.639 -1.165 1.00 0.00 H new ATOM 0 HB2 PRO A 39 14.909 13.094 -1.284 1.00 0.00 H new ATOM 0 HB3 PRO A 39 16.593 13.051 -0.802 1.00 0.00 H new ATOM 0 HG2 PRO A 39 15.980 14.043 -3.218 1.00 0.00 H new ATOM 0 HG3 PRO A 39 17.381 13.000 -3.077 1.00 0.00 H new ATOM 0 HD2 PRO A 39 14.603 12.300 -4.117 1.00 0.00 H new ATOM 0 HD3 PRO A 39 16.158 11.798 -4.750 1.00 0.00 H new ATOM 651 N ASN A 40 13.516 10.756 -0.626 1.00 0.00 N ATOM 652 CA ASN A 40 12.461 10.223 0.292 1.00 0.00 C ATOM 653 C ASN A 40 11.152 9.941 -0.525 1.00 0.00 C ATOM 654 O ASN A 40 10.688 8.801 -0.564 1.00 0.00 O ATOM 655 CB ASN A 40 12.188 11.202 1.482 1.00 0.00 C ATOM 656 CG ASN A 40 13.304 11.359 2.521 1.00 0.00 C ATOM 657 OD1 ASN A 40 14.066 12.320 2.508 1.00 0.00 O ATOM 658 ND2 ASN A 40 13.439 10.444 3.450 1.00 0.00 N ATOM 0 H ASN A 40 13.139 11.296 -1.405 1.00 0.00 H new ATOM 0 HA ASN A 40 12.815 9.289 0.728 1.00 0.00 H new ATOM 0 HB2 ASN A 40 11.969 12.186 1.068 1.00 0.00 H new ATOM 0 HB3 ASN A 40 11.289 10.866 1.998 1.00 0.00 H new ATOM 0 HD21 ASN A 40 14.172 10.535 4.153 1.00 0.00 H new ATOM 0 HD22 ASN A 40 12.811 9.641 3.470 1.00 0.00 H new ATOM 665 N VAL A 41 10.551 10.968 -1.160 1.00 0.00 N ATOM 666 CA VAL A 41 9.325 10.836 -2.005 1.00 0.00 C ATOM 667 C VAL A 41 9.766 11.081 -3.488 1.00 0.00 C ATOM 668 O VAL A 41 10.090 10.106 -4.169 1.00 0.00 O ATOM 669 CB VAL A 41 8.127 11.713 -1.469 1.00 0.00 C ATOM 670 CG1 VAL A 41 7.381 11.003 -0.317 1.00 0.00 C ATOM 671 CG2 VAL A 41 8.422 13.169 -1.025 1.00 0.00 C ATOM 0 H VAL A 41 10.899 11.925 -1.106 1.00 0.00 H new ATOM 0 HA VAL A 41 8.896 9.835 -1.953 1.00 0.00 H new ATOM 0 HB VAL A 41 7.520 11.812 -2.369 1.00 0.00 H new ATOM 0 HG11 VAL A 41 6.562 11.633 0.029 1.00 0.00 H new ATOM 0 HG12 VAL A 41 6.982 10.053 -0.673 1.00 0.00 H new ATOM 0 HG13 VAL A 41 8.072 10.821 0.506 1.00 0.00 H new ATOM 0 HG21 VAL A 41 7.500 13.639 -0.683 1.00 0.00 H new ATOM 0 HG22 VAL A 41 9.148 13.161 -0.212 1.00 0.00 H new ATOM 0 HG23 VAL A 41 8.825 13.732 -1.867 1.00 0.00 H new ATOM 681 N ASN A 42 9.718 12.326 -4.020 1.00 0.00 N ATOM 682 CA ASN A 42 10.082 12.707 -5.430 1.00 0.00 C ATOM 683 C ASN A 42 8.838 12.483 -6.359 1.00 0.00 C ATOM 684 O ASN A 42 8.282 13.457 -6.868 1.00 0.00 O ATOM 685 CB ASN A 42 11.397 12.018 -5.934 1.00 0.00 C ATOM 686 CG ASN A 42 12.121 12.712 -7.087 1.00 0.00 C ATOM 687 OD1 ASN A 42 13.124 13.391 -6.900 1.00 0.00 O ATOM 688 ND2 ASN A 42 11.670 12.555 -8.308 1.00 0.00 N ATOM 0 H ASN A 42 9.416 13.130 -3.470 1.00 0.00 H new ATOM 0 HA ASN A 42 10.331 13.768 -5.459 1.00 0.00 H new ATOM 0 HB2 ASN A 42 12.087 11.939 -5.094 1.00 0.00 H new ATOM 0 HB3 ASN A 42 11.155 11.001 -6.244 1.00 0.00 H new ATOM 0 HD21 ASN A 42 12.153 12.996 -9.091 1.00 0.00 H new ATOM 0 HD22 ASN A 42 10.836 11.992 -8.475 1.00 0.00 H new ATOM 695 N LEU A 43 8.417 11.228 -6.595 1.00 0.00 N ATOM 696 CA LEU A 43 7.183 10.909 -7.380 1.00 0.00 C ATOM 697 C LEU A 43 5.828 10.867 -6.574 1.00 0.00 C ATOM 698 O LEU A 43 4.768 10.752 -7.189 1.00 0.00 O ATOM 699 CB LEU A 43 7.436 9.555 -8.108 1.00 0.00 C ATOM 700 CG LEU A 43 7.902 8.235 -7.418 1.00 0.00 C ATOM 701 CD1 LEU A 43 9.419 8.171 -7.162 1.00 0.00 C ATOM 702 CD2 LEU A 43 7.115 7.864 -6.150 1.00 0.00 C ATOM 0 H LEU A 43 8.910 10.402 -6.255 1.00 0.00 H new ATOM 0 HA LEU A 43 7.028 11.738 -8.070 1.00 0.00 H new ATOM 0 HB2 LEU A 43 6.504 9.312 -8.618 1.00 0.00 H new ATOM 0 HB3 LEU A 43 8.176 9.765 -8.880 1.00 0.00 H new ATOM 0 HG LEU A 43 7.665 7.473 -8.161 1.00 0.00 H new ATOM 0 HD11 LEU A 43 9.667 7.225 -6.680 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.951 8.246 -8.110 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.714 8.996 -6.514 1.00 0.00 H new ATOM 0 HD21 LEU A 43 7.507 6.934 -5.738 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.218 8.660 -5.412 1.00 0.00 H new ATOM 0 HD23 LEU A 43 6.062 7.735 -6.400 1.00 0.00 H new ATOM 714 N GLU A 44 5.883 10.973 -5.234 1.00 0.00 N ATOM 715 CA GLU A 44 4.731 10.940 -4.277 1.00 0.00 C ATOM 716 C GLU A 44 4.069 9.520 -4.210 1.00 0.00 C ATOM 717 O GLU A 44 3.056 9.247 -4.857 1.00 0.00 O ATOM 718 CB GLU A 44 3.681 12.068 -4.562 1.00 0.00 C ATOM 719 CG GLU A 44 4.081 13.492 -4.094 1.00 0.00 C ATOM 720 CD GLU A 44 3.988 13.727 -2.592 1.00 0.00 C ATOM 721 OE1 GLU A 44 4.934 13.380 -1.857 1.00 0.00 O ATOM 722 OE2 GLU A 44 2.954 14.254 -2.125 1.00 0.00 O ATOM 0 H GLU A 44 6.774 11.091 -4.751 1.00 0.00 H new ATOM 0 HA GLU A 44 5.141 11.148 -3.289 1.00 0.00 H new ATOM 0 HB2 GLU A 44 3.489 12.098 -5.635 1.00 0.00 H new ATOM 0 HB3 GLU A 44 2.743 11.796 -4.078 1.00 0.00 H new ATOM 0 HG2 GLU A 44 5.104 13.689 -4.415 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.443 14.217 -4.600 1.00 0.00 H new ATOM 729 N GLU A 45 4.641 8.635 -3.366 1.00 0.00 N ATOM 730 CA GLU A 45 4.098 7.260 -3.093 1.00 0.00 C ATOM 731 C GLU A 45 3.072 7.167 -1.893 1.00 0.00 C ATOM 732 O GLU A 45 2.771 6.085 -1.381 1.00 0.00 O ATOM 733 CB GLU A 45 5.306 6.304 -2.888 1.00 0.00 C ATOM 734 CG GLU A 45 4.977 4.789 -3.057 1.00 0.00 C ATOM 735 CD GLU A 45 4.632 4.360 -4.466 1.00 0.00 C ATOM 736 OE1 GLU A 45 5.564 4.302 -5.289 1.00 0.00 O ATOM 737 OE2 GLU A 45 3.453 4.069 -4.757 1.00 0.00 O ATOM 0 H GLU A 45 5.495 8.841 -2.847 1.00 0.00 H new ATOM 0 HA GLU A 45 3.501 6.967 -3.957 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.089 6.573 -3.598 1.00 0.00 H new ATOM 0 HB3 GLU A 45 5.713 6.464 -1.889 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.833 4.207 -2.716 1.00 0.00 H new ATOM 0 HG3 GLU A 45 4.141 4.540 -2.403 1.00 0.00 H new ATOM 744 N LYS A 46 2.602 8.299 -1.365 1.00 0.00 N ATOM 745 CA LYS A 46 1.682 8.367 -0.200 1.00 0.00 C ATOM 746 C LYS A 46 0.364 9.171 -0.463 1.00 0.00 C ATOM 747 O LYS A 46 0.196 9.782 -1.526 1.00 0.00 O ATOM 748 CB LYS A 46 2.556 8.956 0.957 1.00 0.00 C ATOM 749 CG LYS A 46 3.384 10.263 0.829 1.00 0.00 C ATOM 750 CD LYS A 46 2.566 11.541 0.559 1.00 0.00 C ATOM 751 CE LYS A 46 3.352 12.803 0.952 1.00 0.00 C ATOM 752 NZ LYS A 46 2.648 14.006 0.446 1.00 0.00 N ATOM 0 H LYS A 46 2.848 9.218 -1.733 1.00 0.00 H new ATOM 0 HA LYS A 46 1.289 7.381 0.048 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.886 9.100 1.804 1.00 0.00 H new ATOM 0 HB3 LYS A 46 3.261 8.173 1.237 1.00 0.00 H new ATOM 0 HG2 LYS A 46 3.953 10.404 1.748 1.00 0.00 H new ATOM 0 HG3 LYS A 46 4.107 10.138 0.023 1.00 0.00 H new ATOM 0 HD2 LYS A 46 2.302 11.589 -0.497 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.632 11.503 1.120 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.453 12.858 2.036 1.00 0.00 H new ATOM 0 HE3 LYS A 46 4.360 12.759 0.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.207 14.854 0.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 2.528 13.931 -0.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 1.714 14.078 0.899 1.00 0.00 H new ATOM 766 N ILE A 47 -0.555 9.082 0.535 1.00 0.00 N ATOM 767 CA ILE A 47 -1.818 9.892 0.718 1.00 0.00 C ATOM 768 C ILE A 47 -3.055 8.983 1.104 1.00 0.00 C ATOM 769 O ILE A 47 -3.060 8.387 2.181 1.00 0.00 O ATOM 770 CB ILE A 47 -2.033 11.101 -0.306 1.00 0.00 C ATOM 771 CG1 ILE A 47 -2.923 12.215 0.332 1.00 0.00 C ATOM 772 CG2 ILE A 47 -2.625 10.707 -1.677 1.00 0.00 C ATOM 773 CD1 ILE A 47 -2.935 13.556 -0.424 1.00 0.00 C ATOM 0 H ILE A 47 -0.438 8.404 1.288 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.679 10.502 1.610 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.026 11.468 -0.504 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.946 11.846 0.401 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -2.579 12.393 1.351 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -2.731 11.597 -2.297 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -1.960 9.998 -2.171 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.602 10.247 -1.533 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -3.581 14.262 0.098 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.922 13.956 -0.471 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.310 13.400 -1.435 1.00 0.00 H new ATOM 785 N ASP A 48 -4.141 9.077 0.350 1.00 0.00 N ATOM 786 CA ASP A 48 -5.516 8.574 0.638 1.00 0.00 C ATOM 787 C ASP A 48 -5.690 7.040 0.858 1.00 0.00 C ATOM 788 O ASP A 48 -6.071 6.292 -0.045 1.00 0.00 O ATOM 789 CB ASP A 48 -6.317 9.172 -0.569 1.00 0.00 C ATOM 790 CG ASP A 48 -7.785 8.821 -0.804 1.00 0.00 C ATOM 791 OD1 ASP A 48 -8.437 8.136 0.015 1.00 0.00 O ATOM 792 OD2 ASP A 48 -8.270 9.131 -1.911 1.00 0.00 O ATOM 0 H ASP A 48 -4.101 9.541 -0.557 1.00 0.00 H new ATOM 0 HA ASP A 48 -5.872 8.890 1.618 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -6.261 10.257 -0.480 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -5.777 8.898 -1.475 1.00 0.00 H new ATOM 797 N VAL A 49 -5.506 6.571 2.098 1.00 0.00 N ATOM 798 CA VAL A 49 -5.703 5.129 2.446 1.00 0.00 C ATOM 799 C VAL A 49 -7.074 4.990 3.182 1.00 0.00 C ATOM 800 O VAL A 49 -7.386 5.753 4.106 1.00 0.00 O ATOM 801 CB VAL A 49 -4.500 4.548 3.263 1.00 0.00 C ATOM 802 CG1 VAL A 49 -3.145 4.704 2.533 1.00 0.00 C ATOM 803 CG2 VAL A 49 -4.367 5.047 4.718 1.00 0.00 C ATOM 0 H VAL A 49 -5.222 7.154 2.885 1.00 0.00 H new ATOM 0 HA VAL A 49 -5.730 4.527 1.538 1.00 0.00 H new ATOM 0 HB VAL A 49 -4.758 3.491 3.331 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.350 4.283 3.148 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.183 4.178 1.579 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.946 5.761 2.357 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -3.501 4.579 5.185 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -4.240 6.130 4.721 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -5.266 4.785 5.276 1.00 0.00 H new ATOM 813 N VAL A 50 -7.909 4.024 2.760 1.00 0.00 N ATOM 814 CA VAL A 50 -9.253 3.815 3.381 1.00 0.00 C ATOM 815 C VAL A 50 -9.323 2.336 3.910 1.00 0.00 C ATOM 816 O VAL A 50 -9.075 1.409 3.125 1.00 0.00 O ATOM 817 CB VAL A 50 -10.387 4.171 2.356 1.00 0.00 C ATOM 818 CG1 VAL A 50 -11.815 3.827 2.849 1.00 0.00 C ATOM 819 CG2 VAL A 50 -10.411 5.682 2.014 1.00 0.00 C ATOM 0 H VAL A 50 -7.692 3.377 2.002 1.00 0.00 H new ATOM 0 HA VAL A 50 -9.406 4.481 4.230 1.00 0.00 H new ATOM 0 HB VAL A 50 -10.139 3.562 1.487 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -12.540 4.103 2.084 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -11.884 2.757 3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -12.026 4.378 3.765 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -11.212 5.881 1.302 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -10.583 6.258 2.923 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -9.456 5.971 1.576 1.00 0.00 H new ATOM 829 N PRO A 51 -9.669 2.053 5.204 1.00 0.00 N ATOM 830 CA PRO A 51 -9.772 0.661 5.717 1.00 0.00 C ATOM 831 C PRO A 51 -10.992 -0.153 5.166 1.00 0.00 C ATOM 832 O PRO A 51 -11.923 0.387 4.562 1.00 0.00 O ATOM 833 CB PRO A 51 -9.820 0.896 7.242 1.00 0.00 C ATOM 834 CG PRO A 51 -10.484 2.261 7.420 1.00 0.00 C ATOM 835 CD PRO A 51 -9.978 3.074 6.231 1.00 0.00 C ATOM 0 HA PRO A 51 -8.947 0.027 5.392 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -10.390 0.113 7.743 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -8.819 0.887 7.673 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -11.571 2.180 7.415 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -10.203 2.721 8.367 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.732 3.778 5.879 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -9.095 3.657 6.493 1.00 0.00 H new ATOM 843 N ILE A 52 -10.966 -1.474 5.395 1.00 0.00 N ATOM 844 CA ILE A 52 -12.082 -2.396 5.020 1.00 0.00 C ATOM 845 C ILE A 52 -12.962 -2.627 6.315 1.00 0.00 C ATOM 846 O ILE A 52 -13.211 -1.674 7.067 1.00 0.00 O ATOM 847 CB ILE A 52 -11.389 -3.592 4.236 1.00 0.00 C ATOM 848 CG1 ILE A 52 -12.347 -4.212 3.181 1.00 0.00 C ATOM 849 CG2 ILE A 52 -10.848 -4.734 5.130 1.00 0.00 C ATOM 850 CD1 ILE A 52 -12.382 -3.414 1.864 1.00 0.00 C ATOM 0 H ILE A 52 -10.180 -1.946 5.843 1.00 0.00 H new ATOM 0 HA ILE A 52 -12.844 -2.053 4.320 1.00 0.00 H new ATOM 0 HB ILE A 52 -10.530 -3.123 3.757 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -12.036 -5.236 2.972 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -13.353 -4.263 3.596 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.394 -5.502 4.504 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -10.100 -4.336 5.816 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -11.668 -5.169 5.701 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -13.068 -3.894 1.166 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -12.720 -2.397 2.064 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.383 -3.385 1.429 1.00 0.00 H new ATOM 862 N GLU A 53 -13.498 -3.830 6.568 1.00 0.00 N ATOM 863 CA GLU A 53 -14.254 -4.130 7.825 1.00 0.00 C ATOM 864 C GLU A 53 -13.242 -4.567 8.973 1.00 0.00 C ATOM 865 O GLU A 53 -13.046 -3.711 9.841 1.00 0.00 O ATOM 866 CB GLU A 53 -15.413 -5.131 7.528 1.00 0.00 C ATOM 867 CG GLU A 53 -16.589 -4.638 6.633 1.00 0.00 C ATOM 868 CD GLU A 53 -17.463 -3.462 7.066 1.00 0.00 C ATOM 869 OE1 GLU A 53 -17.281 -2.888 8.161 1.00 0.00 O ATOM 870 OE2 GLU A 53 -18.314 -3.045 6.254 1.00 0.00 O ATOM 0 H GLU A 53 -13.430 -4.621 5.928 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.749 -3.238 8.209 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.980 -6.013 7.056 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -15.831 -5.452 8.482 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -16.166 -4.382 5.661 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -17.252 -5.489 6.478 1.00 0.00 H new ATOM 877 N PRO A 54 -12.519 -5.741 9.048 1.00 0.00 N ATOM 878 CA PRO A 54 -11.610 -6.063 10.197 1.00 0.00 C ATOM 879 C PRO A 54 -10.234 -5.289 10.272 1.00 0.00 C ATOM 880 O PRO A 54 -10.203 -4.209 10.865 1.00 0.00 O ATOM 881 CB PRO A 54 -11.509 -7.604 10.069 1.00 0.00 C ATOM 882 CG PRO A 54 -11.658 -7.897 8.574 1.00 0.00 C ATOM 883 CD PRO A 54 -12.709 -6.883 8.132 1.00 0.00 C ATOM 0 HA PRO A 54 -12.003 -5.717 11.153 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -10.554 -7.968 10.448 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -12.290 -8.098 10.646 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -10.717 -7.763 8.040 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.984 -8.921 8.393 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -12.565 -6.588 7.093 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -13.716 -7.293 8.211 1.00 0.00 H new ATOM 891 N HIS A 55 -9.098 -5.803 9.735 1.00 0.00 N ATOM 892 CA HIS A 55 -7.749 -5.151 9.902 1.00 0.00 C ATOM 893 C HIS A 55 -6.921 -5.025 8.571 1.00 0.00 C ATOM 894 O HIS A 55 -5.731 -5.357 8.504 1.00 0.00 O ATOM 895 CB HIS A 55 -6.963 -5.970 10.980 1.00 0.00 C ATOM 896 CG HIS A 55 -7.553 -6.019 12.394 1.00 0.00 C ATOM 897 ND1 HIS A 55 -8.092 -7.172 12.949 1.00 0.00 N ATOM 898 CD2 HIS A 55 -7.709 -4.925 13.263 1.00 0.00 C ATOM 899 CE1 HIS A 55 -8.542 -6.651 14.135 1.00 0.00 C ATOM 900 NE2 HIS A 55 -8.356 -5.324 14.419 1.00 0.00 N ATOM 0 H HIS A 55 -9.076 -6.661 9.184 1.00 0.00 H new ATOM 0 HA HIS A 55 -7.907 -4.120 10.218 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.865 -6.994 10.620 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.956 -5.558 11.049 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -7.373 -3.919 13.058 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -9.044 -7.289 14.847 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -8.619 -4.785 15.244 1.00 0.00 H new ATOM 908 N ALA A 56 -7.533 -4.471 7.513 1.00 0.00 N ATOM 909 CA ALA A 56 -6.877 -4.266 6.192 1.00 0.00 C ATOM 910 C ALA A 56 -7.314 -2.924 5.532 1.00 0.00 C ATOM 911 O ALA A 56 -8.293 -2.298 5.952 1.00 0.00 O ATOM 912 CB ALA A 56 -7.226 -5.486 5.314 1.00 0.00 C ATOM 0 H ALA A 56 -8.500 -4.148 7.540 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.796 -4.190 6.312 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.762 -5.374 4.334 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.855 -6.394 5.789 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.308 -5.553 5.198 1.00 0.00 H new ATOM 918 N LEU A 57 -6.593 -2.477 4.486 1.00 0.00 N ATOM 919 CA LEU A 57 -6.896 -1.181 3.808 1.00 0.00 C ATOM 920 C LEU A 57 -6.556 -1.173 2.284 1.00 0.00 C ATOM 921 O LEU A 57 -5.593 -1.799 1.835 1.00 0.00 O ATOM 922 CB LEU A 57 -6.154 -0.042 4.591 1.00 0.00 C ATOM 923 CG LEU A 57 -4.623 0.211 4.440 1.00 0.00 C ATOM 924 CD1 LEU A 57 -4.194 1.353 5.379 1.00 0.00 C ATOM 925 CD2 LEU A 57 -3.729 -1.008 4.722 1.00 0.00 C ATOM 0 H LEU A 57 -5.801 -2.982 4.087 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.973 -1.016 3.836 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -6.653 0.892 4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -6.339 -0.219 5.651 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.479 0.463 3.389 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.124 1.529 5.273 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.738 2.261 5.120 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.416 1.079 6.410 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.683 -0.730 4.590 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.888 -1.347 5.746 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -3.981 -1.812 4.030 1.00 0.00 H new ATOM 937 N PHE A 58 -7.377 -0.465 1.487 1.00 0.00 N ATOM 938 CA PHE A 58 -7.143 -0.259 0.025 1.00 0.00 C ATOM 939 C PHE A 58 -6.498 1.162 -0.130 1.00 0.00 C ATOM 940 O PHE A 58 -6.991 2.155 0.434 1.00 0.00 O ATOM 941 CB PHE A 58 -8.460 -0.487 -0.772 1.00 0.00 C ATOM 942 CG PHE A 58 -9.701 0.390 -0.499 1.00 0.00 C ATOM 943 CD1 PHE A 58 -10.588 0.067 0.534 1.00 0.00 C ATOM 944 CD2 PHE A 58 -9.999 1.463 -1.346 1.00 0.00 C ATOM 945 CE1 PHE A 58 -11.753 0.809 0.720 1.00 0.00 C ATOM 946 CE2 PHE A 58 -11.167 2.200 -1.165 1.00 0.00 C ATOM 947 CZ PHE A 58 -12.045 1.869 -0.135 1.00 0.00 C ATOM 0 H PHE A 58 -8.226 -0.014 1.828 1.00 0.00 H new ATOM 0 HA PHE A 58 -6.452 -0.985 -0.404 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -8.218 -0.383 -1.830 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -8.757 -1.524 -0.613 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -10.369 -0.762 1.191 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -9.320 1.721 -2.145 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -12.428 0.562 1.526 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -11.392 3.027 -1.822 1.00 0.00 H new ATOM 0 HZ PHE A 58 -12.954 2.436 0.001 1.00 0.00 H new ATOM 957 N LEU A 59 -5.369 1.266 -0.863 1.00 0.00 N ATOM 958 CA LEU A 59 -4.563 2.524 -0.858 1.00 0.00 C ATOM 959 C LEU A 59 -4.776 3.435 -2.120 1.00 0.00 C ATOM 960 O LEU A 59 -4.939 2.958 -3.240 1.00 0.00 O ATOM 961 CB LEU A 59 -3.083 2.073 -0.683 1.00 0.00 C ATOM 962 CG LEU A 59 -2.605 1.546 0.705 1.00 0.00 C ATOM 963 CD1 LEU A 59 -2.905 0.053 0.907 1.00 0.00 C ATOM 964 CD2 LEU A 59 -1.089 1.758 0.877 1.00 0.00 C ATOM 0 H LEU A 59 -4.996 0.522 -1.453 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.886 3.172 -0.043 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.891 1.289 -1.415 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.449 2.919 -0.948 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.160 2.117 1.449 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.551 -0.260 1.889 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.980 -0.115 0.838 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.397 -0.528 0.137 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -0.778 1.383 1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.555 1.220 0.094 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.860 2.821 0.807 1.00 0.00 H new ATOM 976 N GLY A 60 -4.731 4.765 -1.929 1.00 0.00 N ATOM 977 CA GLY A 60 -4.912 5.796 -2.995 1.00 0.00 C ATOM 978 C GLY A 60 -3.788 6.852 -2.925 1.00 0.00 C ATOM 979 O GLY A 60 -3.785 7.756 -2.084 1.00 0.00 O ATOM 0 H GLY A 60 -4.564 5.175 -1.010 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -4.909 5.318 -3.975 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -5.882 6.281 -2.879 1.00 0.00 H new ATOM 983 N ILE A 61 -2.831 6.726 -3.838 1.00 0.00 N ATOM 984 CA ILE A 61 -1.565 7.515 -3.818 1.00 0.00 C ATOM 985 C ILE A 61 -1.616 8.739 -4.805 1.00 0.00 C ATOM 986 O ILE A 61 -2.317 8.724 -5.824 1.00 0.00 O ATOM 987 CB ILE A 61 -0.456 6.414 -4.095 1.00 0.00 C ATOM 988 CG1 ILE A 61 0.037 5.750 -2.775 1.00 0.00 C ATOM 989 CG2 ILE A 61 0.813 6.950 -4.797 1.00 0.00 C ATOM 990 CD1 ILE A 61 -0.974 4.908 -1.988 1.00 0.00 C ATOM 0 H ILE A 61 -2.894 6.077 -4.622 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.355 8.027 -2.879 1.00 0.00 H new ATOM 0 HB ILE A 61 -0.962 5.705 -4.750 1.00 0.00 H new ATOM 0 HG12 ILE A 61 0.889 5.115 -3.016 1.00 0.00 H new ATOM 0 HG13 ILE A 61 0.403 6.539 -2.117 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.518 6.133 -4.948 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.542 7.378 -5.762 1.00 0.00 H new ATOM 0 HG23 ILE A 61 1.275 7.718 -4.177 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.496 4.507 -1.094 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.820 5.532 -1.699 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -1.326 4.086 -2.611 1.00 0.00 H new ATOM 1002 N HIS A 62 -0.842 9.804 -4.471 1.00 0.00 N ATOM 1003 CA HIS A 62 -0.690 11.060 -5.284 1.00 0.00 C ATOM 1004 C HIS A 62 -2.064 11.778 -5.564 1.00 0.00 C ATOM 1005 O HIS A 62 -2.736 11.535 -6.573 1.00 0.00 O ATOM 1006 CB HIS A 62 0.111 10.722 -6.581 1.00 0.00 C ATOM 1007 CG HIS A 62 0.778 11.898 -7.308 1.00 0.00 C ATOM 1008 ND1 HIS A 62 0.414 13.238 -7.206 1.00 0.00 N ATOM 1009 CD2 HIS A 62 1.903 11.760 -8.139 1.00 0.00 C ATOM 1010 CE1 HIS A 62 1.388 13.794 -7.991 1.00 0.00 C ATOM 1011 NE2 HIS A 62 2.317 12.996 -8.601 1.00 0.00 N ATOM 0 H HIS A 62 -0.291 9.823 -3.613 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.124 11.793 -4.709 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.885 9.999 -6.324 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.566 10.230 -7.280 1.00 0.00 H new ATOM 0 HD2 HIS A 62 2.377 10.821 -8.383 1.00 0.00 H new ATOM 0 HE1 HIS A 62 1.423 14.865 -8.129 1.00 0.00 H new ATOM 0 HE2 HIS A 62 3.091 13.242 -9.218 1.00 0.00 H new ATOM 1019 N GLY A 63 -2.492 12.651 -4.630 1.00 0.00 N ATOM 1020 CA GLY A 63 -3.823 13.327 -4.694 1.00 0.00 C ATOM 1021 C GLY A 63 -5.118 12.459 -4.699 1.00 0.00 C ATOM 1022 O GLY A 63 -6.180 12.983 -5.045 1.00 0.00 O ATOM 0 H GLY A 63 -1.938 12.912 -3.814 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.887 14.007 -3.844 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.836 13.941 -5.595 1.00 0.00 H new ATOM 1026 N GLY A 64 -5.047 11.172 -4.320 1.00 0.00 N ATOM 1027 CA GLY A 64 -6.191 10.221 -4.399 1.00 0.00 C ATOM 1028 C GLY A 64 -6.511 9.703 -5.823 1.00 0.00 C ATOM 1029 O GLY A 64 -7.660 9.796 -6.259 1.00 0.00 O ATOM 0 H GLY A 64 -4.196 10.751 -3.948 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -5.979 9.366 -3.756 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -7.079 10.709 -3.998 1.00 0.00 H new ATOM 1033 N LYS A 65 -5.504 9.162 -6.535 1.00 0.00 N ATOM 1034 CA LYS A 65 -5.662 8.654 -7.934 1.00 0.00 C ATOM 1035 C LYS A 65 -4.977 7.271 -8.196 1.00 0.00 C ATOM 1036 O LYS A 65 -5.528 6.494 -8.979 1.00 0.00 O ATOM 1037 CB LYS A 65 -5.107 9.712 -8.946 1.00 0.00 C ATOM 1038 CG LYS A 65 -6.097 10.829 -9.365 1.00 0.00 C ATOM 1039 CD LYS A 65 -6.140 12.054 -8.423 1.00 0.00 C ATOM 1040 CE LYS A 65 -7.570 12.586 -8.221 1.00 0.00 C ATOM 1041 NZ LYS A 65 -7.556 13.729 -7.274 1.00 0.00 N ATOM 0 H LYS A 65 -4.557 9.060 -6.169 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.731 8.497 -8.078 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.226 10.180 -8.507 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -4.777 9.190 -9.844 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -5.834 11.169 -10.367 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -7.098 10.402 -9.426 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.716 11.781 -7.456 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.514 12.847 -8.833 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.989 12.900 -9.177 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.211 11.793 -7.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.505 13.855 -6.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -6.875 13.539 -6.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.278 14.595 -7.779 1.00 0.00 H new ATOM 1055 N MET A 66 -3.801 6.938 -7.628 1.00 0.00 N ATOM 1056 CA MET A 66 -3.120 5.643 -7.916 1.00 0.00 C ATOM 1057 C MET A 66 -3.614 4.559 -6.906 1.00 0.00 C ATOM 1058 O MET A 66 -3.217 4.550 -5.736 1.00 0.00 O ATOM 1059 CB MET A 66 -1.584 5.858 -7.859 1.00 0.00 C ATOM 1060 CG MET A 66 -0.974 6.829 -8.897 1.00 0.00 C ATOM 1061 SD MET A 66 -1.508 6.459 -10.584 1.00 0.00 S ATOM 1062 CE MET A 66 -0.480 5.034 -10.973 1.00 0.00 C ATOM 0 H MET A 66 -3.300 7.537 -6.972 1.00 0.00 H new ATOM 0 HA MET A 66 -3.367 5.286 -8.916 1.00 0.00 H new ATOM 0 HB2 MET A 66 -1.329 6.222 -6.864 1.00 0.00 H new ATOM 0 HB3 MET A 66 -1.101 4.888 -7.977 1.00 0.00 H new ATOM 0 HG2 MET A 66 -1.257 7.851 -8.645 1.00 0.00 H new ATOM 0 HG3 MET A 66 0.113 6.777 -8.843 1.00 0.00 H new ATOM 0 HE1 MET A 66 -0.698 4.693 -11.985 1.00 0.00 H new ATOM 0 HE2 MET A 66 0.571 5.314 -10.903 1.00 0.00 H new ATOM 0 HE3 MET A 66 -0.689 4.231 -10.267 1.00 0.00 H new ATOM 1072 N CYS A 67 -4.499 3.654 -7.362 1.00 0.00 N ATOM 1073 CA CYS A 67 -5.085 2.588 -6.516 1.00 0.00 C ATOM 1074 C CYS A 67 -4.096 1.407 -6.247 1.00 0.00 C ATOM 1075 O CYS A 67 -3.928 0.512 -7.082 1.00 0.00 O ATOM 1076 CB CYS A 67 -6.366 2.129 -7.242 1.00 0.00 C ATOM 1077 SG CYS A 67 -7.235 0.847 -6.275 1.00 0.00 S ATOM 0 H CYS A 67 -4.831 3.638 -8.326 1.00 0.00 H new ATOM 0 HA CYS A 67 -5.311 2.970 -5.520 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -7.026 2.982 -7.399 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -6.111 1.738 -8.227 1.00 0.00 H new ATOM 0 HG CYS A 67 -8.310 0.480 -6.908 1.00 0.00 H new ATOM 1083 N LEU A 68 -3.432 1.428 -5.074 1.00 0.00 N ATOM 1084 CA LEU A 68 -2.516 0.339 -4.632 1.00 0.00 C ATOM 1085 C LEU A 68 -3.407 -0.809 -4.027 1.00 0.00 C ATOM 1086 O LEU A 68 -3.998 -0.708 -2.933 1.00 0.00 O ATOM 1087 CB LEU A 68 -1.440 0.888 -3.641 1.00 0.00 C ATOM 1088 CG LEU A 68 -0.031 1.177 -4.217 1.00 0.00 C ATOM 1089 CD1 LEU A 68 0.882 1.828 -3.164 1.00 0.00 C ATOM 1090 CD2 LEU A 68 0.681 -0.095 -4.706 1.00 0.00 C ATOM 0 H LEU A 68 -3.510 2.193 -4.404 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.947 -0.069 -5.467 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -1.822 1.810 -3.204 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.332 0.171 -2.828 1.00 0.00 H new ATOM 0 HG LEU A 68 -0.199 1.850 -5.058 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.863 2.018 -3.600 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.443 2.770 -2.834 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.988 1.158 -2.310 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.663 0.166 -5.099 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.796 -0.790 -3.874 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.089 -0.564 -5.492 1.00 0.00 H new ATOM 1102 N SER A 69 -3.475 -1.872 -4.852 1.00 0.00 N ATOM 1103 CA SER A 69 -4.316 -3.086 -4.667 1.00 0.00 C ATOM 1104 C SER A 69 -3.617 -4.330 -5.331 1.00 0.00 C ATOM 1105 O SER A 69 -2.506 -4.254 -5.877 1.00 0.00 O ATOM 1106 CB SER A 69 -5.689 -2.736 -5.299 1.00 0.00 C ATOM 1107 OG SER A 69 -6.418 -1.828 -4.466 1.00 0.00 O ATOM 0 H SER A 69 -2.922 -1.916 -5.708 1.00 0.00 H new ATOM 0 HA SER A 69 -4.452 -3.361 -3.621 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.538 -2.292 -6.283 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.269 -3.647 -5.446 1.00 0.00 H new ATOM 0 HG SER A 69 -6.650 -1.027 -4.980 1.00 0.00 H new ATOM 1113 N CYS A 70 -4.252 -5.513 -5.240 1.00 0.00 N ATOM 1114 CA CYS A 70 -3.728 -6.763 -5.852 1.00 0.00 C ATOM 1115 C CYS A 70 -4.669 -7.165 -7.035 1.00 0.00 C ATOM 1116 O CYS A 70 -5.785 -7.651 -6.830 1.00 0.00 O ATOM 1117 CB CYS A 70 -3.618 -7.807 -4.728 1.00 0.00 C ATOM 1118 SG CYS A 70 -2.337 -9.028 -5.147 1.00 0.00 S ATOM 0 H CYS A 70 -5.136 -5.637 -4.746 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.734 -6.656 -6.287 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -3.372 -7.317 -3.786 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -4.577 -8.306 -4.587 1.00 0.00 H new ATOM 0 HG CYS A 70 -1.239 -8.739 -4.514 1.00 0.00 H new ATOM 1124 N VAL A 71 -4.228 -6.915 -8.279 1.00 0.00 N ATOM 1125 CA VAL A 71 -5.063 -7.115 -9.506 1.00 0.00 C ATOM 1126 C VAL A 71 -4.672 -8.402 -10.322 1.00 0.00 C ATOM 1127 O VAL A 71 -3.557 -8.927 -10.247 1.00 0.00 O ATOM 1128 CB VAL A 71 -4.958 -5.770 -10.320 1.00 0.00 C ATOM 1129 CG1 VAL A 71 -3.635 -5.535 -11.084 1.00 0.00 C ATOM 1130 CG2 VAL A 71 -6.128 -5.552 -11.301 1.00 0.00 C ATOM 0 H VAL A 71 -3.289 -6.570 -8.477 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.103 -7.316 -9.249 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.998 -5.036 -9.516 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.681 -4.579 -11.605 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.804 -5.524 -10.378 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.486 -6.336 -11.808 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.991 -4.607 -11.827 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.155 -6.369 -12.022 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -7.067 -5.526 -10.748 1.00 0.00 H new ATOM 1140 N LYS A 72 -5.631 -8.908 -11.118 1.00 0.00 N ATOM 1141 CA LYS A 72 -5.458 -10.113 -11.982 1.00 0.00 C ATOM 1142 C LYS A 72 -4.713 -9.717 -13.307 1.00 0.00 C ATOM 1143 O LYS A 72 -5.318 -9.128 -14.209 1.00 0.00 O ATOM 1144 CB LYS A 72 -6.909 -10.657 -12.181 1.00 0.00 C ATOM 1145 CG LYS A 72 -7.116 -12.105 -12.682 1.00 0.00 C ATOM 1146 CD LYS A 72 -7.010 -12.333 -14.206 1.00 0.00 C ATOM 1147 CE LYS A 72 -7.689 -13.662 -14.611 1.00 0.00 C ATOM 1148 NZ LYS A 72 -7.382 -14.019 -16.019 1.00 0.00 N ATOM 0 H LYS A 72 -6.561 -8.495 -11.188 1.00 0.00 H new ATOM 0 HA LYS A 72 -4.832 -10.894 -11.551 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.427 -10.564 -11.226 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -7.414 -9.993 -12.883 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -6.382 -12.743 -12.190 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -8.100 -12.441 -12.355 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.479 -11.504 -14.736 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -5.962 -12.350 -14.504 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.353 -14.461 -13.950 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -8.768 -13.575 -14.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.466 -15.048 -16.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -8.052 -13.538 -16.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -6.413 -13.721 -16.249 1.00 0.00 H new ATOM 1162 N SER A 73 -3.401 -10.012 -13.417 1.00 0.00 N ATOM 1163 CA SER A 73 -2.560 -9.599 -14.591 1.00 0.00 C ATOM 1164 C SER A 73 -2.769 -10.570 -15.803 1.00 0.00 C ATOM 1165 O SER A 73 -3.350 -10.161 -16.812 1.00 0.00 O ATOM 1166 CB SER A 73 -1.049 -9.469 -14.183 1.00 0.00 C ATOM 1167 OG SER A 73 -0.807 -9.308 -12.780 1.00 0.00 O ATOM 0 H SER A 73 -2.887 -10.537 -12.710 1.00 0.00 H new ATOM 0 HA SER A 73 -2.887 -8.612 -14.917 1.00 0.00 H new ATOM 0 HB2 SER A 73 -0.519 -10.357 -14.527 1.00 0.00 H new ATOM 0 HB3 SER A 73 -0.619 -8.617 -14.710 1.00 0.00 H new ATOM 0 HG SER A 73 -0.959 -10.161 -12.322 1.00 0.00 H new ATOM 1173 N GLY A 74 -2.285 -11.824 -15.725 1.00 0.00 N ATOM 1174 CA GLY A 74 -2.530 -12.870 -16.752 1.00 0.00 C ATOM 1175 C GLY A 74 -3.651 -13.772 -16.215 1.00 0.00 C ATOM 1176 O GLY A 74 -4.812 -13.563 -16.569 1.00 0.00 O ATOM 0 H GLY A 74 -1.710 -12.147 -14.947 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.819 -12.419 -17.701 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.625 -13.448 -16.937 1.00 0.00 H new ATOM 1180 N ASP A 75 -3.294 -14.739 -15.354 1.00 0.00 N ATOM 1181 CA ASP A 75 -4.274 -15.593 -14.615 1.00 0.00 C ATOM 1182 C ASP A 75 -3.760 -15.832 -13.145 1.00 0.00 C ATOM 1183 O ASP A 75 -3.650 -16.966 -12.669 1.00 0.00 O ATOM 1184 CB ASP A 75 -4.542 -16.905 -15.410 1.00 0.00 C ATOM 1185 CG ASP A 75 -5.536 -16.755 -16.561 1.00 0.00 C ATOM 1186 OD1 ASP A 75 -6.740 -16.531 -16.289 1.00 0.00 O ATOM 1187 OD2 ASP A 75 -5.125 -16.816 -17.736 1.00 0.00 O ATOM 0 H ASP A 75 -2.321 -14.961 -15.142 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.237 -15.090 -14.530 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -3.597 -17.273 -15.808 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.915 -17.663 -14.721 1.00 0.00 H new ATOM 1192 N GLU A 76 -3.516 -14.738 -12.391 1.00 0.00 N ATOM 1193 CA GLU A 76 -2.999 -14.792 -10.992 1.00 0.00 C ATOM 1194 C GLU A 76 -3.645 -13.629 -10.153 1.00 0.00 C ATOM 1195 O GLU A 76 -4.837 -13.316 -10.271 1.00 0.00 O ATOM 1196 CB GLU A 76 -1.423 -14.830 -11.092 1.00 0.00 C ATOM 1197 CG GLU A 76 -0.569 -13.534 -11.277 1.00 0.00 C ATOM 1198 CD GLU A 76 -1.072 -12.468 -12.237 1.00 0.00 C ATOM 1199 OE1 GLU A 76 -1.039 -12.693 -13.460 1.00 0.00 O ATOM 1200 OE2 GLU A 76 -1.479 -11.376 -11.779 1.00 0.00 O ATOM 0 H GLU A 76 -3.670 -13.788 -12.729 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.285 -15.685 -10.437 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.063 -15.316 -10.185 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.178 -15.489 -11.925 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -0.453 -13.070 -10.297 1.00 0.00 H new ATOM 0 HG3 GLU A 76 0.425 -13.836 -11.607 1.00 0.00 H new ATOM 1207 N THR A 77 -2.914 -13.061 -9.187 1.00 0.00 N ATOM 1208 CA THR A 77 -3.343 -11.867 -8.406 1.00 0.00 C ATOM 1209 C THR A 77 -2.001 -11.226 -7.919 1.00 0.00 C ATOM 1210 O THR A 77 -1.307 -11.779 -7.060 1.00 0.00 O ATOM 1211 CB THR A 77 -4.344 -12.240 -7.276 1.00 0.00 C ATOM 1212 OG1 THR A 77 -5.456 -12.953 -7.814 1.00 0.00 O ATOM 1213 CG2 THR A 77 -4.930 -10.999 -6.604 1.00 0.00 C ATOM 0 H THR A 77 -1.996 -13.412 -8.913 1.00 0.00 H new ATOM 0 HA THR A 77 -3.915 -11.147 -8.991 1.00 0.00 H new ATOM 0 HB THR A 77 -3.782 -12.837 -6.558 1.00 0.00 H new ATOM 0 HG1 THR A 77 -5.501 -12.807 -8.782 1.00 0.00 H new ATOM 0 HG21 THR A 77 -5.624 -11.303 -5.821 1.00 0.00 H new ATOM 0 HG22 THR A 77 -4.125 -10.408 -6.166 1.00 0.00 H new ATOM 0 HG23 THR A 77 -5.459 -10.400 -7.345 1.00 0.00 H new ATOM 1221 N ARG A 78 -1.629 -10.074 -8.502 1.00 0.00 N ATOM 1222 CA ARG A 78 -0.299 -9.432 -8.289 1.00 0.00 C ATOM 1223 C ARG A 78 -0.374 -7.947 -7.802 1.00 0.00 C ATOM 1224 O ARG A 78 -1.293 -7.199 -8.149 1.00 0.00 O ATOM 1225 CB ARG A 78 0.399 -9.507 -9.680 1.00 0.00 C ATOM 1226 CG ARG A 78 1.936 -9.319 -9.712 1.00 0.00 C ATOM 1227 CD ARG A 78 2.446 -8.778 -11.065 1.00 0.00 C ATOM 1228 NE ARG A 78 2.462 -7.287 -11.060 1.00 0.00 N ATOM 1229 CZ ARG A 78 1.656 -6.479 -11.745 1.00 0.00 C ATOM 1230 NH1 ARG A 78 0.643 -6.867 -12.477 1.00 0.00 N ATOM 1231 NH2 ARG A 78 1.881 -5.203 -11.675 1.00 0.00 N ATOM 0 H ARG A 78 -2.234 -9.553 -9.136 1.00 0.00 H new ATOM 0 HA ARG A 78 0.240 -9.948 -7.495 1.00 0.00 H new ATOM 0 HB2 ARG A 78 0.168 -10.476 -10.122 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -0.047 -8.749 -10.323 1.00 0.00 H new ATOM 0 HG2 ARG A 78 2.230 -8.633 -8.918 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.418 -10.274 -9.503 1.00 0.00 H new ATOM 0 HD2 ARG A 78 3.449 -9.157 -11.260 1.00 0.00 H new ATOM 0 HD3 ARG A 78 1.807 -9.138 -11.871 1.00 0.00 H new ATOM 0 HE ARG A 78 3.164 -6.840 -10.470 1.00 0.00 H new ATOM 0 HH11 ARG A 78 0.420 -7.859 -12.555 1.00 0.00 H new ATOM 0 HH12 ARG A 78 0.076 -6.177 -12.970 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.654 -4.852 -11.109 1.00 0.00 H new ATOM 0 HH22 ARG A 78 1.285 -4.551 -12.186 1.00 0.00 H new ATOM 1245 N LEU A 79 0.655 -7.494 -7.057 1.00 0.00 N ATOM 1246 CA LEU A 79 0.765 -6.089 -6.560 1.00 0.00 C ATOM 1247 C LEU A 79 0.864 -5.051 -7.737 1.00 0.00 C ATOM 1248 O LEU A 79 1.765 -5.121 -8.583 1.00 0.00 O ATOM 1249 CB LEU A 79 2.048 -5.982 -5.678 1.00 0.00 C ATOM 1250 CG LEU A 79 2.136 -4.898 -4.566 1.00 0.00 C ATOM 1251 CD1 LEU A 79 3.608 -4.718 -4.142 1.00 0.00 C ATOM 1252 CD2 LEU A 79 1.577 -3.513 -4.916 1.00 0.00 C ATOM 0 H LEU A 79 1.438 -8.085 -6.778 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.133 -5.855 -5.989 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.195 -6.950 -5.200 1.00 0.00 H new ATOM 0 HB3 LEU A 79 2.892 -5.827 -6.350 1.00 0.00 H new ATOM 0 HG LEU A 79 1.500 -5.283 -3.769 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.672 -3.959 -3.363 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.995 -5.663 -3.761 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.199 -4.405 -5.003 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.696 -2.846 -4.062 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.118 -3.108 -5.771 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.519 -3.600 -5.164 1.00 0.00 H new ATOM 1264 N GLN A 80 -0.070 -4.091 -7.769 1.00 0.00 N ATOM 1265 CA GLN A 80 -0.093 -3.017 -8.799 1.00 0.00 C ATOM 1266 C GLN A 80 -0.778 -1.716 -8.268 1.00 0.00 C ATOM 1267 O GLN A 80 -1.696 -1.734 -7.435 1.00 0.00 O ATOM 1268 CB GLN A 80 -0.845 -3.539 -10.062 1.00 0.00 C ATOM 1269 CG GLN A 80 -0.672 -2.661 -11.335 1.00 0.00 C ATOM 1270 CD GLN A 80 -1.100 -3.321 -12.647 1.00 0.00 C ATOM 1271 OE1 GLN A 80 -0.500 -4.293 -13.100 1.00 0.00 O ATOM 1272 NE2 GLN A 80 -2.113 -2.818 -13.309 1.00 0.00 N ATOM 0 H GLN A 80 -0.830 -4.027 -7.092 1.00 0.00 H new ATOM 0 HA GLN A 80 0.936 -2.762 -9.052 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -0.497 -4.548 -10.284 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -1.908 -3.612 -9.830 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.246 -1.744 -11.205 1.00 0.00 H new ATOM 0 HG3 GLN A 80 0.376 -2.372 -11.418 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -2.615 -2.011 -12.938 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.400 -3.233 -14.195 1.00 0.00 H new ATOM 1281 N LEU A 81 -0.310 -0.579 -8.812 1.00 0.00 N ATOM 1282 CA LEU A 81 -0.921 0.748 -8.572 1.00 0.00 C ATOM 1283 C LEU A 81 -1.667 1.162 -9.887 1.00 0.00 C ATOM 1284 O LEU A 81 -1.073 1.687 -10.835 1.00 0.00 O ATOM 1285 CB LEU A 81 0.140 1.763 -8.056 1.00 0.00 C ATOM 1286 CG LEU A 81 1.368 2.219 -8.893 1.00 0.00 C ATOM 1287 CD1 LEU A 81 1.928 3.525 -8.301 1.00 0.00 C ATOM 1288 CD2 LEU A 81 2.502 1.178 -8.915 1.00 0.00 C ATOM 0 H LEU A 81 0.501 -0.550 -9.430 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.661 0.724 -7.772 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -0.405 2.669 -7.792 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.537 1.348 -7.130 1.00 0.00 H new ATOM 0 HG LEU A 81 1.018 2.355 -9.916 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.790 3.849 -8.885 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.159 4.297 -8.330 1.00 0.00 H new ATOM 0 HD13 LEU A 81 2.233 3.355 -7.268 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.330 1.555 -9.515 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.846 0.993 -7.897 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.134 0.248 -9.348 1.00 0.00 H new ATOM 1300 N GLU A 82 -2.989 0.912 -9.947 1.00 0.00 N ATOM 1301 CA GLU A 82 -3.831 1.256 -11.130 1.00 0.00 C ATOM 1302 C GLU A 82 -4.202 2.779 -11.162 1.00 0.00 C ATOM 1303 O GLU A 82 -4.677 3.342 -10.171 1.00 0.00 O ATOM 1304 CB GLU A 82 -5.130 0.405 -11.061 1.00 0.00 C ATOM 1305 CG GLU A 82 -4.964 -1.125 -11.240 1.00 0.00 C ATOM 1306 CD GLU A 82 -6.234 -1.904 -10.948 1.00 0.00 C ATOM 1307 OE1 GLU A 82 -7.045 -2.095 -11.877 1.00 0.00 O ATOM 1308 OE2 GLU A 82 -6.408 -2.356 -9.797 1.00 0.00 O ATOM 0 H GLU A 82 -3.509 0.470 -9.189 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.267 1.041 -12.037 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.606 0.586 -10.097 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.816 0.766 -11.828 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -4.646 -1.332 -12.262 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.170 -1.477 -10.581 1.00 0.00 H new ATOM 1315 N ALA A 83 -4.029 3.452 -12.314 1.00 0.00 N ATOM 1316 CA ALA A 83 -4.358 4.898 -12.451 1.00 0.00 C ATOM 1317 C ALA A 83 -5.898 5.117 -12.619 1.00 0.00 C ATOM 1318 O ALA A 83 -6.467 4.877 -13.689 1.00 0.00 O ATOM 1319 CB ALA A 83 -3.553 5.415 -13.659 1.00 0.00 C ATOM 0 H ALA A 83 -3.665 3.026 -13.166 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.087 5.454 -11.554 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -3.758 6.476 -13.806 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -2.488 5.273 -13.474 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.843 4.863 -14.553 1.00 0.00 H new ATOM 1325 N VAL A 84 -6.564 5.567 -11.540 1.00 0.00 N ATOM 1326 CA VAL A 84 -8.045 5.759 -11.506 1.00 0.00 C ATOM 1327 C VAL A 84 -8.425 7.216 -11.051 1.00 0.00 C ATOM 1328 O VAL A 84 -7.606 7.992 -10.545 1.00 0.00 O ATOM 1329 CB VAL A 84 -8.626 4.598 -10.607 1.00 0.00 C ATOM 1330 CG1 VAL A 84 -8.572 4.814 -9.079 1.00 0.00 C ATOM 1331 CG2 VAL A 84 -10.072 4.218 -10.993 1.00 0.00 C ATOM 0 H VAL A 84 -6.102 5.810 -10.664 1.00 0.00 H new ATOM 0 HA VAL A 84 -8.497 5.685 -12.495 1.00 0.00 H new ATOM 0 HB VAL A 84 -7.935 3.784 -10.827 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -9.000 3.948 -8.574 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -7.536 4.941 -8.766 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -9.142 5.705 -8.817 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -10.423 3.416 -10.344 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -10.720 5.087 -10.878 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -10.096 3.883 -12.030 1.00 0.00 H new ATOM 1341 N ASN A 85 -9.701 7.596 -11.238 1.00 0.00 N ATOM 1342 CA ASN A 85 -10.209 8.948 -10.862 1.00 0.00 C ATOM 1343 C ASN A 85 -11.696 8.875 -10.379 1.00 0.00 C ATOM 1344 O ASN A 85 -12.575 8.392 -11.100 1.00 0.00 O ATOM 1345 CB ASN A 85 -10.025 9.939 -12.058 1.00 0.00 C ATOM 1346 CG ASN A 85 -10.506 9.580 -13.477 1.00 0.00 C ATOM 1347 OD1 ASN A 85 -9.721 9.452 -14.409 1.00 0.00 O ATOM 1348 ND2 ASN A 85 -11.787 9.434 -13.708 1.00 0.00 N ATOM 0 H ASN A 85 -10.411 6.990 -11.649 1.00 0.00 H new ATOM 0 HA ASN A 85 -9.626 9.326 -10.023 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -10.522 10.868 -11.780 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -8.959 10.156 -12.129 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -12.114 9.218 -14.650 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -12.458 9.536 -12.946 1.00 0.00 H new ATOM 1355 N ILE A 86 -11.979 9.370 -9.160 1.00 0.00 N ATOM 1356 CA ILE A 86 -13.366 9.410 -8.597 1.00 0.00 C ATOM 1357 C ILE A 86 -13.588 10.742 -7.791 1.00 0.00 C ATOM 1358 O ILE A 86 -12.671 11.455 -7.368 1.00 0.00 O ATOM 1359 CB ILE A 86 -13.666 8.093 -7.780 1.00 0.00 C ATOM 1360 CG1 ILE A 86 -15.192 8.011 -7.464 1.00 0.00 C ATOM 1361 CG2 ILE A 86 -12.859 7.978 -6.461 1.00 0.00 C ATOM 1362 CD1 ILE A 86 -15.740 6.638 -7.119 1.00 0.00 C ATOM 0 H ILE A 86 -11.270 9.752 -8.534 1.00 0.00 H new ATOM 0 HA ILE A 86 -14.099 9.427 -9.403 1.00 0.00 H new ATOM 0 HB ILE A 86 -13.352 7.261 -8.410 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -15.404 8.682 -6.632 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -15.740 8.390 -8.327 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -13.119 7.048 -5.956 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -11.792 7.984 -6.685 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -13.098 8.822 -5.814 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -16.809 6.712 -6.920 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -15.573 5.959 -7.955 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -15.232 6.256 -6.234 1.00 0.00 H new ATOM 1374 N THR A 87 -14.876 11.076 -7.672 1.00 0.00 N ATOM 1375 CA THR A 87 -15.383 12.259 -6.901 1.00 0.00 C ATOM 1376 C THR A 87 -16.735 11.952 -6.152 1.00 0.00 C ATOM 1377 O THR A 87 -16.975 12.549 -5.101 1.00 0.00 O ATOM 1378 CB THR A 87 -15.497 13.499 -7.849 1.00 0.00 C ATOM 1379 OG1 THR A 87 -15.801 14.647 -7.065 1.00 0.00 O ATOM 1380 CG2 THR A 87 -16.573 13.430 -8.951 1.00 0.00 C ATOM 0 H THR A 87 -15.623 10.536 -8.108 1.00 0.00 H new ATOM 0 HA THR A 87 -14.662 12.491 -6.117 1.00 0.00 H new ATOM 0 HB THR A 87 -14.533 13.534 -8.357 1.00 0.00 H new ATOM 0 HG1 THR A 87 -15.874 15.431 -7.648 1.00 0.00 H new ATOM 0 HG21 THR A 87 -16.551 14.348 -9.539 1.00 0.00 H new ATOM 0 HG22 THR A 87 -16.374 12.578 -9.601 1.00 0.00 H new ATOM 0 HG23 THR A 87 -17.556 13.316 -8.493 1.00 0.00 H new ATOM 1388 N ASP A 88 -17.548 10.976 -6.608 1.00 0.00 N ATOM 1389 CA ASP A 88 -18.812 10.528 -5.953 1.00 0.00 C ATOM 1390 C ASP A 88 -18.618 9.853 -4.545 1.00 0.00 C ATOM 1391 O ASP A 88 -19.519 9.931 -3.708 1.00 0.00 O ATOM 1392 CB ASP A 88 -19.493 9.509 -6.914 1.00 0.00 C ATOM 1393 CG ASP A 88 -19.761 9.973 -8.349 1.00 0.00 C ATOM 1394 OD1 ASP A 88 -18.809 9.946 -9.160 1.00 0.00 O ATOM 1395 OD2 ASP A 88 -20.903 10.370 -8.661 1.00 0.00 O ATOM 0 H ASP A 88 -17.345 10.459 -7.464 1.00 0.00 H new ATOM 0 HA ASP A 88 -19.417 11.416 -5.770 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -18.868 8.617 -6.958 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -20.444 9.211 -6.472 1.00 0.00 H new ATOM 1400 N LEU A 89 -17.460 9.188 -4.307 1.00 0.00 N ATOM 1401 CA LEU A 89 -17.072 8.524 -3.020 1.00 0.00 C ATOM 1402 C LEU A 89 -17.790 7.137 -2.889 1.00 0.00 C ATOM 1403 O LEU A 89 -18.883 7.015 -2.328 1.00 0.00 O ATOM 1404 CB LEU A 89 -17.288 9.419 -1.748 1.00 0.00 C ATOM 1405 CG LEU A 89 -16.761 10.883 -1.756 1.00 0.00 C ATOM 1406 CD1 LEU A 89 -16.978 11.541 -0.383 1.00 0.00 C ATOM 1407 CD2 LEU A 89 -15.283 11.016 -2.153 1.00 0.00 C ATOM 0 H LEU A 89 -16.741 9.091 -5.024 1.00 0.00 H new ATOM 0 HA LEU A 89 -15.995 8.363 -3.064 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -18.359 9.456 -1.550 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -16.826 8.908 -0.904 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.340 11.395 -2.524 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -16.604 12.564 -0.407 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -18.042 11.549 -0.148 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -16.442 10.976 0.380 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.994 12.067 -2.134 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -14.666 10.457 -1.450 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -15.139 10.618 -3.158 1.00 0.00 H new ATOM 1419 N SER A 90 -17.134 6.070 -3.384 1.00 0.00 N ATOM 1420 CA SER A 90 -17.700 4.695 -3.375 1.00 0.00 C ATOM 1421 C SER A 90 -17.371 3.899 -2.069 1.00 0.00 C ATOM 1422 O SER A 90 -16.248 3.403 -1.898 1.00 0.00 O ATOM 1423 CB SER A 90 -17.133 3.969 -4.623 1.00 0.00 C ATOM 1424 OG SER A 90 -15.723 3.748 -4.514 1.00 0.00 O ATOM 0 H SER A 90 -16.204 6.129 -3.799 1.00 0.00 H new ATOM 0 HA SER A 90 -18.788 4.754 -3.403 1.00 0.00 H new ATOM 0 HB2 SER A 90 -17.642 3.014 -4.750 1.00 0.00 H new ATOM 0 HB3 SER A 90 -17.340 4.562 -5.514 1.00 0.00 H new ATOM 0 HG SER A 90 -15.482 3.629 -3.571 1.00 0.00 H new ATOM 1430 N GLU A 91 -18.367 3.749 -1.179 1.00 0.00 N ATOM 1431 CA GLU A 91 -18.230 2.949 0.071 1.00 0.00 C ATOM 1432 C GLU A 91 -18.582 1.454 -0.235 1.00 0.00 C ATOM 1433 O GLU A 91 -19.754 1.074 -0.338 1.00 0.00 O ATOM 1434 CB GLU A 91 -19.144 3.601 1.152 1.00 0.00 C ATOM 1435 CG GLU A 91 -19.371 2.823 2.484 1.00 0.00 C ATOM 1436 CD GLU A 91 -18.186 2.421 3.357 1.00 0.00 C ATOM 1437 OE1 GLU A 91 -17.021 2.753 3.060 1.00 0.00 O ATOM 1438 OE2 GLU A 91 -18.433 1.735 4.374 1.00 0.00 O ATOM 0 H GLU A 91 -19.288 4.172 -1.296 1.00 0.00 H new ATOM 0 HA GLU A 91 -17.210 2.948 0.456 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -18.723 4.575 1.402 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -20.119 3.781 0.700 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -20.035 3.429 3.101 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -19.912 1.910 2.235 1.00 0.00 H new ATOM 1445 N ASN A 92 -17.550 0.607 -0.400 1.00 0.00 N ATOM 1446 CA ASN A 92 -17.742 -0.851 -0.666 1.00 0.00 C ATOM 1447 C ASN A 92 -16.767 -1.726 0.197 1.00 0.00 C ATOM 1448 O ASN A 92 -16.028 -2.572 -0.313 1.00 0.00 O ATOM 1449 CB ASN A 92 -17.603 -1.035 -2.210 1.00 0.00 C ATOM 1450 CG ASN A 92 -18.144 -2.343 -2.798 1.00 0.00 C ATOM 1451 OD1 ASN A 92 -17.430 -3.133 -3.407 1.00 0.00 O ATOM 1452 ND2 ASN A 92 -19.431 -2.590 -2.706 1.00 0.00 N ATOM 0 H ASN A 92 -16.573 0.895 -0.356 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.727 -1.203 -0.360 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -18.113 -0.205 -2.699 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.547 -0.957 -2.468 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -19.822 -3.428 -3.137 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -20.040 -1.944 -2.203 1.00 0.00 H new ATOM 1459 N ARG A 93 -16.836 -1.571 1.533 1.00 0.00 N ATOM 1460 CA ARG A 93 -15.978 -2.334 2.491 1.00 0.00 C ATOM 1461 C ARG A 93 -16.526 -3.766 2.826 1.00 0.00 C ATOM 1462 O ARG A 93 -15.735 -4.706 2.923 1.00 0.00 O ATOM 1463 CB ARG A 93 -15.826 -1.496 3.788 1.00 0.00 C ATOM 1464 CG ARG A 93 -15.135 -0.105 3.660 1.00 0.00 C ATOM 1465 CD ARG A 93 -14.924 0.680 4.980 1.00 0.00 C ATOM 1466 NE ARG A 93 -16.209 0.938 5.683 1.00 0.00 N ATOM 1467 CZ ARG A 93 -16.742 0.101 6.567 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -16.037 -0.657 7.367 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -18.034 -0.007 6.581 1.00 0.00 N ATOM 0 H ARG A 93 -17.479 -0.922 1.987 1.00 0.00 H new ATOM 0 HA ARG A 93 -15.012 -2.495 2.012 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -16.819 -1.342 4.209 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -15.262 -2.088 4.509 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -14.163 -0.248 3.188 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -15.730 0.512 2.986 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -14.259 0.117 5.635 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -14.432 1.628 4.764 1.00 0.00 H new ATOM 0 HE ARG A 93 -16.708 1.803 5.476 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -15.018 -0.625 7.333 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -16.506 -1.280 8.025 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -18.598 0.539 5.930 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -18.486 -0.638 7.243 1.00 0.00 H new ATOM 1483 N LYS A 94 -17.852 -3.952 2.994 1.00 0.00 N ATOM 1484 CA LYS A 94 -18.478 -5.281 3.281 1.00 0.00 C ATOM 1485 C LYS A 94 -18.311 -6.377 2.161 1.00 0.00 C ATOM 1486 O LYS A 94 -18.411 -7.565 2.478 1.00 0.00 O ATOM 1487 CB LYS A 94 -19.966 -4.938 3.612 1.00 0.00 C ATOM 1488 CG LYS A 94 -20.938 -6.118 3.887 1.00 0.00 C ATOM 1489 CD LYS A 94 -21.770 -6.515 2.644 1.00 0.00 C ATOM 1490 CE LYS A 94 -22.563 -7.819 2.836 1.00 0.00 C ATOM 1491 NZ LYS A 94 -23.457 -8.029 1.664 1.00 0.00 N ATOM 0 H LYS A 94 -18.528 -3.191 2.936 1.00 0.00 H new ATOM 0 HA LYS A 94 -17.966 -5.774 4.107 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -19.973 -4.288 4.487 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -20.369 -4.359 2.781 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -20.366 -6.982 4.226 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -21.613 -5.845 4.698 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -22.463 -5.708 2.406 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -21.103 -6.626 1.789 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -21.879 -8.661 2.942 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -23.151 -7.769 3.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -23.487 -9.041 1.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -24.416 -7.699 1.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -23.094 -7.493 0.850 1.00 0.00 H new ATOM 1505 N GLN A 95 -18.114 -6.014 0.880 1.00 0.00 N ATOM 1506 CA GLN A 95 -17.892 -6.991 -0.221 1.00 0.00 C ATOM 1507 C GLN A 95 -16.882 -6.368 -1.239 1.00 0.00 C ATOM 1508 O GLN A 95 -17.259 -5.681 -2.192 1.00 0.00 O ATOM 1509 CB GLN A 95 -19.258 -7.432 -0.831 1.00 0.00 C ATOM 1510 CG GLN A 95 -20.246 -6.352 -1.358 1.00 0.00 C ATOM 1511 CD GLN A 95 -21.641 -6.905 -1.667 1.00 0.00 C ATOM 1512 OE1 GLN A 95 -22.407 -7.259 -0.773 1.00 0.00 O ATOM 1513 NE2 GLN A 95 -22.024 -7.002 -2.917 1.00 0.00 N ATOM 0 H GLN A 95 -18.103 -5.042 0.572 1.00 0.00 H new ATOM 0 HA GLN A 95 -17.439 -7.914 0.141 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -19.043 -8.109 -1.658 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -19.783 -8.012 -0.072 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -20.334 -5.558 -0.617 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -19.833 -5.902 -2.261 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -21.396 -6.711 -3.667 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -22.950 -7.368 -3.140 1.00 0.00 H new ATOM 1522 N ASP A 96 -15.583 -6.648 -1.033 1.00 0.00 N ATOM 1523 CA ASP A 96 -14.468 -6.137 -1.880 1.00 0.00 C ATOM 1524 C ASP A 96 -14.344 -6.853 -3.283 1.00 0.00 C ATOM 1525 O ASP A 96 -15.181 -7.658 -3.711 1.00 0.00 O ATOM 1526 CB ASP A 96 -13.215 -6.342 -0.952 1.00 0.00 C ATOM 1527 CG ASP A 96 -11.853 -5.837 -1.450 1.00 0.00 C ATOM 1528 OD1 ASP A 96 -11.819 -4.871 -2.241 1.00 0.00 O ATOM 1529 OD2 ASP A 96 -10.820 -6.461 -1.133 1.00 0.00 O ATOM 0 H ASP A 96 -15.264 -7.242 -0.267 1.00 0.00 H new ATOM 0 HA ASP A 96 -14.610 -5.100 -2.183 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -13.423 -5.855 0.001 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -13.121 -7.409 -0.750 1.00 0.00 H new ATOM 1534 N LYS A 97 -13.334 -6.438 -4.058 1.00 0.00 N ATOM 1535 CA LYS A 97 -12.901 -7.135 -5.310 1.00 0.00 C ATOM 1536 C LYS A 97 -11.399 -7.605 -5.145 1.00 0.00 C ATOM 1537 O LYS A 97 -10.599 -7.510 -6.078 1.00 0.00 O ATOM 1538 CB LYS A 97 -13.117 -6.176 -6.522 1.00 0.00 C ATOM 1539 CG LYS A 97 -14.588 -5.917 -6.933 1.00 0.00 C ATOM 1540 CD LYS A 97 -15.230 -4.681 -6.250 1.00 0.00 C ATOM 1541 CE LYS A 97 -16.761 -4.767 -6.111 1.00 0.00 C ATOM 1542 NZ LYS A 97 -17.114 -5.674 -4.982 1.00 0.00 N ATOM 0 H LYS A 97 -12.782 -5.607 -3.847 1.00 0.00 H new ATOM 0 HA LYS A 97 -13.496 -8.029 -5.497 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -12.652 -5.218 -6.288 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -12.588 -6.586 -7.382 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -14.634 -5.786 -8.014 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -15.181 -6.800 -6.694 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -14.792 -4.558 -5.260 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -14.977 -3.789 -6.824 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -17.176 -3.774 -5.936 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -17.200 -5.137 -7.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -17.993 -6.182 -5.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -16.346 -6.359 -4.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -17.250 -5.114 -4.116 1.00 0.00 H new ATOM 1556 N ARG A 98 -11.054 -8.193 -3.971 1.00 0.00 N ATOM 1557 CA ARG A 98 -9.674 -8.583 -3.527 1.00 0.00 C ATOM 1558 C ARG A 98 -8.585 -7.475 -3.803 1.00 0.00 C ATOM 1559 O ARG A 98 -7.596 -7.659 -4.514 1.00 0.00 O ATOM 1560 CB ARG A 98 -9.380 -10.023 -4.046 1.00 0.00 C ATOM 1561 CG ARG A 98 -8.800 -10.259 -5.469 1.00 0.00 C ATOM 1562 CD ARG A 98 -8.810 -11.722 -5.962 1.00 0.00 C ATOM 1563 NE ARG A 98 -8.115 -12.634 -5.008 1.00 0.00 N ATOM 1564 CZ ARG A 98 -7.740 -13.886 -5.258 1.00 0.00 C ATOM 1565 NH1 ARG A 98 -7.871 -14.467 -6.424 1.00 0.00 N ATOM 1566 NH2 ARG A 98 -7.211 -14.572 -4.287 1.00 0.00 N ATOM 0 H ARG A 98 -11.757 -8.423 -3.269 1.00 0.00 H new ATOM 0 HA ARG A 98 -9.619 -8.635 -2.440 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.688 -10.482 -3.339 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.314 -10.581 -3.986 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -9.365 -9.653 -6.177 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -7.772 -9.896 -5.487 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -9.840 -12.053 -6.096 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -8.327 -11.780 -6.937 1.00 0.00 H new ATOM 0 HE ARG A 98 -7.908 -12.264 -4.080 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -8.281 -13.955 -7.206 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -7.563 -15.431 -6.551 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -7.094 -14.147 -3.367 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -6.913 -15.534 -4.446 1.00 0.00 H new ATOM 1580 N PHE A 99 -8.785 -6.314 -3.169 1.00 0.00 N ATOM 1581 CA PHE A 99 -7.929 -5.100 -3.326 1.00 0.00 C ATOM 1582 C PHE A 99 -7.417 -4.494 -1.976 1.00 0.00 C ATOM 1583 O PHE A 99 -7.017 -3.322 -1.975 1.00 0.00 O ATOM 1584 CB PHE A 99 -8.840 -4.105 -4.131 1.00 0.00 C ATOM 1585 CG PHE A 99 -9.106 -4.303 -5.648 1.00 0.00 C ATOM 1586 CD1 PHE A 99 -8.322 -5.114 -6.482 1.00 0.00 C ATOM 1587 CD2 PHE A 99 -10.142 -3.553 -6.221 1.00 0.00 C ATOM 1588 CE1 PHE A 99 -8.566 -5.171 -7.850 1.00 0.00 C ATOM 1589 CE2 PHE A 99 -10.385 -3.610 -7.592 1.00 0.00 C ATOM 1590 CZ PHE A 99 -9.594 -4.416 -8.405 1.00 0.00 C ATOM 0 H PHE A 99 -9.557 -6.174 -2.517 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.997 -5.334 -3.839 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.811 -4.093 -3.637 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -8.409 -3.111 -4.011 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.521 -5.700 -6.057 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -10.758 -2.925 -5.594 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -7.957 -5.801 -8.481 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -11.187 -3.029 -8.023 1.00 0.00 H new ATOM 0 HZ PHE A 99 -9.778 -4.455 -9.468 1.00 0.00 H new ATOM 1600 N ALA A 100 -7.346 -5.264 -0.864 1.00 0.00 N ATOM 1601 CA ALA A 100 -6.927 -4.735 0.455 1.00 0.00 C ATOM 1602 C ALA A 100 -5.598 -5.375 0.949 1.00 0.00 C ATOM 1603 O ALA A 100 -5.327 -6.568 0.759 1.00 0.00 O ATOM 1604 CB ALA A 100 -8.089 -5.024 1.428 1.00 0.00 C ATOM 0 H ALA A 100 -7.575 -6.258 -0.855 1.00 0.00 H new ATOM 0 HA ALA A 100 -6.724 -3.666 0.390 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -7.833 -4.653 2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -8.991 -4.524 1.076 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -8.265 -6.099 1.476 1.00 0.00 H new ATOM 1610 N PHE A 101 -4.762 -4.558 1.610 1.00 0.00 N ATOM 1611 CA PHE A 101 -3.479 -5.020 2.197 1.00 0.00 C ATOM 1612 C PHE A 101 -3.715 -5.279 3.717 1.00 0.00 C ATOM 1613 O PHE A 101 -4.155 -4.366 4.428 1.00 0.00 O ATOM 1614 CB PHE A 101 -2.352 -3.973 1.958 1.00 0.00 C ATOM 1615 CG PHE A 101 -1.836 -3.666 0.529 1.00 0.00 C ATOM 1616 CD1 PHE A 101 -2.348 -4.245 -0.642 1.00 0.00 C ATOM 1617 CD2 PHE A 101 -0.792 -2.740 0.418 1.00 0.00 C ATOM 1618 CE1 PHE A 101 -1.827 -3.905 -1.888 1.00 0.00 C ATOM 1619 CE2 PHE A 101 -0.277 -2.392 -0.828 1.00 0.00 C ATOM 1620 CZ PHE A 101 -0.799 -2.973 -1.979 1.00 0.00 C ATOM 0 H PHE A 101 -4.948 -3.566 1.756 1.00 0.00 H new ATOM 0 HA PHE A 101 -3.150 -5.942 1.717 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -2.697 -3.030 2.382 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.491 -4.291 2.547 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.154 -4.961 -0.576 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -0.381 -2.290 1.310 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.221 -4.365 -2.782 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.526 -1.673 -0.901 1.00 0.00 H new ATOM 0 HZ PHE A 101 -0.405 -2.699 -2.946 1.00 0.00 H new ATOM 1630 N ILE A 102 -3.495 -6.515 4.221 1.00 0.00 N ATOM 1631 CA ILE A 102 -3.766 -6.821 5.676 1.00 0.00 C ATOM 1632 C ILE A 102 -2.470 -6.473 6.475 1.00 0.00 C ATOM 1633 O ILE A 102 -1.388 -7.001 6.196 1.00 0.00 O ATOM 1634 CB ILE A 102 -4.221 -8.299 5.989 1.00 0.00 C ATOM 1635 CG1 ILE A 102 -5.397 -8.793 5.084 1.00 0.00 C ATOM 1636 CG2 ILE A 102 -4.671 -8.418 7.478 1.00 0.00 C ATOM 1637 CD1 ILE A 102 -5.835 -10.259 5.257 1.00 0.00 C ATOM 0 H ILE A 102 -3.143 -7.303 3.677 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.621 -6.215 5.976 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.354 -8.927 5.784 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.261 -8.156 5.271 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.111 -8.644 4.043 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -4.983 -9.442 7.683 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -3.840 -8.154 8.132 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -5.505 -7.741 7.661 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.656 -10.476 4.574 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.995 -10.918 5.036 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.164 -10.422 6.283 1.00 0.00 H new ATOM 1649 N ARG A 103 -2.617 -5.583 7.471 1.00 0.00 N ATOM 1650 CA ARG A 103 -1.486 -5.136 8.324 1.00 0.00 C ATOM 1651 C ARG A 103 -1.438 -5.931 9.668 1.00 0.00 C ATOM 1652 O ARG A 103 -2.241 -5.708 10.578 1.00 0.00 O ATOM 1653 CB ARG A 103 -1.605 -3.589 8.514 1.00 0.00 C ATOM 1654 CG ARG A 103 -2.882 -2.947 9.138 1.00 0.00 C ATOM 1655 CD ARG A 103 -2.763 -2.555 10.627 1.00 0.00 C ATOM 1656 NE ARG A 103 -3.916 -1.696 11.006 1.00 0.00 N ATOM 1657 CZ ARG A 103 -4.171 -1.237 12.233 1.00 0.00 C ATOM 1658 NH1 ARG A 103 -3.463 -1.521 13.299 1.00 0.00 N ATOM 1659 NH2 ARG A 103 -5.197 -0.452 12.386 1.00 0.00 N ATOM 0 H ARG A 103 -3.510 -5.153 7.711 1.00 0.00 H new ATOM 0 HA ARG A 103 -0.532 -5.349 7.842 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -0.760 -3.278 9.128 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -1.469 -3.136 7.532 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -3.138 -2.056 8.564 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -3.711 -3.646 9.028 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -2.742 -3.450 11.249 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -1.827 -2.024 10.801 1.00 0.00 H new ATOM 0 HE ARG A 103 -4.567 -1.435 10.265 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -2.651 -2.134 13.224 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -3.724 -1.129 14.204 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.776 -0.207 11.583 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -5.423 -0.082 13.309 1.00 0.00 H new ATOM 1673 N SER A 104 -0.483 -6.873 9.800 1.00 0.00 N ATOM 1674 CA SER A 104 -0.253 -7.609 11.081 1.00 0.00 C ATOM 1675 C SER A 104 0.883 -6.861 11.857 1.00 0.00 C ATOM 1676 O SER A 104 2.068 -7.216 11.778 1.00 0.00 O ATOM 1677 CB SER A 104 0.079 -9.086 10.762 1.00 0.00 C ATOM 1678 OG SER A 104 1.367 -9.228 10.163 1.00 0.00 O ATOM 0 H SER A 104 0.144 -7.149 9.045 1.00 0.00 H new ATOM 0 HA SER A 104 -1.137 -7.626 11.719 1.00 0.00 H new ATOM 0 HB2 SER A 104 0.040 -9.673 11.680 1.00 0.00 H new ATOM 0 HB3 SER A 104 -0.679 -9.491 10.092 1.00 0.00 H new ATOM 0 HG SER A 104 2.005 -8.637 10.615 1.00 0.00 H new ATOM 1684 N ASP A 105 0.513 -5.771 12.552 1.00 0.00 N ATOM 1685 CA ASP A 105 1.481 -4.866 13.220 1.00 0.00 C ATOM 1686 C ASP A 105 1.795 -5.195 14.720 1.00 0.00 C ATOM 1687 O ASP A 105 1.502 -6.252 15.289 1.00 0.00 O ATOM 1688 CB ASP A 105 0.902 -3.427 12.986 1.00 0.00 C ATOM 1689 CG ASP A 105 -0.301 -3.015 13.832 1.00 0.00 C ATOM 1690 OD1 ASP A 105 -0.113 -2.547 14.975 1.00 0.00 O ATOM 1691 OD2 ASP A 105 -1.440 -3.174 13.349 1.00 0.00 O ATOM 0 H ASP A 105 -0.460 -5.488 12.670 1.00 0.00 H new ATOM 0 HA ASP A 105 2.474 -4.984 12.787 1.00 0.00 H new ATOM 0 HB2 ASP A 105 1.702 -2.708 13.162 1.00 0.00 H new ATOM 0 HB3 ASP A 105 0.622 -3.342 11.936 1.00 0.00 H new ATOM 1696 N SER A 106 2.588 -4.295 15.303 1.00 0.00 N ATOM 1697 CA SER A 106 2.898 -4.270 16.758 1.00 0.00 C ATOM 1698 C SER A 106 3.112 -2.767 17.157 1.00 0.00 C ATOM 1699 O SER A 106 4.141 -2.401 17.732 1.00 0.00 O ATOM 1700 CB SER A 106 4.119 -5.187 17.032 1.00 0.00 C ATOM 1701 OG SER A 106 3.899 -6.511 16.532 1.00 0.00 O ATOM 0 H SER A 106 3.046 -3.547 14.782 1.00 0.00 H new ATOM 0 HA SER A 106 2.091 -4.665 17.375 1.00 0.00 H new ATOM 0 HB2 SER A 106 5.007 -4.762 16.564 1.00 0.00 H new ATOM 0 HB3 SER A 106 4.312 -5.228 18.104 1.00 0.00 H new ATOM 0 HG SER A 106 2.986 -6.581 16.182 1.00 0.00 H new ATOM 1707 N GLY A 107 2.115 -1.897 16.868 1.00 0.00 N ATOM 1708 CA GLY A 107 2.237 -0.430 17.044 1.00 0.00 C ATOM 1709 C GLY A 107 2.781 0.226 15.738 1.00 0.00 C ATOM 1710 O GLY A 107 2.023 0.265 14.763 1.00 0.00 O ATOM 0 H GLY A 107 1.207 -2.191 16.508 1.00 0.00 H new ATOM 0 HA2 GLY A 107 1.266 -0.005 17.296 1.00 0.00 H new ATOM 0 HA3 GLY A 107 2.906 -0.211 17.876 1.00 0.00 H new ATOM 1714 N PRO A 108 4.058 0.693 15.624 1.00 0.00 N ATOM 1715 CA PRO A 108 4.576 1.315 14.369 1.00 0.00 C ATOM 1716 C PRO A 108 5.057 0.376 13.204 1.00 0.00 C ATOM 1717 O PRO A 108 5.079 0.837 12.060 1.00 0.00 O ATOM 1718 CB PRO A 108 5.731 2.166 14.940 1.00 0.00 C ATOM 1719 CG PRO A 108 6.266 1.377 16.138 1.00 0.00 C ATOM 1720 CD PRO A 108 5.018 0.740 16.748 1.00 0.00 C ATOM 0 HA PRO A 108 3.778 1.837 13.840 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.510 2.322 14.193 1.00 0.00 H new ATOM 0 HB3 PRO A 108 5.379 3.152 15.245 1.00 0.00 H new ATOM 0 HG2 PRO A 108 6.989 0.622 15.828 1.00 0.00 H new ATOM 0 HG3 PRO A 108 6.771 2.028 16.851 1.00 0.00 H new ATOM 0 HD2 PRO A 108 5.227 -0.257 17.137 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.633 1.332 17.578 1.00 0.00 H new ATOM 1728 N THR A 109 5.479 -0.883 13.452 1.00 0.00 N ATOM 1729 CA THR A 109 6.044 -1.777 12.385 1.00 0.00 C ATOM 1730 C THR A 109 5.100 -2.969 12.015 1.00 0.00 C ATOM 1731 O THR A 109 4.542 -3.636 12.895 1.00 0.00 O ATOM 1732 CB THR A 109 7.444 -2.334 12.798 1.00 0.00 C ATOM 1733 OG1 THR A 109 7.413 -2.951 14.080 1.00 0.00 O ATOM 1734 CG2 THR A 109 8.543 -1.261 12.852 1.00 0.00 C ATOM 0 H THR A 109 5.444 -1.314 14.376 1.00 0.00 H new ATOM 0 HA THR A 109 6.144 -1.149 11.499 1.00 0.00 H new ATOM 0 HB THR A 109 7.680 -3.057 12.017 1.00 0.00 H new ATOM 0 HG1 THR A 109 8.306 -3.288 14.302 1.00 0.00 H new ATOM 0 HG21 THR A 109 9.487 -1.721 13.146 1.00 0.00 H new ATOM 0 HG22 THR A 109 8.653 -0.803 11.869 1.00 0.00 H new ATOM 0 HG23 THR A 109 8.270 -0.497 13.580 1.00 0.00 H new ATOM 1742 N THR A 110 4.976 -3.283 10.703 1.00 0.00 N ATOM 1743 CA THR A 110 4.064 -4.365 10.207 1.00 0.00 C ATOM 1744 C THR A 110 4.660 -5.267 9.056 1.00 0.00 C ATOM 1745 O THR A 110 5.821 -5.190 8.648 1.00 0.00 O ATOM 1746 CB THR A 110 2.701 -3.672 9.807 1.00 0.00 C ATOM 1747 OG1 THR A 110 1.644 -4.615 9.927 1.00 0.00 O ATOM 1748 CG2 THR A 110 2.596 -3.174 8.359 1.00 0.00 C ATOM 0 H THR A 110 5.492 -2.808 9.962 1.00 0.00 H new ATOM 0 HA THR A 110 3.912 -5.089 11.008 1.00 0.00 H new ATOM 0 HB THR A 110 2.645 -2.813 10.476 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.109 -4.613 9.106 1.00 0.00 H new ATOM 0 HG21 THR A 110 1.619 -2.718 8.201 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.376 -2.436 8.171 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.719 -4.014 7.675 1.00 0.00 H new ATOM 1756 N SER A 111 3.805 -6.223 8.675 1.00 0.00 N ATOM 1757 CA SER A 111 3.985 -7.199 7.556 1.00 0.00 C ATOM 1758 C SER A 111 2.742 -7.063 6.596 1.00 0.00 C ATOM 1759 O SER A 111 1.737 -6.452 6.998 1.00 0.00 O ATOM 1760 CB SER A 111 4.088 -8.648 8.104 1.00 0.00 C ATOM 1761 OG SER A 111 4.975 -8.789 9.217 1.00 0.00 O ATOM 0 H SER A 111 2.915 -6.357 9.155 1.00 0.00 H new ATOM 0 HA SER A 111 4.908 -6.986 7.017 1.00 0.00 H new ATOM 0 HB2 SER A 111 3.094 -8.985 8.400 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.422 -9.306 7.301 1.00 0.00 H new ATOM 0 HG SER A 111 5.606 -8.040 9.229 1.00 0.00 H new ATOM 1767 N PHE A 112 2.736 -7.608 5.350 1.00 0.00 N ATOM 1768 CA PHE A 112 1.556 -7.387 4.450 1.00 0.00 C ATOM 1769 C PHE A 112 0.989 -8.631 3.701 1.00 0.00 C ATOM 1770 O PHE A 112 1.663 -9.283 2.895 1.00 0.00 O ATOM 1771 CB PHE A 112 1.925 -6.298 3.378 1.00 0.00 C ATOM 1772 CG PHE A 112 1.585 -4.804 3.599 1.00 0.00 C ATOM 1773 CD1 PHE A 112 0.710 -4.319 4.585 1.00 0.00 C ATOM 1774 CD2 PHE A 112 2.187 -3.888 2.724 1.00 0.00 C ATOM 1775 CE1 PHE A 112 0.466 -2.955 4.705 1.00 0.00 C ATOM 1776 CE2 PHE A 112 1.952 -2.521 2.856 1.00 0.00 C ATOM 1777 CZ PHE A 112 1.088 -2.058 3.842 1.00 0.00 C ATOM 0 H PHE A 112 3.487 -8.174 4.955 1.00 0.00 H new ATOM 0 HA PHE A 112 0.761 -7.082 5.130 1.00 0.00 H new ATOM 0 HB2 PHE A 112 3.002 -6.359 3.221 1.00 0.00 H new ATOM 0 HB3 PHE A 112 1.449 -6.597 2.444 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.223 -5.011 5.256 1.00 0.00 H new ATOM 0 HD2 PHE A 112 2.839 -4.246 1.941 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -0.206 -2.592 5.468 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.440 -1.822 2.193 1.00 0.00 H new ATOM 0 HZ PHE A 112 0.899 -0.999 3.938 1.00 0.00 H new ATOM 1787 N GLU A 113 -0.325 -8.850 3.908 1.00 0.00 N ATOM 1788 CA GLU A 113 -1.143 -9.695 2.990 1.00 0.00 C ATOM 1789 C GLU A 113 -1.657 -8.691 1.871 1.00 0.00 C ATOM 1790 O GLU A 113 -1.531 -7.462 1.994 1.00 0.00 O ATOM 1791 CB GLU A 113 -2.295 -10.438 3.712 1.00 0.00 C ATOM 1792 CG GLU A 113 -1.975 -11.209 5.025 1.00 0.00 C ATOM 1793 CD GLU A 113 -1.149 -12.471 4.877 1.00 0.00 C ATOM 1794 OE1 GLU A 113 -1.707 -13.500 4.446 1.00 0.00 O ATOM 1795 OE2 GLU A 113 0.054 -12.443 5.208 1.00 0.00 O ATOM 0 H GLU A 113 -0.847 -8.461 4.693 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.556 -10.508 2.563 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -3.071 -9.706 3.938 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -2.724 -11.149 3.006 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -1.449 -10.533 5.700 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -2.917 -11.471 5.506 1.00 0.00 H new ATOM 1802 N SER A 114 -2.205 -9.148 0.737 1.00 0.00 N ATOM 1803 CA SER A 114 -2.514 -8.267 -0.436 1.00 0.00 C ATOM 1804 C SER A 114 -3.410 -9.096 -1.386 1.00 0.00 C ATOM 1805 O SER A 114 -2.976 -10.059 -2.024 1.00 0.00 O ATOM 1806 CB SER A 114 -1.220 -7.787 -1.143 1.00 0.00 C ATOM 1807 OG SER A 114 -0.534 -6.851 -0.313 1.00 0.00 O ATOM 0 H SER A 114 -2.451 -10.127 0.591 1.00 0.00 H new ATOM 0 HA SER A 114 -3.028 -7.361 -0.116 1.00 0.00 H new ATOM 0 HB2 SER A 114 -0.574 -8.639 -1.357 1.00 0.00 H new ATOM 0 HB3 SER A 114 -1.467 -7.326 -2.099 1.00 0.00 H new ATOM 0 HG SER A 114 -1.058 -6.689 0.499 1.00 0.00 H new ATOM 1813 N ALA A 115 -4.667 -8.649 -1.466 1.00 0.00 N ATOM 1814 CA ALA A 115 -5.842 -9.350 -2.065 1.00 0.00 C ATOM 1815 C ALA A 115 -6.684 -9.391 -0.782 1.00 0.00 C ATOM 1816 O ALA A 115 -7.276 -8.352 -0.437 1.00 0.00 O ATOM 1817 CB ALA A 115 -5.589 -10.651 -2.858 1.00 0.00 C ATOM 0 H ALA A 115 -4.923 -7.734 -1.096 1.00 0.00 H new ATOM 0 HA ALA A 115 -6.319 -8.876 -2.923 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -6.537 -11.041 -3.230 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -4.928 -10.442 -3.699 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -5.124 -11.390 -2.206 1.00 0.00 H new ATOM 1823 N ALA A 116 -6.732 -10.553 -0.111 1.00 0.00 N ATOM 1824 CA ALA A 116 -7.136 -10.558 1.328 1.00 0.00 C ATOM 1825 C ALA A 116 -6.821 -11.925 1.995 1.00 0.00 C ATOM 1826 O ALA A 116 -7.723 -12.742 2.176 1.00 0.00 O ATOM 1827 CB ALA A 116 -8.631 -10.170 1.523 1.00 0.00 C ATOM 0 H ALA A 116 -6.510 -11.467 -0.506 1.00 0.00 H new ATOM 0 HA ALA A 116 -6.541 -9.792 1.826 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -8.876 -10.188 2.585 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -8.801 -9.168 1.128 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.264 -10.882 0.993 1.00 0.00 H new ATOM 1833 N CYS A 117 -5.559 -12.115 2.435 1.00 0.00 N ATOM 1834 CA CYS A 117 -4.994 -13.394 2.987 1.00 0.00 C ATOM 1835 C CYS A 117 -4.697 -14.217 1.687 1.00 0.00 C ATOM 1836 O CYS A 117 -3.626 -13.915 1.144 1.00 0.00 O ATOM 1837 CB CYS A 117 -5.796 -14.020 4.157 1.00 0.00 C ATOM 1838 SG CYS A 117 -4.995 -15.570 4.687 1.00 0.00 S ATOM 0 H CYS A 117 -4.870 -11.363 2.421 1.00 0.00 H new ATOM 0 HA CYS A 117 -4.075 -13.292 3.564 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -5.846 -13.321 4.992 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -6.821 -14.217 3.844 1.00 0.00 H new ATOM 0 HG CYS A 117 -5.667 -16.092 5.669 1.00 0.00 H new ATOM 1844 N PRO A 118 -5.518 -15.116 1.045 1.00 0.00 N ATOM 1845 CA PRO A 118 -5.185 -15.639 -0.301 1.00 0.00 C ATOM 1846 C PRO A 118 -5.082 -14.490 -1.384 1.00 0.00 C ATOM 1847 O PRO A 118 -5.695 -13.396 -1.318 1.00 0.00 O ATOM 1848 CB PRO A 118 -6.301 -16.668 -0.572 1.00 0.00 C ATOM 1849 CG PRO A 118 -7.463 -16.245 0.323 1.00 0.00 C ATOM 1850 CD PRO A 118 -6.781 -15.677 1.567 1.00 0.00 C ATOM 0 HA PRO A 118 -4.198 -16.099 -0.355 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -6.592 -16.665 -1.622 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.970 -17.679 -0.335 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -8.091 -15.499 -0.164 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -8.105 -17.090 0.570 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -7.392 -14.912 2.045 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -6.598 -16.451 2.313 1.00 0.00 H new ATOM 1858 N GLY A 119 -4.244 -14.845 -2.370 1.00 0.00 N ATOM 1859 CA GLY A 119 -3.836 -13.972 -3.490 1.00 0.00 C ATOM 1860 C GLY A 119 -2.314 -13.756 -3.467 1.00 0.00 C ATOM 1861 O GLY A 119 -1.574 -14.545 -4.058 1.00 0.00 O ATOM 0 H GLY A 119 -3.818 -15.771 -2.415 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -4.133 -14.421 -4.438 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.348 -13.012 -3.418 1.00 0.00 H new ATOM 1865 N TRP A 120 -1.861 -12.720 -2.750 1.00 0.00 N ATOM 1866 CA TRP A 120 -0.423 -12.339 -2.669 1.00 0.00 C ATOM 1867 C TRP A 120 -0.095 -11.944 -1.187 1.00 0.00 C ATOM 1868 O TRP A 120 -0.816 -11.151 -0.580 1.00 0.00 O ATOM 1869 CB TRP A 120 -0.251 -11.195 -3.721 1.00 0.00 C ATOM 1870 CG TRP A 120 1.042 -11.104 -4.539 1.00 0.00 C ATOM 1871 CD1 TRP A 120 1.690 -9.888 -4.834 1.00 0.00 C ATOM 1872 CD2 TRP A 120 1.660 -12.052 -5.346 1.00 0.00 C ATOM 1873 NE1 TRP A 120 2.705 -10.042 -5.799 1.00 0.00 N ATOM 1874 CE2 TRP A 120 2.674 -11.395 -6.091 1.00 0.00 C ATOM 1875 CE3 TRP A 120 1.436 -13.444 -5.521 1.00 0.00 C ATOM 1876 CZ2 TRP A 120 3.492 -12.130 -6.981 1.00 0.00 C ATOM 1877 CZ3 TRP A 120 2.254 -14.147 -6.406 1.00 0.00 C ATOM 1878 CH2 TRP A 120 3.267 -13.500 -7.124 1.00 0.00 C ATOM 0 H TRP A 120 -2.473 -12.114 -2.204 1.00 0.00 H new ATOM 0 HA TRP A 120 0.283 -13.134 -2.907 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -1.078 -11.274 -4.427 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -0.371 -10.248 -3.195 1.00 0.00 H new ATOM 0 HD1 TRP A 120 1.437 -8.945 -4.373 1.00 0.00 H new ATOM 0 HE1 TRP A 120 3.318 -9.326 -6.190 1.00 0.00 H new ATOM 0 HE3 TRP A 120 0.649 -13.948 -4.980 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 4.276 -11.640 -7.539 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 2.103 -15.208 -6.539 1.00 0.00 H new ATOM 0 HH2 TRP A 120 3.885 -14.071 -7.801 1.00 0.00 H new ATOM 1889 N PHE A 121 0.975 -12.477 -0.569 1.00 0.00 N ATOM 1890 CA PHE A 121 1.294 -12.211 0.871 1.00 0.00 C ATOM 1891 C PHE A 121 2.799 -12.451 1.246 1.00 0.00 C ATOM 1892 O PHE A 121 3.302 -13.544 1.005 1.00 0.00 O ATOM 1893 CB PHE A 121 0.363 -13.093 1.770 1.00 0.00 C ATOM 1894 CG PHE A 121 0.261 -14.622 1.556 1.00 0.00 C ATOM 1895 CD1 PHE A 121 -0.684 -15.145 0.665 1.00 0.00 C ATOM 1896 CD2 PHE A 121 1.047 -15.499 2.309 1.00 0.00 C ATOM 1897 CE1 PHE A 121 -0.843 -16.522 0.533 1.00 0.00 C ATOM 1898 CE2 PHE A 121 0.891 -16.877 2.174 1.00 0.00 C ATOM 1899 CZ PHE A 121 -0.052 -17.387 1.284 1.00 0.00 C ATOM 0 H PHE A 121 1.641 -13.095 -1.032 1.00 0.00 H new ATOM 0 HA PHE A 121 1.114 -11.150 1.047 1.00 0.00 H new ATOM 0 HB2 PHE A 121 0.675 -12.936 2.803 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -0.645 -12.690 1.677 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -1.294 -14.476 0.076 1.00 0.00 H new ATOM 0 HD2 PHE A 121 1.779 -15.106 2.999 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -1.579 -16.918 -0.151 1.00 0.00 H new ATOM 0 HE2 PHE A 121 1.501 -17.550 2.759 1.00 0.00 H new ATOM 0 HZ PHE A 121 -0.169 -18.455 1.177 1.00 0.00 H new ATOM 1909 N LEU A 122 3.518 -11.415 1.746 1.00 0.00 N ATOM 1910 CA LEU A 122 4.911 -11.504 2.316 1.00 0.00 C ATOM 1911 C LEU A 122 5.277 -10.054 2.877 1.00 0.00 C ATOM 1912 O LEU A 122 4.653 -9.603 3.853 1.00 0.00 O ATOM 1913 CB LEU A 122 6.060 -12.108 1.402 1.00 0.00 C ATOM 1914 CG LEU A 122 6.227 -13.633 1.137 1.00 0.00 C ATOM 1915 CD1 LEU A 122 7.592 -13.918 0.483 1.00 0.00 C ATOM 1916 CD2 LEU A 122 6.072 -14.512 2.389 1.00 0.00 C ATOM 0 H LEU A 122 3.147 -10.465 1.770 1.00 0.00 H new ATOM 0 HA LEU A 122 4.873 -12.264 3.097 1.00 0.00 H new ATOM 0 HB2 LEU A 122 5.957 -11.635 0.425 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.004 -11.764 1.825 1.00 0.00 H new ATOM 0 HG LEU A 122 5.412 -13.901 0.464 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.693 -14.988 0.304 1.00 0.00 H new ATOM 0 HD12 LEU A 122 7.660 -13.384 -0.465 1.00 0.00 H new ATOM 0 HD13 LEU A 122 8.390 -13.584 1.146 1.00 0.00 H new ATOM 0 HD21 LEU A 122 6.203 -15.559 2.117 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.825 -14.232 3.126 1.00 0.00 H new ATOM 0 HD23 LEU A 122 5.078 -14.369 2.813 1.00 0.00 H new ATOM 1928 N CYS A 123 6.311 -9.334 2.348 1.00 0.00 N ATOM 1929 CA CYS A 123 6.794 -8.039 2.914 1.00 0.00 C ATOM 1930 C CYS A 123 7.645 -7.195 1.876 1.00 0.00 C ATOM 1931 O CYS A 123 7.101 -6.616 0.929 1.00 0.00 O ATOM 1932 CB CYS A 123 7.526 -8.362 4.238 1.00 0.00 C ATOM 1933 SG CYS A 123 8.830 -9.625 4.057 1.00 0.00 S ATOM 0 H CYS A 123 6.829 -9.634 1.522 1.00 0.00 H new ATOM 0 HA CYS A 123 5.957 -7.376 3.131 1.00 0.00 H new ATOM 0 HB2 CYS A 123 7.969 -7.447 4.632 1.00 0.00 H new ATOM 0 HB3 CYS A 123 6.798 -8.705 4.973 1.00 0.00 H new ATOM 0 HG CYS A 123 9.054 -9.840 2.795 1.00 0.00 H new ATOM 1939 N THR A 124 8.973 -7.034 2.065 1.00 0.00 N ATOM 1940 CA THR A 124 9.860 -6.169 1.217 1.00 0.00 C ATOM 1941 C THR A 124 11.334 -6.673 1.271 1.00 0.00 C ATOM 1942 O THR A 124 11.773 -7.265 2.261 1.00 0.00 O ATOM 1943 CB THR A 124 9.724 -4.695 1.738 1.00 0.00 C ATOM 1944 OG1 THR A 124 8.395 -4.252 1.503 1.00 0.00 O ATOM 1945 CG2 THR A 124 10.625 -3.632 1.080 1.00 0.00 C ATOM 0 H THR A 124 9.477 -7.502 2.818 1.00 0.00 H new ATOM 0 HA THR A 124 9.559 -6.214 0.170 1.00 0.00 H new ATOM 0 HB THR A 124 10.023 -4.766 2.784 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.292 -3.336 1.835 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.430 -2.660 1.532 1.00 0.00 H new ATOM 0 HG22 THR A 124 11.671 -3.899 1.229 1.00 0.00 H new ATOM 0 HG23 THR A 124 10.412 -3.585 0.012 1.00 0.00 H new ATOM 1953 N ALA A 125 12.132 -6.408 0.219 1.00 0.00 N ATOM 1954 CA ALA A 125 13.564 -6.808 0.188 1.00 0.00 C ATOM 1955 C ALA A 125 14.465 -6.145 1.296 1.00 0.00 C ATOM 1956 O ALA A 125 14.173 -5.064 1.821 1.00 0.00 O ATOM 1957 CB ALA A 125 14.049 -6.444 -1.220 1.00 0.00 C ATOM 0 H ALA A 125 11.817 -5.921 -0.620 1.00 0.00 H new ATOM 0 HA ALA A 125 13.649 -7.872 0.410 1.00 0.00 H new ATOM 0 HB1 ALA A 125 15.101 -6.709 -1.322 1.00 0.00 H new ATOM 0 HB2 ALA A 125 13.463 -6.991 -1.959 1.00 0.00 H new ATOM 0 HB3 ALA A 125 13.928 -5.373 -1.381 1.00 0.00 H new ATOM 1963 N MET A 126 15.567 -6.827 1.656 1.00 0.00 N ATOM 1964 CA MET A 126 16.499 -6.373 2.733 1.00 0.00 C ATOM 1965 C MET A 126 17.267 -5.032 2.453 1.00 0.00 C ATOM 1966 O MET A 126 17.240 -4.137 3.303 1.00 0.00 O ATOM 1967 CB MET A 126 17.478 -7.563 2.972 1.00 0.00 C ATOM 1968 CG MET A 126 18.247 -7.533 4.308 1.00 0.00 C ATOM 1969 SD MET A 126 19.514 -6.247 4.288 1.00 0.00 S ATOM 1970 CE MET A 126 20.104 -6.370 5.984 1.00 0.00 C ATOM 0 H MET A 126 15.846 -7.705 1.218 1.00 0.00 H new ATOM 0 HA MET A 126 15.914 -6.120 3.617 1.00 0.00 H new ATOM 0 HB2 MET A 126 16.911 -8.493 2.920 1.00 0.00 H new ATOM 0 HB3 MET A 126 18.201 -7.585 2.157 1.00 0.00 H new ATOM 0 HG2 MET A 126 17.553 -7.353 5.129 1.00 0.00 H new ATOM 0 HG3 MET A 126 18.710 -8.503 4.489 1.00 0.00 H new ATOM 0 HE1 MET A 126 20.897 -5.640 6.147 1.00 0.00 H new ATOM 0 HE2 MET A 126 19.281 -6.172 6.671 1.00 0.00 H new ATOM 0 HE3 MET A 126 20.492 -7.373 6.162 1.00 0.00 H new ATOM 1980 N GLU A 127 17.906 -4.883 1.282 1.00 0.00 N ATOM 1981 CA GLU A 127 18.737 -3.701 0.931 1.00 0.00 C ATOM 1982 C GLU A 127 17.915 -2.485 0.367 1.00 0.00 C ATOM 1983 O GLU A 127 16.709 -2.552 0.098 1.00 0.00 O ATOM 1984 CB GLU A 127 19.784 -4.206 -0.115 1.00 0.00 C ATOM 1985 CG GLU A 127 20.864 -5.234 0.337 1.00 0.00 C ATOM 1986 CD GLU A 127 20.420 -6.672 0.595 1.00 0.00 C ATOM 1987 OE1 GLU A 127 19.595 -7.213 -0.175 1.00 0.00 O ATOM 1988 OE2 GLU A 127 20.896 -7.265 1.584 1.00 0.00 O ATOM 0 H GLU A 127 17.865 -5.581 0.540 1.00 0.00 H new ATOM 0 HA GLU A 127 19.207 -3.308 1.833 1.00 0.00 H new ATOM 0 HB2 GLU A 127 19.233 -4.650 -0.945 1.00 0.00 H new ATOM 0 HB3 GLU A 127 20.304 -3.333 -0.508 1.00 0.00 H new ATOM 0 HG2 GLU A 127 21.643 -5.257 -0.425 1.00 0.00 H new ATOM 0 HG3 GLU A 127 21.323 -4.857 1.251 1.00 0.00 H new ATOM 1995 N ALA A 128 18.590 -1.330 0.222 1.00 0.00 N ATOM 1996 CA ALA A 128 17.992 -0.095 -0.362 1.00 0.00 C ATOM 1997 C ALA A 128 18.154 -0.007 -1.927 1.00 0.00 C ATOM 1998 O ALA A 128 18.686 0.964 -2.474 1.00 0.00 O ATOM 1999 CB ALA A 128 18.702 1.044 0.402 1.00 0.00 C ATOM 0 H ALA A 128 19.564 -1.217 0.503 1.00 0.00 H new ATOM 0 HA ALA A 128 16.909 -0.056 -0.242 1.00 0.00 H new ATOM 0 HB1 ALA A 128 18.333 2.006 0.047 1.00 0.00 H new ATOM 0 HB2 ALA A 128 18.499 0.949 1.469 1.00 0.00 H new ATOM 0 HB3 ALA A 128 19.777 0.982 0.231 1.00 0.00 H new ATOM 2005 N ASP A 129 17.640 -1.024 -2.641 1.00 0.00 N ATOM 2006 CA ASP A 129 17.793 -1.168 -4.126 1.00 0.00 C ATOM 2007 C ASP A 129 16.744 -2.134 -4.768 1.00 0.00 C ATOM 2008 O ASP A 129 16.133 -1.789 -5.780 1.00 0.00 O ATOM 2009 CB ASP A 129 19.259 -1.606 -4.464 1.00 0.00 C ATOM 2010 CG ASP A 129 19.892 -2.776 -3.683 1.00 0.00 C ATOM 2011 OD1 ASP A 129 19.341 -3.899 -3.694 1.00 0.00 O ATOM 2012 OD2 ASP A 129 20.941 -2.563 -3.042 1.00 0.00 O ATOM 0 H ASP A 129 17.102 -1.779 -2.216 1.00 0.00 H new ATOM 0 HA ASP A 129 17.595 -0.192 -4.569 1.00 0.00 H new ATOM 0 HB2 ASP A 129 19.289 -1.863 -5.523 1.00 0.00 H new ATOM 0 HB3 ASP A 129 19.901 -0.736 -4.329 1.00 0.00 H new ATOM 2017 N GLN A 130 16.509 -3.317 -4.188 1.00 0.00 N ATOM 2018 CA GLN A 130 15.488 -4.296 -4.655 1.00 0.00 C ATOM 2019 C GLN A 130 14.003 -3.814 -4.363 1.00 0.00 C ATOM 2020 O GLN A 130 13.831 -2.795 -3.689 1.00 0.00 O ATOM 2021 CB GLN A 130 15.891 -5.611 -3.929 1.00 0.00 C ATOM 2022 CG GLN A 130 17.149 -6.339 -4.483 1.00 0.00 C ATOM 2023 CD GLN A 130 17.888 -7.145 -3.410 1.00 0.00 C ATOM 2024 OE1 GLN A 130 17.486 -8.243 -3.037 1.00 0.00 O ATOM 2025 NE2 GLN A 130 18.946 -6.598 -2.860 1.00 0.00 N ATOM 0 H GLN A 130 17.024 -3.637 -3.368 1.00 0.00 H new ATOM 0 HA GLN A 130 15.477 -4.425 -5.737 1.00 0.00 H new ATOM 0 HB2 GLN A 130 16.061 -5.384 -2.877 1.00 0.00 H new ATOM 0 HB3 GLN A 130 15.048 -6.300 -3.974 1.00 0.00 H new ATOM 0 HG2 GLN A 130 16.851 -7.007 -5.291 1.00 0.00 H new ATOM 0 HG3 GLN A 130 17.830 -5.604 -4.912 1.00 0.00 H new ATOM 0 HE21 GLN A 130 19.272 -5.685 -3.178 1.00 0.00 H new ATOM 0 HE22 GLN A 130 19.443 -7.086 -2.115 1.00 0.00 H new ATOM 2034 N PRO A 131 12.890 -4.474 -4.805 1.00 0.00 N ATOM 2035 CA PRO A 131 11.507 -3.947 -4.589 1.00 0.00 C ATOM 2036 C PRO A 131 10.706 -4.422 -3.322 1.00 0.00 C ATOM 2037 O PRO A 131 11.145 -5.242 -2.504 1.00 0.00 O ATOM 2038 CB PRO A 131 10.881 -4.429 -5.921 1.00 0.00 C ATOM 2039 CG PRO A 131 11.506 -5.799 -6.193 1.00 0.00 C ATOM 2040 CD PRO A 131 12.943 -5.656 -5.693 1.00 0.00 C ATOM 0 HA PRO A 131 11.495 -2.879 -4.369 1.00 0.00 H new ATOM 0 HB2 PRO A 131 9.796 -4.501 -5.842 1.00 0.00 H new ATOM 0 HB3 PRO A 131 11.096 -3.732 -6.731 1.00 0.00 H new ATOM 0 HG2 PRO A 131 10.976 -6.591 -5.664 1.00 0.00 H new ATOM 0 HG3 PRO A 131 11.475 -6.048 -7.254 1.00 0.00 H new ATOM 0 HD2 PRO A 131 13.270 -6.546 -5.156 1.00 0.00 H new ATOM 0 HD3 PRO A 131 13.641 -5.507 -6.517 1.00 0.00 H new ATOM 2048 N VAL A 132 9.487 -3.852 -3.179 1.00 0.00 N ATOM 2049 CA VAL A 132 8.460 -4.336 -2.186 1.00 0.00 C ATOM 2050 C VAL A 132 7.810 -5.615 -2.826 1.00 0.00 C ATOM 2051 O VAL A 132 7.457 -5.612 -4.014 1.00 0.00 O ATOM 2052 CB VAL A 132 7.416 -3.225 -1.798 1.00 0.00 C ATOM 2053 CG1 VAL A 132 6.814 -2.424 -2.964 1.00 0.00 C ATOM 2054 CG2 VAL A 132 6.221 -3.725 -0.948 1.00 0.00 C ATOM 0 H VAL A 132 9.176 -3.054 -3.733 1.00 0.00 H new ATOM 0 HA VAL A 132 8.922 -4.584 -1.231 1.00 0.00 H new ATOM 0 HB VAL A 132 8.059 -2.571 -1.210 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.109 -1.689 -2.575 1.00 0.00 H new ATOM 0 HG12 VAL A 132 7.611 -1.913 -3.504 1.00 0.00 H new ATOM 0 HG13 VAL A 132 6.294 -3.102 -3.641 1.00 0.00 H new ATOM 0 HG21 VAL A 132 5.555 -2.890 -0.730 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.675 -4.489 -1.502 1.00 0.00 H new ATOM 0 HG23 VAL A 132 6.591 -4.148 -0.014 1.00 0.00 H new ATOM 2064 N SER A 133 7.714 -6.732 -2.073 1.00 0.00 N ATOM 2065 CA SER A 133 7.250 -8.014 -2.664 1.00 0.00 C ATOM 2066 C SER A 133 6.450 -8.898 -1.667 1.00 0.00 C ATOM 2067 O SER A 133 6.893 -9.285 -0.578 1.00 0.00 O ATOM 2068 CB SER A 133 8.487 -8.795 -3.164 1.00 0.00 C ATOM 2069 OG SER A 133 8.092 -9.966 -3.882 1.00 0.00 O ATOM 0 H SER A 133 7.944 -6.778 -1.080 1.00 0.00 H new ATOM 0 HA SER A 133 6.569 -7.773 -3.480 1.00 0.00 H new ATOM 0 HB2 SER A 133 9.091 -8.155 -3.807 1.00 0.00 H new ATOM 0 HB3 SER A 133 9.112 -9.076 -2.316 1.00 0.00 H new ATOM 0 HG SER A 133 8.889 -10.445 -4.191 1.00 0.00 H new ATOM 2075 N LEU A 134 5.237 -9.200 -2.120 1.00 0.00 N ATOM 2076 CA LEU A 134 4.299 -10.136 -1.459 1.00 0.00 C ATOM 2077 C LEU A 134 4.285 -11.426 -2.361 1.00 0.00 C ATOM 2078 O LEU A 134 4.444 -11.339 -3.586 1.00 0.00 O ATOM 2079 CB LEU A 134 2.896 -9.483 -1.294 1.00 0.00 C ATOM 2080 CG LEU A 134 2.700 -8.095 -0.613 1.00 0.00 C ATOM 2081 CD1 LEU A 134 3.627 -7.790 0.572 1.00 0.00 C ATOM 2082 CD2 LEU A 134 2.797 -6.945 -1.620 1.00 0.00 C ATOM 0 H LEU A 134 4.858 -8.797 -2.977 1.00 0.00 H new ATOM 0 HA LEU A 134 4.606 -10.394 -0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 134 2.468 -9.405 -2.293 1.00 0.00 H new ATOM 0 HB3 LEU A 134 2.283 -10.193 -0.739 1.00 0.00 H new ATOM 0 HG LEU A 134 1.693 -8.170 -0.203 1.00 0.00 H new ATOM 0 HD11 LEU A 134 3.400 -6.799 0.966 1.00 0.00 H new ATOM 0 HD12 LEU A 134 3.475 -8.534 1.354 1.00 0.00 H new ATOM 0 HD13 LEU A 134 4.665 -7.820 0.239 1.00 0.00 H new ATOM 0 HD21 LEU A 134 2.655 -5.996 -1.103 1.00 0.00 H new ATOM 0 HD22 LEU A 134 3.779 -6.957 -2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 134 2.026 -7.063 -2.382 1.00 0.00 H new ATOM 2094 N THR A 135 4.206 -12.657 -1.825 1.00 0.00 N ATOM 2095 CA THR A 135 4.221 -13.888 -2.690 1.00 0.00 C ATOM 2096 C THR A 135 3.311 -14.959 -2.023 1.00 0.00 C ATOM 2097 O THR A 135 2.109 -14.739 -1.867 1.00 0.00 O ATOM 2098 CB THR A 135 5.716 -14.256 -3.043 1.00 0.00 C ATOM 2099 OG1 THR A 135 6.410 -13.124 -3.564 1.00 0.00 O ATOM 2100 CG2 THR A 135 5.847 -15.320 -4.148 1.00 0.00 C ATOM 0 H THR A 135 4.132 -12.842 -0.825 1.00 0.00 H new ATOM 0 HA THR A 135 3.776 -13.757 -3.677 1.00 0.00 H new ATOM 0 HB THR A 135 6.126 -14.623 -2.102 1.00 0.00 H new ATOM 0 HG1 THR A 135 5.768 -12.506 -3.972 1.00 0.00 H new ATOM 0 HG21 THR A 135 6.902 -15.521 -4.336 1.00 0.00 H new ATOM 0 HG22 THR A 135 5.354 -16.238 -3.829 1.00 0.00 H new ATOM 0 HG23 THR A 135 5.379 -14.955 -5.062 1.00 0.00 H new ATOM 2108 N ASN A 136 3.854 -16.121 -1.677 1.00 0.00 N ATOM 2109 CA ASN A 136 3.096 -17.235 -1.035 1.00 0.00 C ATOM 2110 C ASN A 136 4.021 -17.995 -0.026 1.00 0.00 C ATOM 2111 O ASN A 136 3.709 -18.035 1.166 1.00 0.00 O ATOM 2112 CB ASN A 136 2.489 -18.188 -2.117 1.00 0.00 C ATOM 2113 CG ASN A 136 1.488 -17.590 -3.122 1.00 0.00 C ATOM 2114 OD1 ASN A 136 1.780 -17.432 -4.302 1.00 0.00 O ATOM 2115 ND2 ASN A 136 0.299 -17.225 -2.706 1.00 0.00 N ATOM 0 H ASN A 136 4.839 -16.337 -1.827 1.00 0.00 H new ATOM 0 HA ASN A 136 2.258 -16.824 -0.472 1.00 0.00 H new ATOM 0 HB2 ASN A 136 3.314 -18.620 -2.683 1.00 0.00 H new ATOM 0 HB3 ASN A 136 1.993 -19.009 -1.599 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -0.367 -16.816 -3.361 1.00 0.00 H new ATOM 0 HD22 ASN A 136 0.041 -17.350 -1.727 1.00 0.00 H new ATOM 2122 N MET A 137 5.140 -18.604 -0.473 1.00 0.00 N ATOM 2123 CA MET A 137 6.087 -19.326 0.422 1.00 0.00 C ATOM 2124 C MET A 137 7.185 -18.357 1.015 1.00 0.00 C ATOM 2125 O MET A 137 7.798 -17.615 0.236 1.00 0.00 O ATOM 2126 CB MET A 137 6.711 -20.511 -0.375 1.00 0.00 C ATOM 2127 CG MET A 137 7.616 -20.201 -1.592 1.00 0.00 C ATOM 2128 SD MET A 137 8.188 -21.734 -2.355 1.00 0.00 S ATOM 2129 CE MET A 137 6.846 -22.057 -3.514 1.00 0.00 C ATOM 0 H MET A 137 5.416 -18.613 -1.455 1.00 0.00 H new ATOM 0 HA MET A 137 5.549 -19.721 1.284 1.00 0.00 H new ATOM 0 HB2 MET A 137 7.295 -21.108 0.326 1.00 0.00 H new ATOM 0 HB3 MET A 137 5.892 -21.140 -0.725 1.00 0.00 H new ATOM 0 HG2 MET A 137 7.065 -19.607 -2.322 1.00 0.00 H new ATOM 0 HG3 MET A 137 8.471 -19.604 -1.275 1.00 0.00 H new ATOM 0 HE1 MET A 137 7.053 -22.975 -4.064 1.00 0.00 H new ATOM 0 HE2 MET A 137 5.910 -22.165 -2.966 1.00 0.00 H new ATOM 0 HE3 MET A 137 6.762 -21.226 -4.214 1.00 0.00 H new ATOM 2139 N PRO A 138 7.495 -18.322 2.348 1.00 0.00 N ATOM 2140 CA PRO A 138 8.542 -17.420 2.907 1.00 0.00 C ATOM 2141 C PRO A 138 10.018 -17.891 2.670 1.00 0.00 C ATOM 2142 O PRO A 138 10.301 -19.077 2.473 1.00 0.00 O ATOM 2143 CB PRO A 138 8.142 -17.391 4.397 1.00 0.00 C ATOM 2144 CG PRO A 138 7.550 -18.776 4.672 1.00 0.00 C ATOM 2145 CD PRO A 138 6.814 -19.133 3.380 1.00 0.00 C ATOM 0 HA PRO A 138 8.564 -16.444 2.423 1.00 0.00 H new ATOM 0 HB2 PRO A 138 9.005 -17.196 5.034 1.00 0.00 H new ATOM 0 HB3 PRO A 138 7.415 -16.604 4.596 1.00 0.00 H new ATOM 0 HG2 PRO A 138 8.329 -19.504 4.901 1.00 0.00 H new ATOM 0 HG3 PRO A 138 6.871 -18.757 5.525 1.00 0.00 H new ATOM 0 HD2 PRO A 138 6.884 -20.199 3.161 1.00 0.00 H new ATOM 0 HD3 PRO A 138 5.753 -18.890 3.444 1.00 0.00 H new ATOM 2153 N ASP A 139 10.957 -16.930 2.723 1.00 0.00 N ATOM 2154 CA ASP A 139 12.411 -17.200 2.524 1.00 0.00 C ATOM 2155 C ASP A 139 13.134 -17.612 3.871 1.00 0.00 C ATOM 2156 O ASP A 139 12.487 -17.960 4.867 1.00 0.00 O ATOM 2157 CB ASP A 139 12.945 -15.904 1.837 1.00 0.00 C ATOM 2158 CG ASP A 139 14.188 -16.119 0.978 1.00 0.00 C ATOM 2159 OD1 ASP A 139 15.267 -16.393 1.543 1.00 0.00 O ATOM 2160 OD2 ASP A 139 14.095 -15.991 -0.260 1.00 0.00 O ATOM 0 H ASP A 139 10.743 -15.949 2.903 1.00 0.00 H new ATOM 0 HA ASP A 139 12.614 -18.067 1.896 1.00 0.00 H new ATOM 0 HB2 ASP A 139 12.155 -15.484 1.215 1.00 0.00 H new ATOM 0 HB3 ASP A 139 13.172 -15.165 2.606 1.00 0.00 H new ATOM 2165 N GLU A 140 14.481 -17.617 3.916 1.00 0.00 N ATOM 2166 CA GLU A 140 15.262 -18.019 5.135 1.00 0.00 C ATOM 2167 C GLU A 140 15.618 -16.809 6.076 1.00 0.00 C ATOM 2168 O GLU A 140 16.741 -16.668 6.570 1.00 0.00 O ATOM 2169 CB GLU A 140 16.511 -18.812 4.636 1.00 0.00 C ATOM 2170 CG GLU A 140 17.573 -18.073 3.772 1.00 0.00 C ATOM 2171 CD GLU A 140 18.812 -18.903 3.467 1.00 0.00 C ATOM 2172 OE1 GLU A 140 18.770 -19.731 2.533 1.00 0.00 O ATOM 2173 OE2 GLU A 140 19.839 -18.721 4.154 1.00 0.00 O ATOM 0 H GLU A 140 15.066 -17.348 3.125 1.00 0.00 H new ATOM 0 HA GLU A 140 14.652 -18.655 5.777 1.00 0.00 H new ATOM 0 HB2 GLU A 140 17.020 -19.212 5.513 1.00 0.00 H new ATOM 0 HB3 GLU A 140 16.152 -19.664 4.059 1.00 0.00 H new ATOM 0 HG2 GLU A 140 17.113 -17.768 2.832 1.00 0.00 H new ATOM 0 HG3 GLU A 140 17.877 -17.163 4.289 1.00 0.00 H new ATOM 2180 N GLY A 141 14.617 -15.970 6.408 1.00 0.00 N ATOM 2181 CA GLY A 141 14.840 -14.713 7.187 1.00 0.00 C ATOM 2182 C GLY A 141 15.603 -13.592 6.427 1.00 0.00 C ATOM 2183 O GLY A 141 16.395 -12.861 7.021 1.00 0.00 O ATOM 0 H GLY A 141 13.642 -16.131 6.154 1.00 0.00 H new ATOM 0 HA2 GLY A 141 13.872 -14.323 7.502 1.00 0.00 H new ATOM 0 HA3 GLY A 141 15.395 -14.959 8.093 1.00 0.00 H new ATOM 2187 N VAL A 142 15.298 -13.437 5.130 1.00 0.00 N ATOM 2188 CA VAL A 142 16.005 -12.501 4.206 1.00 0.00 C ATOM 2189 C VAL A 142 15.248 -11.137 4.093 1.00 0.00 C ATOM 2190 O VAL A 142 15.812 -10.079 4.373 1.00 0.00 O ATOM 2191 CB VAL A 142 16.198 -13.295 2.845 1.00 0.00 C ATOM 2192 CG1 VAL A 142 15.324 -12.941 1.614 1.00 0.00 C ATOM 2193 CG2 VAL A 142 17.655 -13.156 2.345 1.00 0.00 C ATOM 0 H VAL A 142 14.548 -13.958 4.676 1.00 0.00 H new ATOM 0 HA VAL A 142 16.987 -12.201 4.571 1.00 0.00 H new ATOM 0 HB VAL A 142 15.886 -14.290 3.161 1.00 0.00 H new ATOM 0 HG11 VAL A 142 15.595 -13.585 0.778 1.00 0.00 H new ATOM 0 HG12 VAL A 142 14.272 -13.089 1.860 1.00 0.00 H new ATOM 0 HG13 VAL A 142 15.489 -11.899 1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 142 17.773 -13.705 1.411 1.00 0.00 H new ATOM 0 HG22 VAL A 142 17.884 -12.103 2.178 1.00 0.00 H new ATOM 0 HG23 VAL A 142 18.337 -13.561 3.093 1.00 0.00 H new ATOM 2203 N MET A 143 13.945 -11.191 3.776 1.00 0.00 N ATOM 2204 CA MET A 143 13.093 -9.983 3.585 1.00 0.00 C ATOM 2205 C MET A 143 12.719 -9.289 4.942 1.00 0.00 C ATOM 2206 O MET A 143 12.556 -9.929 5.988 1.00 0.00 O ATOM 2207 CB MET A 143 11.790 -10.414 2.849 1.00 0.00 C ATOM 2208 CG MET A 143 11.917 -10.807 1.366 1.00 0.00 C ATOM 2209 SD MET A 143 10.263 -11.076 0.699 1.00 0.00 S ATOM 2210 CE MET A 143 10.680 -11.632 -0.961 1.00 0.00 C ATOM 0 H MET A 143 13.442 -12.068 3.642 1.00 0.00 H new ATOM 0 HA MET A 143 13.659 -9.258 3.000 1.00 0.00 H new ATOM 0 HB2 MET A 143 11.362 -11.260 3.387 1.00 0.00 H new ATOM 0 HB3 MET A 143 11.074 -9.595 2.921 1.00 0.00 H new ATOM 0 HG2 MET A 143 12.427 -10.021 0.809 1.00 0.00 H new ATOM 0 HG3 MET A 143 12.518 -11.711 1.264 1.00 0.00 H new ATOM 0 HE1 MET A 143 9.765 -11.844 -1.514 1.00 0.00 H new ATOM 0 HE2 MET A 143 11.243 -10.853 -1.475 1.00 0.00 H new ATOM 0 HE3 MET A 143 11.285 -12.537 -0.900 1.00 0.00 H new ATOM 2220 N VAL A 144 12.597 -7.947 4.916 1.00 0.00 N ATOM 2221 CA VAL A 144 12.259 -7.135 6.122 1.00 0.00 C ATOM 2222 C VAL A 144 10.709 -7.171 6.378 1.00 0.00 C ATOM 2223 O VAL A 144 9.943 -6.304 5.949 1.00 0.00 O ATOM 2224 CB VAL A 144 12.884 -5.698 5.963 1.00 0.00 C ATOM 2225 CG1 VAL A 144 12.392 -4.818 4.786 1.00 0.00 C ATOM 2226 CG2 VAL A 144 12.769 -4.864 7.260 1.00 0.00 C ATOM 0 H VAL A 144 12.727 -7.391 4.071 1.00 0.00 H new ATOM 0 HA VAL A 144 12.699 -7.554 7.027 1.00 0.00 H new ATOM 0 HB VAL A 144 13.917 -5.953 5.727 1.00 0.00 H new ATOM 0 HG11 VAL A 144 12.911 -3.860 4.806 1.00 0.00 H new ATOM 0 HG12 VAL A 144 12.599 -5.323 3.843 1.00 0.00 H new ATOM 0 HG13 VAL A 144 11.319 -4.651 4.880 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.214 -3.881 7.101 1.00 0.00 H new ATOM 0 HG22 VAL A 144 11.718 -4.748 7.526 1.00 0.00 H new ATOM 0 HG23 VAL A 144 13.294 -5.374 8.068 1.00 0.00 H new ATOM 2236 N THR A 145 10.259 -8.179 7.149 1.00 0.00 N ATOM 2237 CA THR A 145 8.813 -8.347 7.515 1.00 0.00 C ATOM 2238 C THR A 145 8.293 -7.438 8.692 1.00 0.00 C ATOM 2239 O THR A 145 7.149 -7.615 9.117 1.00 0.00 O ATOM 2240 CB THR A 145 8.597 -9.881 7.750 1.00 0.00 C ATOM 2241 OG1 THR A 145 7.202 -10.156 7.754 1.00 0.00 O ATOM 2242 CG2 THR A 145 9.154 -10.461 9.064 1.00 0.00 C ATOM 0 H THR A 145 10.867 -8.899 7.539 1.00 0.00 H new ATOM 0 HA THR A 145 8.192 -7.983 6.696 1.00 0.00 H new ATOM 0 HB THR A 145 9.151 -10.352 6.938 1.00 0.00 H new ATOM 0 HG1 THR A 145 6.745 -9.520 8.343 1.00 0.00 H new ATOM 0 HG21 THR A 145 8.942 -11.529 9.109 1.00 0.00 H new ATOM 0 HG22 THR A 145 10.232 -10.303 9.103 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.683 -9.962 9.911 1.00 0.00 H new ATOM 2250 N LYS A 146 9.091 -6.495 9.224 1.00 0.00 N ATOM 2251 CA LYS A 146 8.645 -5.509 10.249 1.00 0.00 C ATOM 2252 C LYS A 146 9.105 -4.089 9.770 1.00 0.00 C ATOM 2253 O LYS A 146 10.038 -3.487 10.307 1.00 0.00 O ATOM 2254 CB LYS A 146 9.172 -5.928 11.655 1.00 0.00 C ATOM 2255 CG LYS A 146 8.547 -7.210 12.279 1.00 0.00 C ATOM 2256 CD LYS A 146 7.024 -7.175 12.569 1.00 0.00 C ATOM 2257 CE LYS A 146 6.645 -6.370 13.827 1.00 0.00 C ATOM 2258 NZ LYS A 146 5.170 -6.198 13.907 1.00 0.00 N ATOM 0 H LYS A 146 10.070 -6.387 8.960 1.00 0.00 H new ATOM 0 HA LYS A 146 7.561 -5.481 10.355 1.00 0.00 H new ATOM 0 HB2 LYS A 146 10.250 -6.073 11.586 1.00 0.00 H new ATOM 0 HB3 LYS A 146 9.006 -5.099 12.342 1.00 0.00 H new ATOM 0 HG2 LYS A 146 8.746 -8.046 11.609 1.00 0.00 H new ATOM 0 HG3 LYS A 146 9.066 -7.421 13.214 1.00 0.00 H new ATOM 0 HD2 LYS A 146 6.510 -6.748 11.708 1.00 0.00 H new ATOM 0 HD3 LYS A 146 6.662 -8.197 12.681 1.00 0.00 H new ATOM 0 HE2 LYS A 146 7.007 -6.884 14.718 1.00 0.00 H new ATOM 0 HE3 LYS A 146 7.131 -5.394 13.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 4.848 -6.407 14.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 4.921 -5.218 13.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 4.708 -6.849 13.240 1.00 0.00 H new ATOM 2272 N PHE A 147 8.416 -3.567 8.738 1.00 0.00 N ATOM 2273 CA PHE A 147 8.682 -2.224 8.138 1.00 0.00 C ATOM 2274 C PHE A 147 7.736 -1.143 8.762 1.00 0.00 C ATOM 2275 O PHE A 147 6.648 -1.451 9.257 1.00 0.00 O ATOM 2276 CB PHE A 147 8.542 -2.329 6.585 1.00 0.00 C ATOM 2277 CG PHE A 147 7.197 -2.824 6.017 1.00 0.00 C ATOM 2278 CD1 PHE A 147 6.102 -1.957 5.916 1.00 0.00 C ATOM 2279 CD2 PHE A 147 7.041 -4.172 5.675 1.00 0.00 C ATOM 2280 CE1 PHE A 147 4.858 -2.445 5.529 1.00 0.00 C ATOM 2281 CE2 PHE A 147 5.797 -4.656 5.286 1.00 0.00 C ATOM 2282 CZ PHE A 147 4.706 -3.797 5.238 1.00 0.00 C ATOM 0 H PHE A 147 7.648 -4.063 8.285 1.00 0.00 H new ATOM 0 HA PHE A 147 9.699 -1.903 8.364 1.00 0.00 H new ATOM 0 HB2 PHE A 147 8.742 -1.344 6.163 1.00 0.00 H new ATOM 0 HB3 PHE A 147 9.325 -2.996 6.222 1.00 0.00 H new ATOM 0 HD1 PHE A 147 6.223 -0.907 6.139 1.00 0.00 H new ATOM 0 HD2 PHE A 147 7.890 -4.839 5.713 1.00 0.00 H new ATOM 0 HE1 PHE A 147 4.013 -1.777 5.455 1.00 0.00 H new ATOM 0 HE2 PHE A 147 5.679 -5.697 5.022 1.00 0.00 H new ATOM 0 HZ PHE A 147 3.732 -4.182 4.973 1.00 0.00 H new ATOM 2292 N TYR A 148 8.138 0.137 8.730 1.00 0.00 N ATOM 2293 CA TYR A 148 7.389 1.244 9.388 1.00 0.00 C ATOM 2294 C TYR A 148 6.121 1.684 8.570 1.00 0.00 C ATOM 2295 O TYR A 148 6.177 2.167 7.434 1.00 0.00 O ATOM 2296 CB TYR A 148 8.395 2.419 9.593 1.00 0.00 C ATOM 2297 CG TYR A 148 8.114 3.509 10.653 1.00 0.00 C ATOM 2298 CD1 TYR A 148 6.913 3.631 11.365 1.00 0.00 C ATOM 2299 CD2 TYR A 148 9.155 4.405 10.932 1.00 0.00 C ATOM 2300 CE1 TYR A 148 6.764 4.608 12.344 1.00 0.00 C ATOM 2301 CE2 TYR A 148 9.007 5.380 11.916 1.00 0.00 C ATOM 2302 CZ TYR A 148 7.814 5.473 12.626 1.00 0.00 C ATOM 2303 OH TYR A 148 7.664 6.405 13.616 1.00 0.00 O ATOM 0 H TYR A 148 8.986 0.443 8.253 1.00 0.00 H new ATOM 0 HA TYR A 148 6.995 0.909 10.348 1.00 0.00 H new ATOM 0 HB2 TYR A 148 9.363 1.978 9.832 1.00 0.00 H new ATOM 0 HB3 TYR A 148 8.503 2.923 8.633 1.00 0.00 H new ATOM 0 HD1 TYR A 148 6.095 2.959 11.151 1.00 0.00 H new ATOM 0 HD2 TYR A 148 10.080 4.339 10.379 1.00 0.00 H new ATOM 0 HE1 TYR A 148 5.833 4.694 12.884 1.00 0.00 H new ATOM 0 HE2 TYR A 148 9.817 6.063 12.127 1.00 0.00 H new ATOM 0 HH TYR A 148 8.485 6.934 13.694 1.00 0.00 H new ATOM 2313 N PHE A 149 4.968 1.483 9.217 1.00 0.00 N ATOM 2314 CA PHE A 149 3.615 1.807 8.700 1.00 0.00 C ATOM 2315 C PHE A 149 3.130 3.090 9.454 1.00 0.00 C ATOM 2316 O PHE A 149 2.736 2.993 10.621 1.00 0.00 O ATOM 2317 CB PHE A 149 2.823 0.487 8.964 1.00 0.00 C ATOM 2318 CG PHE A 149 1.359 0.385 8.519 1.00 0.00 C ATOM 2319 CD1 PHE A 149 1.037 0.132 7.181 1.00 0.00 C ATOM 2320 CD2 PHE A 149 0.333 0.465 9.467 1.00 0.00 C ATOM 2321 CE1 PHE A 149 -0.296 0.032 6.788 1.00 0.00 C ATOM 2322 CE2 PHE A 149 -0.998 0.353 9.073 1.00 0.00 C ATOM 2323 CZ PHE A 149 -1.311 0.145 7.732 1.00 0.00 C ATOM 0 H PHE A 149 4.940 1.075 10.151 1.00 0.00 H new ATOM 0 HA PHE A 149 3.515 2.064 7.646 1.00 0.00 H new ATOM 0 HB2 PHE A 149 3.369 -0.324 8.481 1.00 0.00 H new ATOM 0 HB3 PHE A 149 2.853 0.297 10.037 1.00 0.00 H new ATOM 0 HD1 PHE A 149 1.824 0.014 6.451 1.00 0.00 H new ATOM 0 HD2 PHE A 149 0.574 0.614 10.509 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -0.541 -0.133 5.749 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -1.787 0.427 9.807 1.00 0.00 H new ATOM 0 HZ PHE A 149 -2.344 0.071 7.425 1.00 0.00 H new ATOM 2333 N GLN A 150 3.203 4.294 8.833 1.00 0.00 N ATOM 2334 CA GLN A 150 2.904 5.573 9.557 1.00 0.00 C ATOM 2335 C GLN A 150 1.979 6.583 8.794 1.00 0.00 C ATOM 2336 O GLN A 150 1.931 6.631 7.561 1.00 0.00 O ATOM 2337 CB GLN A 150 4.303 6.225 9.823 1.00 0.00 C ATOM 2338 CG GLN A 150 4.348 7.320 10.924 1.00 0.00 C ATOM 2339 CD GLN A 150 5.589 8.222 10.932 1.00 0.00 C ATOM 2340 OE1 GLN A 150 6.096 8.657 9.901 1.00 0.00 O ATOM 2341 NE2 GLN A 150 6.056 8.602 12.095 1.00 0.00 N ATOM 0 H GLN A 150 3.460 4.415 7.853 1.00 0.00 H new ATOM 0 HA GLN A 150 2.337 5.339 10.458 1.00 0.00 H new ATOM 0 HB2 GLN A 150 5.003 5.435 10.095 1.00 0.00 H new ATOM 0 HB3 GLN A 150 4.661 6.661 8.890 1.00 0.00 H new ATOM 0 HG2 GLN A 150 3.466 7.951 10.815 1.00 0.00 H new ATOM 0 HG3 GLN A 150 4.273 6.832 11.896 1.00 0.00 H new ATOM 0 HE21 GLN A 150 5.639 8.244 12.954 1.00 0.00 H new ATOM 0 HE22 GLN A 150 6.837 9.256 12.142 1.00 0.00 H new ATOM 2350 N GLU A 151 1.295 7.453 9.565 1.00 0.00 N ATOM 2351 CA GLU A 151 0.502 8.596 9.023 1.00 0.00 C ATOM 2352 C GLU A 151 1.498 9.747 8.597 1.00 0.00 C ATOM 2353 O GLU A 151 2.593 9.893 9.160 1.00 0.00 O ATOM 2354 CB GLU A 151 -0.498 9.018 10.138 1.00 0.00 C ATOM 2355 CG GLU A 151 -1.670 9.950 9.717 1.00 0.00 C ATOM 2356 CD GLU A 151 -2.916 9.321 9.088 1.00 0.00 C ATOM 2357 OE1 GLU A 151 -3.252 8.153 9.382 1.00 0.00 O ATOM 2358 OE2 GLU A 151 -3.614 10.037 8.339 1.00 0.00 O ATOM 0 H GLU A 151 1.271 7.390 10.583 1.00 0.00 H new ATOM 0 HA GLU A 151 -0.069 8.339 8.131 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -0.923 8.113 10.572 1.00 0.00 H new ATOM 0 HB3 GLU A 151 0.065 9.516 10.927 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -1.988 10.502 10.601 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -1.275 10.680 9.011 1.00 0.00 H new ATOM 2365 N ASP A 152 1.140 10.564 7.592 1.00 0.00 N ATOM 2366 CA ASP A 152 2.067 11.573 7.013 1.00 0.00 C ATOM 2367 C ASP A 152 2.380 12.832 7.905 1.00 0.00 C ATOM 2368 O ASP A 152 1.600 13.782 8.025 1.00 0.00 O ATOM 2369 CB ASP A 152 1.520 12.000 5.614 1.00 0.00 C ATOM 2370 CG ASP A 152 2.063 11.192 4.429 1.00 0.00 C ATOM 2371 OD1 ASP A 152 3.306 11.042 4.317 1.00 0.00 O ATOM 2372 OD2 ASP A 152 1.261 10.738 3.589 1.00 0.00 O ATOM 0 H ASP A 152 0.217 10.552 7.158 1.00 0.00 H new ATOM 0 HA ASP A 152 3.036 11.079 6.938 1.00 0.00 H new ATOM 0 HB2 ASP A 152 0.433 11.915 5.624 1.00 0.00 H new ATOM 0 HB3 ASP A 152 1.756 13.052 5.455 1.00 0.00 H new ATOM 2377 N GLU A 153 3.604 12.807 8.456 1.00 0.00 N ATOM 2378 CA GLU A 153 4.247 13.926 9.191 1.00 0.00 C ATOM 2379 C GLU A 153 5.533 14.347 8.397 1.00 0.00 C ATOM 2380 O GLU A 153 5.796 15.567 8.314 1.00 0.00 O ATOM 2381 CB GLU A 153 4.548 13.524 10.669 1.00 0.00 C ATOM 2382 CG GLU A 153 5.543 12.355 10.924 1.00 0.00 C ATOM 2383 CD GLU A 153 5.966 12.036 12.353 1.00 0.00 C ATOM 2384 OE1 GLU A 153 5.360 12.520 13.331 1.00 0.00 O ATOM 2385 OE2 GLU A 153 6.920 11.237 12.484 1.00 0.00 O ATOM 2386 OXT GLU A 153 6.275 13.486 7.845 1.00 0.00 O ATOM 0 H GLU A 153 4.200 11.981 8.404 1.00 0.00 H new ATOM 0 HA GLU A 153 3.577 14.784 9.254 1.00 0.00 H new ATOM 0 HB2 GLU A 153 4.931 14.406 11.183 1.00 0.00 H new ATOM 0 HB3 GLU A 153 3.601 13.265 11.143 1.00 0.00 H new ATOM 0 HG2 GLU A 153 5.102 11.451 10.503 1.00 0.00 H new ATOM 0 HG3 GLU A 153 6.448 12.564 10.353 1.00 0.00 H new TER 2393 GLU A 153