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 106 SER OG : rot 0:sc= 2.18 USER MOD Set 1.2: A 146 LYS NZ :NH3+ -129:sc= 1.21 (180deg=-0.0802) USER MOD Set 2.1: A 30 GLN : amide:sc= 1.04 K(o=1.1,f=-2.1!) USER MOD Set 2.2: A 80 GLN : amide:sc= 0.0325 K(o=1.1,f=-0.54) USER MOD Set 3.1: A 1 MET CE :methyl 171:sc= 0 (180deg=0) USER MOD Set 3.2: A 67 CYS SG : rot 180:sc= -1.39 USER MOD Set 4.1: A 65 LYS NZ :NH3+ 139:sc= 0.966 (180deg=-0.0222) USER MOD Set 4.2: A 85 ASN : amide:sc= 0.838 K(o=1.8,f=-3) USER MOD Set 5.1: A 37 GLN : amide:sc= 0.282 K(o=1.2,f=-5.2!) USER MOD Set 5.2: A 42 ASN : amide:sc= 0.959 K(o=1.2,f=-5.4) USER MOD Set 6.1: A 28 ASN : amide:sc= 0.387 K(o=0.81,f=0) USER MOD Set 6.2: A 29 ASN : amide:sc= 0.421 K(o=0.81,f=0) USER MOD Set 7.1: A 23 THR OG1 : rot -133:sc= 1.18 USER MOD Set 7.2: A 35 TYR OH : rot 15:sc= 1.06 USER MOD Set 8.1: A 4 SER OG : rot 49:sc= 1.71 USER MOD Set 8.2: A 11 MET CE :methyl 162:sc= -1.03 (180deg=-1.61) USER MOD Set 8.3: A 92 ASN : amide:sc= 1.1 K(o=1.8,f=-4.2!) USER MOD Single : A 1 MET N :NH3+ -151:sc= 2.05 (180deg=0.987) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0.0125 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -142:sc= 1.26 (180deg=0.624) USER MOD Single : A 12 GLN : amide:sc= 1.71 K(o=1.7,f=-2.9!) 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+ 174:sc= 2.42 (180deg=2.37) USER MOD Single : A 25 TYR OH : rot -108:sc= 1.26 USER MOD Single : A 40 ASN : amide:sc= 0.544 K(o=0.54,f=-3.4!) USER MOD Single : A 46 LYS NZ :NH3+ 153:sc= 2.31 (180deg=1.57) USER MOD Single : A 55 HIS : no HD1:sc= 0.525 K(o=0.52,f=-3.4!) USER MOD Single : A 62 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot -148:sc= 0.854 USER MOD Single : A 70 CYS SG : rot 180:sc= -1.11 USER MOD Single : A 72 LYS NZ :NH3+ 174:sc= 1.36 (180deg=1.19) USER MOD Single : A 73 SER OG : rot 180:sc= 0.107 USER MOD Single : A 77 THR OG1 : rot 174:sc= 1.26 USER MOD Single : A 87 THR OG1 : rot -39:sc= 0.686 USER MOD Single : A 90 SER OG : rot 130:sc= -0.309 USER MOD Single : A 94 LYS NZ :NH3+ -178:sc= 1.1 (180deg=1.05) USER MOD Single : A 95 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot -150:sc= -0.153 USER MOD Single : A 110 THR OG1 : rot 160:sc= 0.951 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot -18:sc= 1.18 USER MOD Single : A 117 CYS SG : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 1:sc= 0.139 USER MOD Single : A 124 THR OG1 : rot 142:sc= 0.526 USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 GLN : amide:sc= 0.496 K(o=0.5,f=-3!) USER MOD Single : A 133 SER OG : rot -3:sc= 1.1 USER MOD Single : A 135 THR OG1 : rot -119:sc= 1.23 USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=-0.19) 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 Single : A 145 THR OG1 : rot -48:sc= 0.899 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc= 0.173 K(o=0.17,f=0.85) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.615 5.931 -0.442 1.00 0.00 N ATOM 2 CA MET A 1 -7.816 6.013 -1.916 1.00 0.00 C ATOM 3 C MET A 1 -9.173 6.651 -2.347 1.00 0.00 C ATOM 4 O MET A 1 -9.155 7.600 -3.129 1.00 0.00 O ATOM 5 CB MET A 1 -7.648 4.581 -2.492 1.00 0.00 C ATOM 6 CG MET A 1 -7.304 4.546 -3.996 1.00 0.00 C ATOM 7 SD MET A 1 -8.513 5.357 -5.072 1.00 0.00 S ATOM 8 CE MET A 1 -9.781 4.090 -5.213 1.00 0.00 C ATOM 0 H1 MET A 1 -6.599 5.978 -0.227 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.104 6.725 0.020 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.002 5.033 -0.088 1.00 0.00 H new ATOM 0 HA MET A 1 -7.068 6.692 -2.325 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.862 4.067 -1.938 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.570 4.024 -2.328 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.333 5.019 -4.143 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.202 3.506 -4.307 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.657 4.505 -5.712 1.00 0.00 H new ATOM 0 HE2 MET A 1 -9.395 3.252 -5.794 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.061 3.743 -4.218 1.00 0.00 H new ATOM 20 N ARG A 2 -10.320 6.107 -1.906 1.00 0.00 N ATOM 21 CA ARG A 2 -11.677 6.571 -2.297 1.00 0.00 C ATOM 22 C ARG A 2 -12.056 7.951 -1.621 1.00 0.00 C ATOM 23 O ARG A 2 -12.273 7.957 -0.402 1.00 0.00 O ATOM 24 CB ARG A 2 -12.632 5.405 -1.875 1.00 0.00 C ATOM 25 CG ARG A 2 -13.829 5.102 -2.792 1.00 0.00 C ATOM 26 CD ARG A 2 -13.526 4.105 -3.928 1.00 0.00 C ATOM 27 NE ARG A 2 -14.791 3.732 -4.618 1.00 0.00 N ATOM 28 CZ ARG A 2 -15.321 4.359 -5.660 1.00 0.00 C ATOM 29 NH1 ARG A 2 -14.719 5.322 -6.310 1.00 0.00 N ATOM 30 NH2 ARG A 2 -16.521 4.031 -6.030 1.00 0.00 N ATOM 0 H ARG A 2 -10.339 5.320 -1.258 1.00 0.00 H new ATOM 0 HA ARG A 2 -11.747 6.777 -3.365 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -12.036 4.496 -1.788 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -13.018 5.629 -0.881 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -14.644 4.706 -2.186 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -14.181 6.036 -3.229 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -12.830 4.550 -4.639 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -13.044 3.214 -3.525 1.00 0.00 H new ATOM 0 HE ARG A 2 -15.295 2.922 -4.257 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -13.790 5.629 -6.022 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -15.179 5.766 -7.105 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -17.031 3.308 -5.523 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -16.954 4.496 -6.828 1.00 0.00 H new ATOM 44 N PRO A 3 -12.164 9.125 -2.320 1.00 0.00 N ATOM 45 CA PRO A 3 -12.485 10.423 -1.667 1.00 0.00 C ATOM 46 C PRO A 3 -14.019 10.615 -1.441 1.00 0.00 C ATOM 47 O PRO A 3 -14.764 10.952 -2.368 1.00 0.00 O ATOM 48 CB PRO A 3 -11.844 11.415 -2.654 1.00 0.00 C ATOM 49 CG PRO A 3 -12.002 10.766 -4.033 1.00 0.00 C ATOM 50 CD PRO A 3 -11.916 9.259 -3.772 1.00 0.00 C ATOM 0 HA PRO A 3 -12.105 10.537 -0.652 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.340 12.385 -2.616 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -10.794 11.584 -2.416 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -12.955 11.034 -4.489 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -11.218 11.094 -4.716 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.657 8.711 -4.354 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.938 8.863 -4.047 1.00 0.00 H new ATOM 58 N SER A 4 -14.507 10.337 -0.226 1.00 0.00 N ATOM 59 CA SER A 4 -15.956 10.425 0.112 1.00 0.00 C ATOM 60 C SER A 4 -16.275 11.700 0.965 1.00 0.00 C ATOM 61 O SER A 4 -16.428 11.619 2.192 1.00 0.00 O ATOM 62 CB SER A 4 -16.320 9.103 0.839 1.00 0.00 C ATOM 63 OG SER A 4 -15.847 9.122 2.187 1.00 0.00 O ATOM 0 H SER A 4 -13.921 10.045 0.556 1.00 0.00 H new ATOM 0 HA SER A 4 -16.565 10.536 -0.785 1.00 0.00 H new ATOM 0 HB2 SER A 4 -17.401 8.962 0.829 1.00 0.00 H new ATOM 0 HB3 SER A 4 -15.884 8.257 0.307 1.00 0.00 H new ATOM 0 HG SER A 4 -16.115 9.961 2.616 1.00 0.00 H new ATOM 69 N GLY A 5 -16.386 12.869 0.312 1.00 0.00 N ATOM 70 CA GLY A 5 -16.684 14.147 1.018 1.00 0.00 C ATOM 71 C GLY A 5 -15.503 14.842 1.745 1.00 0.00 C ATOM 72 O GLY A 5 -14.423 14.279 1.942 1.00 0.00 O ATOM 0 H GLY A 5 -16.276 12.966 -0.697 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -17.094 14.848 0.291 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -17.467 13.954 1.751 1.00 0.00 H new ATOM 76 N ARG A 6 -15.731 16.109 2.126 1.00 0.00 N ATOM 77 CA ARG A 6 -14.723 16.920 2.878 1.00 0.00 C ATOM 78 C ARG A 6 -15.425 18.016 3.762 1.00 0.00 C ATOM 79 O ARG A 6 -15.234 19.222 3.584 1.00 0.00 O ATOM 80 CB ARG A 6 -13.650 17.501 1.892 1.00 0.00 C ATOM 81 CG ARG A 6 -14.063 18.474 0.750 1.00 0.00 C ATOM 82 CD ARG A 6 -14.515 17.783 -0.550 1.00 0.00 C ATOM 83 NE ARG A 6 -14.899 18.813 -1.553 1.00 0.00 N ATOM 84 CZ ARG A 6 -15.320 18.562 -2.793 1.00 0.00 C ATOM 85 NH1 ARG A 6 -15.442 17.354 -3.286 1.00 0.00 N ATOM 86 NH2 ARG A 6 -15.626 19.571 -3.556 1.00 0.00 N ATOM 0 H ARG A 6 -16.600 16.606 1.932 1.00 0.00 H new ATOM 0 HA ARG A 6 -14.188 16.276 3.576 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -12.904 18.016 2.497 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -13.151 16.652 1.425 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -14.872 19.110 1.108 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -13.220 19.127 0.524 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -13.711 17.161 -0.942 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -15.359 17.123 -0.349 1.00 0.00 H new ATOM 0 HE ARG A 6 -14.835 19.791 -1.269 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -15.209 16.543 -2.712 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -15.770 17.225 -4.243 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -15.541 20.523 -3.201 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -15.951 19.409 -4.509 1.00 0.00 H new ATOM 100 N LYS A 7 -16.247 17.588 4.742 1.00 0.00 N ATOM 101 CA LYS A 7 -16.953 18.508 5.686 1.00 0.00 C ATOM 102 C LYS A 7 -17.252 17.676 6.976 1.00 0.00 C ATOM 103 O LYS A 7 -16.489 17.779 7.943 1.00 0.00 O ATOM 104 CB LYS A 7 -18.189 19.157 4.983 1.00 0.00 C ATOM 105 CG LYS A 7 -18.894 20.255 5.815 1.00 0.00 C ATOM 106 CD LYS A 7 -20.059 20.917 5.044 1.00 0.00 C ATOM 107 CE LYS A 7 -20.715 22.117 5.759 1.00 0.00 C ATOM 108 NZ LYS A 7 -21.596 21.672 6.876 1.00 0.00 N ATOM 0 H LYS A 7 -16.446 16.602 4.909 1.00 0.00 H new ATOM 0 HA LYS A 7 -16.354 19.368 5.987 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -17.868 19.587 4.034 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -18.911 18.375 4.750 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -19.274 19.820 6.739 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -18.168 21.017 6.096 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -19.690 21.249 4.073 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -20.824 20.164 4.854 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -19.940 22.779 6.147 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -21.298 22.695 5.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -22.021 22.503 7.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -22.349 21.060 6.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -21.033 21.142 7.572 1.00 0.00 H new ATOM 122 N SER A 8 -18.323 16.855 7.002 1.00 0.00 N ATOM 123 CA SER A 8 -18.618 15.922 8.129 1.00 0.00 C ATOM 124 C SER A 8 -17.643 14.696 8.064 1.00 0.00 C ATOM 125 O SER A 8 -16.799 14.547 8.953 1.00 0.00 O ATOM 126 CB SER A 8 -20.123 15.547 8.066 1.00 0.00 C ATOM 127 OG SER A 8 -20.493 14.930 6.826 1.00 0.00 O ATOM 0 H SER A 8 -19.010 16.814 6.249 1.00 0.00 H new ATOM 0 HA SER A 8 -18.444 16.384 9.101 1.00 0.00 H new ATOM 0 HB2 SER A 8 -20.358 14.870 8.887 1.00 0.00 H new ATOM 0 HB3 SER A 8 -20.723 16.446 8.212 1.00 0.00 H new ATOM 0 HG SER A 8 -21.449 14.713 6.841 1.00 0.00 H new ATOM 133 N SER A 9 -17.713 13.872 6.997 1.00 0.00 N ATOM 134 CA SER A 9 -16.745 12.770 6.754 1.00 0.00 C ATOM 135 C SER A 9 -15.399 13.360 6.209 1.00 0.00 C ATOM 136 O SER A 9 -15.384 14.283 5.382 1.00 0.00 O ATOM 137 CB SER A 9 -17.379 11.774 5.761 1.00 0.00 C ATOM 138 OG SER A 9 -16.573 10.601 5.675 1.00 0.00 O ATOM 0 H SER A 9 -18.436 13.947 6.281 1.00 0.00 H new ATOM 0 HA SER A 9 -16.518 12.242 7.680 1.00 0.00 H new ATOM 0 HB2 SER A 9 -18.386 11.512 6.087 1.00 0.00 H new ATOM 0 HB3 SER A 9 -17.472 12.236 4.778 1.00 0.00 H new ATOM 0 HG SER A 9 -16.980 9.970 5.045 1.00 0.00 H new ATOM 144 N LYS A 10 -14.268 12.854 6.728 1.00 0.00 N ATOM 145 CA LYS A 10 -12.914 13.379 6.388 1.00 0.00 C ATOM 146 C LYS A 10 -11.956 12.219 5.964 1.00 0.00 C ATOM 147 O LYS A 10 -12.036 11.090 6.462 1.00 0.00 O ATOM 148 CB LYS A 10 -12.352 14.149 7.624 1.00 0.00 C ATOM 149 CG LYS A 10 -13.206 15.347 8.121 1.00 0.00 C ATOM 150 CD LYS A 10 -12.599 16.073 9.342 1.00 0.00 C ATOM 151 CE LYS A 10 -13.606 16.897 10.173 1.00 0.00 C ATOM 152 NZ LYS A 10 -14.155 18.060 9.420 1.00 0.00 N ATOM 0 H LYS A 10 -14.254 12.077 7.389 1.00 0.00 H new ATOM 0 HA LYS A 10 -12.988 14.060 5.540 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -12.238 13.443 8.447 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -11.355 14.515 7.377 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -13.325 16.061 7.306 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -14.203 14.990 8.379 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -12.133 15.333 9.992 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -11.807 16.737 8.995 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -14.427 16.252 10.486 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -13.117 17.254 11.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -14.259 18.871 10.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -13.506 18.311 8.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -15.084 17.810 9.024 1.00 0.00 H new ATOM 166 N MET A 11 -11.011 12.527 5.060 1.00 0.00 N ATOM 167 CA MET A 11 -10.036 11.528 4.536 1.00 0.00 C ATOM 168 C MET A 11 -8.834 11.280 5.509 1.00 0.00 C ATOM 169 O MET A 11 -8.366 12.169 6.229 1.00 0.00 O ATOM 170 CB MET A 11 -9.566 12.022 3.142 1.00 0.00 C ATOM 171 CG MET A 11 -10.625 11.902 2.023 1.00 0.00 C ATOM 172 SD MET A 11 -11.050 10.164 1.753 1.00 0.00 S ATOM 173 CE MET A 11 -12.662 10.046 2.556 1.00 0.00 C ATOM 0 H MET A 11 -10.893 13.462 4.669 1.00 0.00 H new ATOM 0 HA MET A 11 -10.523 10.557 4.449 1.00 0.00 H new ATOM 0 HB2 MET A 11 -9.262 13.065 3.225 1.00 0.00 H new ATOM 0 HB3 MET A 11 -8.682 11.455 2.850 1.00 0.00 H new ATOM 0 HG2 MET A 11 -11.518 12.465 2.295 1.00 0.00 H new ATOM 0 HG3 MET A 11 -10.242 12.338 1.101 1.00 0.00 H new ATOM 0 HE1 MET A 11 -13.179 9.154 2.204 1.00 0.00 H new ATOM 0 HE2 MET A 11 -12.527 9.985 3.636 1.00 0.00 H new ATOM 0 HE3 MET A 11 -13.255 10.928 2.314 1.00 0.00 H new ATOM 183 N GLN A 12 -8.355 10.025 5.520 1.00 0.00 N ATOM 184 CA GLN A 12 -7.265 9.565 6.423 1.00 0.00 C ATOM 185 C GLN A 12 -5.880 9.619 5.693 1.00 0.00 C ATOM 186 O GLN A 12 -5.666 8.948 4.676 1.00 0.00 O ATOM 187 CB GLN A 12 -7.713 8.148 6.879 1.00 0.00 C ATOM 188 CG GLN A 12 -6.962 7.538 8.091 1.00 0.00 C ATOM 189 CD GLN A 12 -7.563 6.208 8.586 1.00 0.00 C ATOM 190 OE1 GLN A 12 -8.739 5.892 8.399 1.00 0.00 O ATOM 191 NE2 GLN A 12 -6.795 5.389 9.260 1.00 0.00 N ATOM 0 H GLN A 12 -8.708 9.292 4.904 1.00 0.00 H new ATOM 0 HA GLN A 12 -7.112 10.201 7.295 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.775 8.188 7.122 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -7.605 7.468 6.034 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -5.919 7.376 7.817 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -6.968 8.257 8.910 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -5.818 5.628 9.428 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -7.174 4.512 9.617 1.00 0.00 H new ATOM 200 N ALA A 13 -4.940 10.423 6.230 1.00 0.00 N ATOM 201 CA ALA A 13 -3.598 10.639 5.620 1.00 0.00 C ATOM 202 C ALA A 13 -2.592 9.471 5.899 1.00 0.00 C ATOM 203 O ALA A 13 -2.457 9.024 7.043 1.00 0.00 O ATOM 204 CB ALA A 13 -3.091 11.976 6.181 1.00 0.00 C ATOM 0 H ALA A 13 -5.082 10.943 7.096 1.00 0.00 H new ATOM 0 HA ALA A 13 -3.680 10.662 4.533 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -2.105 12.193 5.770 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.783 12.772 5.905 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.025 11.913 7.267 1.00 0.00 H new ATOM 210 N PHE A 14 -1.856 8.982 4.867 1.00 0.00 N ATOM 211 CA PHE A 14 -1.010 7.760 5.022 1.00 0.00 C ATOM 212 C PHE A 14 0.156 7.519 3.987 1.00 0.00 C ATOM 213 O PHE A 14 0.136 7.976 2.834 1.00 0.00 O ATOM 214 CB PHE A 14 -2.015 6.555 4.916 1.00 0.00 C ATOM 215 CG PHE A 14 -1.755 5.468 5.955 1.00 0.00 C ATOM 216 CD1 PHE A 14 -2.311 5.588 7.233 1.00 0.00 C ATOM 217 CD2 PHE A 14 -0.846 4.440 5.691 1.00 0.00 C ATOM 218 CE1 PHE A 14 -1.910 4.730 8.249 1.00 0.00 C ATOM 219 CE2 PHE A 14 -0.420 3.611 6.720 1.00 0.00 C ATOM 220 CZ PHE A 14 -0.925 3.785 8.002 1.00 0.00 C ATOM 0 H PHE A 14 -1.828 9.401 3.937 1.00 0.00 H new ATOM 0 HA PHE A 14 -0.478 7.876 5.966 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -3.033 6.927 5.034 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -1.948 6.120 3.919 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -3.052 6.348 7.430 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -0.475 4.291 4.688 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.363 4.798 9.227 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.302 2.833 6.524 1.00 0.00 H new ATOM 0 HZ PHE A 14 -0.548 3.180 8.813 1.00 0.00 H new ATOM 230 N ARG A 15 1.138 6.711 4.455 1.00 0.00 N ATOM 231 CA ARG A 15 2.249 6.114 3.646 1.00 0.00 C ATOM 232 C ARG A 15 2.887 4.899 4.442 1.00 0.00 C ATOM 233 O ARG A 15 2.585 4.661 5.617 1.00 0.00 O ATOM 234 CB ARG A 15 3.323 7.161 3.224 1.00 0.00 C ATOM 235 CG ARG A 15 3.994 8.037 4.318 1.00 0.00 C ATOM 236 CD ARG A 15 5.518 8.235 4.188 1.00 0.00 C ATOM 237 NE ARG A 15 5.910 8.873 2.898 1.00 0.00 N ATOM 238 CZ ARG A 15 7.142 9.256 2.575 1.00 0.00 C ATOM 239 NH1 ARG A 15 8.168 9.208 3.379 1.00 0.00 N ATOM 240 NH2 ARG A 15 7.357 9.703 1.380 1.00 0.00 N ATOM 0 H ARG A 15 1.188 6.443 5.438 1.00 0.00 H new ATOM 0 HA ARG A 15 1.825 5.745 2.712 1.00 0.00 H new ATOM 0 HB2 ARG A 15 4.115 6.626 2.699 1.00 0.00 H new ATOM 0 HB3 ARG A 15 2.860 7.834 2.502 1.00 0.00 H new ATOM 0 HG2 ARG A 15 3.519 9.018 4.311 1.00 0.00 H new ATOM 0 HG3 ARG A 15 3.788 7.589 5.290 1.00 0.00 H new ATOM 0 HD2 ARG A 15 5.872 8.851 5.015 1.00 0.00 H new ATOM 0 HD3 ARG A 15 6.014 7.268 4.276 1.00 0.00 H new ATOM 0 HE ARG A 15 5.174 9.028 2.209 1.00 0.00 H new ATOM 0 HH11 ARG A 15 8.055 8.858 4.330 1.00 0.00 H new ATOM 0 HH12 ARG A 15 9.084 9.521 3.057 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.590 9.756 0.710 1.00 0.00 H new ATOM 0 HH22 ARG A 15 8.293 10.003 1.108 1.00 0.00 H new ATOM 254 N ILE A 16 3.748 4.072 3.809 1.00 0.00 N ATOM 255 CA ILE A 16 4.412 2.907 4.503 1.00 0.00 C ATOM 256 C ILE A 16 5.974 2.976 4.234 1.00 0.00 C ATOM 257 O ILE A 16 6.471 3.413 3.180 1.00 0.00 O ATOM 258 CB ILE A 16 3.741 1.523 4.141 1.00 0.00 C ATOM 259 CG1 ILE A 16 3.757 1.136 2.640 1.00 0.00 C ATOM 260 CG2 ILE A 16 2.263 1.497 4.626 1.00 0.00 C ATOM 261 CD1 ILE A 16 3.416 -0.342 2.364 1.00 0.00 C ATOM 0 H ILE A 16 4.008 4.174 2.828 1.00 0.00 H new ATOM 0 HA ILE A 16 4.261 2.983 5.580 1.00 0.00 H new ATOM 0 HB ILE A 16 4.361 0.789 4.656 1.00 0.00 H new ATOM 0 HG12 ILE A 16 3.046 1.767 2.106 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.744 1.352 2.231 1.00 0.00 H new ATOM 0 HG21 ILE A 16 1.813 0.538 4.370 1.00 0.00 H new ATOM 0 HG22 ILE A 16 2.232 1.635 5.707 1.00 0.00 H new ATOM 0 HG23 ILE A 16 1.707 2.300 4.141 1.00 0.00 H new ATOM 0 HD11 ILE A 16 3.449 -0.529 1.291 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.141 -0.983 2.867 1.00 0.00 H new ATOM 0 HD13 ILE A 16 2.416 -0.561 2.739 1.00 0.00 H new ATOM 273 N TRP A 17 6.767 2.615 5.263 1.00 0.00 N ATOM 274 CA TRP A 17 8.266 2.710 5.228 1.00 0.00 C ATOM 275 C TRP A 17 8.946 1.641 6.162 1.00 0.00 C ATOM 276 O TRP A 17 8.291 0.696 6.590 1.00 0.00 O ATOM 277 CB TRP A 17 8.604 4.208 5.598 1.00 0.00 C ATOM 278 CG TRP A 17 8.815 4.612 7.073 1.00 0.00 C ATOM 279 CD1 TRP A 17 7.921 4.370 8.131 1.00 0.00 C ATOM 280 CD2 TRP A 17 9.952 5.146 7.667 1.00 0.00 C ATOM 281 NE1 TRP A 17 8.471 4.720 9.380 1.00 0.00 N ATOM 282 CE2 TRP A 17 9.730 5.198 9.066 1.00 0.00 C ATOM 283 CE3 TRP A 17 11.197 5.568 7.125 1.00 0.00 C ATOM 284 CZ2 TRP A 17 10.744 5.668 9.931 1.00 0.00 C ATOM 285 CZ3 TRP A 17 12.179 6.037 7.998 1.00 0.00 C ATOM 286 CH2 TRP A 17 11.958 6.085 9.379 1.00 0.00 C ATOM 0 H TRP A 17 6.403 2.250 6.143 1.00 0.00 H new ATOM 0 HA TRP A 17 8.672 2.472 4.245 1.00 0.00 H new ATOM 0 HB2 TRP A 17 9.510 4.479 5.055 1.00 0.00 H new ATOM 0 HB3 TRP A 17 7.799 4.828 5.204 1.00 0.00 H new ATOM 0 HD1 TRP A 17 6.929 3.963 8.001 1.00 0.00 H new ATOM 0 HE1 TRP A 17 8.041 4.640 10.301 1.00 0.00 H new ATOM 0 HE3 TRP A 17 11.378 5.526 6.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 10.584 5.704 10.998 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 13.127 6.369 7.601 1.00 0.00 H new ATOM 0 HH2 TRP A 17 12.739 6.451 10.029 1.00 0.00 H new ATOM 297 N ASP A 18 10.255 1.728 6.460 1.00 0.00 N ATOM 298 CA ASP A 18 10.888 0.928 7.542 1.00 0.00 C ATOM 299 C ASP A 18 12.005 1.839 8.179 1.00 0.00 C ATOM 300 O ASP A 18 12.713 2.650 7.539 1.00 0.00 O ATOM 301 CB ASP A 18 11.339 -0.502 7.123 1.00 0.00 C ATOM 302 CG ASP A 18 12.648 -0.749 6.391 1.00 0.00 C ATOM 303 OD1 ASP A 18 13.718 -0.532 7.001 1.00 0.00 O ATOM 304 OD2 ASP A 18 12.624 -1.178 5.214 1.00 0.00 O ATOM 0 H ASP A 18 10.903 2.344 5.969 1.00 0.00 H new ATOM 0 HA ASP A 18 10.151 0.674 8.304 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.369 -1.102 8.033 1.00 0.00 H new ATOM 0 HB3 ASP A 18 10.546 -0.911 6.497 1.00 0.00 H new ATOM 309 N VAL A 19 12.082 1.640 9.512 1.00 0.00 N ATOM 310 CA VAL A 19 12.949 2.389 10.473 1.00 0.00 C ATOM 311 C VAL A 19 14.484 2.392 10.149 1.00 0.00 C ATOM 312 O VAL A 19 15.162 3.329 10.585 1.00 0.00 O ATOM 313 CB VAL A 19 12.628 1.805 11.906 1.00 0.00 C ATOM 314 CG1 VAL A 19 13.452 2.434 13.058 1.00 0.00 C ATOM 315 CG2 VAL A 19 11.141 1.956 12.341 1.00 0.00 C ATOM 0 H VAL A 19 11.522 0.925 9.977 1.00 0.00 H new ATOM 0 HA VAL A 19 12.710 3.450 10.403 1.00 0.00 H new ATOM 0 HB VAL A 19 12.893 0.757 11.767 1.00 0.00 H new ATOM 0 HG11 VAL A 19 13.166 1.973 14.004 1.00 0.00 H new ATOM 0 HG12 VAL A 19 14.514 2.266 12.879 1.00 0.00 H new ATOM 0 HG13 VAL A 19 13.256 3.505 13.103 1.00 0.00 H new ATOM 0 HG21 VAL A 19 11.008 1.530 13.335 1.00 0.00 H new ATOM 0 HG22 VAL A 19 10.873 3.012 12.360 1.00 0.00 H new ATOM 0 HG23 VAL A 19 10.500 1.432 11.632 1.00 0.00 H new ATOM 325 N ASN A 20 15.048 1.446 9.368 1.00 0.00 N ATOM 326 CA ASN A 20 16.483 1.508 8.939 1.00 0.00 C ATOM 327 C ASN A 20 16.737 2.510 7.738 1.00 0.00 C ATOM 328 O ASN A 20 17.704 2.360 6.986 1.00 0.00 O ATOM 329 CB ASN A 20 16.902 0.049 8.583 1.00 0.00 C ATOM 330 CG ASN A 20 17.066 -0.902 9.777 1.00 0.00 C ATOM 331 OD1 ASN A 20 16.151 -1.607 10.184 1.00 0.00 O ATOM 332 ND2 ASN A 20 18.231 -0.958 10.378 1.00 0.00 N ATOM 0 H ASN A 20 14.545 0.631 9.018 1.00 0.00 H new ATOM 0 HA ASN A 20 17.094 1.907 9.749 1.00 0.00 H new ATOM 0 HB2 ASN A 20 16.156 -0.370 7.907 1.00 0.00 H new ATOM 0 HB3 ASN A 20 17.844 0.083 8.036 1.00 0.00 H new ATOM 0 HD21 ASN A 20 18.365 -1.583 11.173 1.00 0.00 H new ATOM 0 HD22 ASN A 20 19.002 -0.377 10.050 1.00 0.00 H new ATOM 339 N GLN A 21 15.926 3.591 7.636 1.00 0.00 N ATOM 340 CA GLN A 21 15.952 4.641 6.577 1.00 0.00 C ATOM 341 C GLN A 21 15.600 4.000 5.201 1.00 0.00 C ATOM 342 O GLN A 21 16.459 3.832 4.335 1.00 0.00 O ATOM 343 CB GLN A 21 17.290 5.447 6.582 1.00 0.00 C ATOM 344 CG GLN A 21 17.694 6.138 7.914 1.00 0.00 C ATOM 345 CD GLN A 21 16.674 7.123 8.501 1.00 0.00 C ATOM 346 OE1 GLN A 21 16.560 8.269 8.084 1.00 0.00 O ATOM 347 NE2 GLN A 21 15.901 6.718 9.483 1.00 0.00 N ATOM 0 H GLN A 21 15.195 3.768 8.325 1.00 0.00 H new ATOM 0 HA GLN A 21 15.187 5.388 6.789 1.00 0.00 H new ATOM 0 HB2 GLN A 21 18.094 4.770 6.295 1.00 0.00 H new ATOM 0 HB3 GLN A 21 17.227 6.213 5.809 1.00 0.00 H new ATOM 0 HG2 GLN A 21 17.890 5.364 8.656 1.00 0.00 H new ATOM 0 HG3 GLN A 21 18.632 6.670 7.754 1.00 0.00 H new ATOM 0 HE21 GLN A 21 15.986 5.766 9.839 1.00 0.00 H new ATOM 0 HE22 GLN A 21 15.216 7.355 9.889 1.00 0.00 H new ATOM 356 N LYS A 22 14.312 3.662 5.005 1.00 0.00 N ATOM 357 CA LYS A 22 13.810 2.996 3.783 1.00 0.00 C ATOM 358 C LYS A 22 12.310 3.410 3.632 1.00 0.00 C ATOM 359 O LYS A 22 11.542 3.366 4.590 1.00 0.00 O ATOM 360 CB LYS A 22 13.895 1.450 4.041 1.00 0.00 C ATOM 361 CG LYS A 22 15.255 0.692 4.153 1.00 0.00 C ATOM 362 CD LYS A 22 15.718 -0.223 2.993 1.00 0.00 C ATOM 363 CE LYS A 22 14.720 -1.336 2.592 1.00 0.00 C ATOM 364 NZ LYS A 22 15.257 -2.168 1.481 1.00 0.00 N ATOM 0 H LYS A 22 13.583 3.844 5.694 1.00 0.00 H new ATOM 0 HA LYS A 22 14.375 3.266 2.891 1.00 0.00 H new ATOM 0 HB2 LYS A 22 13.354 1.258 4.968 1.00 0.00 H new ATOM 0 HB3 LYS A 22 13.335 0.969 3.239 1.00 0.00 H new ATOM 0 HG2 LYS A 22 16.033 1.439 4.309 1.00 0.00 H new ATOM 0 HG3 LYS A 22 15.214 0.081 5.054 1.00 0.00 H new ATOM 0 HD2 LYS A 22 15.916 0.398 2.119 1.00 0.00 H new ATOM 0 HD3 LYS A 22 16.663 -0.688 3.274 1.00 0.00 H new ATOM 0 HE2 LYS A 22 14.511 -1.968 3.455 1.00 0.00 H new ATOM 0 HE3 LYS A 22 13.774 -0.887 2.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 14.614 -2.965 1.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 15.338 -1.589 0.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 16.196 -2.532 1.742 1.00 0.00 H new ATOM 378 N THR A 23 11.870 3.751 2.428 1.00 0.00 N ATOM 379 CA THR A 23 10.467 4.180 2.124 1.00 0.00 C ATOM 380 C THR A 23 9.887 3.384 0.901 1.00 0.00 C ATOM 381 O THR A 23 10.615 2.865 0.043 1.00 0.00 O ATOM 382 CB THR A 23 10.407 5.737 1.906 1.00 0.00 C ATOM 383 OG1 THR A 23 11.342 6.175 0.921 1.00 0.00 O ATOM 384 CG2 THR A 23 10.717 6.539 3.184 1.00 0.00 C ATOM 0 H THR A 23 12.472 3.745 1.604 1.00 0.00 H new ATOM 0 HA THR A 23 9.834 3.945 2.979 1.00 0.00 H new ATOM 0 HB THR A 23 9.381 5.923 1.587 1.00 0.00 H new ATOM 0 HG1 THR A 23 11.827 6.958 1.256 1.00 0.00 H new ATOM 0 HG21 THR A 23 10.659 7.606 2.967 1.00 0.00 H new ATOM 0 HG22 THR A 23 9.991 6.286 3.957 1.00 0.00 H new ATOM 0 HG23 THR A 23 11.720 6.293 3.533 1.00 0.00 H new ATOM 392 N PHE A 24 8.542 3.275 0.831 1.00 0.00 N ATOM 393 CA PHE A 24 7.830 2.595 -0.297 1.00 0.00 C ATOM 394 C PHE A 24 7.390 3.615 -1.403 1.00 0.00 C ATOM 395 O PHE A 24 6.684 4.584 -1.097 1.00 0.00 O ATOM 396 CB PHE A 24 6.619 1.920 0.383 1.00 0.00 C ATOM 397 CG PHE A 24 5.616 1.159 -0.483 1.00 0.00 C ATOM 398 CD1 PHE A 24 5.752 -0.217 -0.678 1.00 0.00 C ATOM 399 CD2 PHE A 24 4.451 1.809 -0.910 1.00 0.00 C ATOM 400 CE1 PHE A 24 4.711 -0.939 -1.251 1.00 0.00 C ATOM 401 CE2 PHE A 24 3.413 1.081 -1.478 1.00 0.00 C ATOM 402 CZ PHE A 24 3.538 -0.296 -1.628 1.00 0.00 C ATOM 0 H PHE A 24 7.915 3.649 1.543 1.00 0.00 H new ATOM 0 HA PHE A 24 8.463 1.878 -0.821 1.00 0.00 H new ATOM 0 HB2 PHE A 24 7.005 1.225 1.129 1.00 0.00 H new ATOM 0 HB3 PHE A 24 6.070 2.693 0.921 1.00 0.00 H new ATOM 0 HD1 PHE A 24 6.662 -0.719 -0.385 1.00 0.00 H new ATOM 0 HD2 PHE A 24 4.359 2.879 -0.797 1.00 0.00 H new ATOM 0 HE1 PHE A 24 4.814 -2.003 -1.404 1.00 0.00 H new ATOM 0 HE2 PHE A 24 2.513 1.582 -1.802 1.00 0.00 H new ATOM 0 HZ PHE A 24 2.720 -0.868 -2.039 1.00 0.00 H new ATOM 412 N TYR A 25 7.756 3.395 -2.685 1.00 0.00 N ATOM 413 CA TYR A 25 7.438 4.365 -3.785 1.00 0.00 C ATOM 414 C TYR A 25 7.585 3.754 -5.223 1.00 0.00 C ATOM 415 O TYR A 25 8.166 2.689 -5.440 1.00 0.00 O ATOM 416 CB TYR A 25 8.344 5.621 -3.616 1.00 0.00 C ATOM 417 CG TYR A 25 9.881 5.515 -3.573 1.00 0.00 C ATOM 418 CD1 TYR A 25 10.525 5.227 -2.364 1.00 0.00 C ATOM 419 CD2 TYR A 25 10.635 5.980 -4.653 1.00 0.00 C ATOM 420 CE1 TYR A 25 11.885 5.476 -2.210 1.00 0.00 C ATOM 421 CE2 TYR A 25 11.991 6.257 -4.490 1.00 0.00 C ATOM 422 CZ TYR A 25 12.601 6.037 -3.259 1.00 0.00 C ATOM 423 OH TYR A 25 13.829 6.572 -3.013 1.00 0.00 O ATOM 0 H TYR A 25 8.267 2.567 -2.993 1.00 0.00 H new ATOM 0 HA TYR A 25 6.386 4.637 -3.696 1.00 0.00 H new ATOM 0 HB2 TYR A 25 8.098 6.299 -4.433 1.00 0.00 H new ATOM 0 HB3 TYR A 25 8.036 6.110 -2.692 1.00 0.00 H new ATOM 0 HD1 TYR A 25 9.961 4.808 -1.544 1.00 0.00 H new ATOM 0 HD2 TYR A 25 10.167 6.125 -5.615 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.380 5.235 -1.281 1.00 0.00 H new ATOM 0 HE2 TYR A 25 12.568 6.642 -5.318 1.00 0.00 H new ATOM 0 HH TYR A 25 13.777 7.549 -3.066 1.00 0.00 H new ATOM 433 N LEU A 26 7.024 4.450 -6.227 1.00 0.00 N ATOM 434 CA LEU A 26 7.090 4.042 -7.664 1.00 0.00 C ATOM 435 C LEU A 26 8.424 4.503 -8.356 1.00 0.00 C ATOM 436 O LEU A 26 9.112 5.419 -7.893 1.00 0.00 O ATOM 437 CB LEU A 26 5.791 4.646 -8.282 1.00 0.00 C ATOM 438 CG LEU A 26 5.385 4.392 -9.760 1.00 0.00 C ATOM 439 CD1 LEU A 26 5.995 5.385 -10.763 1.00 0.00 C ATOM 440 CD2 LEU A 26 5.514 2.945 -10.251 1.00 0.00 C ATOM 0 H LEU A 26 6.507 5.316 -6.077 1.00 0.00 H new ATOM 0 HA LEU A 26 7.122 2.962 -7.805 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.961 4.303 -7.665 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.856 5.727 -8.156 1.00 0.00 H new ATOM 0 HG LEU A 26 4.313 4.586 -9.729 1.00 0.00 H new ATOM 0 HD11 LEU A 26 5.661 5.136 -11.770 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.675 6.397 -10.514 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.082 5.327 -10.717 1.00 0.00 H new ATOM 0 HD21 LEU A 26 5.204 2.886 -11.294 1.00 0.00 H new ATOM 0 HD22 LEU A 26 6.551 2.622 -10.162 1.00 0.00 H new ATOM 0 HD23 LEU A 26 4.879 2.298 -9.647 1.00 0.00 H new ATOM 452 N ARG A 27 8.820 3.813 -9.443 1.00 0.00 N ATOM 453 CA ARG A 27 10.064 4.159 -10.213 1.00 0.00 C ATOM 454 C ARG A 27 9.714 4.409 -11.716 1.00 0.00 C ATOM 455 O ARG A 27 9.862 5.536 -12.191 1.00 0.00 O ATOM 456 CB ARG A 27 11.115 3.042 -9.945 1.00 0.00 C ATOM 457 CG ARG A 27 12.542 3.278 -10.518 1.00 0.00 C ATOM 458 CD ARG A 27 12.969 2.348 -11.680 1.00 0.00 C ATOM 459 NE ARG A 27 13.311 0.962 -11.234 1.00 0.00 N ATOM 460 CZ ARG A 27 14.496 0.561 -10.754 1.00 0.00 C ATOM 461 NH1 ARG A 27 15.546 1.334 -10.672 1.00 0.00 N ATOM 462 NH2 ARG A 27 14.610 -0.666 -10.332 1.00 0.00 N ATOM 0 H ARG A 27 8.309 3.014 -9.818 1.00 0.00 H new ATOM 0 HA ARG A 27 10.512 5.096 -9.883 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.199 2.904 -8.867 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.732 2.108 -10.357 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.608 4.310 -10.862 1.00 0.00 H new ATOM 0 HG3 ARG A 27 13.261 3.166 -9.706 1.00 0.00 H new ATOM 0 HD2 ARG A 27 12.162 2.298 -12.411 1.00 0.00 H new ATOM 0 HD3 ARG A 27 13.831 2.783 -12.186 1.00 0.00 H new ATOM 0 HE ARG A 27 12.576 0.258 -11.301 1.00 0.00 H new ATOM 0 HH11 ARG A 27 15.491 2.304 -10.984 1.00 0.00 H new ATOM 0 HH12 ARG A 27 16.421 0.968 -10.296 1.00 0.00 H new ATOM 0 HH21 ARG A 27 13.808 -1.296 -10.372 1.00 0.00 H new ATOM 0 HH22 ARG A 27 15.501 -0.997 -9.962 1.00 0.00 H new ATOM 476 N ASN A 28 9.282 3.376 -12.461 1.00 0.00 N ATOM 477 CA ASN A 28 8.803 3.517 -13.865 1.00 0.00 C ATOM 478 C ASN A 28 7.341 2.957 -13.871 1.00 0.00 C ATOM 479 O ASN A 28 6.393 3.738 -13.778 1.00 0.00 O ATOM 480 CB ASN A 28 9.844 2.842 -14.807 1.00 0.00 C ATOM 481 CG ASN A 28 9.473 2.862 -16.292 1.00 0.00 C ATOM 482 OD1 ASN A 28 8.862 1.933 -16.809 1.00 0.00 O ATOM 483 ND2 ASN A 28 9.811 3.901 -17.017 1.00 0.00 N ATOM 0 H ASN A 28 9.252 2.417 -12.115 1.00 0.00 H new ATOM 0 HA ASN A 28 8.739 4.535 -14.249 1.00 0.00 H new ATOM 0 HB2 ASN A 28 10.805 3.341 -14.680 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.978 1.807 -14.494 1.00 0.00 H new ATOM 0 HD21 ASN A 28 9.566 3.934 -18.006 1.00 0.00 H new ATOM 0 HD22 ASN A 28 10.319 4.676 -16.591 1.00 0.00 H new ATOM 490 N ASN A 29 7.160 1.625 -13.930 1.00 0.00 N ATOM 491 CA ASN A 29 5.817 0.971 -13.837 1.00 0.00 C ATOM 492 C ASN A 29 5.763 -0.128 -12.702 1.00 0.00 C ATOM 493 O ASN A 29 4.977 -1.072 -12.809 1.00 0.00 O ATOM 494 CB ASN A 29 5.496 0.403 -15.256 1.00 0.00 C ATOM 495 CG ASN A 29 5.036 1.442 -16.287 1.00 0.00 C ATOM 496 OD1 ASN A 29 3.877 1.836 -16.327 1.00 0.00 O ATOM 497 ND2 ASN A 29 5.899 1.925 -17.149 1.00 0.00 N ATOM 0 H ASN A 29 7.929 0.964 -14.043 1.00 0.00 H new ATOM 0 HA ASN A 29 5.054 1.692 -13.544 1.00 0.00 H new ATOM 0 HB2 ASN A 29 6.386 -0.097 -15.640 1.00 0.00 H new ATOM 0 HB3 ASN A 29 4.721 -0.357 -15.159 1.00 0.00 H new ATOM 0 HD21 ASN A 29 5.600 2.616 -17.837 1.00 0.00 H new ATOM 0 HD22 ASN A 29 6.869 1.609 -17.131 1.00 0.00 H new ATOM 504 N GLN A 30 6.568 -0.028 -11.614 1.00 0.00 N ATOM 505 CA GLN A 30 6.610 -1.022 -10.498 1.00 0.00 C ATOM 506 C GLN A 30 7.036 -0.308 -9.165 1.00 0.00 C ATOM 507 O GLN A 30 7.686 0.747 -9.156 1.00 0.00 O ATOM 508 CB GLN A 30 7.614 -2.178 -10.827 1.00 0.00 C ATOM 509 CG GLN A 30 7.218 -3.230 -11.902 1.00 0.00 C ATOM 510 CD GLN A 30 6.020 -4.149 -11.607 1.00 0.00 C ATOM 511 OE1 GLN A 30 6.137 -5.220 -11.018 1.00 0.00 O ATOM 512 NE2 GLN A 30 4.842 -3.791 -12.055 1.00 0.00 N ATOM 0 H GLN A 30 7.214 0.750 -11.480 1.00 0.00 H new ATOM 0 HA GLN A 30 5.615 -1.451 -10.376 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.552 -1.721 -11.142 1.00 0.00 H new ATOM 0 HB3 GLN A 30 7.816 -2.714 -9.900 1.00 0.00 H new ATOM 0 HG2 GLN A 30 7.009 -2.697 -12.830 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.086 -3.862 -12.086 1.00 0.00 H new ATOM 0 HE21 GLN A 30 4.731 -2.904 -12.546 1.00 0.00 H new ATOM 0 HE22 GLN A 30 4.036 -4.399 -11.913 1.00 0.00 H new ATOM 521 N LEU A 31 6.682 -0.924 -8.024 1.00 0.00 N ATOM 522 CA LEU A 31 6.984 -0.379 -6.669 1.00 0.00 C ATOM 523 C LEU A 31 8.403 -0.787 -6.164 1.00 0.00 C ATOM 524 O LEU A 31 8.639 -1.937 -5.768 1.00 0.00 O ATOM 525 CB LEU A 31 5.902 -0.912 -5.694 1.00 0.00 C ATOM 526 CG LEU A 31 4.505 -0.259 -5.826 1.00 0.00 C ATOM 527 CD1 LEU A 31 3.424 -1.225 -5.332 1.00 0.00 C ATOM 528 CD2 LEU A 31 4.434 1.076 -5.062 1.00 0.00 C ATOM 0 H LEU A 31 6.180 -1.812 -8.004 1.00 0.00 H new ATOM 0 HA LEU A 31 6.974 0.710 -6.718 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.797 -1.986 -5.847 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.256 -0.769 -4.673 1.00 0.00 H new ATOM 0 HG LEU A 31 4.329 -0.043 -6.880 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.445 -0.756 -5.429 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.450 -2.137 -5.929 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.606 -1.471 -4.286 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.440 1.508 -5.176 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.635 0.901 -4.005 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.177 1.765 -5.464 1.00 0.00 H new ATOM 540 N VAL A 32 9.334 0.182 -6.209 1.00 0.00 N ATOM 541 CA VAL A 32 10.727 0.017 -5.696 1.00 0.00 C ATOM 542 C VAL A 32 10.737 0.333 -4.152 1.00 0.00 C ATOM 543 O VAL A 32 9.809 0.904 -3.560 1.00 0.00 O ATOM 544 CB VAL A 32 11.702 0.866 -6.587 1.00 0.00 C ATOM 545 CG1 VAL A 32 13.150 0.961 -6.062 1.00 0.00 C ATOM 546 CG2 VAL A 32 11.817 0.264 -8.009 1.00 0.00 C ATOM 0 H VAL A 32 9.153 1.106 -6.600 1.00 0.00 H new ATOM 0 HA VAL A 32 11.094 -1.006 -5.779 1.00 0.00 H new ATOM 0 HB VAL A 32 11.254 1.859 -6.575 1.00 0.00 H new ATOM 0 HG11 VAL A 32 13.746 1.567 -6.745 1.00 0.00 H new ATOM 0 HG12 VAL A 32 13.149 1.422 -5.074 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.579 -0.039 -5.996 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.498 0.870 -8.607 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.200 -0.754 -7.943 1.00 0.00 H new ATOM 0 HG23 VAL A 32 10.834 0.252 -8.480 1.00 0.00 H new ATOM 556 N ALA A 33 11.795 -0.145 -3.488 1.00 0.00 N ATOM 557 CA ALA A 33 11.926 -0.096 -2.025 1.00 0.00 C ATOM 558 C ALA A 33 13.161 0.626 -1.502 1.00 0.00 C ATOM 559 O ALA A 33 14.266 0.542 -2.052 1.00 0.00 O ATOM 560 CB ALA A 33 12.154 -1.546 -1.571 1.00 0.00 C ATOM 0 H ALA A 33 12.592 -0.580 -3.953 1.00 0.00 H new ATOM 0 HA ALA A 33 11.037 0.418 -1.661 1.00 0.00 H new ATOM 0 HB1 ALA A 33 12.260 -1.575 -0.487 1.00 0.00 H new ATOM 0 HB2 ALA A 33 11.303 -2.159 -1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 33 13.061 -1.934 -2.034 1.00 0.00 H new ATOM 566 N GLY A 34 13.000 1.120 -0.276 1.00 0.00 N ATOM 567 CA GLY A 34 14.141 1.625 0.470 1.00 0.00 C ATOM 568 C GLY A 34 14.545 3.014 0.095 1.00 0.00 C ATOM 569 O GLY A 34 14.087 3.980 0.699 1.00 0.00 O ATOM 0 H GLY A 34 12.106 1.179 0.211 1.00 0.00 H new ATOM 0 HA2 GLY A 34 13.906 1.601 1.534 1.00 0.00 H new ATOM 0 HA3 GLY A 34 14.988 0.957 0.315 1.00 0.00 H new ATOM 573 N TYR A 35 15.497 3.101 -0.820 1.00 0.00 N ATOM 574 CA TYR A 35 15.938 4.455 -1.248 1.00 0.00 C ATOM 575 C TYR A 35 16.562 4.485 -2.689 1.00 0.00 C ATOM 576 O TYR A 35 17.760 4.754 -2.841 1.00 0.00 O ATOM 577 CB TYR A 35 16.912 5.134 -0.199 1.00 0.00 C ATOM 578 CG TYR A 35 16.215 6.217 0.654 1.00 0.00 C ATOM 579 CD1 TYR A 35 15.615 7.325 0.033 1.00 0.00 C ATOM 580 CD2 TYR A 35 16.020 6.020 2.018 1.00 0.00 C ATOM 581 CE1 TYR A 35 14.756 8.146 0.753 1.00 0.00 C ATOM 582 CE2 TYR A 35 15.163 6.846 2.742 1.00 0.00 C ATOM 583 CZ TYR A 35 14.514 7.897 2.098 1.00 0.00 C ATOM 584 OH TYR A 35 13.514 8.584 2.730 1.00 0.00 O ATOM 0 H TYR A 35 15.966 2.314 -1.268 1.00 0.00 H new ATOM 0 HA TYR A 35 15.024 5.047 -1.289 1.00 0.00 H new ATOM 0 HB2 TYR A 35 17.321 4.367 0.459 1.00 0.00 H new ATOM 0 HB3 TYR A 35 17.753 5.581 -0.728 1.00 0.00 H new ATOM 0 HD1 TYR A 35 15.822 7.539 -1.005 1.00 0.00 H new ATOM 0 HD2 TYR A 35 16.539 5.218 2.521 1.00 0.00 H new ATOM 0 HE1 TYR A 35 14.275 8.981 0.265 1.00 0.00 H new ATOM 0 HE2 TYR A 35 15.003 6.673 3.796 1.00 0.00 H new ATOM 0 HH TYR A 35 12.936 9.009 2.062 1.00 0.00 H new ATOM 594 N LEU A 36 15.769 4.379 -3.778 1.00 0.00 N ATOM 595 CA LEU A 36 16.342 4.549 -5.165 1.00 0.00 C ATOM 596 C LEU A 36 16.684 6.032 -5.560 1.00 0.00 C ATOM 597 O LEU A 36 17.674 6.314 -6.238 1.00 0.00 O ATOM 598 CB LEU A 36 15.354 3.864 -6.156 1.00 0.00 C ATOM 599 CG LEU A 36 15.720 3.736 -7.664 1.00 0.00 C ATOM 600 CD1 LEU A 36 15.381 4.992 -8.487 1.00 0.00 C ATOM 601 CD2 LEU A 36 17.178 3.315 -7.911 1.00 0.00 C ATOM 0 H LEU A 36 14.768 4.185 -3.747 1.00 0.00 H new ATOM 0 HA LEU A 36 17.320 4.069 -5.203 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.167 2.857 -5.782 1.00 0.00 H new ATOM 0 HB3 LEU A 36 14.410 4.406 -6.097 1.00 0.00 H new ATOM 0 HG LEU A 36 15.081 2.927 -8.018 1.00 0.00 H new ATOM 0 HD11 LEU A 36 15.663 4.832 -9.528 1.00 0.00 H new ATOM 0 HD12 LEU A 36 14.311 5.188 -8.427 1.00 0.00 H new ATOM 0 HD13 LEU A 36 15.929 5.846 -8.090 1.00 0.00 H new ATOM 0 HD21 LEU A 36 17.360 3.246 -8.983 1.00 0.00 H new ATOM 0 HD22 LEU A 36 17.849 4.055 -7.476 1.00 0.00 H new ATOM 0 HD23 LEU A 36 17.360 2.344 -7.449 1.00 0.00 H new ATOM 613 N GLN A 37 15.812 6.942 -5.166 1.00 0.00 N ATOM 614 CA GLN A 37 15.958 8.412 -5.354 1.00 0.00 C ATOM 615 C GLN A 37 15.103 9.113 -4.253 1.00 0.00 C ATOM 616 O GLN A 37 13.890 8.876 -4.162 1.00 0.00 O ATOM 617 CB GLN A 37 15.514 8.827 -6.791 1.00 0.00 C ATOM 618 CG GLN A 37 15.947 10.239 -7.279 1.00 0.00 C ATOM 619 CD GLN A 37 15.250 11.463 -6.660 1.00 0.00 C ATOM 620 OE1 GLN A 37 14.149 11.406 -6.123 1.00 0.00 O ATOM 621 NE2 GLN A 37 15.863 12.621 -6.734 1.00 0.00 N ATOM 0 H GLN A 37 14.947 6.691 -4.688 1.00 0.00 H new ATOM 0 HA GLN A 37 17.000 8.716 -5.254 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.905 8.090 -7.493 1.00 0.00 H new ATOM 0 HB3 GLN A 37 14.427 8.769 -6.840 1.00 0.00 H new ATOM 0 HG2 GLN A 37 17.018 10.340 -7.102 1.00 0.00 H new ATOM 0 HG3 GLN A 37 15.797 10.280 -8.358 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.779 12.686 -7.177 1.00 0.00 H new ATOM 0 HE22 GLN A 37 15.423 13.456 -6.348 1.00 0.00 H new ATOM 630 N GLY A 38 15.708 9.953 -3.398 1.00 0.00 N ATOM 631 CA GLY A 38 14.929 10.676 -2.361 1.00 0.00 C ATOM 632 C GLY A 38 15.720 11.529 -1.344 1.00 0.00 C ATOM 633 O GLY A 38 15.802 11.091 -0.196 1.00 0.00 O ATOM 0 H GLY A 38 16.709 10.150 -3.396 1.00 0.00 H new ATOM 0 HA2 GLY A 38 14.218 11.329 -2.868 1.00 0.00 H new ATOM 0 HA3 GLY A 38 14.347 9.942 -1.804 1.00 0.00 H new ATOM 637 N PRO A 39 16.257 12.747 -1.656 1.00 0.00 N ATOM 638 CA PRO A 39 16.931 13.619 -0.641 1.00 0.00 C ATOM 639 C PRO A 39 16.022 14.112 0.545 1.00 0.00 C ATOM 640 O PRO A 39 16.464 14.165 1.694 1.00 0.00 O ATOM 641 CB PRO A 39 17.464 14.786 -1.507 1.00 0.00 C ATOM 642 CG PRO A 39 17.448 14.278 -2.952 1.00 0.00 C ATOM 643 CD PRO A 39 16.248 13.335 -3.008 1.00 0.00 C ATOM 0 HA PRO A 39 17.701 13.072 -0.097 1.00 0.00 H new ATOM 0 HB2 PRO A 39 16.838 15.671 -1.397 1.00 0.00 H new ATOM 0 HB3 PRO A 39 18.472 15.069 -1.204 1.00 0.00 H new ATOM 0 HG2 PRO A 39 17.342 15.099 -3.661 1.00 0.00 H new ATOM 0 HG3 PRO A 39 18.374 13.759 -3.201 1.00 0.00 H new ATOM 0 HD2 PRO A 39 15.320 13.868 -3.215 1.00 0.00 H new ATOM 0 HD3 PRO A 39 16.360 12.577 -3.783 1.00 0.00 H new ATOM 651 N ASN A 40 14.769 14.492 0.239 1.00 0.00 N ATOM 652 CA ASN A 40 13.748 14.929 1.231 1.00 0.00 C ATOM 653 C ASN A 40 12.339 14.438 0.738 1.00 0.00 C ATOM 654 O ASN A 40 11.765 13.535 1.348 1.00 0.00 O ATOM 655 CB ASN A 40 13.874 16.465 1.500 1.00 0.00 C ATOM 656 CG ASN A 40 13.813 17.476 0.334 1.00 0.00 C ATOM 657 OD1 ASN A 40 13.634 17.157 -0.838 1.00 0.00 O ATOM 658 ND2 ASN A 40 13.953 18.744 0.627 1.00 0.00 N ATOM 0 H ASN A 40 14.423 14.507 -0.720 1.00 0.00 H new ATOM 0 HA ASN A 40 13.906 14.474 2.209 1.00 0.00 H new ATOM 0 HB2 ASN A 40 13.083 16.734 2.200 1.00 0.00 H new ATOM 0 HB3 ASN A 40 14.822 16.624 2.014 1.00 0.00 H new ATOM 0 HD21 ASN A 40 13.912 19.446 -0.112 1.00 0.00 H new ATOM 0 HD22 ASN A 40 14.103 19.030 1.594 1.00 0.00 H new ATOM 665 N VAL A 41 11.796 14.996 -0.362 1.00 0.00 N ATOM 666 CA VAL A 41 10.494 14.574 -0.956 1.00 0.00 C ATOM 667 C VAL A 41 10.605 14.833 -2.500 1.00 0.00 C ATOM 668 O VAL A 41 10.482 15.964 -2.982 1.00 0.00 O ATOM 669 CB VAL A 41 9.288 15.283 -0.236 1.00 0.00 C ATOM 670 CG1 VAL A 41 9.240 16.829 -0.283 1.00 0.00 C ATOM 671 CG2 VAL A 41 7.927 14.725 -0.708 1.00 0.00 C ATOM 0 H VAL A 41 12.244 15.757 -0.873 1.00 0.00 H new ATOM 0 HA VAL A 41 10.286 13.515 -0.805 1.00 0.00 H new ATOM 0 HB VAL A 41 9.480 15.037 0.808 1.00 0.00 H new ATOM 0 HG11 VAL A 41 8.358 17.182 0.252 1.00 0.00 H new ATOM 0 HG12 VAL A 41 10.136 17.235 0.186 1.00 0.00 H new ATOM 0 HG13 VAL A 41 9.192 17.160 -1.320 1.00 0.00 H new ATOM 0 HG21 VAL A 41 7.121 15.242 -0.186 1.00 0.00 H new ATOM 0 HG22 VAL A 41 7.823 14.881 -1.782 1.00 0.00 H new ATOM 0 HG23 VAL A 41 7.875 13.658 -0.489 1.00 0.00 H new ATOM 681 N ASN A 42 10.931 13.784 -3.276 1.00 0.00 N ATOM 682 CA ASN A 42 11.064 13.868 -4.763 1.00 0.00 C ATOM 683 C ASN A 42 10.260 12.673 -5.373 1.00 0.00 C ATOM 684 O ASN A 42 9.081 12.851 -5.685 1.00 0.00 O ATOM 685 CB ASN A 42 12.577 13.906 -5.153 1.00 0.00 C ATOM 686 CG ASN A 42 13.451 15.158 -4.994 1.00 0.00 C ATOM 687 OD1 ASN A 42 14.608 15.140 -5.402 1.00 0.00 O ATOM 688 ND2 ASN A 42 13.013 16.253 -4.422 1.00 0.00 N ATOM 0 H ASN A 42 11.112 12.852 -2.903 1.00 0.00 H new ATOM 0 HA ASN A 42 10.643 14.786 -5.172 1.00 0.00 H new ATOM 0 HB2 ASN A 42 13.063 13.115 -4.582 1.00 0.00 H new ATOM 0 HB3 ASN A 42 12.633 13.621 -6.204 1.00 0.00 H new ATOM 0 HD21 ASN A 42 13.629 17.060 -4.326 1.00 0.00 H new ATOM 0 HD22 ASN A 42 12.056 16.298 -4.073 1.00 0.00 H new ATOM 695 N LEU A 43 10.849 11.467 -5.525 1.00 0.00 N ATOM 696 CA LEU A 43 10.107 10.260 -6.010 1.00 0.00 C ATOM 697 C LEU A 43 9.209 9.593 -4.899 1.00 0.00 C ATOM 698 O LEU A 43 8.156 9.046 -5.240 1.00 0.00 O ATOM 699 CB LEU A 43 11.155 9.269 -6.615 1.00 0.00 C ATOM 700 CG LEU A 43 11.398 9.299 -8.151 1.00 0.00 C ATOM 701 CD1 LEU A 43 10.186 8.776 -8.945 1.00 0.00 C ATOM 702 CD2 LEU A 43 11.832 10.669 -8.699 1.00 0.00 C ATOM 0 H LEU A 43 11.833 11.293 -5.322 1.00 0.00 H new ATOM 0 HA LEU A 43 9.394 10.560 -6.778 1.00 0.00 H new ATOM 0 HB2 LEU A 43 12.110 9.455 -6.124 1.00 0.00 H new ATOM 0 HB3 LEU A 43 10.850 8.258 -6.346 1.00 0.00 H new ATOM 0 HG LEU A 43 12.239 8.622 -8.298 1.00 0.00 H new ATOM 0 HD11 LEU A 43 10.405 8.817 -10.012 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.979 7.745 -8.656 1.00 0.00 H new ATOM 0 HD13 LEU A 43 9.315 9.395 -8.729 1.00 0.00 H new ATOM 0 HD21 LEU A 43 11.979 10.600 -9.777 1.00 0.00 H new ATOM 0 HD22 LEU A 43 11.060 11.408 -8.485 1.00 0.00 H new ATOM 0 HD23 LEU A 43 12.765 10.972 -8.224 1.00 0.00 H new ATOM 714 N GLU A 44 9.591 9.620 -3.602 1.00 0.00 N ATOM 715 CA GLU A 44 8.750 9.098 -2.491 1.00 0.00 C ATOM 716 C GLU A 44 7.661 10.136 -2.060 1.00 0.00 C ATOM 717 O GLU A 44 7.990 11.283 -1.732 1.00 0.00 O ATOM 718 CB GLU A 44 9.674 8.684 -1.310 1.00 0.00 C ATOM 719 CG GLU A 44 10.523 9.769 -0.581 1.00 0.00 C ATOM 720 CD GLU A 44 10.846 9.419 0.854 1.00 0.00 C ATOM 721 OE1 GLU A 44 11.734 8.580 1.091 1.00 0.00 O ATOM 722 OE2 GLU A 44 10.165 9.940 1.761 1.00 0.00 O ATOM 0 H GLU A 44 10.485 10.001 -3.293 1.00 0.00 H new ATOM 0 HA GLU A 44 8.204 8.217 -2.830 1.00 0.00 H new ATOM 0 HB2 GLU A 44 9.048 8.201 -0.560 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.363 7.928 -1.685 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.454 9.919 -1.128 1.00 0.00 H new ATOM 0 HG3 GLU A 44 9.984 10.716 -0.603 1.00 0.00 H new ATOM 729 N GLU A 45 6.368 9.738 -2.023 1.00 0.00 N ATOM 730 CA GLU A 45 5.278 10.697 -1.664 1.00 0.00 C ATOM 731 C GLU A 45 4.286 10.120 -0.575 1.00 0.00 C ATOM 732 O GLU A 45 4.703 9.335 0.289 1.00 0.00 O ATOM 733 CB GLU A 45 4.646 11.018 -3.080 1.00 0.00 C ATOM 734 CG GLU A 45 4.474 12.525 -3.425 1.00 0.00 C ATOM 735 CD GLU A 45 3.306 13.312 -2.846 1.00 0.00 C ATOM 736 OE1 GLU A 45 2.671 12.869 -1.867 1.00 0.00 O ATOM 737 OE2 GLU A 45 3.018 14.399 -3.386 1.00 0.00 O ATOM 0 H GLU A 45 6.052 8.790 -2.229 1.00 0.00 H new ATOM 0 HA GLU A 45 5.614 11.604 -1.161 1.00 0.00 H new ATOM 0 HB2 GLU A 45 5.270 10.559 -3.847 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.668 10.539 -3.136 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.389 13.033 -3.121 1.00 0.00 H new ATOM 0 HG3 GLU A 45 4.411 12.604 -4.510 1.00 0.00 H new ATOM 744 N LYS A 46 2.972 10.403 -0.656 1.00 0.00 N ATOM 745 CA LYS A 46 1.910 9.928 0.292 1.00 0.00 C ATOM 746 C LYS A 46 0.470 10.323 -0.233 1.00 0.00 C ATOM 747 O LYS A 46 0.318 10.869 -1.330 1.00 0.00 O ATOM 748 CB LYS A 46 2.206 10.537 1.723 1.00 0.00 C ATOM 749 CG LYS A 46 2.367 12.076 1.884 1.00 0.00 C ATOM 750 CD LYS A 46 1.071 12.927 1.947 1.00 0.00 C ATOM 751 CE LYS A 46 0.303 12.903 3.285 1.00 0.00 C ATOM 752 NZ LYS A 46 1.138 13.524 4.346 1.00 0.00 N ATOM 0 H LYS A 46 2.594 10.986 -1.402 1.00 0.00 H new ATOM 0 HA LYS A 46 1.927 8.840 0.360 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.399 10.222 2.385 1.00 0.00 H new ATOM 0 HB3 LYS A 46 3.120 10.073 2.092 1.00 0.00 H new ATOM 0 HG2 LYS A 46 2.936 12.262 2.795 1.00 0.00 H new ATOM 0 HG3 LYS A 46 2.969 12.441 1.052 1.00 0.00 H new ATOM 0 HD2 LYS A 46 1.329 13.961 1.719 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.399 12.585 1.160 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.639 13.443 3.186 1.00 0.00 H new ATOM 0 HE3 LYS A 46 0.055 11.877 3.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 0.522 13.923 5.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 1.758 12.803 4.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 1.719 14.281 3.932 1.00 0.00 H new ATOM 766 N ILE A 47 -0.571 10.046 0.587 1.00 0.00 N ATOM 767 CA ILE A 47 -1.901 10.759 0.568 1.00 0.00 C ATOM 768 C ILE A 47 -2.981 9.907 1.283 1.00 0.00 C ATOM 769 O ILE A 47 -3.073 9.979 2.504 1.00 0.00 O ATOM 770 CB ILE A 47 -2.395 11.604 -0.697 1.00 0.00 C ATOM 771 CG1 ILE A 47 -3.554 12.596 -0.343 1.00 0.00 C ATOM 772 CG2 ILE A 47 -2.888 10.820 -1.927 1.00 0.00 C ATOM 773 CD1 ILE A 47 -3.182 13.735 0.626 1.00 0.00 C ATOM 0 H ILE A 47 -0.525 9.314 1.295 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.675 11.656 1.144 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.465 12.104 -0.967 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.926 13.037 -1.268 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -4.375 12.027 0.092 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -3.191 11.519 -2.707 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.084 10.186 -2.301 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.739 10.199 -1.646 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -4.056 14.362 0.803 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -2.841 13.312 1.571 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -2.385 14.338 0.190 1.00 0.00 H new ATOM 785 N ASP A 48 -3.800 9.164 0.578 1.00 0.00 N ATOM 786 CA ASP A 48 -5.085 8.643 1.132 1.00 0.00 C ATOM 787 C ASP A 48 -5.180 7.108 1.417 1.00 0.00 C ATOM 788 O ASP A 48 -4.966 6.285 0.524 1.00 0.00 O ATOM 789 CB ASP A 48 -6.117 9.113 0.061 1.00 0.00 C ATOM 790 CG ASP A 48 -7.564 9.181 0.532 1.00 0.00 C ATOM 791 OD1 ASP A 48 -8.163 8.114 0.786 1.00 0.00 O ATOM 792 OD2 ASP A 48 -8.120 10.292 0.609 1.00 0.00 O ATOM 0 H ASP A 48 -3.623 8.890 -0.388 1.00 0.00 H new ATOM 0 HA ASP A 48 -5.244 9.024 2.141 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -5.822 10.100 -0.294 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -6.062 8.437 -0.793 1.00 0.00 H new ATOM 797 N VAL A 49 -5.606 6.711 2.632 1.00 0.00 N ATOM 798 CA VAL A 49 -5.888 5.278 2.975 1.00 0.00 C ATOM 799 C VAL A 49 -7.430 5.073 3.167 1.00 0.00 C ATOM 800 O VAL A 49 -8.114 5.877 3.811 1.00 0.00 O ATOM 801 CB VAL A 49 -5.096 4.816 4.245 1.00 0.00 C ATOM 802 CG1 VAL A 49 -5.487 5.481 5.585 1.00 0.00 C ATOM 803 CG2 VAL A 49 -5.149 3.289 4.466 1.00 0.00 C ATOM 0 H VAL A 49 -5.767 7.357 3.405 1.00 0.00 H new ATOM 0 HA VAL A 49 -5.547 4.656 2.147 1.00 0.00 H new ATOM 0 HB VAL A 49 -4.090 5.151 3.992 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -4.868 5.077 6.386 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.333 6.558 5.515 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.536 5.277 5.800 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.582 3.031 5.361 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -6.185 2.975 4.590 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -4.717 2.781 3.604 1.00 0.00 H new ATOM 813 N VAL A 50 -7.972 3.980 2.603 1.00 0.00 N ATOM 814 CA VAL A 50 -9.400 3.598 2.813 1.00 0.00 C ATOM 815 C VAL A 50 -9.384 2.138 3.410 1.00 0.00 C ATOM 816 O VAL A 50 -8.886 1.218 2.738 1.00 0.00 O ATOM 817 CB VAL A 50 -10.241 3.799 1.506 1.00 0.00 C ATOM 818 CG1 VAL A 50 -11.569 3.007 1.451 1.00 0.00 C ATOM 819 CG2 VAL A 50 -10.641 5.294 1.390 1.00 0.00 C ATOM 0 H VAL A 50 -7.455 3.341 1.999 1.00 0.00 H new ATOM 0 HA VAL A 50 -9.913 4.244 3.525 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.598 3.440 0.703 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -12.077 3.213 0.509 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -11.360 1.940 1.525 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -12.208 3.309 2.281 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -11.227 5.445 0.483 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -11.235 5.580 2.258 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -9.742 5.909 1.347 1.00 0.00 H new ATOM 829 N PRO A 51 -9.934 1.867 4.639 1.00 0.00 N ATOM 830 CA PRO A 51 -9.962 0.504 5.216 1.00 0.00 C ATOM 831 C PRO A 51 -11.022 -0.494 4.647 1.00 0.00 C ATOM 832 O PRO A 51 -12.113 -0.146 4.185 1.00 0.00 O ATOM 833 CB PRO A 51 -10.248 0.756 6.719 1.00 0.00 C ATOM 834 CG PRO A 51 -10.132 2.259 6.940 1.00 0.00 C ATOM 835 CD PRO A 51 -10.459 2.878 5.584 1.00 0.00 C ATOM 0 HA PRO A 51 -9.022 0.008 4.976 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.243 0.401 6.989 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -9.536 0.217 7.344 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -10.825 2.601 7.708 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.130 2.534 7.269 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -11.530 3.036 5.457 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -9.977 3.846 5.452 1.00 0.00 H new ATOM 843 N ILE A 52 -10.636 -1.766 4.756 1.00 0.00 N ATOM 844 CA ILE A 52 -11.492 -2.960 4.519 1.00 0.00 C ATOM 845 C ILE A 52 -11.713 -3.555 5.979 1.00 0.00 C ATOM 846 O ILE A 52 -10.873 -3.408 6.880 1.00 0.00 O ATOM 847 CB ILE A 52 -10.834 -3.960 3.493 1.00 0.00 C ATOM 848 CG1 ILE A 52 -10.352 -3.314 2.153 1.00 0.00 C ATOM 849 CG2 ILE A 52 -11.807 -5.110 3.111 1.00 0.00 C ATOM 850 CD1 ILE A 52 -11.378 -2.534 1.310 1.00 0.00 C ATOM 0 H ILE A 52 -9.684 -2.017 5.022 1.00 0.00 H new ATOM 0 HA ILE A 52 -12.446 -2.730 4.044 1.00 0.00 H new ATOM 0 HB ILE A 52 -9.959 -4.326 4.031 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.530 -2.637 2.387 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -9.943 -4.108 1.529 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -11.319 -5.779 2.402 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -12.081 -5.667 4.007 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -12.704 -4.691 2.656 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -10.893 -2.147 0.413 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -12.194 -3.198 1.024 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.774 -1.704 1.895 1.00 0.00 H new ATOM 862 N GLU A 53 -12.768 -4.352 6.219 1.00 0.00 N ATOM 863 CA GLU A 53 -13.156 -4.734 7.616 1.00 0.00 C ATOM 864 C GLU A 53 -12.241 -5.764 8.396 1.00 0.00 C ATOM 865 O GLU A 53 -12.018 -5.468 9.576 1.00 0.00 O ATOM 866 CB GLU A 53 -14.619 -5.275 7.576 1.00 0.00 C ATOM 867 CG GLU A 53 -15.731 -4.381 6.957 1.00 0.00 C ATOM 868 CD GLU A 53 -15.888 -2.978 7.525 1.00 0.00 C ATOM 869 OE1 GLU A 53 -16.657 -2.806 8.496 1.00 0.00 O ATOM 870 OE2 GLU A 53 -15.338 -2.025 6.934 1.00 0.00 O ATOM 0 H GLU A 53 -13.365 -4.744 5.491 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.031 -3.816 8.190 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.608 -6.216 7.026 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.913 -5.507 8.600 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -15.539 -4.294 5.888 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -16.683 -4.900 7.068 1.00 0.00 H new ATOM 877 N PRO A 54 -11.667 -6.913 7.911 1.00 0.00 N ATOM 878 CA PRO A 54 -10.832 -7.815 8.764 1.00 0.00 C ATOM 879 C PRO A 54 -9.332 -7.372 8.927 1.00 0.00 C ATOM 880 O PRO A 54 -8.407 -8.102 8.559 1.00 0.00 O ATOM 881 CB PRO A 54 -11.044 -9.149 8.018 1.00 0.00 C ATOM 882 CG PRO A 54 -11.139 -8.767 6.537 1.00 0.00 C ATOM 883 CD PRO A 54 -11.840 -7.405 6.534 1.00 0.00 C ATOM 0 HA PRO A 54 -11.118 -7.837 9.816 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -10.217 -9.836 8.196 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -11.952 -9.649 8.355 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -10.152 -8.706 6.079 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.707 -9.506 5.972 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.391 -6.727 5.808 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -12.894 -7.499 6.273 1.00 0.00 H new ATOM 891 N HIS A 55 -9.100 -6.181 9.524 1.00 0.00 N ATOM 892 CA HIS A 55 -7.735 -5.561 9.709 1.00 0.00 C ATOM 893 C HIS A 55 -6.877 -5.498 8.383 1.00 0.00 C ATOM 894 O HIS A 55 -5.712 -5.906 8.329 1.00 0.00 O ATOM 895 CB HIS A 55 -6.996 -6.299 10.872 1.00 0.00 C ATOM 896 CG HIS A 55 -7.495 -5.955 12.276 1.00 0.00 C ATOM 897 ND1 HIS A 55 -7.094 -4.826 12.988 1.00 0.00 N ATOM 898 CD2 HIS A 55 -8.391 -6.731 13.030 1.00 0.00 C ATOM 899 CE1 HIS A 55 -7.815 -5.036 14.141 1.00 0.00 C ATOM 900 NE2 HIS A 55 -8.613 -6.141 14.260 1.00 0.00 N ATOM 0 H HIS A 55 -9.852 -5.604 9.901 1.00 0.00 H new ATOM 0 HA HIS A 55 -7.874 -4.514 9.979 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -7.095 -7.374 10.721 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.933 -6.065 10.813 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -8.841 -7.655 12.697 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -7.751 -4.327 14.953 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -9.203 -6.443 15.035 1.00 0.00 H new ATOM 908 N ALA A 56 -7.476 -4.957 7.310 1.00 0.00 N ATOM 909 CA ALA A 56 -6.866 -4.867 5.966 1.00 0.00 C ATOM 910 C ALA A 56 -7.184 -3.488 5.349 1.00 0.00 C ATOM 911 O ALA A 56 -8.248 -2.926 5.601 1.00 0.00 O ATOM 912 CB ALA A 56 -7.427 -6.026 5.120 1.00 0.00 C ATOM 0 H ALA A 56 -8.415 -4.561 7.349 1.00 0.00 H new ATOM 0 HA ALA A 56 -5.780 -4.955 6.010 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.996 -5.988 4.120 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.172 -6.976 5.590 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.511 -5.935 5.051 1.00 0.00 H new ATOM 918 N LEU A 57 -6.262 -2.900 4.579 1.00 0.00 N ATOM 919 CA LEU A 57 -6.456 -1.526 4.034 1.00 0.00 C ATOM 920 C LEU A 57 -5.844 -1.370 2.609 1.00 0.00 C ATOM 921 O LEU A 57 -4.989 -2.156 2.182 1.00 0.00 O ATOM 922 CB LEU A 57 -5.783 -0.510 5.023 1.00 0.00 C ATOM 923 CG LEU A 57 -6.389 -0.362 6.446 1.00 0.00 C ATOM 924 CD1 LEU A 57 -5.667 -1.217 7.508 1.00 0.00 C ATOM 925 CD2 LEU A 57 -6.410 1.090 6.951 1.00 0.00 C ATOM 0 H LEU A 57 -5.379 -3.337 4.314 1.00 0.00 H new ATOM 0 HA LEU A 57 -7.524 -1.330 3.943 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.737 -0.796 5.134 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.796 0.473 4.551 1.00 0.00 H new ATOM 0 HG LEU A 57 -7.412 -0.719 6.324 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.140 -1.067 8.479 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.730 -2.270 7.232 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.620 -0.919 7.565 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -6.845 1.122 7.950 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.392 1.478 6.987 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -7.008 1.702 6.275 1.00 0.00 H new ATOM 937 N PHE A 58 -6.293 -0.334 1.870 1.00 0.00 N ATOM 938 CA PHE A 58 -5.711 -0.029 0.515 1.00 0.00 C ATOM 939 C PHE A 58 -5.322 1.484 0.378 1.00 0.00 C ATOM 940 O PHE A 58 -5.861 2.350 1.081 1.00 0.00 O ATOM 941 CB PHE A 58 -6.655 -0.587 -0.584 1.00 0.00 C ATOM 942 CG PHE A 58 -7.896 0.173 -1.072 1.00 0.00 C ATOM 943 CD1 PHE A 58 -9.090 0.125 -0.347 1.00 0.00 C ATOM 944 CD2 PHE A 58 -7.891 0.739 -2.351 1.00 0.00 C ATOM 945 CE1 PHE A 58 -10.265 0.628 -0.900 1.00 0.00 C ATOM 946 CE2 PHE A 58 -9.070 1.229 -2.906 1.00 0.00 C ATOM 947 CZ PHE A 58 -10.256 1.179 -2.179 1.00 0.00 C ATOM 0 H PHE A 58 -7.036 0.299 2.165 1.00 0.00 H new ATOM 0 HA PHE A 58 -4.759 -0.543 0.382 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -6.036 -0.770 -1.463 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -7.003 -1.558 -0.232 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -9.101 -0.303 0.644 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -6.969 0.796 -2.910 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -11.185 0.591 -0.336 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -9.064 1.648 -3.901 1.00 0.00 H new ATOM 0 HZ PHE A 58 -11.169 1.567 -2.607 1.00 0.00 H new ATOM 957 N LEU A 59 -4.325 1.796 -0.487 1.00 0.00 N ATOM 958 CA LEU A 59 -3.746 3.186 -0.566 1.00 0.00 C ATOM 959 C LEU A 59 -4.056 3.975 -1.879 1.00 0.00 C ATOM 960 O LEU A 59 -4.481 3.447 -2.903 1.00 0.00 O ATOM 961 CB LEU A 59 -2.188 3.083 -0.324 1.00 0.00 C ATOM 962 CG LEU A 59 -1.577 3.572 1.014 1.00 0.00 C ATOM 963 CD1 LEU A 59 -1.509 5.108 1.091 1.00 0.00 C ATOM 964 CD2 LEU A 59 -2.285 3.011 2.248 1.00 0.00 C ATOM 0 H LEU A 59 -3.904 1.128 -1.133 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.239 3.774 0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -1.910 2.036 -0.444 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.698 3.636 -1.125 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.561 3.178 1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.074 5.406 2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.891 5.486 0.277 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.514 5.521 1.005 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.805 3.395 3.148 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.332 3.315 2.237 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.223 1.923 2.240 1.00 0.00 H new ATOM 976 N GLY A 60 -3.803 5.285 -1.808 1.00 0.00 N ATOM 977 CA GLY A 60 -3.921 6.257 -2.921 1.00 0.00 C ATOM 978 C GLY A 60 -2.733 7.233 -2.803 1.00 0.00 C ATOM 979 O GLY A 60 -2.547 7.810 -1.726 1.00 0.00 O ATOM 0 H GLY A 60 -3.497 5.725 -0.940 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -3.903 5.744 -3.883 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -4.868 6.795 -2.863 1.00 0.00 H new ATOM 983 N ILE A 61 -1.925 7.411 -3.865 1.00 0.00 N ATOM 984 CA ILE A 61 -0.704 8.282 -3.804 1.00 0.00 C ATOM 985 C ILE A 61 -0.936 9.482 -4.799 1.00 0.00 C ATOM 986 O ILE A 61 -1.433 9.330 -5.932 1.00 0.00 O ATOM 987 CB ILE A 61 0.592 7.423 -4.087 1.00 0.00 C ATOM 988 CG1 ILE A 61 0.797 6.296 -3.019 1.00 0.00 C ATOM 989 CG2 ILE A 61 1.867 8.311 -4.088 1.00 0.00 C ATOM 990 CD1 ILE A 61 1.882 5.250 -3.339 1.00 0.00 C ATOM 0 H ILE A 61 -2.081 6.974 -4.773 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.540 8.704 -2.813 1.00 0.00 H new ATOM 0 HB ILE A 61 0.442 6.972 -5.068 1.00 0.00 H new ATOM 0 HG12 ILE A 61 1.043 6.766 -2.067 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -0.151 5.776 -2.882 1.00 0.00 H new ATOM 0 HG21 ILE A 61 2.742 7.691 -4.285 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.779 9.073 -4.863 1.00 0.00 H new ATOM 0 HG23 ILE A 61 1.976 8.793 -3.116 1.00 0.00 H new ATOM 0 HD11 ILE A 61 1.934 4.521 -2.530 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.634 4.741 -4.271 1.00 0.00 H new ATOM 0 HD13 ILE A 61 2.847 5.747 -3.443 1.00 0.00 H new ATOM 1002 N HIS A 62 -0.513 10.670 -4.317 1.00 0.00 N ATOM 1003 CA HIS A 62 -0.716 11.990 -4.981 1.00 0.00 C ATOM 1004 C HIS A 62 0.031 12.281 -6.324 1.00 0.00 C ATOM 1005 O HIS A 62 -0.351 13.251 -6.989 1.00 0.00 O ATOM 1006 CB HIS A 62 -0.317 13.024 -3.889 1.00 0.00 C ATOM 1007 CG HIS A 62 -0.825 14.448 -4.092 1.00 0.00 C ATOM 1008 ND1 HIS A 62 -2.156 14.820 -3.937 1.00 0.00 N ATOM 1009 CD2 HIS A 62 -0.026 15.559 -4.404 1.00 0.00 C ATOM 1010 CE1 HIS A 62 -2.033 16.162 -4.194 1.00 0.00 C ATOM 1011 NE2 HIS A 62 -0.805 16.699 -4.481 1.00 0.00 N ATOM 0 H HIS A 62 -0.008 10.747 -3.434 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.750 12.031 -5.324 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -0.682 12.664 -2.927 1.00 0.00 H new ATOM 0 HB3 HIS A 62 0.771 13.054 -3.827 1.00 0.00 H new ATOM 0 HD2 HIS A 62 1.042 15.528 -4.561 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -2.906 16.797 -4.170 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.542 17.662 -4.691 1.00 0.00 H new ATOM 1019 N GLY A 63 1.051 11.510 -6.759 1.00 0.00 N ATOM 1020 CA GLY A 63 1.707 11.729 -8.086 1.00 0.00 C ATOM 1021 C GLY A 63 0.846 11.255 -9.286 1.00 0.00 C ATOM 1022 O GLY A 63 1.220 10.335 -10.013 1.00 0.00 O ATOM 0 H GLY A 63 1.442 10.735 -6.223 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.927 12.790 -8.203 1.00 0.00 H new ATOM 0 HA3 GLY A 63 2.661 11.202 -8.103 1.00 0.00 H new ATOM 1026 N GLY A 64 -0.284 11.945 -9.489 1.00 0.00 N ATOM 1027 CA GLY A 64 -1.312 11.587 -10.489 1.00 0.00 C ATOM 1028 C GLY A 64 -2.626 11.212 -9.778 1.00 0.00 C ATOM 1029 O GLY A 64 -3.391 12.073 -9.337 1.00 0.00 O ATOM 0 H GLY A 64 -0.518 12.783 -8.956 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -1.481 12.425 -11.166 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -0.965 10.751 -11.096 1.00 0.00 H new ATOM 1033 N LYS A 65 -2.887 9.905 -9.716 1.00 0.00 N ATOM 1034 CA LYS A 65 -4.091 9.310 -9.058 1.00 0.00 C ATOM 1035 C LYS A 65 -3.803 7.776 -8.926 1.00 0.00 C ATOM 1036 O LYS A 65 -4.440 6.932 -9.576 1.00 0.00 O ATOM 1037 CB LYS A 65 -5.414 9.675 -9.823 1.00 0.00 C ATOM 1038 CG LYS A 65 -5.450 9.900 -11.369 1.00 0.00 C ATOM 1039 CD LYS A 65 -6.019 8.755 -12.234 1.00 0.00 C ATOM 1040 CE LYS A 65 -7.552 8.570 -12.227 1.00 0.00 C ATOM 1041 NZ LYS A 65 -8.275 9.754 -12.765 1.00 0.00 N ATOM 0 H LYS A 65 -2.268 9.204 -10.123 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.264 9.722 -8.064 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -6.130 8.882 -9.606 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -5.799 10.586 -9.365 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -6.037 10.797 -11.567 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.433 10.104 -11.705 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.702 8.918 -13.264 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.563 7.822 -11.904 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.811 7.692 -12.818 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -7.886 8.378 -11.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -9.062 9.437 -13.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -8.648 10.320 -11.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.621 10.334 -13.328 1.00 0.00 H new ATOM 1055 N MET A 66 -2.824 7.428 -8.050 1.00 0.00 N ATOM 1056 CA MET A 66 -2.288 6.040 -7.978 1.00 0.00 C ATOM 1057 C MET A 66 -2.948 5.165 -6.869 1.00 0.00 C ATOM 1058 O MET A 66 -2.545 5.210 -5.704 1.00 0.00 O ATOM 1059 CB MET A 66 -0.748 6.202 -7.781 1.00 0.00 C ATOM 1060 CG MET A 66 0.094 6.342 -9.070 1.00 0.00 C ATOM 1061 SD MET A 66 -0.323 7.834 -9.995 1.00 0.00 S ATOM 1062 CE MET A 66 -1.132 7.138 -11.449 1.00 0.00 C ATOM 0 H MET A 66 -2.394 8.078 -7.392 1.00 0.00 H new ATOM 0 HA MET A 66 -2.523 5.492 -8.890 1.00 0.00 H new ATOM 0 HB2 MET A 66 -0.573 7.081 -7.160 1.00 0.00 H new ATOM 0 HB3 MET A 66 -0.381 5.340 -7.224 1.00 0.00 H new ATOM 0 HG2 MET A 66 1.153 6.361 -8.811 1.00 0.00 H new ATOM 0 HG3 MET A 66 -0.064 5.468 -9.702 1.00 0.00 H new ATOM 0 HE1 MET A 66 -1.444 7.944 -12.112 1.00 0.00 H new ATOM 0 HE2 MET A 66 -0.436 6.485 -11.975 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.005 6.564 -11.140 1.00 0.00 H new ATOM 1072 N CYS A 67 -3.934 4.335 -7.250 1.00 0.00 N ATOM 1073 CA CYS A 67 -4.632 3.399 -6.335 1.00 0.00 C ATOM 1074 C CYS A 67 -3.804 2.101 -6.086 1.00 0.00 C ATOM 1075 O CYS A 67 -3.719 1.206 -6.931 1.00 0.00 O ATOM 1076 CB CYS A 67 -6.004 3.109 -6.983 1.00 0.00 C ATOM 1077 SG CYS A 67 -6.877 1.726 -6.161 1.00 0.00 S ATOM 0 H CYS A 67 -4.276 4.290 -8.210 1.00 0.00 H new ATOM 0 HA CYS A 67 -4.760 3.838 -5.346 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -6.622 4.005 -6.937 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -5.863 2.872 -8.038 1.00 0.00 H new ATOM 0 HG CYS A 67 -8.022 1.528 -6.744 1.00 0.00 H new ATOM 1083 N LEU A 68 -3.180 2.023 -4.902 1.00 0.00 N ATOM 1084 CA LEU A 68 -2.387 0.853 -4.462 1.00 0.00 C ATOM 1085 C LEU A 68 -3.345 -0.292 -3.996 1.00 0.00 C ATOM 1086 O LEU A 68 -3.959 -0.239 -2.912 1.00 0.00 O ATOM 1087 CB LEU A 68 -1.430 1.334 -3.341 1.00 0.00 C ATOM 1088 CG LEU A 68 -0.386 0.353 -2.741 1.00 0.00 C ATOM 1089 CD1 LEU A 68 -0.962 -0.722 -1.803 1.00 0.00 C ATOM 1090 CD2 LEU A 68 0.469 -0.305 -3.830 1.00 0.00 C ATOM 0 H LEU A 68 -3.208 2.774 -4.212 1.00 0.00 H new ATOM 0 HA LEU A 68 -1.791 0.439 -5.275 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.883 2.194 -3.728 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -2.048 1.693 -2.518 1.00 0.00 H new ATOM 0 HG LEU A 68 0.241 0.989 -2.116 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -0.154 -1.356 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -1.457 -0.241 -0.959 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -1.683 -1.331 -2.348 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.186 -0.984 -3.369 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.174 -0.864 -4.509 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.004 0.464 -4.387 1.00 0.00 H new ATOM 1102 N SER A 69 -3.368 -1.304 -4.879 1.00 0.00 N ATOM 1103 CA SER A 69 -4.202 -2.527 -4.800 1.00 0.00 C ATOM 1104 C SER A 69 -3.381 -3.801 -5.194 1.00 0.00 C ATOM 1105 O SER A 69 -2.340 -3.736 -5.865 1.00 0.00 O ATOM 1106 CB SER A 69 -5.380 -2.309 -5.785 1.00 0.00 C ATOM 1107 OG SER A 69 -4.942 -2.184 -7.143 1.00 0.00 O ATOM 0 H SER A 69 -2.778 -1.296 -5.711 1.00 0.00 H new ATOM 0 HA SER A 69 -4.556 -2.692 -3.782 1.00 0.00 H new ATOM 0 HB2 SER A 69 -6.075 -3.145 -5.706 1.00 0.00 H new ATOM 0 HB3 SER A 69 -5.928 -1.411 -5.499 1.00 0.00 H new ATOM 0 HG SER A 69 -5.541 -1.576 -7.625 1.00 0.00 H new ATOM 1113 N CYS A 70 -3.857 -4.990 -4.778 1.00 0.00 N ATOM 1114 CA CYS A 70 -3.250 -6.281 -5.200 1.00 0.00 C ATOM 1115 C CYS A 70 -4.019 -6.780 -6.469 1.00 0.00 C ATOM 1116 O CYS A 70 -5.038 -7.474 -6.406 1.00 0.00 O ATOM 1117 CB CYS A 70 -3.278 -7.230 -3.992 1.00 0.00 C ATOM 1118 SG CYS A 70 -2.568 -8.842 -4.454 1.00 0.00 S ATOM 0 H CYS A 70 -4.656 -5.090 -4.153 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.204 -6.203 -5.496 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -2.714 -6.798 -3.166 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -4.303 -7.360 -3.644 1.00 0.00 H new ATOM 0 HG CYS A 70 -2.594 -9.638 -3.426 1.00 0.00 H new ATOM 1124 N VAL A 71 -3.519 -6.355 -7.641 1.00 0.00 N ATOM 1125 CA VAL A 71 -4.153 -6.623 -8.960 1.00 0.00 C ATOM 1126 C VAL A 71 -3.641 -7.987 -9.548 1.00 0.00 C ATOM 1127 O VAL A 71 -2.442 -8.204 -9.766 1.00 0.00 O ATOM 1128 CB VAL A 71 -3.901 -5.351 -9.852 1.00 0.00 C ATOM 1129 CG1 VAL A 71 -2.448 -5.080 -10.310 1.00 0.00 C ATOM 1130 CG2 VAL A 71 -4.824 -5.294 -11.085 1.00 0.00 C ATOM 0 H VAL A 71 -2.658 -5.812 -7.710 1.00 0.00 H new ATOM 0 HA VAL A 71 -5.232 -6.765 -8.896 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.141 -4.556 -9.146 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.420 -4.174 -10.916 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -1.809 -4.952 -9.436 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -2.090 -5.923 -10.901 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.605 -4.396 -11.662 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -4.657 -6.174 -11.706 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.864 -5.272 -10.760 1.00 0.00 H new ATOM 1140 N LYS A 72 -4.578 -8.927 -9.771 1.00 0.00 N ATOM 1141 CA LYS A 72 -4.270 -10.280 -10.309 1.00 0.00 C ATOM 1142 C LYS A 72 -4.747 -10.378 -11.793 1.00 0.00 C ATOM 1143 O LYS A 72 -5.932 -10.190 -12.085 1.00 0.00 O ATOM 1144 CB LYS A 72 -4.947 -11.315 -9.359 1.00 0.00 C ATOM 1145 CG LYS A 72 -4.377 -12.752 -9.440 1.00 0.00 C ATOM 1146 CD LYS A 72 -4.935 -13.619 -10.586 1.00 0.00 C ATOM 1147 CE LYS A 72 -3.881 -14.589 -11.150 1.00 0.00 C ATOM 1148 NZ LYS A 72 -4.469 -15.268 -12.329 1.00 0.00 N ATOM 0 H LYS A 72 -5.570 -8.778 -9.586 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.200 -10.487 -10.332 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.851 -10.960 -8.333 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.013 -11.350 -9.586 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -3.294 -12.690 -9.548 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -4.575 -13.257 -8.495 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -5.792 -14.187 -10.225 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -5.295 -12.972 -11.386 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.978 -14.048 -11.433 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.592 -15.319 -10.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -3.744 -15.854 -12.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -5.259 -15.872 -12.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -4.818 -14.556 -13.002 1.00 0.00 H new ATOM 1162 N SER A 73 -3.826 -10.692 -12.723 1.00 0.00 N ATOM 1163 CA SER A 73 -4.147 -10.780 -14.180 1.00 0.00 C ATOM 1164 C SER A 73 -4.289 -12.274 -14.654 1.00 0.00 C ATOM 1165 O SER A 73 -4.941 -13.082 -13.981 1.00 0.00 O ATOM 1166 CB SER A 73 -3.039 -9.918 -14.854 1.00 0.00 C ATOM 1167 OG SER A 73 -3.262 -9.811 -16.260 1.00 0.00 O ATOM 0 H SER A 73 -2.850 -10.891 -12.502 1.00 0.00 H new ATOM 0 HA SER A 73 -5.124 -10.386 -14.461 1.00 0.00 H new ATOM 0 HB2 SER A 73 -3.024 -8.924 -14.407 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.062 -10.365 -14.670 1.00 0.00 H new ATOM 0 HG SER A 73 -2.555 -9.264 -16.663 1.00 0.00 H new ATOM 1173 N GLY A 74 -3.717 -12.660 -15.811 1.00 0.00 N ATOM 1174 CA GLY A 74 -3.768 -14.060 -16.330 1.00 0.00 C ATOM 1175 C GLY A 74 -3.091 -15.139 -15.453 1.00 0.00 C ATOM 1176 O GLY A 74 -3.767 -16.053 -14.974 1.00 0.00 O ATOM 0 H GLY A 74 -3.206 -12.019 -16.418 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -4.813 -14.337 -16.467 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -3.302 -14.077 -17.315 1.00 0.00 H new ATOM 1180 N ASP A 75 -1.789 -14.983 -15.189 1.00 0.00 N ATOM 1181 CA ASP A 75 -1.003 -15.938 -14.355 1.00 0.00 C ATOM 1182 C ASP A 75 -0.624 -15.325 -12.962 1.00 0.00 C ATOM 1183 O ASP A 75 -1.062 -15.850 -11.933 1.00 0.00 O ATOM 1184 CB ASP A 75 0.250 -16.375 -15.167 1.00 0.00 C ATOM 1185 CG ASP A 75 -0.042 -17.260 -16.379 1.00 0.00 C ATOM 1186 OD1 ASP A 75 -0.219 -18.483 -16.200 1.00 0.00 O ATOM 1187 OD2 ASP A 75 -0.102 -16.729 -17.509 1.00 0.00 O ATOM 0 H ASP A 75 -1.240 -14.198 -15.540 1.00 0.00 H new ATOM 0 HA ASP A 75 -1.611 -16.814 -14.130 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.774 -15.482 -15.506 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.928 -16.909 -14.501 1.00 0.00 H new ATOM 1192 N GLU A 76 0.128 -14.208 -12.913 1.00 0.00 N ATOM 1193 CA GLU A 76 0.639 -13.616 -11.646 1.00 0.00 C ATOM 1194 C GLU A 76 -0.347 -12.708 -10.826 1.00 0.00 C ATOM 1195 O GLU A 76 -1.300 -12.098 -11.328 1.00 0.00 O ATOM 1196 CB GLU A 76 1.885 -12.761 -12.029 1.00 0.00 C ATOM 1197 CG GLU A 76 3.188 -13.548 -12.326 1.00 0.00 C ATOM 1198 CD GLU A 76 4.421 -12.690 -12.134 1.00 0.00 C ATOM 1199 OE1 GLU A 76 4.912 -12.611 -10.989 1.00 0.00 O ATOM 1200 OE2 GLU A 76 4.850 -11.986 -13.068 1.00 0.00 O ATOM 0 H GLU A 76 0.402 -13.686 -13.746 1.00 0.00 H new ATOM 0 HA GLU A 76 0.837 -14.458 -10.982 1.00 0.00 H new ATOM 0 HB2 GLU A 76 1.636 -12.166 -12.908 1.00 0.00 H new ATOM 0 HB3 GLU A 76 2.084 -12.062 -11.217 1.00 0.00 H new ATOM 0 HG2 GLU A 76 3.245 -14.417 -11.671 1.00 0.00 H new ATOM 0 HG3 GLU A 76 3.161 -13.922 -13.350 1.00 0.00 H new ATOM 1207 N THR A 77 -0.025 -12.616 -9.522 1.00 0.00 N ATOM 1208 CA THR A 77 -0.688 -11.710 -8.542 1.00 0.00 C ATOM 1209 C THR A 77 0.369 -10.609 -8.203 1.00 0.00 C ATOM 1210 O THR A 77 1.469 -10.928 -7.730 1.00 0.00 O ATOM 1211 CB THR A 77 -1.133 -12.485 -7.263 1.00 0.00 C ATOM 1212 OG1 THR A 77 -1.926 -13.620 -7.590 1.00 0.00 O ATOM 1213 CG2 THR A 77 -2.003 -11.631 -6.329 1.00 0.00 C ATOM 0 H THR A 77 0.717 -13.177 -9.104 1.00 0.00 H new ATOM 0 HA THR A 77 -1.598 -11.274 -8.955 1.00 0.00 H new ATOM 0 HB THR A 77 -0.202 -12.768 -6.773 1.00 0.00 H new ATOM 0 HG1 THR A 77 -2.101 -14.141 -6.779 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.285 -12.219 -5.455 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.441 -10.753 -6.010 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.902 -11.314 -6.858 1.00 0.00 H new ATOM 1221 N ARG A 78 0.055 -9.319 -8.421 1.00 0.00 N ATOM 1222 CA ARG A 78 1.039 -8.223 -8.197 1.00 0.00 C ATOM 1223 C ARG A 78 0.459 -7.021 -7.393 1.00 0.00 C ATOM 1224 O ARG A 78 -0.646 -6.539 -7.653 1.00 0.00 O ATOM 1225 CB ARG A 78 1.512 -7.766 -9.612 1.00 0.00 C ATOM 1226 CG ARG A 78 2.703 -6.772 -9.656 1.00 0.00 C ATOM 1227 CD ARG A 78 4.081 -7.354 -9.261 1.00 0.00 C ATOM 1228 NE ARG A 78 4.772 -7.947 -10.440 1.00 0.00 N ATOM 1229 CZ ARG A 78 4.825 -9.241 -10.761 1.00 0.00 C ATOM 1230 NH1 ARG A 78 4.372 -10.207 -10.003 1.00 0.00 N ATOM 1231 NH2 ARG A 78 5.359 -9.568 -11.902 1.00 0.00 N ATOM 0 H ARG A 78 -0.858 -9.004 -8.748 1.00 0.00 H new ATOM 0 HA ARG A 78 1.862 -8.594 -7.586 1.00 0.00 H new ATOM 0 HB2 ARG A 78 1.787 -8.653 -10.183 1.00 0.00 H new ATOM 0 HB3 ARG A 78 0.666 -7.307 -10.123 1.00 0.00 H new ATOM 0 HG2 ARG A 78 2.777 -6.367 -10.665 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.479 -5.936 -8.993 1.00 0.00 H new ATOM 0 HD2 ARG A 78 4.701 -6.568 -8.830 1.00 0.00 H new ATOM 0 HD3 ARG A 78 3.951 -8.115 -8.492 1.00 0.00 H new ATOM 0 HE ARG A 78 5.253 -7.299 -11.064 1.00 0.00 H new ATOM 0 HH11 ARG A 78 3.945 -9.991 -9.102 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.446 -11.176 -10.313 1.00 0.00 H new ATOM 0 HH21 ARG A 78 5.722 -8.844 -12.522 1.00 0.00 H new ATOM 0 HH22 ARG A 78 5.415 -10.549 -12.177 1.00 0.00 H new ATOM 1245 N LEU A 79 1.249 -6.493 -6.435 1.00 0.00 N ATOM 1246 CA LEU A 79 0.906 -5.225 -5.737 1.00 0.00 C ATOM 1247 C LEU A 79 1.334 -4.068 -6.703 1.00 0.00 C ATOM 1248 O LEU A 79 2.499 -3.971 -7.108 1.00 0.00 O ATOM 1249 CB LEU A 79 1.623 -5.142 -4.365 1.00 0.00 C ATOM 1250 CG LEU A 79 0.969 -4.145 -3.369 1.00 0.00 C ATOM 1251 CD1 LEU A 79 -0.329 -4.699 -2.752 1.00 0.00 C ATOM 1252 CD2 LEU A 79 1.929 -3.769 -2.232 1.00 0.00 C ATOM 0 H LEU A 79 2.123 -6.917 -6.125 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.159 -5.158 -5.516 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.637 -6.134 -3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 79 2.661 -4.850 -4.526 1.00 0.00 H new ATOM 0 HG LEU A 79 0.730 -3.258 -3.956 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.747 -3.965 -2.063 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.049 -4.905 -3.544 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.111 -5.620 -2.212 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.436 -3.070 -1.556 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.212 -4.667 -1.683 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.821 -3.302 -2.649 1.00 0.00 H new ATOM 1264 N GLN A 80 0.366 -3.252 -7.133 1.00 0.00 N ATOM 1265 CA GLN A 80 0.602 -2.200 -8.166 1.00 0.00 C ATOM 1266 C GLN A 80 -0.366 -0.977 -8.009 1.00 0.00 C ATOM 1267 O GLN A 80 -1.331 -0.987 -7.234 1.00 0.00 O ATOM 1268 CB GLN A 80 0.458 -2.905 -9.559 1.00 0.00 C ATOM 1269 CG GLN A 80 1.275 -2.293 -10.726 1.00 0.00 C ATOM 1270 CD GLN A 80 1.170 -3.110 -12.020 1.00 0.00 C ATOM 1271 OE1 GLN A 80 1.757 -4.180 -12.158 1.00 0.00 O ATOM 1272 NE2 GLN A 80 0.431 -2.643 -12.999 1.00 0.00 N ATOM 0 H GLN A 80 -0.594 -3.288 -6.790 1.00 0.00 H new ATOM 0 HA GLN A 80 1.598 -1.771 -8.055 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.751 -3.949 -9.446 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -0.596 -2.899 -9.839 1.00 0.00 H new ATOM 0 HG2 GLN A 80 0.926 -1.278 -10.914 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.322 -2.221 -10.431 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -0.059 -1.755 -12.890 1.00 0.00 H new ATOM 0 HE22 GLN A 80 0.346 -3.168 -13.869 1.00 0.00 H new ATOM 1281 N LEU A 81 -0.074 0.090 -8.775 1.00 0.00 N ATOM 1282 CA LEU A 81 -0.866 1.344 -8.762 1.00 0.00 C ATOM 1283 C LEU A 81 -1.837 1.419 -9.987 1.00 0.00 C ATOM 1284 O LEU A 81 -1.421 1.701 -11.118 1.00 0.00 O ATOM 1285 CB LEU A 81 0.077 2.589 -8.795 1.00 0.00 C ATOM 1286 CG LEU A 81 1.155 2.845 -7.707 1.00 0.00 C ATOM 1287 CD1 LEU A 81 0.626 2.671 -6.276 1.00 0.00 C ATOM 1288 CD2 LEU A 81 2.430 2.020 -7.935 1.00 0.00 C ATOM 0 H LEU A 81 0.715 0.112 -9.421 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.451 1.345 -7.842 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.599 2.560 -9.751 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.567 3.468 -8.810 1.00 0.00 H new ATOM 0 HG LEU A 81 1.424 3.896 -7.814 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.429 2.864 -5.565 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.189 3.373 -6.102 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.262 1.652 -6.144 1.00 0.00 H new ATOM 0 HD21 LEU A 81 3.150 2.237 -7.146 1.00 0.00 H new ATOM 0 HD22 LEU A 81 2.184 0.958 -7.919 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.862 2.278 -8.902 1.00 0.00 H new ATOM 1300 N GLU A 82 -3.140 1.216 -9.752 1.00 0.00 N ATOM 1301 CA GLU A 82 -4.194 1.411 -10.789 1.00 0.00 C ATOM 1302 C GLU A 82 -4.531 2.944 -10.930 1.00 0.00 C ATOM 1303 O GLU A 82 -4.455 3.710 -9.964 1.00 0.00 O ATOM 1304 CB GLU A 82 -5.463 0.616 -10.367 1.00 0.00 C ATOM 1305 CG GLU A 82 -5.345 -0.930 -10.330 1.00 0.00 C ATOM 1306 CD GLU A 82 -6.585 -1.623 -9.785 1.00 0.00 C ATOM 1307 OE1 GLU A 82 -6.756 -1.652 -8.545 1.00 0.00 O ATOM 1308 OE2 GLU A 82 -7.374 -2.168 -10.581 1.00 0.00 O ATOM 0 H GLU A 82 -3.504 0.914 -8.848 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.839 1.047 -11.753 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.762 0.957 -9.376 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -6.270 0.878 -11.051 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.148 -1.295 -11.338 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -4.486 -1.206 -9.718 1.00 0.00 H new ATOM 1315 N ALA A 83 -4.918 3.429 -12.123 1.00 0.00 N ATOM 1316 CA ALA A 83 -5.284 4.865 -12.310 1.00 0.00 C ATOM 1317 C ALA A 83 -6.760 5.118 -11.846 1.00 0.00 C ATOM 1318 O ALA A 83 -7.696 4.989 -12.642 1.00 0.00 O ATOM 1319 CB ALA A 83 -5.042 5.185 -13.799 1.00 0.00 C ATOM 0 H ALA A 83 -4.989 2.864 -12.970 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.677 5.532 -11.697 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.295 6.227 -13.993 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -3.993 5.015 -14.042 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.667 4.539 -14.416 1.00 0.00 H new ATOM 1325 N VAL A 84 -6.982 5.476 -10.558 1.00 0.00 N ATOM 1326 CA VAL A 84 -8.375 5.591 -9.998 1.00 0.00 C ATOM 1327 C VAL A 84 -8.465 6.718 -8.907 1.00 0.00 C ATOM 1328 O VAL A 84 -7.644 6.795 -7.989 1.00 0.00 O ATOM 1329 CB VAL A 84 -8.853 4.228 -9.356 1.00 0.00 C ATOM 1330 CG1 VAL A 84 -10.335 4.240 -8.897 1.00 0.00 C ATOM 1331 CG2 VAL A 84 -8.712 2.964 -10.240 1.00 0.00 C ATOM 0 H VAL A 84 -6.241 5.688 -9.890 1.00 0.00 H new ATOM 0 HA VAL A 84 -9.025 5.845 -10.835 1.00 0.00 H new ATOM 0 HB VAL A 84 -8.161 4.161 -8.517 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -10.591 3.272 -8.467 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -10.478 5.019 -8.148 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -10.980 4.438 -9.753 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -9.072 2.094 -9.691 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -9.300 3.088 -11.149 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -7.664 2.819 -10.503 1.00 0.00 H new ATOM 1341 N ASN A 85 -9.487 7.593 -9.032 1.00 0.00 N ATOM 1342 CA ASN A 85 -9.823 8.631 -7.991 1.00 0.00 C ATOM 1343 C ASN A 85 -11.217 9.340 -8.093 1.00 0.00 C ATOM 1344 O ASN A 85 -11.712 9.856 -7.089 1.00 0.00 O ATOM 1345 CB ASN A 85 -8.721 9.740 -7.883 1.00 0.00 C ATOM 1346 CG ASN A 85 -8.611 10.812 -8.989 1.00 0.00 C ATOM 1347 OD1 ASN A 85 -8.909 10.606 -10.162 1.00 0.00 O ATOM 1348 ND2 ASN A 85 -8.166 11.997 -8.651 1.00 0.00 N ATOM 0 H ASN A 85 -10.106 7.613 -9.843 1.00 0.00 H new ATOM 0 HA ASN A 85 -9.871 8.014 -7.093 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -8.873 10.261 -6.937 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -7.756 9.237 -7.819 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -8.073 12.727 -9.357 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -7.913 12.189 -7.682 1.00 0.00 H new ATOM 1355 N ILE A 86 -11.831 9.347 -9.272 1.00 0.00 N ATOM 1356 CA ILE A 86 -13.105 10.093 -9.540 1.00 0.00 C ATOM 1357 C ILE A 86 -14.288 9.088 -9.775 1.00 0.00 C ATOM 1358 O ILE A 86 -14.829 8.614 -8.774 1.00 0.00 O ATOM 1359 CB ILE A 86 -12.730 11.209 -10.609 1.00 0.00 C ATOM 1360 CG1 ILE A 86 -13.735 12.402 -10.620 1.00 0.00 C ATOM 1361 CG2 ILE A 86 -12.524 10.714 -12.071 1.00 0.00 C ATOM 1362 CD1 ILE A 86 -15.228 12.154 -10.903 1.00 0.00 C ATOM 0 H ILE A 86 -11.477 8.842 -10.085 1.00 0.00 H new ATOM 0 HA ILE A 86 -13.533 10.655 -8.710 1.00 0.00 H new ATOM 0 HB ILE A 86 -11.755 11.541 -10.252 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -13.667 12.891 -9.648 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -13.380 13.117 -11.362 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -12.273 11.561 -12.710 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -11.713 9.986 -12.098 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -13.442 10.248 -12.430 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -15.767 13.101 -10.868 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -15.342 11.708 -11.891 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -15.634 11.478 -10.150 1.00 0.00 H new ATOM 1374 N THR A 87 -14.695 8.755 -11.020 1.00 0.00 N ATOM 1375 CA THR A 87 -15.858 7.862 -11.394 1.00 0.00 C ATOM 1376 C THR A 87 -17.292 8.319 -10.921 1.00 0.00 C ATOM 1377 O THR A 87 -18.269 7.674 -11.312 1.00 0.00 O ATOM 1378 CB THR A 87 -15.596 6.356 -11.047 1.00 0.00 C ATOM 1379 OG1 THR A 87 -16.548 5.577 -11.764 1.00 0.00 O ATOM 1380 CG2 THR A 87 -15.741 5.925 -9.581 1.00 0.00 C ATOM 0 H THR A 87 -14.210 9.109 -11.845 1.00 0.00 H new ATOM 0 HA THR A 87 -15.896 7.976 -12.477 1.00 0.00 H new ATOM 0 HB THR A 87 -14.548 6.206 -11.306 1.00 0.00 H new ATOM 0 HG1 THR A 87 -17.415 6.034 -11.758 1.00 0.00 H new ATOM 0 HG21 THR A 87 -15.530 4.859 -9.493 1.00 0.00 H new ATOM 0 HG22 THR A 87 -15.038 6.486 -8.966 1.00 0.00 H new ATOM 0 HG23 THR A 87 -16.758 6.123 -9.242 1.00 0.00 H new ATOM 1388 N ASP A 88 -17.412 9.420 -10.156 1.00 0.00 N ATOM 1389 CA ASP A 88 -18.690 10.055 -9.680 1.00 0.00 C ATOM 1390 C ASP A 88 -19.572 9.174 -8.700 1.00 0.00 C ATOM 1391 O ASP A 88 -20.793 9.307 -8.594 1.00 0.00 O ATOM 1392 CB ASP A 88 -19.373 10.578 -10.981 1.00 0.00 C ATOM 1393 CG ASP A 88 -20.462 11.627 -10.785 1.00 0.00 C ATOM 1394 OD1 ASP A 88 -20.193 12.654 -10.124 1.00 0.00 O ATOM 1395 OD2 ASP A 88 -21.576 11.448 -11.321 1.00 0.00 O ATOM 0 H ASP A 88 -16.590 9.928 -9.828 1.00 0.00 H new ATOM 0 HA ASP A 88 -18.504 10.882 -8.995 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -18.603 10.998 -11.629 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -19.805 9.728 -11.509 1.00 0.00 H new ATOM 1400 N LEU A 89 -18.896 8.321 -7.915 1.00 0.00 N ATOM 1401 CA LEU A 89 -19.474 7.416 -6.882 1.00 0.00 C ATOM 1402 C LEU A 89 -18.293 7.162 -5.889 1.00 0.00 C ATOM 1403 O LEU A 89 -17.191 6.826 -6.346 1.00 0.00 O ATOM 1404 CB LEU A 89 -19.985 6.059 -7.463 1.00 0.00 C ATOM 1405 CG LEU A 89 -21.316 6.084 -8.270 1.00 0.00 C ATOM 1406 CD1 LEU A 89 -21.078 6.114 -9.792 1.00 0.00 C ATOM 1407 CD2 LEU A 89 -22.203 4.867 -7.947 1.00 0.00 C ATOM 0 H LEU A 89 -17.882 8.231 -7.978 1.00 0.00 H new ATOM 0 HA LEU A 89 -20.350 7.871 -6.420 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -19.206 5.654 -8.109 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -20.106 5.361 -6.634 1.00 0.00 H new ATOM 0 HG LEU A 89 -21.821 7.001 -7.967 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -22.037 6.131 -10.310 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -20.509 7.006 -10.054 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -20.520 5.227 -10.091 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -23.122 4.922 -8.530 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -21.668 3.951 -8.197 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -22.447 4.866 -6.885 1.00 0.00 H new ATOM 1419 N SER A 90 -18.473 7.302 -4.557 1.00 0.00 N ATOM 1420 CA SER A 90 -17.340 7.131 -3.594 1.00 0.00 C ATOM 1421 C SER A 90 -17.759 6.561 -2.194 1.00 0.00 C ATOM 1422 O SER A 90 -18.550 7.166 -1.463 1.00 0.00 O ATOM 1423 CB SER A 90 -16.663 8.515 -3.449 1.00 0.00 C ATOM 1424 OG SER A 90 -15.401 8.376 -2.807 1.00 0.00 O ATOM 0 H SER A 90 -19.368 7.528 -4.122 1.00 0.00 H new ATOM 0 HA SER A 90 -16.658 6.380 -3.993 1.00 0.00 H new ATOM 0 HB2 SER A 90 -16.532 8.969 -4.431 1.00 0.00 H new ATOM 0 HB3 SER A 90 -17.302 9.183 -2.871 1.00 0.00 H new ATOM 0 HG SER A 90 -14.715 8.843 -3.329 1.00 0.00 H new ATOM 1430 N GLU A 91 -17.150 5.426 -1.802 1.00 0.00 N ATOM 1431 CA GLU A 91 -17.411 4.727 -0.509 1.00 0.00 C ATOM 1432 C GLU A 91 -16.330 5.074 0.579 1.00 0.00 C ATOM 1433 O GLU A 91 -15.128 5.040 0.299 1.00 0.00 O ATOM 1434 CB GLU A 91 -17.377 3.176 -0.723 1.00 0.00 C ATOM 1435 CG GLU A 91 -18.234 2.532 -1.851 1.00 0.00 C ATOM 1436 CD GLU A 91 -17.603 2.558 -3.238 1.00 0.00 C ATOM 1437 OE1 GLU A 91 -16.475 2.049 -3.414 1.00 0.00 O ATOM 1438 OE2 GLU A 91 -18.205 3.120 -4.172 1.00 0.00 O ATOM 0 H GLU A 91 -16.451 4.954 -2.376 1.00 0.00 H new ATOM 0 HA GLU A 91 -18.390 5.061 -0.165 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -16.339 2.895 -0.903 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -17.675 2.711 0.217 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -18.441 1.496 -1.582 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -19.194 3.047 -1.896 1.00 0.00 H new ATOM 1445 N ASN A 92 -16.728 5.345 1.840 1.00 0.00 N ATOM 1446 CA ASN A 92 -15.741 5.608 2.941 1.00 0.00 C ATOM 1447 C ASN A 92 -15.158 4.288 3.571 1.00 0.00 C ATOM 1448 O ASN A 92 -13.941 4.180 3.727 1.00 0.00 O ATOM 1449 CB ASN A 92 -16.418 6.506 4.018 1.00 0.00 C ATOM 1450 CG ASN A 92 -15.432 7.073 5.051 1.00 0.00 C ATOM 1451 OD1 ASN A 92 -15.200 6.505 6.114 1.00 0.00 O ATOM 1452 ND2 ASN A 92 -14.789 8.176 4.755 1.00 0.00 N ATOM 0 H ASN A 92 -17.705 5.390 2.131 1.00 0.00 H new ATOM 0 HA ASN A 92 -14.883 6.127 2.514 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -16.928 7.332 3.523 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -17.181 5.925 4.536 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -14.102 8.556 5.406 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -14.976 8.654 3.874 1.00 0.00 H new ATOM 1459 N ARG A 93 -16.016 3.350 4.011 1.00 0.00 N ATOM 1460 CA ARG A 93 -15.618 2.034 4.596 1.00 0.00 C ATOM 1461 C ARG A 93 -16.550 0.910 4.010 1.00 0.00 C ATOM 1462 O ARG A 93 -17.502 1.181 3.267 1.00 0.00 O ATOM 1463 CB ARG A 93 -15.673 2.172 6.153 1.00 0.00 C ATOM 1464 CG ARG A 93 -14.392 2.779 6.791 1.00 0.00 C ATOM 1465 CD ARG A 93 -14.655 3.666 8.027 1.00 0.00 C ATOM 1466 NE ARG A 93 -13.397 4.044 8.738 1.00 0.00 N ATOM 1467 CZ ARG A 93 -12.505 4.956 8.343 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -12.658 5.731 7.298 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -11.410 5.071 9.040 1.00 0.00 N ATOM 0 H ARG A 93 -17.027 3.477 3.974 1.00 0.00 H new ATOM 0 HA ARG A 93 -14.601 1.744 4.333 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -16.527 2.795 6.420 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -15.848 1.187 6.587 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -13.723 1.967 7.077 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -13.871 3.371 6.038 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -15.179 4.570 7.717 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -15.313 3.137 8.716 1.00 0.00 H new ATOM 0 HE ARG A 93 -13.200 3.557 9.612 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -13.501 5.658 6.728 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -11.934 6.407 7.054 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -11.259 4.476 9.855 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -10.704 5.756 8.771 1.00 0.00 H new ATOM 1483 N LYS A 94 -16.263 -0.378 4.308 1.00 0.00 N ATOM 1484 CA LYS A 94 -17.024 -1.564 3.766 1.00 0.00 C ATOM 1485 C LYS A 94 -16.968 -1.665 2.192 1.00 0.00 C ATOM 1486 O LYS A 94 -17.992 -1.705 1.503 1.00 0.00 O ATOM 1487 CB LYS A 94 -18.489 -1.580 4.328 1.00 0.00 C ATOM 1488 CG LYS A 94 -18.570 -2.017 5.804 1.00 0.00 C ATOM 1489 CD LYS A 94 -19.970 -1.950 6.449 1.00 0.00 C ATOM 1490 CE LYS A 94 -20.077 -2.667 7.817 1.00 0.00 C ATOM 1491 NZ LYS A 94 -19.134 -2.109 8.831 1.00 0.00 N ATOM 0 H LYS A 94 -15.499 -0.641 4.930 1.00 0.00 H new ATOM 0 HA LYS A 94 -16.525 -2.465 4.121 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -18.921 -0.584 4.227 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -19.096 -2.254 3.723 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -18.204 -3.041 5.881 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -17.892 -1.392 6.386 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -20.248 -0.904 6.578 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -20.694 -2.390 5.764 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -21.098 -2.582 8.189 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -19.874 -3.730 7.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -19.221 -2.645 9.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -18.159 -2.183 8.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -19.364 -1.110 9.006 1.00 0.00 H new ATOM 1505 N GLN A 95 -15.744 -1.757 1.640 1.00 0.00 N ATOM 1506 CA GLN A 95 -15.499 -1.884 0.173 1.00 0.00 C ATOM 1507 C GLN A 95 -15.060 -3.357 -0.177 1.00 0.00 C ATOM 1508 O GLN A 95 -14.746 -4.177 0.698 1.00 0.00 O ATOM 1509 CB GLN A 95 -14.469 -0.758 -0.170 1.00 0.00 C ATOM 1510 CG GLN A 95 -14.320 -0.329 -1.658 1.00 0.00 C ATOM 1511 CD GLN A 95 -13.325 -1.125 -2.516 1.00 0.00 C ATOM 1512 OE1 GLN A 95 -12.290 -1.605 -2.067 1.00 0.00 O ATOM 1513 NE2 GLN A 95 -13.581 -1.267 -3.793 1.00 0.00 N ATOM 0 H GLN A 95 -14.887 -1.746 2.193 1.00 0.00 H new ATOM 0 HA GLN A 95 -16.383 -1.736 -0.447 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.738 0.127 0.407 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -13.490 -1.083 0.183 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -15.301 -0.393 -2.129 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -14.024 0.720 -1.680 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -14.436 -0.876 -4.188 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -12.925 -1.769 -4.392 1.00 0.00 H new ATOM 1522 N ASP A 96 -15.078 -3.713 -1.475 1.00 0.00 N ATOM 1523 CA ASP A 96 -14.722 -5.077 -1.968 1.00 0.00 C ATOM 1524 C ASP A 96 -13.267 -5.565 -1.600 1.00 0.00 C ATOM 1525 O ASP A 96 -12.346 -4.792 -1.319 1.00 0.00 O ATOM 1526 CB ASP A 96 -14.956 -5.018 -3.506 1.00 0.00 C ATOM 1527 CG ASP A 96 -14.875 -6.343 -4.271 1.00 0.00 C ATOM 1528 OD1 ASP A 96 -15.153 -7.426 -3.711 1.00 0.00 O ATOM 1529 OD2 ASP A 96 -14.495 -6.318 -5.458 1.00 0.00 O ATOM 0 H ASP A 96 -15.339 -3.069 -2.221 1.00 0.00 H new ATOM 0 HA ASP A 96 -15.343 -5.824 -1.474 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -15.940 -4.584 -3.683 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -14.224 -4.334 -3.935 1.00 0.00 H new ATOM 1534 N LYS A 97 -13.106 -6.898 -1.545 1.00 0.00 N ATOM 1535 CA LYS A 97 -11.798 -7.552 -1.238 1.00 0.00 C ATOM 1536 C LYS A 97 -10.919 -7.693 -2.538 1.00 0.00 C ATOM 1537 O LYS A 97 -11.228 -7.090 -3.569 1.00 0.00 O ATOM 1538 CB LYS A 97 -12.151 -8.868 -0.472 1.00 0.00 C ATOM 1539 CG LYS A 97 -12.637 -8.607 0.981 1.00 0.00 C ATOM 1540 CD LYS A 97 -13.113 -9.869 1.732 1.00 0.00 C ATOM 1541 CE LYS A 97 -13.708 -9.592 3.133 1.00 0.00 C ATOM 1542 NZ LYS A 97 -15.040 -8.927 3.035 1.00 0.00 N ATOM 0 H LYS A 97 -13.866 -7.559 -1.709 1.00 0.00 H new ATOM 0 HA LYS A 97 -11.148 -6.962 -0.592 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -12.926 -9.404 -1.019 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -11.274 -9.515 -0.446 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -11.825 -8.148 1.545 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -13.454 -7.886 0.954 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -13.863 -10.376 1.126 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -12.271 -10.554 1.837 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -13.807 -10.529 3.680 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -13.025 -8.961 3.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -15.413 -8.754 3.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -14.940 -8.021 2.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -15.697 -9.541 2.513 1.00 0.00 H new ATOM 1556 N ARG A 98 -9.771 -8.412 -2.496 1.00 0.00 N ATOM 1557 CA ARG A 98 -8.762 -8.496 -3.626 1.00 0.00 C ATOM 1558 C ARG A 98 -7.892 -7.186 -3.756 1.00 0.00 C ATOM 1559 O ARG A 98 -6.699 -7.282 -4.026 1.00 0.00 O ATOM 1560 CB ARG A 98 -9.351 -8.845 -5.032 1.00 0.00 C ATOM 1561 CG ARG A 98 -10.008 -10.239 -5.172 1.00 0.00 C ATOM 1562 CD ARG A 98 -10.869 -10.395 -6.454 1.00 0.00 C ATOM 1563 NE ARG A 98 -12.331 -10.390 -6.150 1.00 0.00 N ATOM 1564 CZ ARG A 98 -13.065 -9.306 -5.884 1.00 0.00 C ATOM 1565 NH1 ARG A 98 -12.691 -8.088 -6.158 1.00 0.00 N ATOM 1566 NH2 ARG A 98 -14.221 -9.462 -5.308 1.00 0.00 N ATOM 0 H ARG A 98 -9.500 -8.960 -1.680 1.00 0.00 H new ATOM 0 HA ARG A 98 -8.139 -9.338 -3.325 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -10.093 -8.089 -5.289 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -8.550 -8.769 -5.767 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -9.228 -11.000 -5.174 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -10.634 -10.426 -4.299 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -10.640 -9.584 -7.146 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -10.606 -11.326 -6.956 1.00 0.00 H new ATOM 0 HE ARG A 98 -12.810 -11.291 -6.145 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -11.789 -7.919 -6.602 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -13.301 -7.303 -5.928 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -14.550 -10.398 -5.069 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -14.799 -8.649 -5.095 1.00 0.00 H new ATOM 1580 N PHE A 99 -8.440 -5.980 -3.553 1.00 0.00 N ATOM 1581 CA PHE A 99 -7.690 -4.695 -3.633 1.00 0.00 C ATOM 1582 C PHE A 99 -6.897 -4.299 -2.337 1.00 0.00 C ATOM 1583 O PHE A 99 -6.517 -3.128 -2.275 1.00 0.00 O ATOM 1584 CB PHE A 99 -8.758 -3.592 -3.966 1.00 0.00 C ATOM 1585 CG PHE A 99 -9.630 -3.731 -5.235 1.00 0.00 C ATOM 1586 CD1 PHE A 99 -9.131 -3.373 -6.492 1.00 0.00 C ATOM 1587 CD2 PHE A 99 -10.952 -4.180 -5.126 1.00 0.00 C ATOM 1588 CE1 PHE A 99 -9.936 -3.473 -7.624 1.00 0.00 C ATOM 1589 CE2 PHE A 99 -11.756 -4.279 -6.259 1.00 0.00 C ATOM 1590 CZ PHE A 99 -11.248 -3.927 -7.507 1.00 0.00 C ATOM 0 H PHE A 99 -9.426 -5.856 -3.325 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.917 -4.800 -4.394 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.433 -3.523 -3.113 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -8.233 -2.639 -4.034 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -8.116 -3.017 -6.585 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -11.350 -4.451 -4.159 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -9.543 -3.199 -8.592 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -12.774 -4.629 -6.170 1.00 0.00 H new ATOM 0 HZ PHE A 99 -11.872 -4.006 -8.385 1.00 0.00 H new ATOM 1600 N ALA A 100 -6.566 -5.166 -1.339 1.00 0.00 N ATOM 1601 CA ALA A 100 -5.927 -4.674 -0.084 1.00 0.00 C ATOM 1602 C ALA A 100 -4.741 -5.520 0.461 1.00 0.00 C ATOM 1603 O ALA A 100 -4.411 -6.610 -0.018 1.00 0.00 O ATOM 1604 CB ALA A 100 -7.104 -4.619 0.921 1.00 0.00 C ATOM 0 H ALA A 100 -6.724 -6.173 -1.374 1.00 0.00 H new ATOM 0 HA ALA A 100 -5.440 -3.716 -0.265 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -6.742 -4.266 1.887 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.868 -3.937 0.549 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -7.531 -5.615 1.036 1.00 0.00 H new ATOM 1610 N PHE A 101 -4.088 -4.947 1.488 1.00 0.00 N ATOM 1611 CA PHE A 101 -3.015 -5.616 2.268 1.00 0.00 C ATOM 1612 C PHE A 101 -3.535 -5.886 3.718 1.00 0.00 C ATOM 1613 O PHE A 101 -4.191 -5.017 4.305 1.00 0.00 O ATOM 1614 CB PHE A 101 -1.704 -4.768 2.267 1.00 0.00 C ATOM 1615 CG PHE A 101 -1.751 -3.282 2.700 1.00 0.00 C ATOM 1616 CD1 PHE A 101 -1.919 -2.938 4.045 1.00 0.00 C ATOM 1617 CD2 PHE A 101 -1.609 -2.264 1.750 1.00 0.00 C ATOM 1618 CE1 PHE A 101 -1.945 -1.605 4.437 1.00 0.00 C ATOM 1619 CE2 PHE A 101 -1.631 -0.926 2.144 1.00 0.00 C ATOM 1620 CZ PHE A 101 -1.796 -0.599 3.489 1.00 0.00 C ATOM 0 H PHE A 101 -4.287 -3.999 1.808 1.00 0.00 H new ATOM 0 HA PHE A 101 -2.765 -6.569 1.802 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.989 -5.274 2.916 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -1.296 -4.800 1.257 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -2.030 -3.716 4.786 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.482 -2.515 0.707 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -2.081 -1.351 5.478 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -1.520 -0.144 1.407 1.00 0.00 H new ATOM 0 HZ PHE A 101 -1.808 0.437 3.795 1.00 0.00 H new ATOM 1630 N ILE A 102 -3.250 -7.062 4.316 1.00 0.00 N ATOM 1631 CA ILE A 102 -3.724 -7.361 5.721 1.00 0.00 C ATOM 1632 C ILE A 102 -2.528 -7.038 6.673 1.00 0.00 C ATOM 1633 O ILE A 102 -1.541 -7.776 6.723 1.00 0.00 O ATOM 1634 CB ILE A 102 -4.253 -8.826 5.959 1.00 0.00 C ATOM 1635 CG1 ILE A 102 -5.227 -9.330 4.849 1.00 0.00 C ATOM 1636 CG2 ILE A 102 -4.979 -8.904 7.334 1.00 0.00 C ATOM 1637 CD1 ILE A 102 -5.668 -10.798 4.978 1.00 0.00 C ATOM 0 H ILE A 102 -2.712 -7.811 3.880 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.599 -6.742 5.919 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.376 -9.473 5.935 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.116 -8.699 4.855 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -4.747 -9.196 3.880 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.344 -9.918 7.496 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -4.282 -8.638 8.129 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -5.820 -8.211 7.341 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.342 -11.049 4.159 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.792 -11.446 4.938 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.182 -10.941 5.928 1.00 0.00 H new ATOM 1649 N ARG A 103 -2.602 -5.929 7.424 1.00 0.00 N ATOM 1650 CA ARG A 103 -1.499 -5.517 8.337 1.00 0.00 C ATOM 1651 C ARG A 103 -1.714 -6.089 9.778 1.00 0.00 C ATOM 1652 O ARG A 103 -2.708 -5.775 10.444 1.00 0.00 O ATOM 1653 CB ARG A 103 -1.392 -3.963 8.276 1.00 0.00 C ATOM 1654 CG ARG A 103 -2.486 -3.091 8.943 1.00 0.00 C ATOM 1655 CD ARG A 103 -2.122 -2.646 10.376 1.00 0.00 C ATOM 1656 NE ARG A 103 -3.281 -1.980 11.031 1.00 0.00 N ATOM 1657 CZ ARG A 103 -4.271 -2.609 11.670 1.00 0.00 C ATOM 1658 NH1 ARG A 103 -4.360 -3.911 11.778 1.00 0.00 N ATOM 1659 NH2 ARG A 103 -5.213 -1.896 12.211 1.00 0.00 N ATOM 0 H ARG A 103 -3.404 -5.298 7.425 1.00 0.00 H new ATOM 0 HA ARG A 103 -0.544 -5.936 8.020 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -0.437 -3.685 8.722 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -1.347 -3.681 7.224 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -2.661 -2.208 8.329 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -3.421 -3.651 8.970 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -1.814 -3.511 10.963 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -1.273 -1.963 10.345 1.00 0.00 H new ATOM 0 HE ARG A 103 -3.322 -0.962 10.988 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -3.646 -4.507 11.360 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -5.143 -4.329 12.280 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.186 -0.879 12.142 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -5.980 -2.354 12.704 1.00 0.00 H new ATOM 1673 N SER A 104 -0.786 -6.938 10.257 1.00 0.00 N ATOM 1674 CA SER A 104 -0.841 -7.487 11.650 1.00 0.00 C ATOM 1675 C SER A 104 0.099 -6.628 12.574 1.00 0.00 C ATOM 1676 O SER A 104 0.108 -5.395 12.435 1.00 0.00 O ATOM 1677 CB SER A 104 -0.514 -9.000 11.531 1.00 0.00 C ATOM 1678 OG SER A 104 -1.489 -9.677 10.737 1.00 0.00 O ATOM 0 H SER A 104 0.012 -7.265 9.713 1.00 0.00 H new ATOM 0 HA SER A 104 -1.815 -7.415 12.133 1.00 0.00 H new ATOM 0 HB2 SER A 104 0.473 -9.128 11.087 1.00 0.00 H new ATOM 0 HB3 SER A 104 -0.477 -9.446 12.525 1.00 0.00 H new ATOM 0 HG SER A 104 -1.259 -10.628 10.676 1.00 0.00 H new ATOM 1684 N ASP A 105 0.889 -7.203 13.511 1.00 0.00 N ATOM 1685 CA ASP A 105 1.847 -6.412 14.346 1.00 0.00 C ATOM 1686 C ASP A 105 2.993 -7.309 14.950 1.00 0.00 C ATOM 1687 O ASP A 105 3.065 -8.537 14.811 1.00 0.00 O ATOM 1688 CB ASP A 105 1.060 -5.640 15.459 1.00 0.00 C ATOM 1689 CG ASP A 105 1.684 -4.282 15.809 1.00 0.00 C ATOM 1690 OD1 ASP A 105 2.875 -4.240 16.197 1.00 0.00 O ATOM 1691 OD2 ASP A 105 0.993 -3.253 15.672 1.00 0.00 O ATOM 0 H ASP A 105 0.889 -8.203 13.713 1.00 0.00 H new ATOM 0 HA ASP A 105 2.345 -5.686 13.703 1.00 0.00 H new ATOM 0 HB2 ASP A 105 0.033 -5.486 15.128 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.017 -6.255 16.358 1.00 0.00 H new ATOM 1696 N SER A 106 3.998 -6.623 15.507 1.00 0.00 N ATOM 1697 CA SER A 106 5.159 -7.215 16.242 1.00 0.00 C ATOM 1698 C SER A 106 5.914 -6.180 17.170 1.00 0.00 C ATOM 1699 O SER A 106 6.986 -6.523 17.680 1.00 0.00 O ATOM 1700 CB SER A 106 6.144 -7.839 15.213 1.00 0.00 C ATOM 1701 OG SER A 106 5.559 -8.964 14.553 1.00 0.00 O ATOM 0 H SER A 106 4.042 -5.605 15.466 1.00 0.00 H new ATOM 0 HA SER A 106 4.764 -7.980 16.910 1.00 0.00 H new ATOM 0 HB2 SER A 106 6.427 -7.088 14.475 1.00 0.00 H new ATOM 0 HB3 SER A 106 7.058 -8.147 15.721 1.00 0.00 H new ATOM 0 HG SER A 106 4.651 -9.106 14.892 1.00 0.00 H new ATOM 1707 N GLY A 107 5.399 -4.955 17.437 1.00 0.00 N ATOM 1708 CA GLY A 107 6.093 -3.934 18.264 1.00 0.00 C ATOM 1709 C GLY A 107 6.891 -2.917 17.401 1.00 0.00 C ATOM 1710 O GLY A 107 6.263 -1.950 16.961 1.00 0.00 O ATOM 0 H GLY A 107 4.492 -4.646 17.086 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.360 -3.398 18.867 1.00 0.00 H new ATOM 0 HA3 GLY A 107 6.772 -4.431 18.956 1.00 0.00 H new ATOM 1714 N PRO A 108 8.216 -3.067 17.093 1.00 0.00 N ATOM 1715 CA PRO A 108 8.964 -2.086 16.247 1.00 0.00 C ATOM 1716 C PRO A 108 8.509 -1.903 14.755 1.00 0.00 C ATOM 1717 O PRO A 108 8.536 -0.779 14.255 1.00 0.00 O ATOM 1718 CB PRO A 108 10.418 -2.609 16.341 1.00 0.00 C ATOM 1719 CG PRO A 108 10.459 -3.515 17.572 1.00 0.00 C ATOM 1720 CD PRO A 108 9.073 -4.154 17.608 1.00 0.00 C ATOM 0 HA PRO A 108 8.792 -1.076 16.620 1.00 0.00 H new ATOM 0 HB2 PRO A 108 10.694 -3.159 15.442 1.00 0.00 H new ATOM 0 HB3 PRO A 108 11.124 -1.784 16.439 1.00 0.00 H new ATOM 0 HG2 PRO A 108 11.243 -4.267 17.488 1.00 0.00 H new ATOM 0 HG3 PRO A 108 10.660 -2.946 18.480 1.00 0.00 H new ATOM 0 HD2 PRO A 108 9.019 -5.046 16.983 1.00 0.00 H new ATOM 0 HD3 PRO A 108 8.789 -4.454 18.617 1.00 0.00 H new ATOM 1728 N THR A 109 8.177 -2.993 14.041 1.00 0.00 N ATOM 1729 CA THR A 109 7.733 -2.977 12.608 1.00 0.00 C ATOM 1730 C THR A 109 6.718 -4.151 12.384 1.00 0.00 C ATOM 1731 O THR A 109 6.838 -5.212 13.006 1.00 0.00 O ATOM 1732 CB THR A 109 8.935 -3.136 11.611 1.00 0.00 C ATOM 1733 OG1 THR A 109 9.817 -4.166 12.034 1.00 0.00 O ATOM 1734 CG2 THR A 109 9.810 -1.887 11.452 1.00 0.00 C ATOM 0 H THR A 109 8.205 -3.933 14.437 1.00 0.00 H new ATOM 0 HA THR A 109 7.268 -2.011 12.409 1.00 0.00 H new ATOM 0 HB THR A 109 8.447 -3.355 10.661 1.00 0.00 H new ATOM 0 HG1 THR A 109 10.728 -3.959 11.737 1.00 0.00 H new ATOM 0 HG21 THR A 109 10.613 -2.093 10.744 1.00 0.00 H new ATOM 0 HG22 THR A 109 9.202 -1.062 11.081 1.00 0.00 H new ATOM 0 HG23 THR A 109 10.238 -1.617 12.418 1.00 0.00 H new ATOM 1742 N THR A 110 5.715 -3.989 11.495 1.00 0.00 N ATOM 1743 CA THR A 110 4.705 -5.061 11.218 1.00 0.00 C ATOM 1744 C THR A 110 5.113 -5.981 9.999 1.00 0.00 C ATOM 1745 O THR A 110 6.269 -6.091 9.599 1.00 0.00 O ATOM 1746 CB THR A 110 3.292 -4.383 11.100 1.00 0.00 C ATOM 1747 OG1 THR A 110 2.316 -5.414 11.131 1.00 0.00 O ATOM 1748 CG2 THR A 110 2.982 -3.610 9.812 1.00 0.00 C ATOM 0 H THR A 110 5.574 -3.136 10.954 1.00 0.00 H new ATOM 0 HA THR A 110 4.664 -5.768 12.046 1.00 0.00 H new ATOM 0 HB THR A 110 3.281 -3.663 11.918 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.448 -5.035 11.382 1.00 0.00 H new ATOM 0 HG21 THR A 110 1.975 -3.197 9.869 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.701 -2.799 9.692 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.050 -4.284 8.958 1.00 0.00 H new ATOM 1756 N SER A 111 4.152 -6.767 9.522 1.00 0.00 N ATOM 1757 CA SER A 111 4.286 -7.744 8.399 1.00 0.00 C ATOM 1758 C SER A 111 2.942 -7.733 7.619 1.00 0.00 C ATOM 1759 O SER A 111 1.878 -7.690 8.262 1.00 0.00 O ATOM 1760 CB SER A 111 4.605 -9.155 8.954 1.00 0.00 C ATOM 1761 OG SER A 111 3.619 -9.615 9.882 1.00 0.00 O ATOM 0 H SER A 111 3.209 -6.755 9.912 1.00 0.00 H new ATOM 0 HA SER A 111 5.105 -7.471 7.734 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.676 -9.860 8.126 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.579 -9.138 9.443 1.00 0.00 H new ATOM 0 HG SER A 111 3.863 -10.508 10.202 1.00 0.00 H new ATOM 1767 N PHE A 112 2.939 -7.779 6.268 1.00 0.00 N ATOM 1768 CA PHE A 112 1.660 -7.603 5.529 1.00 0.00 C ATOM 1769 C PHE A 112 1.183 -8.917 4.842 1.00 0.00 C ATOM 1770 O PHE A 112 1.945 -9.852 4.597 1.00 0.00 O ATOM 1771 CB PHE A 112 1.917 -6.438 4.521 1.00 0.00 C ATOM 1772 CG PHE A 112 2.123 -5.028 5.126 1.00 0.00 C ATOM 1773 CD1 PHE A 112 1.017 -4.232 5.426 1.00 0.00 C ATOM 1774 CD2 PHE A 112 3.409 -4.535 5.384 1.00 0.00 C ATOM 1775 CE1 PHE A 112 1.190 -2.952 5.952 1.00 0.00 C ATOM 1776 CE2 PHE A 112 3.578 -3.265 5.934 1.00 0.00 C ATOM 1777 CZ PHE A 112 2.470 -2.470 6.206 1.00 0.00 C ATOM 0 H PHE A 112 3.763 -7.929 5.686 1.00 0.00 H new ATOM 0 HA PHE A 112 0.840 -7.356 6.203 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.799 -6.687 3.931 1.00 0.00 H new ATOM 0 HB3 PHE A 112 1.074 -6.393 3.831 1.00 0.00 H new ATOM 0 HD1 PHE A 112 0.021 -4.610 5.250 1.00 0.00 H new ATOM 0 HD2 PHE A 112 4.273 -5.141 5.156 1.00 0.00 H new ATOM 0 HE1 PHE A 112 0.329 -2.334 6.162 1.00 0.00 H new ATOM 0 HE2 PHE A 112 4.571 -2.898 6.149 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.603 -1.479 6.614 1.00 0.00 H new ATOM 1787 N GLU A 113 -0.119 -8.971 4.543 1.00 0.00 N ATOM 1788 CA GLU A 113 -0.720 -10.005 3.653 1.00 0.00 C ATOM 1789 C GLU A 113 -1.281 -9.233 2.396 1.00 0.00 C ATOM 1790 O GLU A 113 -1.088 -8.017 2.262 1.00 0.00 O ATOM 1791 CB GLU A 113 -1.717 -10.893 4.444 1.00 0.00 C ATOM 1792 CG GLU A 113 -1.592 -12.406 4.140 1.00 0.00 C ATOM 1793 CD GLU A 113 -2.456 -13.292 5.018 1.00 0.00 C ATOM 1794 OE1 GLU A 113 -2.023 -13.631 6.139 1.00 0.00 O ATOM 1795 OE2 GLU A 113 -3.566 -13.661 4.585 1.00 0.00 O ATOM 0 H GLU A 113 -0.799 -8.303 4.906 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.005 -10.739 3.280 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -1.562 -10.733 5.511 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -2.733 -10.570 4.218 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -1.857 -12.578 3.097 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -0.550 -12.703 4.257 1.00 0.00 H new ATOM 1802 N SER A 114 -1.941 -9.891 1.429 1.00 0.00 N ATOM 1803 CA SER A 114 -2.257 -9.267 0.111 1.00 0.00 C ATOM 1804 C SER A 114 -3.341 -10.084 -0.634 1.00 0.00 C ATOM 1805 O SER A 114 -3.405 -11.321 -0.584 1.00 0.00 O ATOM 1806 CB SER A 114 -0.980 -9.126 -0.764 1.00 0.00 C ATOM 1807 OG SER A 114 -0.251 -10.345 -0.894 1.00 0.00 O ATOM 0 H SER A 114 -2.270 -10.852 1.524 1.00 0.00 H new ATOM 0 HA SER A 114 -2.647 -8.267 0.299 1.00 0.00 H new ATOM 0 HB2 SER A 114 -1.264 -8.772 -1.755 1.00 0.00 H new ATOM 0 HB3 SER A 114 -0.331 -8.367 -0.328 1.00 0.00 H new ATOM 0 HG SER A 114 -0.520 -10.964 -0.183 1.00 0.00 H new ATOM 1813 N ALA A 115 -4.138 -9.293 -1.383 1.00 0.00 N ATOM 1814 CA ALA A 115 -5.425 -9.684 -2.017 1.00 0.00 C ATOM 1815 C ALA A 115 -6.362 -9.404 -0.818 1.00 0.00 C ATOM 1816 O ALA A 115 -6.697 -8.225 -0.591 1.00 0.00 O ATOM 1817 CB ALA A 115 -5.409 -11.027 -2.785 1.00 0.00 C ATOM 0 H ALA A 115 -3.896 -8.321 -1.574 1.00 0.00 H new ATOM 0 HA ALA A 115 -5.765 -9.150 -2.904 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -6.396 -11.216 -3.207 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -4.674 -10.978 -3.588 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -5.146 -11.834 -2.101 1.00 0.00 H new ATOM 1823 N ALA A 116 -6.917 -10.457 -0.218 1.00 0.00 N ATOM 1824 CA ALA A 116 -7.387 -10.404 1.201 1.00 0.00 C ATOM 1825 C ALA A 116 -7.982 -11.797 1.587 1.00 0.00 C ATOM 1826 O ALA A 116 -7.486 -12.462 2.495 1.00 0.00 O ATOM 1827 CB ALA A 116 -8.384 -9.260 1.547 1.00 0.00 C ATOM 0 H ALA A 116 -7.059 -11.359 -0.673 1.00 0.00 H new ATOM 0 HA ALA A 116 -6.507 -10.165 1.798 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -8.655 -9.320 2.601 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -7.915 -8.296 1.347 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.280 -9.361 0.935 1.00 0.00 H new ATOM 1833 N CYS A 117 -9.113 -12.196 0.937 1.00 0.00 N ATOM 1834 CA CYS A 117 -9.738 -13.547 1.097 1.00 0.00 C ATOM 1835 C CYS A 117 -8.678 -14.608 0.633 1.00 0.00 C ATOM 1836 O CYS A 117 -8.253 -15.361 1.515 1.00 0.00 O ATOM 1837 CB CYS A 117 -11.102 -13.554 0.372 1.00 0.00 C ATOM 1838 SG CYS A 117 -11.908 -15.185 0.536 1.00 0.00 S ATOM 0 H CYS A 117 -9.618 -11.593 0.288 1.00 0.00 H new ATOM 0 HA CYS A 117 -9.985 -13.809 2.126 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -11.746 -12.780 0.790 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -10.961 -13.316 -0.682 1.00 0.00 H new ATOM 0 HG CYS A 117 -13.053 -15.167 -0.079 1.00 0.00 H new ATOM 1844 N PRO A 118 -8.144 -14.681 -0.634 1.00 0.00 N ATOM 1845 CA PRO A 118 -6.873 -15.397 -0.887 1.00 0.00 C ATOM 1846 C PRO A 118 -5.731 -14.565 -0.184 1.00 0.00 C ATOM 1847 O PRO A 118 -5.595 -13.340 -0.371 1.00 0.00 O ATOM 1848 CB PRO A 118 -6.830 -15.487 -2.417 1.00 0.00 C ATOM 1849 CG PRO A 118 -7.567 -14.236 -2.902 1.00 0.00 C ATOM 1850 CD PRO A 118 -8.599 -13.915 -1.813 1.00 0.00 C ATOM 0 HA PRO A 118 -6.760 -16.403 -0.484 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -5.804 -15.509 -2.783 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -7.315 -16.395 -2.774 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -6.876 -13.405 -3.044 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -8.053 -14.415 -3.861 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -8.634 -12.846 -1.602 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -9.602 -14.213 -2.117 1.00 0.00 H new ATOM 1858 N GLY A 119 -5.017 -15.258 0.714 1.00 0.00 N ATOM 1859 CA GLY A 119 -3.995 -14.636 1.582 1.00 0.00 C ATOM 1860 C GLY A 119 -2.542 -14.833 1.150 1.00 0.00 C ATOM 1861 O GLY A 119 -1.833 -15.683 1.694 1.00 0.00 O ATOM 0 H GLY A 119 -5.127 -16.261 0.862 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -4.195 -13.566 1.637 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.111 -15.034 2.590 1.00 0.00 H new ATOM 1865 N TRP A 120 -2.096 -14.025 0.182 1.00 0.00 N ATOM 1866 CA TRP A 120 -0.660 -14.019 -0.229 1.00 0.00 C ATOM 1867 C TRP A 120 0.146 -13.136 0.776 1.00 0.00 C ATOM 1868 O TRP A 120 -0.260 -12.011 1.069 1.00 0.00 O ATOM 1869 CB TRP A 120 -0.516 -13.459 -1.666 1.00 0.00 C ATOM 1870 CG TRP A 120 -0.733 -14.463 -2.799 1.00 0.00 C ATOM 1871 CD1 TRP A 120 0.249 -15.332 -3.318 1.00 0.00 C ATOM 1872 CD2 TRP A 120 -1.848 -14.643 -3.595 1.00 0.00 C ATOM 1873 NE1 TRP A 120 -0.226 -16.050 -4.431 1.00 0.00 N ATOM 1874 CE2 TRP A 120 -1.530 -15.610 -4.582 1.00 0.00 C ATOM 1875 CE3 TRP A 120 -3.123 -14.024 -3.580 1.00 0.00 C ATOM 1876 CZ2 TRP A 120 -2.486 -15.964 -5.562 1.00 0.00 C ATOM 1877 CZ3 TRP A 120 -4.042 -14.374 -4.570 1.00 0.00 C ATOM 1878 CH2 TRP A 120 -3.733 -15.336 -5.540 1.00 0.00 C ATOM 0 H TRP A 120 -2.686 -13.371 -0.333 1.00 0.00 H new ATOM 0 HA TRP A 120 -0.271 -15.037 -0.219 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -1.227 -12.642 -1.790 1.00 0.00 H new ATOM 0 HB3 TRP A 120 0.482 -13.032 -1.771 1.00 0.00 H new ATOM 0 HD1 TRP A 120 1.244 -15.434 -2.911 1.00 0.00 H new ATOM 0 HE1 TRP A 120 0.275 -16.736 -4.996 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -3.377 -13.299 -2.821 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -2.256 -16.706 -6.313 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -5.009 -13.894 -4.589 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -4.472 -15.596 -6.284 1.00 0.00 H new ATOM 1889 N PHE A 121 1.289 -13.603 1.295 1.00 0.00 N ATOM 1890 CA PHE A 121 2.094 -12.837 2.290 1.00 0.00 C ATOM 1891 C PHE A 121 2.959 -11.741 1.587 1.00 0.00 C ATOM 1892 O PHE A 121 3.721 -12.028 0.660 1.00 0.00 O ATOM 1893 CB PHE A 121 2.999 -13.818 3.090 1.00 0.00 C ATOM 1894 CG PHE A 121 2.263 -14.838 3.976 1.00 0.00 C ATOM 1895 CD1 PHE A 121 1.658 -14.429 5.169 1.00 0.00 C ATOM 1896 CD2 PHE A 121 2.146 -16.171 3.568 1.00 0.00 C ATOM 1897 CE1 PHE A 121 0.930 -15.337 5.933 1.00 0.00 C ATOM 1898 CE2 PHE A 121 1.421 -17.079 4.337 1.00 0.00 C ATOM 1899 CZ PHE A 121 0.813 -16.661 5.518 1.00 0.00 C ATOM 0 H PHE A 121 1.688 -14.509 1.049 1.00 0.00 H new ATOM 0 HA PHE A 121 1.415 -12.332 2.977 1.00 0.00 H new ATOM 0 HB2 PHE A 121 3.624 -14.364 2.383 1.00 0.00 H new ATOM 0 HB3 PHE A 121 3.668 -13.233 3.721 1.00 0.00 H new ATOM 0 HD1 PHE A 121 1.756 -13.405 5.499 1.00 0.00 H new ATOM 0 HD2 PHE A 121 2.619 -16.497 2.654 1.00 0.00 H new ATOM 0 HE1 PHE A 121 0.456 -15.014 6.848 1.00 0.00 H new ATOM 0 HE2 PHE A 121 1.331 -18.107 4.017 1.00 0.00 H new ATOM 0 HZ PHE A 121 0.250 -17.365 6.113 1.00 0.00 H new ATOM 1909 N LEU A 122 2.804 -10.486 2.029 1.00 0.00 N ATOM 1910 CA LEU A 122 3.488 -9.302 1.453 1.00 0.00 C ATOM 1911 C LEU A 122 4.652 -8.801 2.386 1.00 0.00 C ATOM 1912 O LEU A 122 4.494 -8.438 3.574 1.00 0.00 O ATOM 1913 CB LEU A 122 2.377 -8.238 1.199 1.00 0.00 C ATOM 1914 CG LEU A 122 2.672 -6.985 0.325 1.00 0.00 C ATOM 1915 CD1 LEU A 122 3.497 -5.896 1.031 1.00 0.00 C ATOM 1916 CD2 LEU A 122 3.304 -7.341 -1.030 1.00 0.00 C ATOM 0 H LEU A 122 2.191 -10.252 2.810 1.00 0.00 H new ATOM 0 HA LEU A 122 3.987 -9.535 0.512 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.532 -8.756 0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 122 2.045 -7.880 2.173 1.00 0.00 H new ATOM 0 HG LEU A 122 1.686 -6.557 0.144 1.00 0.00 H new ATOM 0 HD11 LEU A 122 3.655 -5.060 0.349 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.960 -5.548 1.913 1.00 0.00 H new ATOM 0 HD13 LEU A 122 4.461 -6.307 1.331 1.00 0.00 H new ATOM 0 HD21 LEU A 122 3.488 -6.428 -1.597 1.00 0.00 H new ATOM 0 HD22 LEU A 122 4.247 -7.862 -0.866 1.00 0.00 H new ATOM 0 HD23 LEU A 122 2.626 -7.985 -1.590 1.00 0.00 H new ATOM 1928 N CYS A 123 5.830 -8.794 1.730 1.00 0.00 N ATOM 1929 CA CYS A 123 7.132 -8.376 2.300 1.00 0.00 C ATOM 1930 C CYS A 123 7.909 -7.447 1.296 1.00 0.00 C ATOM 1931 O CYS A 123 7.660 -7.444 0.082 1.00 0.00 O ATOM 1932 CB CYS A 123 7.902 -9.683 2.615 1.00 0.00 C ATOM 1933 SG CYS A 123 7.899 -10.876 1.221 1.00 0.00 S ATOM 0 H CYS A 123 5.906 -9.088 0.756 1.00 0.00 H new ATOM 0 HA CYS A 123 7.008 -7.784 3.207 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.932 -9.437 2.872 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.459 -10.156 3.491 1.00 0.00 H new ATOM 0 HG CYS A 123 7.252 -10.366 0.215 1.00 0.00 H new ATOM 1939 N THR A 124 8.868 -6.650 1.803 1.00 0.00 N ATOM 1940 CA THR A 124 9.657 -5.689 0.964 1.00 0.00 C ATOM 1941 C THR A 124 11.140 -6.164 0.831 1.00 0.00 C ATOM 1942 O THR A 124 11.739 -6.623 1.804 1.00 0.00 O ATOM 1943 CB THR A 124 9.568 -4.265 1.596 1.00 0.00 C ATOM 1944 OG1 THR A 124 8.220 -3.891 1.873 1.00 0.00 O ATOM 1945 CG2 THR A 124 10.103 -3.161 0.676 1.00 0.00 C ATOM 0 H THR A 124 9.126 -6.642 2.790 1.00 0.00 H new ATOM 0 HA THR A 124 9.238 -5.652 -0.042 1.00 0.00 H new ATOM 0 HB THR A 124 10.170 -4.343 2.501 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.185 -3.398 2.719 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.012 -2.196 1.175 1.00 0.00 H new ATOM 0 HG22 THR A 124 11.151 -3.354 0.447 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.526 -3.147 -0.249 1.00 0.00 H new ATOM 1953 N ALA A 125 11.780 -6.016 -0.345 1.00 0.00 N ATOM 1954 CA ALA A 125 13.183 -6.483 -0.544 1.00 0.00 C ATOM 1955 C ALA A 125 14.300 -5.728 0.267 1.00 0.00 C ATOM 1956 O ALA A 125 14.122 -4.626 0.800 1.00 0.00 O ATOM 1957 CB ALA A 125 13.416 -6.391 -2.057 1.00 0.00 C ATOM 0 H ALA A 125 11.361 -5.583 -1.168 1.00 0.00 H new ATOM 0 HA ALA A 125 13.276 -7.493 -0.144 1.00 0.00 H new ATOM 0 HB1 ALA A 125 14.429 -6.718 -2.290 1.00 0.00 H new ATOM 0 HB2 ALA A 125 12.701 -7.030 -2.575 1.00 0.00 H new ATOM 0 HB3 ALA A 125 13.284 -5.359 -2.383 1.00 0.00 H new ATOM 1963 N MET A 126 15.473 -6.381 0.351 1.00 0.00 N ATOM 1964 CA MET A 126 16.650 -5.912 1.139 1.00 0.00 C ATOM 1965 C MET A 126 17.357 -4.600 0.654 1.00 0.00 C ATOM 1966 O MET A 126 17.572 -3.709 1.483 1.00 0.00 O ATOM 1967 CB MET A 126 17.684 -7.082 1.145 1.00 0.00 C ATOM 1968 CG MET A 126 17.280 -8.357 1.916 1.00 0.00 C ATOM 1969 SD MET A 126 18.586 -9.591 1.764 1.00 0.00 S ATOM 1970 CE MET A 126 17.769 -10.989 2.554 1.00 0.00 C ATOM 0 H MET A 126 15.643 -7.264 -0.131 1.00 0.00 H new ATOM 0 HA MET A 126 16.267 -5.644 2.124 1.00 0.00 H new ATOM 0 HB2 MET A 126 17.890 -7.360 0.111 1.00 0.00 H new ATOM 0 HB3 MET A 126 18.617 -6.710 1.567 1.00 0.00 H new ATOM 0 HG2 MET A 126 17.109 -8.121 2.966 1.00 0.00 H new ATOM 0 HG3 MET A 126 16.344 -8.752 1.521 1.00 0.00 H new ATOM 0 HE1 MET A 126 18.437 -11.850 2.550 1.00 0.00 H new ATOM 0 HE2 MET A 126 17.517 -10.730 3.582 1.00 0.00 H new ATOM 0 HE3 MET A 126 16.858 -11.234 2.008 1.00 0.00 H new ATOM 1980 N GLU A 127 17.666 -4.439 -0.644 1.00 0.00 N ATOM 1981 CA GLU A 127 18.472 -3.285 -1.148 1.00 0.00 C ATOM 1982 C GLU A 127 17.634 -2.003 -1.514 1.00 0.00 C ATOM 1983 O GLU A 127 16.435 -1.892 -1.221 1.00 0.00 O ATOM 1984 CB GLU A 127 19.303 -3.860 -2.347 1.00 0.00 C ATOM 1985 CG GLU A 127 20.303 -5.016 -2.053 1.00 0.00 C ATOM 1986 CD GLU A 127 21.297 -4.762 -0.929 1.00 0.00 C ATOM 1987 OE1 GLU A 127 22.237 -3.967 -1.131 1.00 0.00 O ATOM 1988 OE2 GLU A 127 21.135 -5.359 0.155 1.00 0.00 O ATOM 0 H GLU A 127 17.375 -5.089 -1.374 1.00 0.00 H new ATOM 0 HA GLU A 127 19.118 -2.898 -0.360 1.00 0.00 H new ATOM 0 HB2 GLU A 127 18.600 -4.210 -3.103 1.00 0.00 H new ATOM 0 HB3 GLU A 127 19.864 -3.037 -2.790 1.00 0.00 H new ATOM 0 HG2 GLU A 127 19.732 -5.913 -1.812 1.00 0.00 H new ATOM 0 HG3 GLU A 127 20.861 -5.229 -2.965 1.00 0.00 H new ATOM 1995 N ALA A 128 18.303 -0.994 -2.114 1.00 0.00 N ATOM 1996 CA ALA A 128 17.670 0.301 -2.513 1.00 0.00 C ATOM 1997 C ALA A 128 16.971 0.411 -3.909 1.00 0.00 C ATOM 1998 O ALA A 128 16.141 1.293 -4.124 1.00 0.00 O ATOM 1999 CB ALA A 128 18.808 1.331 -2.363 1.00 0.00 C ATOM 0 H ALA A 128 19.297 -1.046 -2.339 1.00 0.00 H new ATOM 0 HA ALA A 128 16.802 0.456 -1.872 1.00 0.00 H new ATOM 0 HB1 ALA A 128 18.441 2.321 -2.635 1.00 0.00 H new ATOM 0 HB2 ALA A 128 19.154 1.343 -1.329 1.00 0.00 H new ATOM 0 HB3 ALA A 128 19.635 1.058 -3.019 1.00 0.00 H new ATOM 2005 N ASP A 129 17.330 -0.470 -4.830 1.00 0.00 N ATOM 2006 CA ASP A 129 16.706 -0.591 -6.191 1.00 0.00 C ATOM 2007 C ASP A 129 15.683 -1.786 -6.307 1.00 0.00 C ATOM 2008 O ASP A 129 14.811 -1.756 -7.182 1.00 0.00 O ATOM 2009 CB ASP A 129 17.875 -0.719 -7.211 1.00 0.00 C ATOM 2010 CG ASP A 129 17.469 -0.556 -8.678 1.00 0.00 C ATOM 2011 OD1 ASP A 129 16.920 -1.502 -9.277 1.00 0.00 O ATOM 2012 OD2 ASP A 129 17.637 0.541 -9.245 1.00 0.00 O ATOM 0 H ASP A 129 18.077 -1.147 -4.675 1.00 0.00 H new ATOM 0 HA ASP A 129 16.103 0.293 -6.397 1.00 0.00 H new ATOM 0 HB2 ASP A 129 18.630 0.030 -6.972 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.343 -1.695 -7.085 1.00 0.00 H new ATOM 2017 N GLN A 130 15.762 -2.825 -5.449 1.00 0.00 N ATOM 2018 CA GLN A 130 14.842 -3.990 -5.476 1.00 0.00 C ATOM 2019 C GLN A 130 13.344 -3.624 -5.107 1.00 0.00 C ATOM 2020 O GLN A 130 13.117 -2.634 -4.396 1.00 0.00 O ATOM 2021 CB GLN A 130 15.404 -5.043 -4.484 1.00 0.00 C ATOM 2022 CG GLN A 130 16.738 -5.742 -4.854 1.00 0.00 C ATOM 2023 CD GLN A 130 17.259 -6.721 -3.786 1.00 0.00 C ATOM 2024 OE1 GLN A 130 16.997 -6.623 -2.590 1.00 0.00 O ATOM 2025 NE2 GLN A 130 18.053 -7.688 -4.175 1.00 0.00 N ATOM 0 H GLN A 130 16.467 -2.883 -4.714 1.00 0.00 H new ATOM 0 HA GLN A 130 14.800 -4.376 -6.495 1.00 0.00 H new ATOM 0 HB2 GLN A 130 15.537 -4.556 -3.518 1.00 0.00 H new ATOM 0 HB3 GLN A 130 14.647 -5.815 -4.350 1.00 0.00 H new ATOM 0 HG2 GLN A 130 16.603 -6.283 -5.791 1.00 0.00 H new ATOM 0 HG3 GLN A 130 17.497 -4.980 -5.032 1.00 0.00 H new ATOM 0 HE21 GLN A 130 18.286 -7.791 -5.163 1.00 0.00 H new ATOM 0 HE22 GLN A 130 18.438 -8.338 -3.490 1.00 0.00 H new ATOM 2034 N PRO A 131 12.300 -4.408 -5.518 1.00 0.00 N ATOM 2035 CA PRO A 131 10.878 -4.057 -5.253 1.00 0.00 C ATOM 2036 C PRO A 131 10.169 -4.717 -4.022 1.00 0.00 C ATOM 2037 O PRO A 131 10.745 -5.462 -3.221 1.00 0.00 O ATOM 2038 CB PRO A 131 10.296 -4.513 -6.616 1.00 0.00 C ATOM 2039 CG PRO A 131 11.026 -5.822 -6.932 1.00 0.00 C ATOM 2040 CD PRO A 131 12.446 -5.571 -6.426 1.00 0.00 C ATOM 0 HA PRO A 131 10.739 -3.017 -4.957 1.00 0.00 H new ATOM 0 HB2 PRO A 131 9.218 -4.665 -6.555 1.00 0.00 H new ATOM 0 HB3 PRO A 131 10.469 -3.766 -7.391 1.00 0.00 H new ATOM 0 HG2 PRO A 131 10.564 -6.671 -6.427 1.00 0.00 H new ATOM 0 HG3 PRO A 131 11.013 -6.041 -8.000 1.00 0.00 H new ATOM 0 HD2 PRO A 131 12.843 -6.440 -5.901 1.00 0.00 H new ATOM 0 HD3 PRO A 131 13.130 -5.354 -7.246 1.00 0.00 H new ATOM 2048 N VAL A 132 8.863 -4.421 -3.897 1.00 0.00 N ATOM 2049 CA VAL A 132 7.969 -5.134 -2.928 1.00 0.00 C ATOM 2050 C VAL A 132 7.463 -6.476 -3.588 1.00 0.00 C ATOM 2051 O VAL A 132 7.326 -6.554 -4.819 1.00 0.00 O ATOM 2052 CB VAL A 132 6.814 -4.172 -2.484 1.00 0.00 C ATOM 2053 CG1 VAL A 132 5.694 -3.957 -3.532 1.00 0.00 C ATOM 2054 CG2 VAL A 132 6.193 -4.638 -1.150 1.00 0.00 C ATOM 0 H VAL A 132 8.393 -3.700 -4.445 1.00 0.00 H new ATOM 0 HA VAL A 132 8.505 -5.412 -2.020 1.00 0.00 H new ATOM 0 HB VAL A 132 7.299 -3.203 -2.365 1.00 0.00 H new ATOM 0 HG11 VAL A 132 4.944 -3.277 -3.129 1.00 0.00 H new ATOM 0 HG12 VAL A 132 6.122 -3.529 -4.439 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.227 -4.913 -3.767 1.00 0.00 H new ATOM 0 HG21 VAL A 132 5.394 -3.955 -0.862 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.786 -5.642 -1.269 1.00 0.00 H new ATOM 0 HG23 VAL A 132 6.960 -4.646 -0.375 1.00 0.00 H new ATOM 2064 N SER A 133 7.208 -7.566 -2.828 1.00 0.00 N ATOM 2065 CA SER A 133 6.749 -8.850 -3.449 1.00 0.00 C ATOM 2066 C SER A 133 5.896 -9.781 -2.522 1.00 0.00 C ATOM 2067 O SER A 133 5.865 -9.686 -1.287 1.00 0.00 O ATOM 2068 CB SER A 133 8.014 -9.589 -3.979 1.00 0.00 C ATOM 2069 OG SER A 133 8.566 -8.895 -5.100 1.00 0.00 O ATOM 0 H SER A 133 7.306 -7.594 -1.813 1.00 0.00 H new ATOM 0 HA SER A 133 6.057 -8.595 -4.252 1.00 0.00 H new ATOM 0 HB2 SER A 133 8.759 -9.662 -3.186 1.00 0.00 H new ATOM 0 HB3 SER A 133 7.754 -10.608 -4.267 1.00 0.00 H new ATOM 0 HG SER A 133 7.997 -8.128 -5.323 1.00 0.00 H new ATOM 2075 N LEU A 134 5.180 -10.686 -3.220 1.00 0.00 N ATOM 2076 CA LEU A 134 4.216 -11.649 -2.634 1.00 0.00 C ATOM 2077 C LEU A 134 4.762 -13.117 -2.610 1.00 0.00 C ATOM 2078 O LEU A 134 5.457 -13.566 -3.527 1.00 0.00 O ATOM 2079 CB LEU A 134 2.925 -11.640 -3.514 1.00 0.00 C ATOM 2080 CG LEU A 134 1.989 -10.402 -3.477 1.00 0.00 C ATOM 2081 CD1 LEU A 134 2.514 -9.184 -4.260 1.00 0.00 C ATOM 2082 CD2 LEU A 134 0.624 -10.761 -4.085 1.00 0.00 C ATOM 0 H LEU A 134 5.256 -10.772 -4.234 1.00 0.00 H new ATOM 0 HA LEU A 134 4.028 -11.341 -1.605 1.00 0.00 H new ATOM 0 HB2 LEU A 134 3.233 -11.787 -4.549 1.00 0.00 H new ATOM 0 HB3 LEU A 134 2.330 -12.509 -3.232 1.00 0.00 H new ATOM 0 HG LEU A 134 1.926 -10.129 -2.424 1.00 0.00 H new ATOM 0 HD11 LEU A 134 1.799 -8.365 -4.181 1.00 0.00 H new ATOM 0 HD12 LEU A 134 3.472 -8.870 -3.845 1.00 0.00 H new ATOM 0 HD13 LEU A 134 2.643 -9.453 -5.308 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -0.028 -9.888 -4.056 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.759 -11.079 -5.119 1.00 0.00 H new ATOM 0 HD23 LEU A 134 0.172 -11.571 -3.512 1.00 0.00 H new ATOM 2094 N THR A 135 4.349 -13.891 -1.594 1.00 0.00 N ATOM 2095 CA THR A 135 4.691 -15.344 -1.471 1.00 0.00 C ATOM 2096 C THR A 135 3.476 -16.122 -0.860 1.00 0.00 C ATOM 2097 O THR A 135 2.768 -15.628 0.021 1.00 0.00 O ATOM 2098 CB THR A 135 6.003 -15.551 -0.633 1.00 0.00 C ATOM 2099 OG1 THR A 135 6.323 -16.940 -0.603 1.00 0.00 O ATOM 2100 CG2 THR A 135 5.974 -15.103 0.839 1.00 0.00 C ATOM 0 H THR A 135 3.770 -13.543 -0.830 1.00 0.00 H new ATOM 0 HA THR A 135 4.890 -15.747 -2.464 1.00 0.00 H new ATOM 0 HB THR A 135 6.728 -14.917 -1.144 1.00 0.00 H new ATOM 0 HG1 THR A 135 6.311 -17.258 0.324 1.00 0.00 H new ATOM 0 HG21 THR A 135 6.942 -15.303 1.299 1.00 0.00 H new ATOM 0 HG22 THR A 135 5.761 -14.035 0.890 1.00 0.00 H new ATOM 0 HG23 THR A 135 5.198 -15.653 1.372 1.00 0.00 H new ATOM 2108 N ASN A 136 3.258 -17.383 -1.277 1.00 0.00 N ATOM 2109 CA ASN A 136 2.188 -18.247 -0.669 1.00 0.00 C ATOM 2110 C ASN A 136 2.578 -18.805 0.752 1.00 0.00 C ATOM 2111 O ASN A 136 1.686 -19.067 1.561 1.00 0.00 O ATOM 2112 CB ASN A 136 1.874 -19.420 -1.641 1.00 0.00 C ATOM 2113 CG ASN A 136 1.041 -19.030 -2.866 1.00 0.00 C ATOM 2114 OD1 ASN A 136 1.557 -18.679 -3.921 1.00 0.00 O ATOM 2115 ND2 ASN A 136 -0.268 -19.062 -2.765 1.00 0.00 N ATOM 0 H ASN A 136 3.791 -17.835 -2.020 1.00 0.00 H new ATOM 0 HA ASN A 136 1.305 -17.625 -0.520 1.00 0.00 H new ATOM 0 HB2 ASN A 136 2.814 -19.854 -1.981 1.00 0.00 H new ATOM 0 HB3 ASN A 136 1.344 -20.198 -1.091 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -0.848 -18.796 -3.561 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -0.705 -19.353 -1.891 1.00 0.00 H new ATOM 2122 N MET A 137 3.876 -18.991 1.049 1.00 0.00 N ATOM 2123 CA MET A 137 4.392 -19.399 2.381 1.00 0.00 C ATOM 2124 C MET A 137 5.674 -18.537 2.724 1.00 0.00 C ATOM 2125 O MET A 137 6.436 -18.215 1.797 1.00 0.00 O ATOM 2126 CB MET A 137 4.685 -20.929 2.396 1.00 0.00 C ATOM 2127 CG MET A 137 5.784 -21.473 1.455 1.00 0.00 C ATOM 2128 SD MET A 137 5.928 -23.257 1.662 1.00 0.00 S ATOM 2129 CE MET A 137 7.266 -23.584 0.502 1.00 0.00 C ATOM 0 H MET A 137 4.617 -18.861 0.360 1.00 0.00 H new ATOM 0 HA MET A 137 3.644 -19.212 3.151 1.00 0.00 H new ATOM 0 HB2 MET A 137 4.953 -21.206 3.416 1.00 0.00 H new ATOM 0 HB3 MET A 137 3.756 -21.448 2.158 1.00 0.00 H new ATOM 0 HG2 MET A 137 5.541 -21.235 0.419 1.00 0.00 H new ATOM 0 HG3 MET A 137 6.737 -20.993 1.677 1.00 0.00 H new ATOM 0 HE1 MET A 137 7.492 -24.650 0.498 1.00 0.00 H new ATOM 0 HE2 MET A 137 6.964 -23.273 -0.498 1.00 0.00 H new ATOM 0 HE3 MET A 137 8.153 -23.026 0.803 1.00 0.00 H new ATOM 2139 N PRO A 138 5.990 -18.148 4.001 1.00 0.00 N ATOM 2140 CA PRO A 138 7.238 -17.396 4.336 1.00 0.00 C ATOM 2141 C PRO A 138 8.574 -18.114 3.929 1.00 0.00 C ATOM 2142 O PRO A 138 8.754 -19.304 4.206 1.00 0.00 O ATOM 2143 CB PRO A 138 7.126 -17.217 5.865 1.00 0.00 C ATOM 2144 CG PRO A 138 5.637 -17.355 6.178 1.00 0.00 C ATOM 2145 CD PRO A 138 5.147 -18.408 5.186 1.00 0.00 C ATOM 0 HA PRO A 138 7.300 -16.463 3.775 1.00 0.00 H new ATOM 0 HB2 PRO A 138 7.711 -17.970 6.393 1.00 0.00 H new ATOM 0 HB3 PRO A 138 7.505 -16.243 6.176 1.00 0.00 H new ATOM 0 HG2 PRO A 138 5.473 -17.671 7.208 1.00 0.00 H new ATOM 0 HG3 PRO A 138 5.112 -16.409 6.047 1.00 0.00 H new ATOM 0 HD2 PRO A 138 5.284 -19.420 5.567 1.00 0.00 H new ATOM 0 HD3 PRO A 138 4.086 -18.293 4.963 1.00 0.00 H new ATOM 2153 N ASP A 139 9.497 -17.380 3.284 1.00 0.00 N ATOM 2154 CA ASP A 139 10.788 -17.951 2.794 1.00 0.00 C ATOM 2155 C ASP A 139 11.938 -17.896 3.881 1.00 0.00 C ATOM 2156 O ASP A 139 11.663 -17.854 5.087 1.00 0.00 O ATOM 2157 CB ASP A 139 11.046 -17.174 1.468 1.00 0.00 C ATOM 2158 CG ASP A 139 11.946 -17.897 0.467 1.00 0.00 C ATOM 2159 OD1 ASP A 139 13.170 -17.965 0.705 1.00 0.00 O ATOM 2160 OD2 ASP A 139 11.439 -18.378 -0.567 1.00 0.00 O ATOM 0 H ASP A 139 9.383 -16.386 3.084 1.00 0.00 H new ATOM 0 HA ASP A 139 10.755 -19.024 2.602 1.00 0.00 H new ATOM 0 HB2 ASP A 139 10.088 -16.969 0.991 1.00 0.00 H new ATOM 0 HB3 ASP A 139 11.495 -16.211 1.709 1.00 0.00 H new ATOM 2165 N GLU A 140 13.226 -17.969 3.480 1.00 0.00 N ATOM 2166 CA GLU A 140 14.380 -17.996 4.436 1.00 0.00 C ATOM 2167 C GLU A 140 15.553 -17.119 3.885 1.00 0.00 C ATOM 2168 O GLU A 140 16.539 -17.608 3.323 1.00 0.00 O ATOM 2169 CB GLU A 140 14.832 -19.468 4.693 1.00 0.00 C ATOM 2170 CG GLU A 140 13.891 -20.320 5.585 1.00 0.00 C ATOM 2171 CD GLU A 140 14.461 -21.671 5.991 1.00 0.00 C ATOM 2172 OE1 GLU A 140 15.183 -21.733 7.009 1.00 0.00 O ATOM 2173 OE2 GLU A 140 14.172 -22.677 5.310 1.00 0.00 O ATOM 0 H GLU A 140 13.504 -18.011 2.500 1.00 0.00 H new ATOM 0 HA GLU A 140 14.068 -17.574 5.391 1.00 0.00 H new ATOM 0 HB2 GLU A 140 14.939 -19.968 3.730 1.00 0.00 H new ATOM 0 HB3 GLU A 140 15.819 -19.449 5.154 1.00 0.00 H new ATOM 0 HG2 GLU A 140 13.654 -19.754 6.486 1.00 0.00 H new ATOM 0 HG3 GLU A 140 12.953 -20.480 5.053 1.00 0.00 H new ATOM 2180 N GLY A 141 15.466 -15.797 4.117 1.00 0.00 N ATOM 2181 CA GLY A 141 16.490 -14.825 3.635 1.00 0.00 C ATOM 2182 C GLY A 141 16.349 -14.426 2.152 1.00 0.00 C ATOM 2183 O GLY A 141 17.305 -14.531 1.382 1.00 0.00 O ATOM 0 H GLY A 141 14.700 -15.367 4.635 1.00 0.00 H new ATOM 0 HA2 GLY A 141 16.433 -13.925 4.247 1.00 0.00 H new ATOM 0 HA3 GLY A 141 17.480 -15.254 3.790 1.00 0.00 H new ATOM 2187 N VAL A 142 15.167 -13.913 1.788 1.00 0.00 N ATOM 2188 CA VAL A 142 14.823 -13.554 0.377 1.00 0.00 C ATOM 2189 C VAL A 142 14.351 -12.057 0.373 1.00 0.00 C ATOM 2190 O VAL A 142 15.025 -11.173 -0.162 1.00 0.00 O ATOM 2191 CB VAL A 142 13.821 -14.675 -0.144 1.00 0.00 C ATOM 2192 CG1 VAL A 142 12.308 -14.367 -0.288 1.00 0.00 C ATOM 2193 CG2 VAL A 142 14.259 -15.170 -1.541 1.00 0.00 C ATOM 0 H VAL A 142 14.413 -13.730 2.450 1.00 0.00 H new ATOM 0 HA VAL A 142 15.643 -13.565 -0.341 1.00 0.00 H new ATOM 0 HB VAL A 142 13.898 -15.389 0.676 1.00 0.00 H new ATOM 0 HG11 VAL A 142 11.790 -15.253 -0.656 1.00 0.00 H new ATOM 0 HG12 VAL A 142 11.900 -14.085 0.683 1.00 0.00 H new ATOM 0 HG13 VAL A 142 12.169 -13.547 -0.992 1.00 0.00 H new ATOM 0 HG21 VAL A 142 13.567 -15.937 -1.889 1.00 0.00 H new ATOM 0 HG22 VAL A 142 14.256 -14.334 -2.241 1.00 0.00 H new ATOM 0 HG23 VAL A 142 15.264 -15.588 -1.480 1.00 0.00 H new ATOM 2203 N MET A 143 13.212 -11.799 1.027 1.00 0.00 N ATOM 2204 CA MET A 143 12.631 -10.448 1.243 1.00 0.00 C ATOM 2205 C MET A 143 12.522 -10.186 2.785 1.00 0.00 C ATOM 2206 O MET A 143 12.457 -11.101 3.618 1.00 0.00 O ATOM 2207 CB MET A 143 11.241 -10.358 0.544 1.00 0.00 C ATOM 2208 CG MET A 143 11.249 -9.951 -0.945 1.00 0.00 C ATOM 2209 SD MET A 143 12.166 -11.116 -1.969 1.00 0.00 S ATOM 2210 CE MET A 143 12.140 -10.239 -3.542 1.00 0.00 C ATOM 0 H MET A 143 12.644 -12.540 1.437 1.00 0.00 H new ATOM 0 HA MET A 143 13.271 -9.681 0.806 1.00 0.00 H new ATOM 0 HB2 MET A 143 10.751 -11.328 0.631 1.00 0.00 H new ATOM 0 HB3 MET A 143 10.629 -9.641 1.091 1.00 0.00 H new ATOM 0 HG2 MET A 143 10.223 -9.883 -1.306 1.00 0.00 H new ATOM 0 HG3 MET A 143 11.688 -8.959 -1.046 1.00 0.00 H new ATOM 0 HE1 MET A 143 12.668 -10.825 -4.294 1.00 0.00 H new ATOM 0 HE2 MET A 143 11.108 -10.089 -3.858 1.00 0.00 H new ATOM 0 HE3 MET A 143 12.628 -9.271 -3.427 1.00 0.00 H new ATOM 2220 N VAL A 144 12.518 -8.903 3.177 1.00 0.00 N ATOM 2221 CA VAL A 144 12.419 -8.478 4.602 1.00 0.00 C ATOM 2222 C VAL A 144 10.901 -8.424 4.980 1.00 0.00 C ATOM 2223 O VAL A 144 10.165 -7.511 4.586 1.00 0.00 O ATOM 2224 CB VAL A 144 13.146 -7.098 4.813 1.00 0.00 C ATOM 2225 CG1 VAL A 144 13.057 -6.559 6.262 1.00 0.00 C ATOM 2226 CG2 VAL A 144 14.649 -7.122 4.443 1.00 0.00 C ATOM 0 H VAL A 144 12.583 -8.123 2.523 1.00 0.00 H new ATOM 0 HA VAL A 144 12.920 -9.188 5.260 1.00 0.00 H new ATOM 0 HB VAL A 144 12.601 -6.442 4.134 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.581 -5.606 6.328 1.00 0.00 H new ATOM 0 HG12 VAL A 144 12.011 -6.418 6.534 1.00 0.00 H new ATOM 0 HG13 VAL A 144 13.516 -7.274 6.945 1.00 0.00 H new ATOM 0 HG21 VAL A 144 15.082 -6.136 4.615 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.164 -7.857 5.061 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.761 -7.389 3.392 1.00 0.00 H new ATOM 2236 N THR A 145 10.440 -9.405 5.776 1.00 0.00 N ATOM 2237 CA THR A 145 9.024 -9.445 6.272 1.00 0.00 C ATOM 2238 C THR A 145 8.761 -8.586 7.572 1.00 0.00 C ATOM 2239 O THR A 145 7.836 -8.888 8.333 1.00 0.00 O ATOM 2240 CB THR A 145 8.626 -10.951 6.438 1.00 0.00 C ATOM 2241 OG1 THR A 145 7.248 -11.012 6.783 1.00 0.00 O ATOM 2242 CG2 THR A 145 9.369 -11.750 7.528 1.00 0.00 C ATOM 0 H THR A 145 11.014 -10.185 6.097 1.00 0.00 H new ATOM 0 HA THR A 145 8.380 -8.964 5.536 1.00 0.00 H new ATOM 0 HB THR A 145 8.890 -11.404 5.483 1.00 0.00 H new ATOM 0 HG1 THR A 145 7.066 -10.385 7.514 1.00 0.00 H new ATOM 0 HG21 THR A 145 9.002 -12.776 7.541 1.00 0.00 H new ATOM 0 HG22 THR A 145 10.438 -11.749 7.315 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.193 -11.290 8.500 1.00 0.00 H new ATOM 2250 N LYS A 146 9.544 -7.518 7.800 1.00 0.00 N ATOM 2251 CA LYS A 146 9.394 -6.570 8.932 1.00 0.00 C ATOM 2252 C LYS A 146 9.408 -5.134 8.313 1.00 0.00 C ATOM 2253 O LYS A 146 10.467 -4.569 8.028 1.00 0.00 O ATOM 2254 CB LYS A 146 10.496 -6.832 9.996 1.00 0.00 C ATOM 2255 CG LYS A 146 10.202 -7.965 11.024 1.00 0.00 C ATOM 2256 CD LYS A 146 9.086 -7.663 12.066 1.00 0.00 C ATOM 2257 CE LYS A 146 7.669 -8.182 11.721 1.00 0.00 C ATOM 2258 NZ LYS A 146 7.329 -9.444 12.430 1.00 0.00 N ATOM 0 H LYS A 146 10.323 -7.278 7.187 1.00 0.00 H new ATOM 0 HA LYS A 146 8.457 -6.697 9.474 1.00 0.00 H new ATOM 0 HB2 LYS A 146 11.424 -7.072 9.477 1.00 0.00 H new ATOM 0 HB3 LYS A 146 10.669 -5.907 10.546 1.00 0.00 H new ATOM 0 HG2 LYS A 146 9.926 -8.865 10.475 1.00 0.00 H new ATOM 0 HG3 LYS A 146 11.123 -8.190 11.562 1.00 0.00 H new ATOM 0 HD2 LYS A 146 9.385 -8.093 13.022 1.00 0.00 H new ATOM 0 HD3 LYS A 146 9.031 -6.583 12.205 1.00 0.00 H new ATOM 0 HE2 LYS A 146 6.935 -7.418 11.977 1.00 0.00 H new ATOM 0 HE3 LYS A 146 7.598 -8.345 10.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 6.985 -10.146 11.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 8.176 -9.813 12.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 6.588 -9.257 13.135 1.00 0.00 H new ATOM 2272 N PHE A 147 8.205 -4.579 8.065 1.00 0.00 N ATOM 2273 CA PHE A 147 8.021 -3.246 7.418 1.00 0.00 C ATOM 2274 C PHE A 147 6.952 -2.405 8.208 1.00 0.00 C ATOM 2275 O PHE A 147 5.970 -2.935 8.731 1.00 0.00 O ATOM 2276 CB PHE A 147 7.642 -3.529 5.931 1.00 0.00 C ATOM 2277 CG PHE A 147 7.953 -2.392 4.946 1.00 0.00 C ATOM 2278 CD1 PHE A 147 9.277 -2.168 4.553 1.00 0.00 C ATOM 2279 CD2 PHE A 147 6.937 -1.594 4.410 1.00 0.00 C ATOM 2280 CE1 PHE A 147 9.586 -1.136 3.672 1.00 0.00 C ATOM 2281 CE2 PHE A 147 7.246 -0.580 3.506 1.00 0.00 C ATOM 2282 CZ PHE A 147 8.570 -0.350 3.139 1.00 0.00 C ATOM 0 H PHE A 147 7.326 -5.037 8.305 1.00 0.00 H new ATOM 0 HA PHE A 147 8.924 -2.636 7.438 1.00 0.00 H new ATOM 0 HB2 PHE A 147 8.169 -4.425 5.603 1.00 0.00 H new ATOM 0 HB3 PHE A 147 6.576 -3.749 5.881 1.00 0.00 H new ATOM 0 HD1 PHE A 147 10.064 -2.800 4.936 1.00 0.00 H new ATOM 0 HD2 PHE A 147 5.910 -1.764 4.698 1.00 0.00 H new ATOM 0 HE1 PHE A 147 10.614 -0.946 3.402 1.00 0.00 H new ATOM 0 HE2 PHE A 147 6.458 0.029 3.089 1.00 0.00 H new ATOM 0 HZ PHE A 147 8.807 0.439 2.441 1.00 0.00 H new ATOM 2292 N TYR A 148 7.169 -1.090 8.348 1.00 0.00 N ATOM 2293 CA TYR A 148 6.312 -0.169 9.149 1.00 0.00 C ATOM 2294 C TYR A 148 5.090 0.461 8.380 1.00 0.00 C ATOM 2295 O TYR A 148 5.141 0.826 7.201 1.00 0.00 O ATOM 2296 CB TYR A 148 7.262 0.961 9.661 1.00 0.00 C ATOM 2297 CG TYR A 148 6.780 1.727 10.907 1.00 0.00 C ATOM 2298 CD1 TYR A 148 5.962 2.855 10.796 1.00 0.00 C ATOM 2299 CD2 TYR A 148 7.176 1.296 12.177 1.00 0.00 C ATOM 2300 CE1 TYR A 148 5.541 3.538 11.934 1.00 0.00 C ATOM 2301 CE2 TYR A 148 6.755 1.978 13.317 1.00 0.00 C ATOM 2302 CZ TYR A 148 5.939 3.098 13.194 1.00 0.00 C ATOM 2303 OH TYR A 148 5.518 3.769 14.309 1.00 0.00 O ATOM 0 H TYR A 148 7.956 -0.616 7.905 1.00 0.00 H new ATOM 0 HA TYR A 148 5.847 -0.747 9.947 1.00 0.00 H new ATOM 0 HB2 TYR A 148 8.234 0.520 9.882 1.00 0.00 H new ATOM 0 HB3 TYR A 148 7.413 1.677 8.853 1.00 0.00 H new ATOM 0 HD1 TYR A 148 5.654 3.200 9.820 1.00 0.00 H new ATOM 0 HD2 TYR A 148 7.812 0.429 12.275 1.00 0.00 H new ATOM 0 HE1 TYR A 148 4.907 4.407 11.840 1.00 0.00 H new ATOM 0 HE2 TYR A 148 7.062 1.637 14.295 1.00 0.00 H new ATOM 0 HH TYR A 148 5.882 3.335 15.109 1.00 0.00 H new ATOM 2313 N PHE A 149 4.001 0.636 9.144 1.00 0.00 N ATOM 2314 CA PHE A 149 2.719 1.254 8.706 1.00 0.00 C ATOM 2315 C PHE A 149 2.654 2.725 9.263 1.00 0.00 C ATOM 2316 O PHE A 149 2.453 2.900 10.470 1.00 0.00 O ATOM 2317 CB PHE A 149 1.661 0.242 9.267 1.00 0.00 C ATOM 2318 CG PHE A 149 0.158 0.520 9.118 1.00 0.00 C ATOM 2319 CD1 PHE A 149 -0.507 0.272 7.913 1.00 0.00 C ATOM 2320 CD2 PHE A 149 -0.579 0.946 10.232 1.00 0.00 C ATOM 2321 CE1 PHE A 149 -1.883 0.480 7.815 1.00 0.00 C ATOM 2322 CE2 PHE A 149 -1.954 1.149 10.132 1.00 0.00 C ATOM 2323 CZ PHE A 149 -2.605 0.914 8.925 1.00 0.00 C ATOM 0 H PHE A 149 3.978 0.344 10.121 1.00 0.00 H new ATOM 0 HA PHE A 149 2.565 1.388 7.635 1.00 0.00 H new ATOM 0 HB2 PHE A 149 1.858 -0.722 8.797 1.00 0.00 H new ATOM 0 HB3 PHE A 149 1.862 0.124 10.332 1.00 0.00 H new ATOM 0 HD1 PHE A 149 0.046 -0.082 7.056 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.078 1.118 11.173 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -2.389 0.304 6.877 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -2.514 1.489 10.991 1.00 0.00 H new ATOM 0 HZ PHE A 149 -3.671 1.068 8.848 1.00 0.00 H new ATOM 2333 N GLN A 150 2.885 3.777 8.437 1.00 0.00 N ATOM 2334 CA GLN A 150 2.974 5.188 8.936 1.00 0.00 C ATOM 2335 C GLN A 150 1.675 6.031 8.691 1.00 0.00 C ATOM 2336 O GLN A 150 1.297 6.345 7.552 1.00 0.00 O ATOM 2337 CB GLN A 150 4.209 5.855 8.250 1.00 0.00 C ATOM 2338 CG GLN A 150 4.558 7.284 8.759 1.00 0.00 C ATOM 2339 CD GLN A 150 5.775 7.964 8.108 1.00 0.00 C ATOM 2340 OE1 GLN A 150 6.801 7.364 7.807 1.00 0.00 O ATOM 2341 NE2 GLN A 150 5.735 9.256 7.895 1.00 0.00 N ATOM 0 H GLN A 150 3.013 3.684 7.429 1.00 0.00 H new ATOM 0 HA GLN A 150 3.088 5.161 10.020 1.00 0.00 H new ATOM 0 HB2 GLN A 150 5.077 5.212 8.397 1.00 0.00 H new ATOM 0 HB3 GLN A 150 4.026 5.904 7.177 1.00 0.00 H new ATOM 0 HG2 GLN A 150 3.688 7.923 8.607 1.00 0.00 H new ATOM 0 HG3 GLN A 150 4.731 7.231 9.834 1.00 0.00 H new ATOM 0 HE21 GLN A 150 4.897 9.787 8.134 1.00 0.00 H new ATOM 0 HE22 GLN A 150 6.542 9.731 7.491 1.00 0.00 H new ATOM 2350 N GLU A 151 1.061 6.473 9.807 1.00 0.00 N ATOM 2351 CA GLU A 151 -0.132 7.362 9.787 1.00 0.00 C ATOM 2352 C GLU A 151 0.345 8.859 9.730 1.00 0.00 C ATOM 2353 O GLU A 151 0.730 9.471 10.732 1.00 0.00 O ATOM 2354 CB GLU A 151 -1.009 7.005 11.025 1.00 0.00 C ATOM 2355 CG GLU A 151 -2.486 7.500 10.957 1.00 0.00 C ATOM 2356 CD GLU A 151 -3.562 6.427 11.145 1.00 0.00 C ATOM 2357 OE1 GLU A 151 -3.638 5.820 12.232 1.00 0.00 O ATOM 2358 OE2 GLU A 151 -4.339 6.196 10.193 1.00 0.00 O ATOM 0 H GLU A 151 1.372 6.228 10.747 1.00 0.00 H new ATOM 0 HA GLU A 151 -0.753 7.218 8.903 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -1.011 5.922 11.149 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -0.542 7.427 11.915 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -2.627 8.266 11.720 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -2.644 7.979 9.991 1.00 0.00 H new ATOM 2365 N ASP A 152 0.359 9.398 8.503 1.00 0.00 N ATOM 2366 CA ASP A 152 0.787 10.790 8.178 1.00 0.00 C ATOM 2367 C ASP A 152 -0.224 11.941 8.540 1.00 0.00 C ATOM 2368 O ASP A 152 -1.328 11.725 9.048 1.00 0.00 O ATOM 2369 CB ASP A 152 1.091 10.768 6.635 1.00 0.00 C ATOM 2370 CG ASP A 152 2.551 10.866 6.220 1.00 0.00 C ATOM 2371 OD1 ASP A 152 3.421 10.183 6.797 1.00 0.00 O ATOM 2372 OD2 ASP A 152 2.821 11.639 5.271 1.00 0.00 O ATOM 0 H ASP A 152 0.067 8.874 7.678 1.00 0.00 H new ATOM 0 HA ASP A 152 1.646 11.042 8.800 1.00 0.00 H new ATOM 0 HB2 ASP A 152 0.682 9.846 6.222 1.00 0.00 H new ATOM 0 HB3 ASP A 152 0.550 11.593 6.171 1.00 0.00 H new ATOM 2377 N GLU A 153 0.218 13.189 8.278 1.00 0.00 N ATOM 2378 CA GLU A 153 -0.608 14.425 8.405 1.00 0.00 C ATOM 2379 C GLU A 153 -1.210 14.805 7.015 1.00 0.00 C ATOM 2380 O GLU A 153 -2.407 15.170 6.966 1.00 0.00 O ATOM 2381 CB GLU A 153 0.245 15.598 8.977 1.00 0.00 C ATOM 2382 CG GLU A 153 1.495 16.034 8.162 1.00 0.00 C ATOM 2383 CD GLU A 153 2.286 17.174 8.776 1.00 0.00 C ATOM 2384 OE1 GLU A 153 1.990 18.346 8.461 1.00 0.00 O ATOM 2385 OE2 GLU A 153 3.222 16.903 9.557 1.00 0.00 O ATOM 2386 OXT GLU A 153 -0.507 14.736 5.972 1.00 0.00 O ATOM 0 H GLU A 153 1.171 13.377 7.967 1.00 0.00 H new ATOM 0 HA GLU A 153 -1.425 14.234 9.100 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -0.405 16.466 9.087 1.00 0.00 H new ATOM 0 HB3 GLU A 153 0.575 15.318 9.977 1.00 0.00 H new ATOM 0 HG2 GLU A 153 2.154 15.174 8.046 1.00 0.00 H new ATOM 0 HG3 GLU A 153 1.176 16.328 7.162 1.00 0.00 H new