USER MOD reduce.3.24.130724 H: found=0, std=0, add=1185, rem=0, adj=34 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 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 133 SER OG : rot 170:sc= 0 USER MOD Set 1.3: A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 106 SER OG : rot -49:sc= 1.16 USER MOD Set 2.2: A 109 THR OG1 : rot 2:sc= 0.282 USER MOD Set 3.1: A 95 GLN : amide:sc= 1.07 K(o=2.3,f=-8.2!) USER MOD Set 3.2: A 97 LYS NZ :NH3+ 175:sc= 1.24 (180deg=0) USER MOD Set 4.1: A 73 SER OG : rot 56:sc= 1.25 USER MOD Set 4.2: A 80 GLN : amide:sc= 1.06 K(o=2.3,f=0.55) USER MOD Set 5.1: A 35 TYR OH : rot -69:sc= 1.56 USER MOD Set 5.2: A 40 ASN : amide:sc= 0.531 K(o=2.1,f=1.1) USER MOD Set 6.1: A 29 ASN : amide:sc= 0.104 K(o=0.1,f=-1) USER MOD Set 6.2: A 66 MET CE :methyl -173:sc= 0 (180deg=-0.0661) USER MOD Set 7.1: A 8 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 158:sc= 1.26 (180deg=1.1) USER MOD Single : A 4 SER OG : rot 4:sc= 1.28 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 169:sc= 1.29 (180deg=0.955) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= 0.622 K(o=0.62,f=-2.1) 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+ 173:sc= 1.24 (180deg=1.03) USER MOD Single : A 23 THR OG1 : rot -43:sc= 0.968 USER MOD Single : A 25 TYR OH : rot -152:sc= 1.8 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 GLN : amide:sc= 0.901 K(o=0.9,f=-6.5!) USER MOD Single : A 37 GLN : amide:sc= 1.09 K(o=1.1,f=-7.9!) USER MOD Single : A 42 ASN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 46 LYS NZ :NH3+ 156:sc= 1.16 (180deg=-0.0443!) USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 62 HIS : no HD1:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 CYS SG : rot 21:sc= 0.15 USER MOD Single : A 69 SER OG : rot 138:sc= 0.944 USER MOD Single : A 70 CYS SG : rot -149:sc= -2.43! USER MOD Single : A 72 LYS NZ :NH3+ 146:sc= 1.92 (180deg=0.823) USER MOD Single : A 77 THR OG1 : rot 97:sc= 0.968 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 THR OG1 : rot -101:sc= 1.33 USER MOD Single : A 90 SER OG : rot 43:sc= 0.526 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.227 USER MOD Single : A 111 SER OG : rot 66:sc= 0.792 USER MOD Single : A 114 SER OG : rot 103:sc= 1.23 USER MOD Single : A 117 CYS SG : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 110:sc= -3.1! USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= 1.14 K(o=1.1,f=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= -0.0425 USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -40:sc= 0.988 USER MOD Single : A 146 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.122) USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc= 0.223 X(o=0.22,f=-0.082) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.617 6.051 -0.350 1.00 0.00 N ATOM 2 CA MET A 1 -5.824 7.220 -1.250 1.00 0.00 C ATOM 3 C MET A 1 -7.074 8.046 -0.787 1.00 0.00 C ATOM 4 O MET A 1 -7.015 8.641 0.291 1.00 0.00 O ATOM 5 CB MET A 1 -5.836 6.655 -2.703 1.00 0.00 C ATOM 6 CG MET A 1 -5.784 7.731 -3.806 1.00 0.00 C ATOM 7 SD MET A 1 -5.896 6.938 -5.422 1.00 0.00 S ATOM 8 CE MET A 1 -7.200 7.916 -6.188 1.00 0.00 C ATOM 0 H1 MET A 1 -5.058 5.327 -0.845 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.109 6.356 0.504 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.539 5.653 -0.081 1.00 0.00 H new ATOM 0 HA MET A 1 -5.027 7.963 -1.211 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.985 5.985 -2.826 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.736 6.056 -2.839 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.603 8.438 -3.678 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.857 8.300 -3.731 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.387 7.547 -7.197 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.112 7.833 -5.597 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.892 8.960 -6.235 1.00 0.00 H new ATOM 20 N ARG A 2 -8.182 8.073 -1.567 1.00 0.00 N ATOM 21 CA ARG A 2 -9.414 8.879 -1.302 1.00 0.00 C ATOM 22 C ARG A 2 -9.108 10.431 -1.239 1.00 0.00 C ATOM 23 O ARG A 2 -8.979 10.975 -0.137 1.00 0.00 O ATOM 24 CB ARG A 2 -10.156 8.296 -0.058 1.00 0.00 C ATOM 25 CG ARG A 2 -11.335 9.115 0.518 1.00 0.00 C ATOM 26 CD ARG A 2 -12.485 9.535 -0.425 1.00 0.00 C ATOM 27 NE ARG A 2 -13.313 8.439 -1.009 1.00 0.00 N ATOM 28 CZ ARG A 2 -14.200 7.718 -0.328 1.00 0.00 C ATOM 29 NH1 ARG A 2 -14.168 7.562 0.962 1.00 0.00 N ATOM 30 NH2 ARG A 2 -15.158 7.120 -0.955 1.00 0.00 N ATOM 0 H ARG A 2 -8.252 7.522 -2.423 1.00 0.00 H new ATOM 0 HA ARG A 2 -10.104 8.792 -2.142 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -10.531 7.307 -0.323 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -9.423 8.157 0.737 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -11.771 8.536 1.332 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -10.922 10.023 0.958 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -13.147 10.205 0.124 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -12.058 10.112 -1.245 1.00 0.00 H new ATOM 0 HE ARG A 2 -13.190 8.228 -1.999 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -13.432 8.006 1.511 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -14.879 6.996 1.425 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -15.233 7.201 -1.969 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -15.840 6.566 -0.436 1.00 0.00 H new ATOM 44 N PRO A 3 -9.064 11.205 -2.366 1.00 0.00 N ATOM 45 CA PRO A 3 -8.839 12.679 -2.316 1.00 0.00 C ATOM 46 C PRO A 3 -10.148 13.518 -2.074 1.00 0.00 C ATOM 47 O PRO A 3 -10.524 14.381 -2.874 1.00 0.00 O ATOM 48 CB PRO A 3 -8.161 12.888 -3.684 1.00 0.00 C ATOM 49 CG PRO A 3 -8.834 11.885 -4.622 1.00 0.00 C ATOM 50 CD PRO A 3 -9.146 10.673 -3.743 1.00 0.00 C ATOM 0 HA PRO A 3 -8.243 13.029 -1.473 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -8.296 13.910 -4.038 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -7.087 12.711 -3.623 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -9.742 12.300 -5.059 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -8.177 11.615 -5.449 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -10.135 10.268 -3.957 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -8.430 9.867 -3.904 1.00 0.00 H new ATOM 58 N SER A 4 -10.871 13.239 -0.972 1.00 0.00 N ATOM 59 CA SER A 4 -12.130 13.954 -0.600 1.00 0.00 C ATOM 60 C SER A 4 -12.498 13.640 0.888 1.00 0.00 C ATOM 61 O SER A 4 -13.354 12.797 1.186 1.00 0.00 O ATOM 62 CB SER A 4 -13.282 13.569 -1.570 1.00 0.00 C ATOM 63 OG SER A 4 -13.076 14.155 -2.854 1.00 0.00 O ATOM 0 H SER A 4 -10.607 12.512 -0.307 1.00 0.00 H new ATOM 0 HA SER A 4 -11.974 15.029 -0.691 1.00 0.00 H new ATOM 0 HB2 SER A 4 -13.338 12.485 -1.664 1.00 0.00 H new ATOM 0 HB3 SER A 4 -14.236 13.903 -1.161 1.00 0.00 H new ATOM 0 HG SER A 4 -12.219 14.630 -2.863 1.00 0.00 H new ATOM 69 N GLY A 5 -11.841 14.352 1.821 1.00 0.00 N ATOM 70 CA GLY A 5 -12.095 14.222 3.281 1.00 0.00 C ATOM 71 C GLY A 5 -12.663 15.534 3.848 1.00 0.00 C ATOM 72 O GLY A 5 -11.906 16.371 4.341 1.00 0.00 O ATOM 0 H GLY A 5 -11.119 15.035 1.592 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -12.795 13.407 3.463 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -11.169 13.967 3.796 1.00 0.00 H new ATOM 76 N ARG A 6 -13.995 15.699 3.802 1.00 0.00 N ATOM 77 CA ARG A 6 -14.659 16.966 4.236 1.00 0.00 C ATOM 78 C ARG A 6 -14.701 17.233 5.784 1.00 0.00 C ATOM 79 O ARG A 6 -14.628 18.404 6.167 1.00 0.00 O ATOM 80 CB ARG A 6 -16.082 16.942 3.601 1.00 0.00 C ATOM 81 CG ARG A 6 -16.795 18.317 3.573 1.00 0.00 C ATOM 82 CD ARG A 6 -18.146 18.270 2.834 1.00 0.00 C ATOM 83 NE ARG A 6 -18.717 19.643 2.754 1.00 0.00 N ATOM 84 CZ ARG A 6 -19.874 19.965 2.173 1.00 0.00 C ATOM 85 NH1 ARG A 6 -20.675 19.090 1.615 1.00 0.00 N ATOM 86 NH2 ARG A 6 -20.229 21.217 2.158 1.00 0.00 N ATOM 0 H ARG A 6 -14.641 14.982 3.472 1.00 0.00 H new ATOM 0 HA ARG A 6 -14.058 17.806 3.888 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -16.005 16.566 2.581 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -16.702 16.237 4.155 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -16.956 18.659 4.595 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -16.147 19.048 3.091 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -18.011 17.862 1.832 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -18.836 17.608 3.357 1.00 0.00 H new ATOM 0 HE ARG A 6 -18.180 20.399 3.178 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -20.426 18.101 1.610 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -21.548 19.398 1.186 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -19.628 21.923 2.583 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -21.108 21.493 1.721 1.00 0.00 H new ATOM 100 N LYS A 7 -14.867 16.220 6.661 1.00 0.00 N ATOM 101 CA LYS A 7 -14.888 16.434 8.141 1.00 0.00 C ATOM 102 C LYS A 7 -14.043 15.362 8.903 1.00 0.00 C ATOM 103 O LYS A 7 -13.026 15.735 9.493 1.00 0.00 O ATOM 104 CB LYS A 7 -16.366 16.496 8.646 1.00 0.00 C ATOM 105 CG LYS A 7 -17.144 17.815 8.389 1.00 0.00 C ATOM 106 CD LYS A 7 -16.548 19.115 8.985 1.00 0.00 C ATOM 107 CE LYS A 7 -16.408 19.118 10.521 1.00 0.00 C ATOM 108 NZ LYS A 7 -15.837 20.417 10.971 1.00 0.00 N ATOM 0 H LYS A 7 -14.989 15.247 6.381 1.00 0.00 H new ATOM 0 HA LYS A 7 -14.414 17.391 8.358 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -16.918 15.681 8.179 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -16.365 16.307 9.719 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -17.236 17.949 7.311 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -18.153 17.694 8.783 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -15.565 19.283 8.544 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -17.177 19.955 8.690 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -17.381 18.958 10.985 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.765 18.298 10.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.744 20.415 12.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -14.900 20.553 10.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -16.467 21.192 10.681 1.00 0.00 H new ATOM 122 N SER A 8 -14.444 14.073 8.946 1.00 0.00 N ATOM 123 CA SER A 8 -13.703 13.024 9.706 1.00 0.00 C ATOM 124 C SER A 8 -13.839 11.608 9.061 1.00 0.00 C ATOM 125 O SER A 8 -14.833 11.280 8.405 1.00 0.00 O ATOM 126 CB SER A 8 -14.260 13.008 11.155 1.00 0.00 C ATOM 127 OG SER A 8 -13.546 12.086 11.985 1.00 0.00 O ATOM 0 H SER A 8 -15.275 13.727 8.466 1.00 0.00 H new ATOM 0 HA SER A 8 -12.640 13.265 9.693 1.00 0.00 H new ATOM 0 HB2 SER A 8 -14.194 14.009 11.582 1.00 0.00 H new ATOM 0 HB3 SER A 8 -15.316 12.739 11.136 1.00 0.00 H new ATOM 0 HG SER A 8 -13.921 12.102 12.890 1.00 0.00 H new ATOM 133 N SER A 9 -12.807 10.766 9.282 1.00 0.00 N ATOM 134 CA SER A 9 -12.749 9.328 8.845 1.00 0.00 C ATOM 135 C SER A 9 -13.063 9.026 7.330 1.00 0.00 C ATOM 136 O SER A 9 -13.726 8.036 7.001 1.00 0.00 O ATOM 137 CB SER A 9 -13.676 8.522 9.806 1.00 0.00 C ATOM 138 OG SER A 9 -13.272 8.648 11.174 1.00 0.00 O ATOM 0 H SER A 9 -11.966 11.060 9.779 1.00 0.00 H new ATOM 0 HA SER A 9 -11.706 9.018 8.913 1.00 0.00 H new ATOM 0 HB2 SER A 9 -14.702 8.872 9.698 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.666 7.470 9.521 1.00 0.00 H new ATOM 0 HG SER A 9 -13.879 8.130 11.743 1.00 0.00 H new ATOM 144 N LYS A 10 -12.533 9.839 6.392 1.00 0.00 N ATOM 145 CA LYS A 10 -12.767 9.642 4.928 1.00 0.00 C ATOM 146 C LYS A 10 -11.549 10.136 4.055 1.00 0.00 C ATOM 147 O LYS A 10 -11.734 10.869 3.083 1.00 0.00 O ATOM 148 CB LYS A 10 -14.127 10.351 4.602 1.00 0.00 C ATOM 149 CG LYS A 10 -14.817 9.868 3.305 1.00 0.00 C ATOM 150 CD LYS A 10 -16.165 10.574 3.042 1.00 0.00 C ATOM 151 CE LYS A 10 -16.921 10.114 1.774 1.00 0.00 C ATOM 152 NZ LYS A 10 -17.635 8.810 1.953 1.00 0.00 N ATOM 0 H LYS A 10 -11.940 10.639 6.612 1.00 0.00 H new ATOM 0 HA LYS A 10 -12.839 8.585 4.672 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -14.809 10.198 5.438 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.952 11.424 4.525 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -14.151 10.041 2.459 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -14.982 8.792 3.366 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -16.811 10.418 3.906 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -15.985 11.646 2.968 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -17.643 10.880 1.491 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -16.213 10.023 0.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -18.268 8.647 1.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -16.940 8.038 2.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -18.193 8.838 2.830 1.00 0.00 H new ATOM 166 N MET A 11 -10.312 9.685 4.367 1.00 0.00 N ATOM 167 CA MET A 11 -9.049 10.039 3.636 1.00 0.00 C ATOM 168 C MET A 11 -7.874 9.246 4.306 1.00 0.00 C ATOM 169 O MET A 11 -7.636 9.424 5.506 1.00 0.00 O ATOM 170 CB MET A 11 -8.753 11.573 3.676 1.00 0.00 C ATOM 171 CG MET A 11 -7.487 12.027 2.915 1.00 0.00 C ATOM 172 SD MET A 11 -7.334 13.824 2.995 1.00 0.00 S ATOM 173 CE MET A 11 -7.865 14.291 1.338 1.00 0.00 C ATOM 0 H MET A 11 -10.149 9.051 5.149 1.00 0.00 H new ATOM 0 HA MET A 11 -9.158 9.771 2.585 1.00 0.00 H new ATOM 0 HB2 MET A 11 -9.612 12.102 3.264 1.00 0.00 H new ATOM 0 HB3 MET A 11 -8.659 11.880 4.718 1.00 0.00 H new ATOM 0 HG2 MET A 11 -6.604 11.558 3.349 1.00 0.00 H new ATOM 0 HG3 MET A 11 -7.541 11.704 1.875 1.00 0.00 H new ATOM 0 HE1 MET A 11 -7.824 15.375 1.235 1.00 0.00 H new ATOM 0 HE2 MET A 11 -7.206 13.831 0.602 1.00 0.00 H new ATOM 0 HE3 MET A 11 -8.887 13.949 1.174 1.00 0.00 H new ATOM 183 N GLN A 12 -7.144 8.376 3.570 1.00 0.00 N ATOM 184 CA GLN A 12 -5.989 7.623 4.155 1.00 0.00 C ATOM 185 C GLN A 12 -4.848 7.429 3.094 1.00 0.00 C ATOM 186 O GLN A 12 -4.891 6.525 2.245 1.00 0.00 O ATOM 187 CB GLN A 12 -6.458 6.249 4.743 1.00 0.00 C ATOM 188 CG GLN A 12 -7.136 6.325 6.139 1.00 0.00 C ATOM 189 CD GLN A 12 -7.461 4.994 6.840 1.00 0.00 C ATOM 190 OE1 GLN A 12 -6.927 3.922 6.573 1.00 0.00 O ATOM 191 NE2 GLN A 12 -8.346 5.027 7.809 1.00 0.00 N ATOM 0 H GLN A 12 -7.323 8.174 2.586 1.00 0.00 H new ATOM 0 HA GLN A 12 -5.581 8.214 4.975 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -7.156 5.791 4.042 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -5.595 5.587 4.811 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -6.488 6.903 6.797 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -8.065 6.886 6.033 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.805 5.905 8.051 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -8.575 4.174 8.320 1.00 0.00 H new ATOM 200 N ALA A 13 -3.821 8.302 3.169 1.00 0.00 N ATOM 201 CA ALA A 13 -2.549 8.202 2.392 1.00 0.00 C ATOM 202 C ALA A 13 -1.415 8.651 3.385 1.00 0.00 C ATOM 203 O ALA A 13 -1.491 9.672 4.074 1.00 0.00 O ATOM 204 CB ALA A 13 -2.607 8.978 1.084 1.00 0.00 C ATOM 0 H ALA A 13 -3.845 9.117 3.782 1.00 0.00 H new ATOM 0 HA ALA A 13 -2.351 7.187 2.048 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -1.659 8.874 0.557 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.412 8.585 0.463 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -2.791 10.032 1.294 1.00 0.00 H new ATOM 210 N PHE A 14 -0.361 7.833 3.443 1.00 0.00 N ATOM 211 CA PHE A 14 0.667 7.832 4.524 1.00 0.00 C ATOM 212 C PHE A 14 2.112 7.594 3.960 1.00 0.00 C ATOM 213 O PHE A 14 2.335 7.580 2.739 1.00 0.00 O ATOM 214 CB PHE A 14 0.119 6.653 5.407 1.00 0.00 C ATOM 215 CG PHE A 14 0.598 6.424 6.834 1.00 0.00 C ATOM 216 CD1 PHE A 14 -0.082 7.011 7.905 1.00 0.00 C ATOM 217 CD2 PHE A 14 1.544 5.428 7.083 1.00 0.00 C ATOM 218 CE1 PHE A 14 0.197 6.620 9.213 1.00 0.00 C ATOM 219 CE2 PHE A 14 1.820 5.044 8.386 1.00 0.00 C ATOM 220 CZ PHE A 14 1.156 5.643 9.453 1.00 0.00 C ATOM 0 H PHE A 14 -0.181 7.129 2.727 1.00 0.00 H new ATOM 0 HA PHE A 14 0.789 8.769 5.067 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -0.963 6.772 5.454 1.00 0.00 H new ATOM 0 HB3 PHE A 14 0.315 5.732 4.858 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -0.827 7.771 7.718 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.061 4.957 6.260 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -0.331 7.075 10.038 1.00 0.00 H new ATOM 0 HE2 PHE A 14 2.555 4.275 8.575 1.00 0.00 H new ATOM 0 HZ PHE A 14 1.386 5.349 10.466 1.00 0.00 H new ATOM 230 N ARG A 15 3.127 7.475 4.838 1.00 0.00 N ATOM 231 CA ARG A 15 4.499 7.097 4.401 1.00 0.00 C ATOM 232 C ARG A 15 5.070 5.983 5.357 1.00 0.00 C ATOM 233 O ARG A 15 5.382 6.153 6.546 1.00 0.00 O ATOM 234 CB ARG A 15 5.416 8.338 4.250 1.00 0.00 C ATOM 235 CG ARG A 15 5.596 9.310 5.434 1.00 0.00 C ATOM 236 CD ARG A 15 6.724 10.306 5.138 1.00 0.00 C ATOM 237 NE ARG A 15 6.837 11.288 6.239 1.00 0.00 N ATOM 238 CZ ARG A 15 7.739 12.262 6.285 1.00 0.00 C ATOM 239 NH1 ARG A 15 8.656 12.492 5.377 1.00 0.00 N ATOM 240 NH2 ARG A 15 7.721 13.069 7.292 1.00 0.00 N ATOM 0 H ARG A 15 3.033 7.631 5.842 1.00 0.00 H new ATOM 0 HA ARG A 15 4.459 6.665 3.401 1.00 0.00 H new ATOM 0 HB2 ARG A 15 6.407 7.978 3.972 1.00 0.00 H new ATOM 0 HB3 ARG A 15 5.040 8.919 3.408 1.00 0.00 H new ATOM 0 HG2 ARG A 15 4.666 9.848 5.617 1.00 0.00 H new ATOM 0 HG3 ARG A 15 5.824 8.751 6.341 1.00 0.00 H new ATOM 0 HD2 ARG A 15 7.667 9.774 5.017 1.00 0.00 H new ATOM 0 HD3 ARG A 15 6.527 10.822 4.199 1.00 0.00 H new ATOM 0 HE ARG A 15 6.178 11.212 7.014 1.00 0.00 H new ATOM 0 HH11 ARG A 15 8.716 11.897 4.551 1.00 0.00 H new ATOM 0 HH12 ARG A 15 9.309 13.266 5.497 1.00 0.00 H new ATOM 0 HH21 ARG A 15 7.025 12.950 8.028 1.00 0.00 H new ATOM 0 HH22 ARG A 15 8.403 13.825 7.352 1.00 0.00 H new ATOM 254 N ILE A 16 5.187 4.787 4.766 1.00 0.00 N ATOM 255 CA ILE A 16 5.771 3.582 5.414 1.00 0.00 C ATOM 256 C ILE A 16 7.261 3.520 4.926 1.00 0.00 C ATOM 257 O ILE A 16 7.565 3.574 3.728 1.00 0.00 O ATOM 258 CB ILE A 16 4.974 2.247 5.111 1.00 0.00 C ATOM 259 CG1 ILE A 16 4.110 2.179 3.802 1.00 0.00 C ATOM 260 CG2 ILE A 16 4.087 1.906 6.338 1.00 0.00 C ATOM 261 CD1 ILE A 16 2.721 2.867 3.768 1.00 0.00 C ATOM 0 H ILE A 16 4.877 4.616 3.809 1.00 0.00 H new ATOM 0 HA ILE A 16 5.709 3.666 6.499 1.00 0.00 H new ATOM 0 HB ILE A 16 5.758 1.513 4.923 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.706 2.605 2.995 1.00 0.00 H new ATOM 0 HG13 ILE A 16 3.959 1.126 3.565 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.532 0.988 6.142 1.00 0.00 H new ATOM 0 HG22 ILE A 16 4.718 1.768 7.216 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.387 2.722 6.519 1.00 0.00 H new ATOM 0 HD11 ILE A 16 2.266 2.720 2.789 1.00 0.00 H new ATOM 0 HD12 ILE A 16 2.080 2.432 4.535 1.00 0.00 H new ATOM 0 HD13 ILE A 16 2.839 3.934 3.956 1.00 0.00 H new ATOM 273 N TRP A 17 8.201 3.480 5.882 1.00 0.00 N ATOM 274 CA TRP A 17 9.670 3.504 5.603 1.00 0.00 C ATOM 275 C TRP A 17 10.428 2.492 6.539 1.00 0.00 C ATOM 276 O TRP A 17 9.805 1.575 7.066 1.00 0.00 O ATOM 277 CB TRP A 17 10.056 5.033 5.723 1.00 0.00 C ATOM 278 CG TRP A 17 10.543 5.585 7.077 1.00 0.00 C ATOM 279 CD1 TRP A 17 9.874 5.454 8.310 1.00 0.00 C ATOM 280 CD2 TRP A 17 11.782 6.131 7.385 1.00 0.00 C ATOM 281 NE1 TRP A 17 10.667 5.891 9.389 1.00 0.00 N ATOM 282 CE2 TRP A 17 11.854 6.280 8.793 1.00 0.00 C ATOM 283 CE3 TRP A 17 12.903 6.457 6.572 1.00 0.00 C ATOM 284 CZ2 TRP A 17 13.052 6.720 9.401 1.00 0.00 C ATOM 285 CZ3 TRP A 17 14.072 6.895 7.195 1.00 0.00 C ATOM 286 CH2 TRP A 17 14.147 7.019 8.589 1.00 0.00 C ATOM 0 H TRP A 17 7.978 3.430 6.876 1.00 0.00 H new ATOM 0 HA TRP A 17 9.965 3.150 4.615 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.836 5.232 4.988 1.00 0.00 H new ATOM 0 HB3 TRP A 17 9.183 5.615 5.427 1.00 0.00 H new ATOM 0 HD1 TRP A 17 8.872 5.065 8.415 1.00 0.00 H new ATOM 0 HE1 TRP A 17 10.423 5.915 10.379 1.00 0.00 H new ATOM 0 HE3 TRP A 17 12.850 6.367 5.497 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 13.119 6.823 10.474 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 14.934 7.143 6.593 1.00 0.00 H new ATOM 0 HH2 TRP A 17 15.069 7.352 9.043 1.00 0.00 H new ATOM 297 N ASP A 18 11.761 2.550 6.720 1.00 0.00 N ATOM 298 CA ASP A 18 12.439 1.781 7.801 1.00 0.00 C ATOM 299 C ASP A 18 13.681 2.637 8.231 1.00 0.00 C ATOM 300 O ASP A 18 14.341 3.362 7.458 1.00 0.00 O ATOM 301 CB ASP A 18 12.690 0.271 7.466 1.00 0.00 C ATOM 302 CG ASP A 18 14.032 -0.330 7.043 1.00 0.00 C ATOM 303 OD1 ASP A 18 15.116 0.253 7.259 1.00 0.00 O ATOM 304 OD2 ASP A 18 14.016 -1.462 6.512 1.00 0.00 O ATOM 0 H ASP A 18 12.389 3.111 6.145 1.00 0.00 H new ATOM 0 HA ASP A 18 11.791 1.653 8.668 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.380 -0.286 8.350 1.00 0.00 H new ATOM 0 HB3 ASP A 18 11.988 0.022 6.670 1.00 0.00 H new ATOM 309 N VAL A 19 13.934 2.509 9.546 1.00 0.00 N ATOM 310 CA VAL A 19 14.985 3.265 10.300 1.00 0.00 C ATOM 311 C VAL A 19 16.459 3.066 9.785 1.00 0.00 C ATOM 312 O VAL A 19 17.288 3.940 10.057 1.00 0.00 O ATOM 313 CB VAL A 19 14.805 2.887 11.824 1.00 0.00 C ATOM 314 CG1 VAL A 19 15.855 3.511 12.778 1.00 0.00 C ATOM 315 CG2 VAL A 19 13.428 3.302 12.416 1.00 0.00 C ATOM 0 H VAL A 19 13.409 1.866 10.139 1.00 0.00 H new ATOM 0 HA VAL A 19 14.837 4.332 10.136 1.00 0.00 H new ATOM 0 HB VAL A 19 14.917 1.803 11.786 1.00 0.00 H new ATOM 0 HG11 VAL A 19 15.650 3.195 13.801 1.00 0.00 H new ATOM 0 HG12 VAL A 19 16.852 3.179 12.489 1.00 0.00 H new ATOM 0 HG13 VAL A 19 15.802 4.598 12.716 1.00 0.00 H new ATOM 0 HG21 VAL A 19 13.380 3.009 13.465 1.00 0.00 H new ATOM 0 HG22 VAL A 19 13.308 4.382 12.335 1.00 0.00 H new ATOM 0 HG23 VAL A 19 12.630 2.806 11.864 1.00 0.00 H new ATOM 325 N ASN A 20 16.821 1.992 9.053 1.00 0.00 N ATOM 326 CA ASN A 20 18.188 1.845 8.461 1.00 0.00 C ATOM 327 C ASN A 20 18.299 2.521 7.037 1.00 0.00 C ATOM 328 O ASN A 20 19.015 2.031 6.159 1.00 0.00 O ATOM 329 CB ASN A 20 18.516 0.323 8.431 1.00 0.00 C ATOM 330 CG ASN A 20 18.736 -0.350 9.792 1.00 0.00 C ATOM 331 OD1 ASN A 20 17.865 -1.021 10.332 1.00 0.00 O ATOM 332 ND2 ASN A 20 19.899 -0.214 10.383 1.00 0.00 N ATOM 0 H ASN A 20 16.196 1.211 8.852 1.00 0.00 H new ATOM 0 HA ASN A 20 18.923 2.370 9.071 1.00 0.00 H new ATOM 0 HB2 ASN A 20 17.702 -0.193 7.921 1.00 0.00 H new ATOM 0 HB3 ASN A 20 19.412 0.178 7.828 1.00 0.00 H new ATOM 0 HD21 ASN A 20 20.070 -0.664 11.282 1.00 0.00 H new ATOM 0 HD22 ASN A 20 20.632 0.342 9.944 1.00 0.00 H new ATOM 339 N GLN A 21 17.675 3.711 6.863 1.00 0.00 N ATOM 340 CA GLN A 21 17.630 4.516 5.605 1.00 0.00 C ATOM 341 C GLN A 21 16.887 3.745 4.468 1.00 0.00 C ATOM 342 O GLN A 21 17.492 3.304 3.484 1.00 0.00 O ATOM 343 CB GLN A 21 19.048 5.004 5.168 1.00 0.00 C ATOM 344 CG GLN A 21 19.733 6.009 6.129 1.00 0.00 C ATOM 345 CD GLN A 21 21.058 6.568 5.604 1.00 0.00 C ATOM 346 OE1 GLN A 21 21.129 7.658 5.048 1.00 0.00 O ATOM 347 NE2 GLN A 21 22.148 5.854 5.758 1.00 0.00 N ATOM 0 H GLN A 21 17.166 4.161 7.624 1.00 0.00 H new ATOM 0 HA GLN A 21 17.052 5.417 5.812 1.00 0.00 H new ATOM 0 HB2 GLN A 21 19.695 4.134 5.059 1.00 0.00 H new ATOM 0 HB3 GLN A 21 18.967 5.466 4.184 1.00 0.00 H new ATOM 0 HG2 GLN A 21 19.051 6.838 6.319 1.00 0.00 H new ATOM 0 HG3 GLN A 21 19.911 5.518 7.085 1.00 0.00 H new ATOM 0 HE21 GLN A 21 22.102 4.945 6.219 1.00 0.00 H new ATOM 0 HE22 GLN A 21 23.042 6.208 5.417 1.00 0.00 H new ATOM 356 N LYS A 22 15.551 3.616 4.583 1.00 0.00 N ATOM 357 CA LYS A 22 14.718 2.942 3.571 1.00 0.00 C ATOM 358 C LYS A 22 13.313 3.612 3.564 1.00 0.00 C ATOM 359 O LYS A 22 12.776 4.042 4.579 1.00 0.00 O ATOM 360 CB LYS A 22 14.572 1.433 3.940 1.00 0.00 C ATOM 361 CG LYS A 22 15.820 0.543 3.731 1.00 0.00 C ATOM 362 CD LYS A 22 15.472 -0.966 3.638 1.00 0.00 C ATOM 363 CE LYS A 22 16.544 -1.922 4.201 1.00 0.00 C ATOM 364 NZ LYS A 22 16.486 -1.869 5.687 1.00 0.00 N ATOM 0 H LYS A 22 15.021 3.975 5.377 1.00 0.00 H new ATOM 0 HA LYS A 22 15.180 3.027 2.587 1.00 0.00 H new ATOM 0 HB2 LYS A 22 14.278 1.366 4.987 1.00 0.00 H new ATOM 0 HB3 LYS A 22 13.754 1.016 3.352 1.00 0.00 H new ATOM 0 HG2 LYS A 22 16.331 0.850 2.819 1.00 0.00 H new ATOM 0 HG3 LYS A 22 16.516 0.701 4.555 1.00 0.00 H new ATOM 0 HD2 LYS A 22 14.537 -1.140 4.170 1.00 0.00 H new ATOM 0 HD3 LYS A 22 15.296 -1.218 2.592 1.00 0.00 H new ATOM 0 HE2 LYS A 22 16.367 -2.939 3.851 1.00 0.00 H new ATOM 0 HE3 LYS A 22 17.534 -1.631 3.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 17.118 -2.593 6.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 16.788 -0.929 6.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 15.512 -2.049 6.003 1.00 0.00 H new ATOM 378 N THR A 23 12.709 3.606 2.389 1.00 0.00 N ATOM 379 CA THR A 23 11.360 4.170 2.094 1.00 0.00 C ATOM 380 C THR A 23 10.567 3.196 1.152 1.00 0.00 C ATOM 381 O THR A 23 11.134 2.515 0.291 1.00 0.00 O ATOM 382 CB THR A 23 11.485 5.582 1.437 1.00 0.00 C ATOM 383 OG1 THR A 23 12.204 5.481 0.214 1.00 0.00 O ATOM 384 CG2 THR A 23 12.202 6.633 2.311 1.00 0.00 C ATOM 0 H THR A 23 13.146 3.195 1.564 1.00 0.00 H new ATOM 0 HA THR A 23 10.814 4.278 3.031 1.00 0.00 H new ATOM 0 HB THR A 23 10.459 5.921 1.291 1.00 0.00 H new ATOM 0 HG1 THR A 23 12.979 4.894 0.338 1.00 0.00 H new ATOM 0 HG21 THR A 23 12.244 7.582 1.777 1.00 0.00 H new ATOM 0 HG22 THR A 23 11.654 6.765 3.244 1.00 0.00 H new ATOM 0 HG23 THR A 23 13.215 6.295 2.530 1.00 0.00 H new ATOM 392 N PHE A 24 9.234 3.139 1.293 1.00 0.00 N ATOM 393 CA PHE A 24 8.348 2.314 0.414 1.00 0.00 C ATOM 394 C PHE A 24 7.591 3.342 -0.504 1.00 0.00 C ATOM 395 O PHE A 24 6.483 3.780 -0.173 1.00 0.00 O ATOM 396 CB PHE A 24 7.444 1.471 1.372 1.00 0.00 C ATOM 397 CG PHE A 24 6.905 0.114 0.890 1.00 0.00 C ATOM 398 CD1 PHE A 24 6.217 -0.022 -0.321 1.00 0.00 C ATOM 399 CD2 PHE A 24 7.016 -0.996 1.740 1.00 0.00 C ATOM 400 CE1 PHE A 24 5.663 -1.249 -0.680 1.00 0.00 C ATOM 401 CE2 PHE A 24 6.457 -2.218 1.382 1.00 0.00 C ATOM 402 CZ PHE A 24 5.778 -2.341 0.177 1.00 0.00 C ATOM 0 H PHE A 24 8.728 3.656 2.012 1.00 0.00 H new ATOM 0 HA PHE A 24 8.847 1.603 -0.244 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.010 1.294 2.286 1.00 0.00 H new ATOM 0 HB3 PHE A 24 6.587 2.088 1.642 1.00 0.00 H new ATOM 0 HD1 PHE A 24 6.115 0.828 -0.980 1.00 0.00 H new ATOM 0 HD2 PHE A 24 7.540 -0.901 2.680 1.00 0.00 H new ATOM 0 HE1 PHE A 24 5.145 -1.353 -1.622 1.00 0.00 H new ATOM 0 HE2 PHE A 24 6.551 -3.069 2.040 1.00 0.00 H new ATOM 0 HZ PHE A 24 5.337 -3.288 -0.097 1.00 0.00 H new ATOM 412 N TYR A 25 8.206 3.771 -1.629 1.00 0.00 N ATOM 413 CA TYR A 25 7.684 4.903 -2.461 1.00 0.00 C ATOM 414 C TYR A 25 7.430 4.572 -3.967 1.00 0.00 C ATOM 415 O TYR A 25 8.175 3.843 -4.619 1.00 0.00 O ATOM 416 CB TYR A 25 8.689 6.093 -2.315 1.00 0.00 C ATOM 417 CG TYR A 25 10.054 6.073 -3.055 1.00 0.00 C ATOM 418 CD1 TYR A 25 11.013 5.084 -2.800 1.00 0.00 C ATOM 419 CD2 TYR A 25 10.349 7.082 -3.982 1.00 0.00 C ATOM 420 CE1 TYR A 25 12.233 5.094 -3.470 1.00 0.00 C ATOM 421 CE2 TYR A 25 11.582 7.106 -4.632 1.00 0.00 C ATOM 422 CZ TYR A 25 12.521 6.113 -4.372 1.00 0.00 C ATOM 423 OH TYR A 25 13.757 6.168 -4.950 1.00 0.00 O ATOM 0 H TYR A 25 9.065 3.357 -1.990 1.00 0.00 H new ATOM 0 HA TYR A 25 6.692 5.150 -2.083 1.00 0.00 H new ATOM 0 HB2 TYR A 25 8.166 6.995 -2.631 1.00 0.00 H new ATOM 0 HB3 TYR A 25 8.902 6.204 -1.252 1.00 0.00 H new ATOM 0 HD1 TYR A 25 10.804 4.308 -2.078 1.00 0.00 H new ATOM 0 HD2 TYR A 25 9.616 7.846 -4.194 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.955 4.311 -3.290 1.00 0.00 H new ATOM 0 HE2 TYR A 25 11.808 7.894 -5.336 1.00 0.00 H new ATOM 0 HH TYR A 25 13.973 7.098 -5.172 1.00 0.00 H new ATOM 433 N LEU A 26 6.372 5.170 -4.530 1.00 0.00 N ATOM 434 CA LEU A 26 5.966 4.975 -5.955 1.00 0.00 C ATOM 435 C LEU A 26 6.426 6.144 -6.890 1.00 0.00 C ATOM 436 O LEU A 26 6.618 7.287 -6.463 1.00 0.00 O ATOM 437 CB LEU A 26 4.414 4.821 -5.909 1.00 0.00 C ATOM 438 CG LEU A 26 3.628 4.660 -7.248 1.00 0.00 C ATOM 439 CD1 LEU A 26 2.413 3.735 -7.085 1.00 0.00 C ATOM 440 CD2 LEU A 26 3.136 6.016 -7.795 1.00 0.00 C ATOM 0 H LEU A 26 5.762 5.808 -4.020 1.00 0.00 H new ATOM 0 HA LEU A 26 6.449 4.100 -6.389 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.188 3.954 -5.289 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.012 5.694 -5.395 1.00 0.00 H new ATOM 0 HG LEU A 26 4.331 4.220 -7.955 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.892 3.648 -8.038 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.747 2.749 -6.763 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.737 4.151 -6.338 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.594 5.857 -8.727 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.474 6.484 -7.066 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.991 6.666 -7.979 1.00 0.00 H new ATOM 452 N ARG A 27 6.591 5.828 -8.191 1.00 0.00 N ATOM 453 CA ARG A 27 6.874 6.852 -9.242 1.00 0.00 C ATOM 454 C ARG A 27 5.725 6.806 -10.307 1.00 0.00 C ATOM 455 O ARG A 27 4.942 7.755 -10.374 1.00 0.00 O ATOM 456 CB ARG A 27 8.313 6.627 -9.777 1.00 0.00 C ATOM 457 CG ARG A 27 8.777 7.707 -10.792 1.00 0.00 C ATOM 458 CD ARG A 27 10.299 7.939 -10.836 1.00 0.00 C ATOM 459 NE ARG A 27 10.735 8.671 -9.612 1.00 0.00 N ATOM 460 CZ ARG A 27 11.974 9.083 -9.360 1.00 0.00 C ATOM 461 NH1 ARG A 27 12.977 8.912 -10.180 1.00 0.00 N ATOM 462 NH2 ARG A 27 12.211 9.695 -8.238 1.00 0.00 N ATOM 0 H ARG A 27 6.535 4.874 -8.548 1.00 0.00 H new ATOM 0 HA ARG A 27 6.868 7.873 -8.861 1.00 0.00 H new ATOM 0 HB2 ARG A 27 9.006 6.610 -8.936 1.00 0.00 H new ATOM 0 HB3 ARG A 27 8.365 5.648 -10.253 1.00 0.00 H new ATOM 0 HG2 ARG A 27 8.438 7.420 -11.787 1.00 0.00 H new ATOM 0 HG3 ARG A 27 8.287 8.649 -10.548 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.820 6.984 -10.904 1.00 0.00 H new ATOM 0 HD3 ARG A 27 10.563 8.510 -11.726 1.00 0.00 H new ATOM 0 HE ARG A 27 10.023 8.872 -8.909 1.00 0.00 H new ATOM 0 HH11 ARG A 27 12.832 8.439 -11.072 1.00 0.00 H new ATOM 0 HH12 ARG A 27 13.905 9.252 -9.928 1.00 0.00 H new ATOM 0 HH21 ARG A 27 11.454 9.850 -7.572 1.00 0.00 H new ATOM 0 HH22 ARG A 27 13.154 10.020 -8.023 1.00 0.00 H new ATOM 476 N ASN A 28 5.592 5.727 -11.105 1.00 0.00 N ATOM 477 CA ASN A 28 4.470 5.568 -12.083 1.00 0.00 C ATOM 478 C ASN A 28 3.468 4.518 -11.489 1.00 0.00 C ATOM 479 O ASN A 28 2.392 4.902 -11.028 1.00 0.00 O ATOM 480 CB ASN A 28 5.048 5.211 -13.485 1.00 0.00 C ATOM 481 CG ASN A 28 5.882 6.317 -14.149 1.00 0.00 C ATOM 482 OD1 ASN A 28 7.088 6.421 -13.951 1.00 0.00 O ATOM 483 ND2 ASN A 28 5.285 7.173 -14.943 1.00 0.00 N ATOM 0 H ASN A 28 6.245 4.944 -11.099 1.00 0.00 H new ATOM 0 HA ASN A 28 3.910 6.490 -12.237 1.00 0.00 H new ATOM 0 HB2 ASN A 28 5.667 4.319 -13.389 1.00 0.00 H new ATOM 0 HB3 ASN A 28 4.221 4.955 -14.147 1.00 0.00 H new ATOM 0 HD21 ASN A 28 5.823 7.916 -15.389 1.00 0.00 H new ATOM 0 HD22 ASN A 28 4.283 7.096 -15.115 1.00 0.00 H new ATOM 490 N ASN A 29 3.804 3.211 -11.480 1.00 0.00 N ATOM 491 CA ASN A 29 2.980 2.152 -10.820 1.00 0.00 C ATOM 492 C ASN A 29 3.917 0.968 -10.382 1.00 0.00 C ATOM 493 O ASN A 29 3.673 -0.188 -10.747 1.00 0.00 O ATOM 494 CB ASN A 29 1.836 1.727 -11.795 1.00 0.00 C ATOM 495 CG ASN A 29 0.701 0.881 -11.190 1.00 0.00 C ATOM 496 OD1 ASN A 29 0.697 0.456 -10.038 1.00 0.00 O ATOM 497 ND2 ASN A 29 -0.322 0.624 -11.966 1.00 0.00 N ATOM 0 H ASN A 29 4.648 2.851 -11.925 1.00 0.00 H new ATOM 0 HA ASN A 29 2.501 2.518 -9.912 1.00 0.00 H new ATOM 0 HB2 ASN A 29 1.399 2.629 -12.223 1.00 0.00 H new ATOM 0 HB3 ASN A 29 2.279 1.166 -12.618 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -1.107 0.078 -11.611 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -0.334 0.970 -12.925 1.00 0.00 H new ATOM 504 N GLN A 30 4.973 1.232 -9.574 1.00 0.00 N ATOM 505 CA GLN A 30 5.955 0.169 -9.164 1.00 0.00 C ATOM 506 C GLN A 30 6.219 -0.075 -7.657 1.00 0.00 C ATOM 507 O GLN A 30 6.671 -1.166 -7.306 1.00 0.00 O ATOM 508 CB GLN A 30 7.310 0.496 -9.879 1.00 0.00 C ATOM 509 CG GLN A 30 7.453 -0.012 -11.340 1.00 0.00 C ATOM 510 CD GLN A 30 7.996 -1.446 -11.473 1.00 0.00 C ATOM 511 OE1 GLN A 30 7.311 -2.435 -11.229 1.00 0.00 O ATOM 512 NE2 GLN A 30 9.238 -1.614 -11.864 1.00 0.00 N ATOM 0 H GLN A 30 5.175 2.156 -9.192 1.00 0.00 H new ATOM 0 HA GLN A 30 5.483 -0.766 -9.465 1.00 0.00 H new ATOM 0 HB2 GLN A 30 7.446 1.577 -9.877 1.00 0.00 H new ATOM 0 HB3 GLN A 30 8.121 0.071 -9.287 1.00 0.00 H new ATOM 0 HG2 GLN A 30 6.478 0.039 -11.825 1.00 0.00 H new ATOM 0 HG3 GLN A 30 8.114 0.664 -11.882 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.822 -0.803 -12.071 1.00 0.00 H new ATOM 0 HE22 GLN A 30 9.619 -2.555 -11.961 1.00 0.00 H new ATOM 521 N LEU A 31 5.965 0.921 -6.807 1.00 0.00 N ATOM 522 CA LEU A 31 6.264 0.916 -5.332 1.00 0.00 C ATOM 523 C LEU A 31 7.700 0.332 -5.039 1.00 0.00 C ATOM 524 O LEU A 31 7.872 -0.861 -4.762 1.00 0.00 O ATOM 525 CB LEU A 31 5.167 0.161 -4.530 1.00 0.00 C ATOM 526 CG LEU A 31 3.744 0.779 -4.456 1.00 0.00 C ATOM 527 CD1 LEU A 31 2.831 0.259 -5.582 1.00 0.00 C ATOM 528 CD2 LEU A 31 3.075 0.476 -3.103 1.00 0.00 C ATOM 0 H LEU A 31 5.532 1.792 -7.113 1.00 0.00 H new ATOM 0 HA LEU A 31 6.257 1.952 -4.994 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.073 -0.837 -4.957 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.528 0.038 -3.509 1.00 0.00 H new ATOM 0 HG LEU A 31 3.872 1.855 -4.572 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.846 0.717 -5.492 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.264 0.516 -6.549 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.736 -0.824 -5.503 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.080 0.921 -3.081 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.992 -0.603 -2.971 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.678 0.895 -2.297 1.00 0.00 H new ATOM 540 N VAL A 32 8.727 1.175 -5.214 1.00 0.00 N ATOM 541 CA VAL A 32 10.156 0.772 -5.074 1.00 0.00 C ATOM 542 C VAL A 32 10.557 0.714 -3.570 1.00 0.00 C ATOM 543 O VAL A 32 10.037 1.431 -2.703 1.00 0.00 O ATOM 544 CB VAL A 32 11.161 1.723 -5.845 1.00 0.00 C ATOM 545 CG1 VAL A 32 12.297 0.880 -6.454 1.00 0.00 C ATOM 546 CG2 VAL A 32 10.620 2.626 -6.979 1.00 0.00 C ATOM 0 H VAL A 32 8.603 2.158 -5.457 1.00 0.00 H new ATOM 0 HA VAL A 32 10.234 -0.215 -5.530 1.00 0.00 H new ATOM 0 HB VAL A 32 11.463 2.415 -5.059 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.990 1.533 -6.985 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.828 0.357 -5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.878 0.153 -7.150 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.438 3.211 -7.400 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.179 2.006 -7.759 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.862 3.298 -6.578 1.00 0.00 H new ATOM 556 N ALA A 33 11.515 -0.171 -3.286 1.00 0.00 N ATOM 557 CA ALA A 33 12.008 -0.390 -1.927 1.00 0.00 C ATOM 558 C ALA A 33 13.202 0.495 -1.557 1.00 0.00 C ATOM 559 O ALA A 33 14.128 0.730 -2.340 1.00 0.00 O ATOM 560 CB ALA A 33 12.540 -1.831 -1.860 1.00 0.00 C ATOM 0 H ALA A 33 11.969 -0.754 -3.990 1.00 0.00 H new ATOM 0 HA ALA A 33 11.181 -0.170 -1.251 1.00 0.00 H new ATOM 0 HB1 ALA A 33 12.918 -2.033 -0.858 1.00 0.00 H new ATOM 0 HB2 ALA A 33 11.734 -2.528 -2.091 1.00 0.00 H new ATOM 0 HB3 ALA A 33 13.346 -1.955 -2.584 1.00 0.00 H new ATOM 566 N GLY A 34 13.233 0.780 -0.262 1.00 0.00 N ATOM 567 CA GLY A 34 14.365 1.418 0.389 1.00 0.00 C ATOM 568 C GLY A 34 14.916 2.723 -0.159 1.00 0.00 C ATOM 569 O GLY A 34 14.432 3.809 0.174 1.00 0.00 O ATOM 0 H GLY A 34 12.462 0.571 0.372 1.00 0.00 H new ATOM 0 HA2 GLY A 34 14.085 1.594 1.428 1.00 0.00 H new ATOM 0 HA3 GLY A 34 15.183 0.698 0.397 1.00 0.00 H new ATOM 573 N TYR A 35 16.015 2.567 -0.886 1.00 0.00 N ATOM 574 CA TYR A 35 16.772 3.724 -1.421 1.00 0.00 C ATOM 575 C TYR A 35 17.190 3.545 -2.931 1.00 0.00 C ATOM 576 O TYR A 35 18.363 3.757 -3.260 1.00 0.00 O ATOM 577 CB TYR A 35 17.995 4.010 -0.462 1.00 0.00 C ATOM 578 CG TYR A 35 17.878 5.312 0.359 1.00 0.00 C ATOM 579 CD1 TYR A 35 16.916 5.460 1.360 1.00 0.00 C ATOM 580 CD2 TYR A 35 18.680 6.411 0.023 1.00 0.00 C ATOM 581 CE1 TYR A 35 16.732 6.682 1.995 1.00 0.00 C ATOM 582 CE2 TYR A 35 18.499 7.638 0.660 1.00 0.00 C ATOM 583 CZ TYR A 35 17.518 7.771 1.637 1.00 0.00 C ATOM 584 OH TYR A 35 17.177 9.007 2.106 1.00 0.00 O ATOM 0 H TYR A 35 16.412 1.659 -1.126 1.00 0.00 H new ATOM 0 HA TYR A 35 16.123 4.600 -1.434 1.00 0.00 H new ATOM 0 HB2 TYR A 35 18.104 3.171 0.225 1.00 0.00 H new ATOM 0 HB3 TYR A 35 18.906 4.053 -1.059 1.00 0.00 H new ATOM 0 HD1 TYR A 35 16.307 4.614 1.644 1.00 0.00 H new ATOM 0 HD2 TYR A 35 19.443 6.307 -0.734 1.00 0.00 H new ATOM 0 HE1 TYR A 35 15.981 6.785 2.764 1.00 0.00 H new ATOM 0 HE2 TYR A 35 19.118 8.482 0.396 1.00 0.00 H new ATOM 0 HH TYR A 35 16.339 9.296 1.687 1.00 0.00 H new ATOM 594 N LEU A 36 16.264 3.350 -3.909 1.00 0.00 N ATOM 595 CA LEU A 36 16.693 3.182 -5.347 1.00 0.00 C ATOM 596 C LEU A 36 17.173 4.482 -6.073 1.00 0.00 C ATOM 597 O LEU A 36 18.183 4.484 -6.782 1.00 0.00 O ATOM 598 CB LEU A 36 15.533 2.469 -6.110 1.00 0.00 C ATOM 599 CG LEU A 36 15.767 1.952 -7.567 1.00 0.00 C ATOM 600 CD1 LEU A 36 15.525 3.020 -8.647 1.00 0.00 C ATOM 601 CD2 LEU A 36 17.124 1.267 -7.801 1.00 0.00 C ATOM 0 H LEU A 36 15.257 3.305 -3.752 1.00 0.00 H new ATOM 0 HA LEU A 36 17.597 2.573 -5.346 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.223 1.615 -5.507 1.00 0.00 H new ATOM 0 HB3 LEU A 36 14.690 3.160 -6.141 1.00 0.00 H new ATOM 0 HG LEU A 36 15.003 1.182 -7.670 1.00 0.00 H new ATOM 0 HD11 LEU A 36 15.706 2.589 -9.632 1.00 0.00 H new ATOM 0 HD12 LEU A 36 14.494 3.370 -8.588 1.00 0.00 H new ATOM 0 HD13 LEU A 36 16.203 3.859 -8.487 1.00 0.00 H new ATOM 0 HD21 LEU A 36 17.194 0.943 -8.839 1.00 0.00 H new ATOM 0 HD22 LEU A 36 17.928 1.970 -7.586 1.00 0.00 H new ATOM 0 HD23 LEU A 36 17.213 0.402 -7.144 1.00 0.00 H new ATOM 613 N GLN A 37 16.427 5.557 -5.903 1.00 0.00 N ATOM 614 CA GLN A 37 16.736 6.891 -6.492 1.00 0.00 C ATOM 615 C GLN A 37 16.318 8.019 -5.490 1.00 0.00 C ATOM 616 O GLN A 37 15.150 8.422 -5.431 1.00 0.00 O ATOM 617 CB GLN A 37 16.034 7.010 -7.880 1.00 0.00 C ATOM 618 CG GLN A 37 16.627 8.072 -8.845 1.00 0.00 C ATOM 619 CD GLN A 37 16.273 9.534 -8.555 1.00 0.00 C ATOM 620 OE1 GLN A 37 15.156 9.982 -8.798 1.00 0.00 O ATOM 621 NE2 GLN A 37 17.193 10.323 -8.052 1.00 0.00 N ATOM 0 H GLN A 37 15.572 5.551 -5.347 1.00 0.00 H new ATOM 0 HA GLN A 37 17.807 7.005 -6.660 1.00 0.00 H new ATOM 0 HB2 GLN A 37 16.073 6.038 -8.371 1.00 0.00 H new ATOM 0 HB3 GLN A 37 14.982 7.242 -7.716 1.00 0.00 H new ATOM 0 HG2 GLN A 37 17.713 7.975 -8.833 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.297 7.835 -9.857 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.123 9.957 -7.848 1.00 0.00 H new ATOM 0 HE22 GLN A 37 16.978 11.302 -7.865 1.00 0.00 H new ATOM 630 N GLY A 38 17.300 8.477 -4.691 1.00 0.00 N ATOM 631 CA GLY A 38 17.169 9.584 -3.698 1.00 0.00 C ATOM 632 C GLY A 38 15.892 9.920 -2.868 1.00 0.00 C ATOM 633 O GLY A 38 15.543 11.104 -2.870 1.00 0.00 O ATOM 0 H GLY A 38 18.240 8.081 -4.712 1.00 0.00 H new ATOM 0 HA2 GLY A 38 17.961 9.420 -2.967 1.00 0.00 H new ATOM 0 HA3 GLY A 38 17.418 10.497 -4.239 1.00 0.00 H new ATOM 637 N PRO A 39 15.215 9.020 -2.101 1.00 0.00 N ATOM 638 CA PRO A 39 14.035 9.398 -1.275 1.00 0.00 C ATOM 639 C PRO A 39 14.447 10.002 0.108 1.00 0.00 C ATOM 640 O PRO A 39 14.936 9.308 1.007 1.00 0.00 O ATOM 641 CB PRO A 39 13.303 8.062 -1.181 1.00 0.00 C ATOM 642 CG PRO A 39 14.418 7.008 -1.162 1.00 0.00 C ATOM 643 CD PRO A 39 15.528 7.578 -2.042 1.00 0.00 C ATOM 0 HA PRO A 39 13.418 10.193 -1.693 1.00 0.00 H new ATOM 0 HB2 PRO A 39 12.691 8.008 -0.280 1.00 0.00 H new ATOM 0 HB3 PRO A 39 12.634 7.916 -2.029 1.00 0.00 H new ATOM 0 HG2 PRO A 39 14.773 6.830 -0.147 1.00 0.00 H new ATOM 0 HG3 PRO A 39 14.062 6.052 -1.547 1.00 0.00 H new ATOM 0 HD2 PRO A 39 16.513 7.398 -1.612 1.00 0.00 H new ATOM 0 HD3 PRO A 39 15.526 7.126 -3.034 1.00 0.00 H new ATOM 651 N ASN A 40 14.335 11.327 0.241 1.00 0.00 N ATOM 652 CA ASN A 40 14.747 12.055 1.469 1.00 0.00 C ATOM 653 C ASN A 40 13.955 13.397 1.539 1.00 0.00 C ATOM 654 O ASN A 40 14.470 14.471 1.217 1.00 0.00 O ATOM 655 CB ASN A 40 16.297 12.251 1.441 1.00 0.00 C ATOM 656 CG ASN A 40 16.910 12.598 2.801 1.00 0.00 C ATOM 657 OD1 ASN A 40 16.886 13.735 3.258 1.00 0.00 O ATOM 658 ND2 ASN A 40 17.479 11.643 3.498 1.00 0.00 N ATOM 0 H ASN A 40 13.960 11.932 -0.489 1.00 0.00 H new ATOM 0 HA ASN A 40 14.513 11.494 2.374 1.00 0.00 H new ATOM 0 HB2 ASN A 40 16.761 11.338 1.068 1.00 0.00 H new ATOM 0 HB3 ASN A 40 16.539 13.044 0.733 1.00 0.00 H new ATOM 0 HD21 ASN A 40 17.893 11.852 4.406 1.00 0.00 H new ATOM 0 HD22 ASN A 40 17.507 10.692 3.131 1.00 0.00 H new ATOM 665 N VAL A 41 12.685 13.306 1.972 1.00 0.00 N ATOM 666 CA VAL A 41 11.732 14.466 2.161 1.00 0.00 C ATOM 667 C VAL A 41 11.568 15.419 0.906 1.00 0.00 C ATOM 668 O VAL A 41 11.390 16.635 1.018 1.00 0.00 O ATOM 669 CB VAL A 41 12.065 15.253 3.492 1.00 0.00 C ATOM 670 CG1 VAL A 41 12.024 14.367 4.758 1.00 0.00 C ATOM 671 CG2 VAL A 41 13.361 16.095 3.549 1.00 0.00 C ATOM 0 H VAL A 41 12.261 12.410 2.212 1.00 0.00 H new ATOM 0 HA VAL A 41 10.743 14.020 2.262 1.00 0.00 H new ATOM 0 HB VAL A 41 11.245 15.971 3.472 1.00 0.00 H new ATOM 0 HG11 VAL A 41 12.262 14.972 5.633 1.00 0.00 H new ATOM 0 HG12 VAL A 41 11.027 13.941 4.872 1.00 0.00 H new ATOM 0 HG13 VAL A 41 12.754 13.563 4.663 1.00 0.00 H new ATOM 0 HG21 VAL A 41 13.443 16.571 4.526 1.00 0.00 H new ATOM 0 HG22 VAL A 41 14.223 15.448 3.387 1.00 0.00 H new ATOM 0 HG23 VAL A 41 13.332 16.861 2.774 1.00 0.00 H new ATOM 681 N ASN A 42 11.565 14.832 -0.304 1.00 0.00 N ATOM 682 CA ASN A 42 11.444 15.565 -1.597 1.00 0.00 C ATOM 683 C ASN A 42 10.909 14.584 -2.697 1.00 0.00 C ATOM 684 O ASN A 42 9.832 14.822 -3.245 1.00 0.00 O ATOM 685 CB ASN A 42 12.824 16.214 -1.934 1.00 0.00 C ATOM 686 CG ASN A 42 12.791 17.255 -3.054 1.00 0.00 C ATOM 687 OD1 ASN A 42 13.071 16.975 -4.212 1.00 0.00 O ATOM 688 ND2 ASN A 42 12.462 18.488 -2.754 1.00 0.00 N ATOM 0 H ASN A 42 11.647 13.822 -0.423 1.00 0.00 H new ATOM 0 HA ASN A 42 10.721 16.379 -1.539 1.00 0.00 H new ATOM 0 HB2 ASN A 42 13.218 16.684 -1.033 1.00 0.00 H new ATOM 0 HB3 ASN A 42 13.522 15.424 -2.212 1.00 0.00 H new ATOM 0 HD21 ASN A 42 12.441 19.202 -3.482 1.00 0.00 H new ATOM 0 HD22 ASN A 42 12.227 18.733 -1.792 1.00 0.00 H new ATOM 695 N LEU A 43 11.624 13.479 -2.997 1.00 0.00 N ATOM 696 CA LEU A 43 11.181 12.454 -3.998 1.00 0.00 C ATOM 697 C LEU A 43 10.185 11.349 -3.460 1.00 0.00 C ATOM 698 O LEU A 43 9.753 10.505 -4.251 1.00 0.00 O ATOM 699 CB LEU A 43 12.491 11.812 -4.558 1.00 0.00 C ATOM 700 CG LEU A 43 13.189 12.532 -5.747 1.00 0.00 C ATOM 701 CD1 LEU A 43 13.623 13.982 -5.466 1.00 0.00 C ATOM 702 CD2 LEU A 43 14.437 11.740 -6.166 1.00 0.00 C ATOM 0 H LEU A 43 12.521 13.262 -2.562 1.00 0.00 H new ATOM 0 HA LEU A 43 10.587 12.955 -4.762 1.00 0.00 H new ATOM 0 HB2 LEU A 43 13.208 11.741 -3.740 1.00 0.00 H new ATOM 0 HB3 LEU A 43 12.260 10.793 -4.870 1.00 0.00 H new ATOM 0 HG LEU A 43 12.436 12.575 -6.534 1.00 0.00 H new ATOM 0 HD11 LEU A 43 14.099 14.398 -6.354 1.00 0.00 H new ATOM 0 HD12 LEU A 43 12.749 14.580 -5.209 1.00 0.00 H new ATOM 0 HD13 LEU A 43 14.329 13.996 -4.635 1.00 0.00 H new ATOM 0 HD21 LEU A 43 14.926 12.245 -6.999 1.00 0.00 H new ATOM 0 HD22 LEU A 43 15.127 11.677 -5.325 1.00 0.00 H new ATOM 0 HD23 LEU A 43 14.145 10.735 -6.472 1.00 0.00 H new ATOM 714 N GLU A 44 9.834 11.327 -2.159 1.00 0.00 N ATOM 715 CA GLU A 44 8.862 10.371 -1.559 1.00 0.00 C ATOM 716 C GLU A 44 7.406 10.953 -1.665 1.00 0.00 C ATOM 717 O GLU A 44 7.119 12.036 -1.140 1.00 0.00 O ATOM 718 CB GLU A 44 9.316 10.082 -0.092 1.00 0.00 C ATOM 719 CG GLU A 44 9.353 11.268 0.920 1.00 0.00 C ATOM 720 CD GLU A 44 9.985 10.976 2.272 1.00 0.00 C ATOM 721 OE1 GLU A 44 11.230 10.889 2.349 1.00 0.00 O ATOM 722 OE2 GLU A 44 9.241 10.909 3.277 1.00 0.00 O ATOM 0 H GLU A 44 10.220 11.981 -1.478 1.00 0.00 H new ATOM 0 HA GLU A 44 8.843 9.423 -2.096 1.00 0.00 H new ATOM 0 HB2 GLU A 44 8.654 9.318 0.316 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.316 9.649 -0.133 1.00 0.00 H new ATOM 0 HG2 GLU A 44 9.894 12.095 0.460 1.00 0.00 H new ATOM 0 HG3 GLU A 44 8.331 11.609 1.086 1.00 0.00 H new ATOM 729 N GLU A 45 6.480 10.225 -2.321 1.00 0.00 N ATOM 730 CA GLU A 45 5.083 10.715 -2.536 1.00 0.00 C ATOM 731 C GLU A 45 4.148 10.438 -1.297 1.00 0.00 C ATOM 732 O GLU A 45 4.491 10.788 -0.162 1.00 0.00 O ATOM 733 CB GLU A 45 4.644 10.089 -3.907 1.00 0.00 C ATOM 734 CG GLU A 45 5.269 10.678 -5.201 1.00 0.00 C ATOM 735 CD GLU A 45 4.713 12.031 -5.628 1.00 0.00 C ATOM 736 OE1 GLU A 45 3.555 12.086 -6.092 1.00 0.00 O ATOM 737 OE2 GLU A 45 5.438 13.039 -5.511 1.00 0.00 O ATOM 0 H GLU A 45 6.662 9.301 -2.713 1.00 0.00 H new ATOM 0 HA GLU A 45 5.009 11.800 -2.604 1.00 0.00 H new ATOM 0 HB2 GLU A 45 4.873 9.024 -3.878 1.00 0.00 H new ATOM 0 HB3 GLU A 45 3.561 10.180 -3.986 1.00 0.00 H new ATOM 0 HG2 GLU A 45 6.345 10.774 -5.055 1.00 0.00 H new ATOM 0 HG3 GLU A 45 5.120 9.968 -6.014 1.00 0.00 H new ATOM 744 N LYS A 46 2.988 9.788 -1.479 1.00 0.00 N ATOM 745 CA LYS A 46 2.006 9.525 -0.385 1.00 0.00 C ATOM 746 C LYS A 46 1.139 8.275 -0.748 1.00 0.00 C ATOM 747 O LYS A 46 0.280 8.341 -1.636 1.00 0.00 O ATOM 748 CB LYS A 46 1.135 10.807 -0.177 1.00 0.00 C ATOM 749 CG LYS A 46 0.660 11.053 1.281 1.00 0.00 C ATOM 750 CD LYS A 46 1.085 12.425 1.853 1.00 0.00 C ATOM 751 CE LYS A 46 2.589 12.531 2.189 1.00 0.00 C ATOM 752 NZ LYS A 46 2.923 13.937 2.528 1.00 0.00 N ATOM 0 H LYS A 46 2.693 9.425 -2.385 1.00 0.00 H new ATOM 0 HA LYS A 46 2.517 9.303 0.552 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.708 11.674 -0.507 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.259 10.740 -0.822 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.427 10.976 1.317 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.057 10.265 1.920 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.829 13.202 1.132 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.507 12.625 2.755 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.832 11.876 3.026 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.186 12.199 1.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.774 13.957 3.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.100 14.472 1.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 2.129 14.368 3.043 1.00 0.00 H new ATOM 766 N ILE A 47 1.380 7.127 -0.089 1.00 0.00 N ATOM 767 CA ILE A 47 0.650 5.850 -0.376 1.00 0.00 C ATOM 768 C ILE A 47 0.000 5.299 0.935 1.00 0.00 C ATOM 769 O ILE A 47 0.567 5.397 2.026 1.00 0.00 O ATOM 770 CB ILE A 47 1.650 4.832 -1.068 1.00 0.00 C ATOM 771 CG1 ILE A 47 0.968 3.850 -2.077 1.00 0.00 C ATOM 772 CG2 ILE A 47 2.466 4.003 -0.049 1.00 0.00 C ATOM 773 CD1 ILE A 47 0.181 2.619 -1.581 1.00 0.00 C ATOM 0 H ILE A 47 2.076 7.044 0.652 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.172 6.017 -1.072 1.00 0.00 H new ATOM 0 HB ILE A 47 2.321 5.482 -1.629 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.284 4.442 -2.685 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.749 3.482 -2.742 1.00 0.00 H new ATOM 0 HG21 ILE A 47 3.132 3.325 -0.582 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.055 4.673 0.577 1.00 0.00 H new ATOM 0 HG23 ILE A 47 1.786 3.426 0.578 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.212 2.069 -2.436 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.843 1.971 -1.007 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.645 2.946 -0.949 1.00 0.00 H new ATOM 785 N ASP A 48 -1.233 4.811 0.807 1.00 0.00 N ATOM 786 CA ASP A 48 -1.917 4.051 1.886 1.00 0.00 C ATOM 787 C ASP A 48 -3.143 3.276 1.309 1.00 0.00 C ATOM 788 O ASP A 48 -2.977 2.388 0.467 1.00 0.00 O ATOM 789 CB ASP A 48 -2.172 4.854 3.195 1.00 0.00 C ATOM 790 CG ASP A 48 -2.340 4.036 4.457 1.00 0.00 C ATOM 791 OD1 ASP A 48 -1.493 3.160 4.747 1.00 0.00 O ATOM 792 OD2 ASP A 48 -3.315 4.296 5.192 1.00 0.00 O ATOM 0 H ASP A 48 -1.795 4.923 -0.037 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.220 3.295 2.249 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.341 5.544 3.342 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -3.068 5.459 3.057 1.00 0.00 H new ATOM 797 N VAL A 49 -4.362 3.589 1.763 1.00 0.00 N ATOM 798 CA VAL A 49 -5.542 2.693 1.550 1.00 0.00 C ATOM 799 C VAL A 49 -6.931 3.417 1.466 1.00 0.00 C ATOM 800 O VAL A 49 -7.123 4.573 1.849 1.00 0.00 O ATOM 801 CB VAL A 49 -5.489 1.659 2.763 1.00 0.00 C ATOM 802 CG1 VAL A 49 -5.935 2.222 4.133 1.00 0.00 C ATOM 803 CG2 VAL A 49 -6.231 0.321 2.560 1.00 0.00 C ATOM 0 H VAL A 49 -4.573 4.444 2.277 1.00 0.00 H new ATOM 0 HA VAL A 49 -5.468 2.219 0.571 1.00 0.00 H new ATOM 0 HB VAL A 49 -4.417 1.465 2.772 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.862 1.440 4.889 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.291 3.056 4.411 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.967 2.567 4.066 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.122 -0.295 3.453 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.288 0.515 2.380 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -5.808 -0.203 1.703 1.00 0.00 H new ATOM 813 N VAL A 50 -7.906 2.685 0.916 1.00 0.00 N ATOM 814 CA VAL A 50 -9.359 3.019 0.987 1.00 0.00 C ATOM 815 C VAL A 50 -9.845 1.824 1.901 1.00 0.00 C ATOM 816 O VAL A 50 -9.920 0.710 1.362 1.00 0.00 O ATOM 817 CB VAL A 50 -10.052 3.101 -0.413 1.00 0.00 C ATOM 818 CG1 VAL A 50 -11.571 3.365 -0.299 1.00 0.00 C ATOM 819 CG2 VAL A 50 -9.448 4.187 -1.333 1.00 0.00 C ATOM 0 H VAL A 50 -7.719 1.827 0.397 1.00 0.00 H new ATOM 0 HA VAL A 50 -9.597 4.009 1.376 1.00 0.00 H new ATOM 0 HB VAL A 50 -9.874 2.122 -0.859 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -12.008 3.414 -1.297 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -12.039 2.557 0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -11.738 4.311 0.217 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.975 4.190 -2.287 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.550 5.163 -0.859 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.392 3.975 -1.502 1.00 0.00 H new ATOM 829 N PRO A 51 -10.113 1.979 3.240 1.00 0.00 N ATOM 830 CA PRO A 51 -10.367 0.833 4.172 1.00 0.00 C ATOM 831 C PRO A 51 -11.790 0.177 4.188 1.00 0.00 C ATOM 832 O PRO A 51 -12.787 0.805 3.829 1.00 0.00 O ATOM 833 CB PRO A 51 -10.039 1.498 5.527 1.00 0.00 C ATOM 834 CG PRO A 51 -10.479 2.950 5.364 1.00 0.00 C ATOM 835 CD PRO A 51 -10.055 3.284 3.936 1.00 0.00 C ATOM 0 HA PRO A 51 -9.779 -0.035 3.875 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -10.571 1.013 6.345 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -8.975 1.430 5.754 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -11.554 3.063 5.502 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.994 3.602 6.091 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -10.725 4.012 3.479 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -9.052 3.710 3.905 1.00 0.00 H new ATOM 843 N ILE A 52 -11.886 -1.052 4.761 1.00 0.00 N ATOM 844 CA ILE A 52 -13.185 -1.811 4.857 1.00 0.00 C ATOM 845 C ILE A 52 -14.138 -1.206 5.954 1.00 0.00 C ATOM 846 O ILE A 52 -15.344 -1.060 5.755 1.00 0.00 O ATOM 847 CB ILE A 52 -12.946 -3.371 5.039 1.00 0.00 C ATOM 848 CG1 ILE A 52 -14.260 -4.151 4.721 1.00 0.00 C ATOM 849 CG2 ILE A 52 -12.422 -3.801 6.439 1.00 0.00 C ATOM 850 CD1 ILE A 52 -14.065 -5.642 4.388 1.00 0.00 C ATOM 0 H ILE A 52 -11.090 -1.545 5.165 1.00 0.00 H new ATOM 0 HA ILE A 52 -13.703 -1.691 3.905 1.00 0.00 H new ATOM 0 HB ILE A 52 -12.152 -3.620 4.335 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -14.930 -4.070 5.577 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -14.757 -3.668 3.880 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -12.291 -4.883 6.462 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -11.466 -3.316 6.634 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -13.141 -3.506 7.203 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -15.033 -6.098 4.182 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -13.424 -5.738 3.511 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -13.599 -6.146 5.235 1.00 0.00 H new ATOM 862 N GLU A 53 -13.524 -0.932 7.096 1.00 0.00 N ATOM 863 CA GLU A 53 -14.104 -0.256 8.277 1.00 0.00 C ATOM 864 C GLU A 53 -12.908 0.603 8.864 1.00 0.00 C ATOM 865 O GLU A 53 -12.863 1.774 8.467 1.00 0.00 O ATOM 866 CB GLU A 53 -14.806 -1.277 9.230 1.00 0.00 C ATOM 867 CG GLU A 53 -16.206 -1.808 8.825 1.00 0.00 C ATOM 868 CD GLU A 53 -17.303 -0.765 8.734 1.00 0.00 C ATOM 869 OE1 GLU A 53 -17.829 -0.336 9.780 1.00 0.00 O ATOM 870 OE2 GLU A 53 -17.623 -0.342 7.602 1.00 0.00 O ATOM 0 H GLU A 53 -12.547 -1.186 7.245 1.00 0.00 H new ATOM 0 HA GLU A 53 -14.932 0.419 8.061 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -14.144 -2.135 9.346 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.897 -0.810 10.211 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -16.121 -2.304 7.858 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -16.510 -2.566 9.547 1.00 0.00 H new ATOM 877 N PRO A 54 -11.880 0.154 9.669 1.00 0.00 N ATOM 878 CA PRO A 54 -10.804 1.058 10.174 1.00 0.00 C ATOM 879 C PRO A 54 -9.546 1.287 9.254 1.00 0.00 C ATOM 880 O PRO A 54 -9.317 2.420 8.819 1.00 0.00 O ATOM 881 CB PRO A 54 -10.472 0.373 11.521 1.00 0.00 C ATOM 882 CG PRO A 54 -10.666 -1.128 11.275 1.00 0.00 C ATOM 883 CD PRO A 54 -11.833 -1.188 10.288 1.00 0.00 C ATOM 0 HA PRO A 54 -11.140 2.093 10.233 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -9.450 0.591 11.831 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -11.129 0.729 12.315 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -9.767 -1.585 10.860 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -10.896 -1.658 12.199 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.676 -1.963 9.538 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -12.768 -1.421 10.797 1.00 0.00 H new ATOM 891 N HIS A 55 -8.732 0.248 8.960 1.00 0.00 N ATOM 892 CA HIS A 55 -7.410 0.405 8.262 1.00 0.00 C ATOM 893 C HIS A 55 -7.037 -0.596 7.104 1.00 0.00 C ATOM 894 O HIS A 55 -5.964 -0.425 6.512 1.00 0.00 O ATOM 895 CB HIS A 55 -6.332 0.253 9.390 1.00 0.00 C ATOM 896 CG HIS A 55 -6.245 1.315 10.494 1.00 0.00 C ATOM 897 ND1 HIS A 55 -5.889 0.991 11.794 1.00 0.00 N ATOM 898 CD2 HIS A 55 -6.403 2.709 10.360 1.00 0.00 C ATOM 899 CE1 HIS A 55 -5.854 2.248 12.338 1.00 0.00 C ATOM 900 NE2 HIS A 55 -6.159 3.338 11.566 1.00 0.00 N ATOM 0 H HIS A 55 -8.959 -0.719 9.192 1.00 0.00 H new ATOM 0 HA HIS A 55 -7.462 1.364 7.747 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.498 -0.710 9.874 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.357 0.203 8.906 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.676 3.214 9.445 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -5.586 2.380 13.376 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -6.195 4.328 11.811 1.00 0.00 H new ATOM 908 N ALA A 56 -7.867 -1.599 6.768 1.00 0.00 N ATOM 909 CA ALA A 56 -7.549 -2.658 5.769 1.00 0.00 C ATOM 910 C ALA A 56 -8.599 -2.797 4.611 1.00 0.00 C ATOM 911 O ALA A 56 -9.771 -2.921 4.949 1.00 0.00 O ATOM 912 CB ALA A 56 -7.548 -3.946 6.618 1.00 0.00 C ATOM 0 H ALA A 56 -8.792 -1.707 7.183 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.614 -2.432 5.257 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.323 -4.801 5.981 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -6.792 -3.866 7.399 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -8.528 -4.082 7.075 1.00 0.00 H new ATOM 918 N LEU A 57 -8.227 -2.711 3.307 1.00 0.00 N ATOM 919 CA LEU A 57 -9.140 -2.922 2.103 1.00 0.00 C ATOM 920 C LEU A 57 -8.304 -2.603 0.808 1.00 0.00 C ATOM 921 O LEU A 57 -7.289 -3.250 0.574 1.00 0.00 O ATOM 922 CB LEU A 57 -10.553 -2.264 2.159 1.00 0.00 C ATOM 923 CG LEU A 57 -11.730 -2.574 1.179 1.00 0.00 C ATOM 924 CD1 LEU A 57 -12.049 -1.420 0.216 1.00 0.00 C ATOM 925 CD2 LEU A 57 -11.650 -3.933 0.464 1.00 0.00 C ATOM 0 H LEU A 57 -7.269 -2.490 3.035 1.00 0.00 H new ATOM 0 HA LEU A 57 -9.447 -3.968 2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -10.937 -2.465 3.159 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -10.385 -1.189 2.093 1.00 0.00 H new ATOM 0 HG LEU A 57 -12.587 -2.668 1.845 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.876 -1.706 -0.434 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -12.327 -0.535 0.788 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -11.171 -1.199 -0.390 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -12.513 -4.050 -0.192 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -10.735 -3.980 -0.127 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -11.645 -4.734 1.204 1.00 0.00 H new ATOM 937 N PHE A 58 -8.693 -1.670 -0.063 1.00 0.00 N ATOM 938 CA PHE A 58 -7.986 -1.414 -1.372 1.00 0.00 C ATOM 939 C PHE A 58 -6.716 -0.523 -1.201 1.00 0.00 C ATOM 940 O PHE A 58 -6.765 0.474 -0.481 1.00 0.00 O ATOM 941 CB PHE A 58 -8.940 -0.716 -2.389 1.00 0.00 C ATOM 942 CG PHE A 58 -10.105 -1.475 -3.062 1.00 0.00 C ATOM 943 CD1 PHE A 58 -10.432 -2.811 -2.796 1.00 0.00 C ATOM 944 CD2 PHE A 58 -10.891 -0.754 -3.969 1.00 0.00 C ATOM 945 CE1 PHE A 58 -11.558 -3.390 -3.375 1.00 0.00 C ATOM 946 CE2 PHE A 58 -11.995 -1.347 -4.577 1.00 0.00 C ATOM 947 CZ PHE A 58 -12.331 -2.662 -4.274 1.00 0.00 C ATOM 0 H PHE A 58 -9.497 -1.062 0.093 1.00 0.00 H new ATOM 0 HA PHE A 58 -7.679 -2.391 -1.745 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -9.376 0.141 -1.876 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -8.314 -0.323 -3.190 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -9.807 -3.396 -2.138 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -10.639 0.271 -4.199 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -11.832 -4.405 -3.126 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -12.589 -0.786 -5.283 1.00 0.00 H new ATOM 0 HZ PHE A 58 -13.193 -3.119 -4.737 1.00 0.00 H new ATOM 957 N LEU A 59 -5.584 -0.857 -1.852 1.00 0.00 N ATOM 958 CA LEU A 59 -4.321 -0.043 -1.712 1.00 0.00 C ATOM 959 C LEU A 59 -4.246 1.068 -2.792 1.00 0.00 C ATOM 960 O LEU A 59 -4.576 0.810 -3.952 1.00 0.00 O ATOM 961 CB LEU A 59 -3.055 -0.961 -1.787 1.00 0.00 C ATOM 962 CG LEU A 59 -2.315 -1.361 -0.470 1.00 0.00 C ATOM 963 CD1 LEU A 59 -0.992 -0.597 -0.302 1.00 0.00 C ATOM 964 CD2 LEU A 59 -3.110 -1.219 0.843 1.00 0.00 C ATOM 0 H LEU A 59 -5.500 -1.663 -2.471 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.344 0.436 -0.733 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.349 -1.883 -2.289 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -2.329 -0.465 -2.431 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.153 -2.428 -0.619 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -0.510 -0.905 0.626 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -0.335 -0.818 -1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -1.192 0.474 -0.269 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.486 -1.528 1.682 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.409 -0.179 0.977 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.998 -1.849 0.801 1.00 0.00 H new ATOM 976 N GLY A 60 -3.798 2.286 -2.420 1.00 0.00 N ATOM 977 CA GLY A 60 -3.697 3.406 -3.391 1.00 0.00 C ATOM 978 C GLY A 60 -2.736 4.570 -3.073 1.00 0.00 C ATOM 979 O GLY A 60 -2.326 4.789 -1.931 1.00 0.00 O ATOM 0 H GLY A 60 -3.504 2.521 -1.472 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -3.402 2.986 -4.353 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -4.695 3.825 -3.519 1.00 0.00 H new ATOM 983 N ILE A 61 -2.450 5.366 -4.117 1.00 0.00 N ATOM 984 CA ILE A 61 -1.464 6.477 -4.080 1.00 0.00 C ATOM 985 C ILE A 61 -2.134 7.839 -4.476 1.00 0.00 C ATOM 986 O ILE A 61 -2.805 7.966 -5.522 1.00 0.00 O ATOM 987 CB ILE A 61 -0.257 6.027 -4.997 1.00 0.00 C ATOM 988 CG1 ILE A 61 1.093 6.622 -4.504 1.00 0.00 C ATOM 989 CG2 ILE A 61 -0.468 6.305 -6.511 1.00 0.00 C ATOM 990 CD1 ILE A 61 1.439 8.096 -4.746 1.00 0.00 C ATOM 0 H ILE A 61 -2.900 5.260 -5.026 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.081 6.669 -3.078 1.00 0.00 H new ATOM 0 HB ILE A 61 -0.217 4.942 -4.898 1.00 0.00 H new ATOM 0 HG12 ILE A 61 1.142 6.454 -3.428 1.00 0.00 H new ATOM 0 HG13 ILE A 61 1.888 6.029 -4.956 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.406 5.967 -7.068 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.351 5.769 -6.860 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.607 7.375 -6.669 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.422 8.313 -4.327 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.449 8.296 -5.817 1.00 0.00 H new ATOM 0 HD13 ILE A 61 0.692 8.729 -4.266 1.00 0.00 H new ATOM 1002 N HIS A 62 -1.936 8.818 -3.567 1.00 0.00 N ATOM 1003 CA HIS A 62 -2.361 10.232 -3.737 1.00 0.00 C ATOM 1004 C HIS A 62 -1.107 11.040 -4.235 1.00 0.00 C ATOM 1005 O HIS A 62 -0.355 11.658 -3.477 1.00 0.00 O ATOM 1006 CB HIS A 62 -2.943 10.699 -2.374 1.00 0.00 C ATOM 1007 CG HIS A 62 -3.549 12.104 -2.335 1.00 0.00 C ATOM 1008 ND1 HIS A 62 -4.311 12.670 -3.352 1.00 0.00 N ATOM 1009 CD2 HIS A 62 -3.468 12.976 -1.234 1.00 0.00 C ATOM 1010 CE1 HIS A 62 -4.605 13.873 -2.760 1.00 0.00 C ATOM 1011 NE2 HIS A 62 -4.159 14.145 -1.496 1.00 0.00 N ATOM 0 H HIS A 62 -1.468 8.649 -2.677 1.00 0.00 H new ATOM 0 HA HIS A 62 -3.143 10.383 -4.481 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -3.711 9.988 -2.069 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.149 10.649 -1.629 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -2.941 12.763 -0.315 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -5.190 14.607 -3.294 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -4.296 14.972 -0.914 1.00 0.00 H new ATOM 1019 N GLY A 63 -0.926 10.972 -5.554 1.00 0.00 N ATOM 1020 CA GLY A 63 0.234 11.531 -6.303 1.00 0.00 C ATOM 1021 C GLY A 63 0.243 10.720 -7.615 1.00 0.00 C ATOM 1022 O GLY A 63 0.944 9.716 -7.736 1.00 0.00 O ATOM 0 H GLY A 63 -1.600 10.512 -6.166 1.00 0.00 H new ATOM 0 HA2 GLY A 63 0.113 12.598 -6.492 1.00 0.00 H new ATOM 0 HA3 GLY A 63 1.165 11.409 -5.750 1.00 0.00 H new ATOM 1026 N GLY A 64 -0.610 11.123 -8.570 1.00 0.00 N ATOM 1027 CA GLY A 64 -0.939 10.267 -9.750 1.00 0.00 C ATOM 1028 C GLY A 64 -2.432 9.851 -9.783 1.00 0.00 C ATOM 1029 O GLY A 64 -3.075 9.937 -10.828 1.00 0.00 O ATOM 0 H GLY A 64 -1.087 12.025 -8.561 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -0.695 10.806 -10.665 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -0.316 9.373 -9.731 1.00 0.00 H new ATOM 1033 N LYS A 65 -2.950 9.410 -8.618 1.00 0.00 N ATOM 1034 CA LYS A 65 -4.351 8.948 -8.372 1.00 0.00 C ATOM 1035 C LYS A 65 -4.548 7.507 -8.915 1.00 0.00 C ATOM 1036 O LYS A 65 -5.230 7.257 -9.919 1.00 0.00 O ATOM 1037 CB LYS A 65 -5.431 9.924 -8.902 1.00 0.00 C ATOM 1038 CG LYS A 65 -5.461 11.281 -8.167 1.00 0.00 C ATOM 1039 CD LYS A 65 -6.884 11.847 -8.066 1.00 0.00 C ATOM 1040 CE LYS A 65 -7.556 12.312 -9.378 1.00 0.00 C ATOM 1041 NZ LYS A 65 -6.877 13.508 -9.951 1.00 0.00 N ATOM 0 H LYS A 65 -2.381 9.360 -7.773 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.493 8.934 -7.291 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.258 10.100 -9.964 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.409 9.452 -8.813 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -5.046 11.161 -7.166 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.824 11.992 -8.692 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -7.519 11.085 -7.613 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -6.863 12.693 -7.379 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.537 11.500 -10.105 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.604 12.545 -9.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -7.355 13.791 -10.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -6.917 14.291 -9.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.884 13.278 -10.156 1.00 0.00 H new ATOM 1055 N MET A 66 -3.955 6.556 -8.178 1.00 0.00 N ATOM 1056 CA MET A 66 -4.007 5.117 -8.607 1.00 0.00 C ATOM 1057 C MET A 66 -4.347 4.198 -7.403 1.00 0.00 C ATOM 1058 O MET A 66 -3.664 4.256 -6.387 1.00 0.00 O ATOM 1059 CB MET A 66 -2.668 4.672 -9.272 1.00 0.00 C ATOM 1060 CG MET A 66 -2.156 5.521 -10.455 1.00 0.00 C ATOM 1061 SD MET A 66 -0.798 4.670 -11.285 1.00 0.00 S ATOM 1062 CE MET A 66 -1.709 3.848 -12.603 1.00 0.00 C ATOM 0 H MET A 66 -3.447 6.729 -7.310 1.00 0.00 H new ATOM 0 HA MET A 66 -4.797 5.023 -9.352 1.00 0.00 H new ATOM 0 HB2 MET A 66 -1.895 4.662 -8.503 1.00 0.00 H new ATOM 0 HB3 MET A 66 -2.787 3.645 -9.618 1.00 0.00 H new ATOM 0 HG2 MET A 66 -2.967 5.703 -11.160 1.00 0.00 H new ATOM 0 HG3 MET A 66 -1.821 6.494 -10.096 1.00 0.00 H new ATOM 0 HE1 MET A 66 -1.042 3.175 -13.142 1.00 0.00 H new ATOM 0 HE2 MET A 66 -2.532 3.276 -12.175 1.00 0.00 H new ATOM 0 HE3 MET A 66 -2.105 4.594 -13.292 1.00 0.00 H new ATOM 1072 N CYS A 67 -5.379 3.344 -7.491 1.00 0.00 N ATOM 1073 CA CYS A 67 -5.783 2.428 -6.388 1.00 0.00 C ATOM 1074 C CYS A 67 -6.429 1.099 -6.894 1.00 0.00 C ATOM 1075 O CYS A 67 -7.134 1.136 -7.905 1.00 0.00 O ATOM 1076 CB CYS A 67 -6.808 3.199 -5.518 1.00 0.00 C ATOM 1077 SG CYS A 67 -7.306 2.219 -4.061 1.00 0.00 S ATOM 0 H CYS A 67 -5.963 3.261 -8.324 1.00 0.00 H new ATOM 0 HA CYS A 67 -4.892 2.138 -5.831 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -6.374 4.145 -5.193 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -7.687 3.440 -6.115 1.00 0.00 H new ATOM 0 HG CYS A 67 -6.406 1.312 -3.820 1.00 0.00 H new ATOM 1083 N LEU A 68 -6.148 -0.071 -6.253 1.00 0.00 N ATOM 1084 CA LEU A 68 -6.875 -1.357 -6.530 1.00 0.00 C ATOM 1085 C LEU A 68 -6.479 -2.525 -5.517 1.00 0.00 C ATOM 1086 O LEU A 68 -6.717 -2.450 -4.301 1.00 0.00 O ATOM 1087 CB LEU A 68 -6.897 -1.764 -8.073 1.00 0.00 C ATOM 1088 CG LEU A 68 -8.096 -2.660 -8.509 1.00 0.00 C ATOM 1089 CD1 LEU A 68 -9.451 -1.922 -8.468 1.00 0.00 C ATOM 1090 CD2 LEU A 68 -7.893 -3.210 -9.930 1.00 0.00 C ATOM 0 H LEU A 68 -5.424 -0.156 -5.540 1.00 0.00 H new ATOM 0 HA LEU A 68 -7.926 -1.165 -6.314 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -6.909 -0.853 -8.672 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -5.970 -2.287 -8.307 1.00 0.00 H new ATOM 0 HG LEU A 68 -8.123 -3.474 -7.785 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -10.244 -2.600 -8.783 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -9.648 -1.579 -7.452 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -9.419 -1.065 -9.140 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -8.746 -3.831 -10.205 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -7.806 -2.381 -10.632 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -6.983 -3.809 -9.962 1.00 0.00 H new ATOM 1102 N SER A 69 -6.027 -3.640 -6.104 1.00 0.00 N ATOM 1103 CA SER A 69 -6.020 -5.023 -5.527 1.00 0.00 C ATOM 1104 C SER A 69 -4.748 -5.869 -5.895 1.00 0.00 C ATOM 1105 O SER A 69 -3.764 -5.379 -6.460 1.00 0.00 O ATOM 1106 CB SER A 69 -7.331 -5.607 -6.135 1.00 0.00 C ATOM 1107 OG SER A 69 -7.552 -6.965 -5.776 1.00 0.00 O ATOM 0 H SER A 69 -5.632 -3.619 -7.044 1.00 0.00 H new ATOM 0 HA SER A 69 -5.981 -5.034 -4.438 1.00 0.00 H new ATOM 0 HB2 SER A 69 -8.178 -5.007 -5.803 1.00 0.00 H new ATOM 0 HB3 SER A 69 -7.289 -5.526 -7.221 1.00 0.00 H new ATOM 0 HG SER A 69 -8.498 -7.095 -5.553 1.00 0.00 H new ATOM 1113 N CYS A 70 -4.730 -7.152 -5.484 1.00 0.00 N ATOM 1114 CA CYS A 70 -3.677 -8.123 -5.888 1.00 0.00 C ATOM 1115 C CYS A 70 -4.064 -8.697 -7.297 1.00 0.00 C ATOM 1116 O CYS A 70 -4.863 -9.629 -7.431 1.00 0.00 O ATOM 1117 CB CYS A 70 -3.589 -9.169 -4.762 1.00 0.00 C ATOM 1118 SG CYS A 70 -2.261 -10.376 -5.053 1.00 0.00 S ATOM 0 H CYS A 70 -5.438 -7.549 -4.866 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.684 -7.688 -6.005 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -3.418 -8.664 -3.811 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -4.542 -9.692 -4.678 1.00 0.00 H new ATOM 0 HG CYS A 70 -2.594 -11.521 -4.535 1.00 0.00 H new ATOM 1124 N VAL A 71 -3.551 -8.051 -8.357 1.00 0.00 N ATOM 1125 CA VAL A 71 -3.910 -8.358 -9.779 1.00 0.00 C ATOM 1126 C VAL A 71 -2.573 -8.410 -10.602 1.00 0.00 C ATOM 1127 O VAL A 71 -1.629 -7.645 -10.384 1.00 0.00 O ATOM 1128 CB VAL A 71 -5.047 -7.373 -10.327 1.00 0.00 C ATOM 1129 CG1 VAL A 71 -5.592 -6.214 -9.448 1.00 0.00 C ATOM 1130 CG2 VAL A 71 -4.886 -6.795 -11.754 1.00 0.00 C ATOM 0 H VAL A 71 -2.872 -7.296 -8.267 1.00 0.00 H new ATOM 0 HA VAL A 71 -4.382 -9.335 -9.882 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.784 -8.175 -10.305 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -6.354 -5.665 -10.001 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.029 -6.623 -8.537 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.776 -5.539 -9.188 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.733 -6.147 -11.982 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.963 -6.219 -11.811 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -4.849 -7.611 -12.475 1.00 0.00 H new ATOM 1140 N LYS A 72 -2.483 -9.345 -11.567 1.00 0.00 N ATOM 1141 CA LYS A 72 -1.248 -9.531 -12.374 1.00 0.00 C ATOM 1142 C LYS A 72 -1.052 -8.492 -13.531 1.00 0.00 C ATOM 1143 O LYS A 72 -2.003 -8.070 -14.197 1.00 0.00 O ATOM 1144 CB LYS A 72 -1.251 -10.968 -12.977 1.00 0.00 C ATOM 1145 CG LYS A 72 -2.338 -11.409 -14.001 1.00 0.00 C ATOM 1146 CD LYS A 72 -1.789 -12.292 -15.147 1.00 0.00 C ATOM 1147 CE LYS A 72 -1.162 -13.626 -14.690 1.00 0.00 C ATOM 1148 NZ LYS A 72 -0.475 -14.282 -15.832 1.00 0.00 N ATOM 0 H LYS A 72 -3.241 -9.982 -11.810 1.00 0.00 H new ATOM 0 HA LYS A 72 -0.415 -9.373 -11.689 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.283 -11.114 -13.457 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.300 -11.665 -12.140 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -3.120 -11.956 -13.475 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -2.803 -10.521 -14.429 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.600 -12.507 -15.842 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.039 -11.724 -15.698 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.452 -13.446 -13.883 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.935 -14.284 -14.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.364 -14.790 -15.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.124 -14.955 -16.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.183 -13.561 -16.522 1.00 0.00 H new ATOM 1162 N SER A 73 0.216 -8.117 -13.782 1.00 0.00 N ATOM 1163 CA SER A 73 0.591 -7.278 -14.963 1.00 0.00 C ATOM 1164 C SER A 73 0.764 -8.149 -16.264 1.00 0.00 C ATOM 1165 O SER A 73 0.240 -7.776 -17.316 1.00 0.00 O ATOM 1166 CB SER A 73 1.892 -6.503 -14.633 1.00 0.00 C ATOM 1167 OG SER A 73 1.642 -5.361 -13.815 1.00 0.00 O ATOM 0 H SER A 73 1.006 -8.375 -13.191 1.00 0.00 H new ATOM 0 HA SER A 73 -0.214 -6.571 -15.166 1.00 0.00 H new ATOM 0 HB2 SER A 73 2.590 -7.167 -14.124 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.371 -6.187 -15.560 1.00 0.00 H new ATOM 0 HG SER A 73 1.170 -5.638 -13.002 1.00 0.00 H new ATOM 1173 N GLY A 74 1.487 -9.285 -16.200 1.00 0.00 N ATOM 1174 CA GLY A 74 1.702 -10.193 -17.358 1.00 0.00 C ATOM 1175 C GLY A 74 2.051 -11.635 -16.928 1.00 0.00 C ATOM 1176 O GLY A 74 1.264 -12.561 -17.146 1.00 0.00 O ATOM 0 H GLY A 74 1.942 -9.604 -15.345 1.00 0.00 H new ATOM 0 HA2 GLY A 74 0.803 -10.209 -17.973 1.00 0.00 H new ATOM 0 HA3 GLY A 74 2.506 -9.799 -17.979 1.00 0.00 H new ATOM 1180 N ASP A 75 3.226 -11.801 -16.304 1.00 0.00 N ATOM 1181 CA ASP A 75 3.758 -13.099 -15.795 1.00 0.00 C ATOM 1182 C ASP A 75 2.919 -13.721 -14.612 1.00 0.00 C ATOM 1183 O ASP A 75 2.102 -14.612 -14.873 1.00 0.00 O ATOM 1184 CB ASP A 75 5.265 -12.833 -15.464 1.00 0.00 C ATOM 1185 CG ASP A 75 5.602 -11.667 -14.517 1.00 0.00 C ATOM 1186 OD1 ASP A 75 5.743 -10.525 -15.005 1.00 0.00 O ATOM 1187 OD2 ASP A 75 5.643 -11.880 -13.288 1.00 0.00 O ATOM 0 H ASP A 75 3.860 -11.021 -16.128 1.00 0.00 H new ATOM 0 HA ASP A 75 3.668 -13.882 -16.547 1.00 0.00 H new ATOM 0 HB2 ASP A 75 5.678 -13.744 -15.032 1.00 0.00 H new ATOM 0 HB3 ASP A 75 5.788 -12.661 -16.405 1.00 0.00 H new ATOM 1192 N GLU A 76 3.067 -13.256 -13.357 1.00 0.00 N ATOM 1193 CA GLU A 76 2.307 -13.769 -12.179 1.00 0.00 C ATOM 1194 C GLU A 76 1.610 -12.583 -11.405 1.00 0.00 C ATOM 1195 O GLU A 76 1.579 -11.419 -11.826 1.00 0.00 O ATOM 1196 CB GLU A 76 3.318 -14.657 -11.375 1.00 0.00 C ATOM 1197 CG GLU A 76 2.825 -15.442 -10.118 1.00 0.00 C ATOM 1198 CD GLU A 76 1.460 -16.124 -10.183 1.00 0.00 C ATOM 1199 OE1 GLU A 76 1.349 -17.214 -10.774 1.00 0.00 O ATOM 1200 OE2 GLU A 76 0.487 -15.551 -9.638 1.00 0.00 O ATOM 0 H GLU A 76 3.719 -12.509 -13.120 1.00 0.00 H new ATOM 0 HA GLU A 76 1.456 -14.400 -12.435 1.00 0.00 H new ATOM 0 HB2 GLU A 76 3.737 -15.384 -12.070 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.137 -14.012 -11.056 1.00 0.00 H new ATOM 0 HG2 GLU A 76 3.568 -16.206 -9.890 1.00 0.00 H new ATOM 0 HG3 GLU A 76 2.811 -14.749 -9.277 1.00 0.00 H new ATOM 1207 N THR A 77 1.030 -12.898 -10.242 1.00 0.00 N ATOM 1208 CA THR A 77 0.205 -11.977 -9.417 1.00 0.00 C ATOM 1209 C THR A 77 1.085 -10.924 -8.667 1.00 0.00 C ATOM 1210 O THR A 77 2.137 -11.222 -8.091 1.00 0.00 O ATOM 1211 CB THR A 77 -0.618 -12.841 -8.411 1.00 0.00 C ATOM 1212 OG1 THR A 77 -1.248 -13.965 -9.040 1.00 0.00 O ATOM 1213 CG2 THR A 77 -1.753 -12.044 -7.751 1.00 0.00 C ATOM 0 H THR A 77 1.118 -13.826 -9.827 1.00 0.00 H new ATOM 0 HA THR A 77 -0.465 -11.410 -10.063 1.00 0.00 H new ATOM 0 HB THR A 77 0.116 -13.166 -7.674 1.00 0.00 H new ATOM 0 HG1 THR A 77 -0.689 -14.761 -8.922 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.296 -12.689 -7.060 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.334 -11.198 -7.205 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.435 -11.679 -8.519 1.00 0.00 H new ATOM 1221 N ARG A 78 0.609 -9.670 -8.687 1.00 0.00 N ATOM 1222 CA ARG A 78 1.355 -8.501 -8.156 1.00 0.00 C ATOM 1223 C ARG A 78 0.434 -7.509 -7.374 1.00 0.00 C ATOM 1224 O ARG A 78 -0.786 -7.451 -7.569 1.00 0.00 O ATOM 1225 CB ARG A 78 1.965 -7.870 -9.448 1.00 0.00 C ATOM 1226 CG ARG A 78 2.938 -6.678 -9.308 1.00 0.00 C ATOM 1227 CD ARG A 78 3.391 -6.210 -10.707 1.00 0.00 C ATOM 1228 NE ARG A 78 4.221 -4.977 -10.669 1.00 0.00 N ATOM 1229 CZ ARG A 78 3.748 -3.732 -10.666 1.00 0.00 C ATOM 1230 NH1 ARG A 78 2.491 -3.421 -10.486 1.00 0.00 N ATOM 1231 NH2 ARG A 78 4.579 -2.761 -10.851 1.00 0.00 N ATOM 0 H ARG A 78 -0.305 -9.429 -9.071 1.00 0.00 H new ATOM 0 HA ARG A 78 2.110 -8.772 -7.418 1.00 0.00 H new ATOM 0 HB2 ARG A 78 2.488 -8.661 -9.986 1.00 0.00 H new ATOM 0 HB3 ARG A 78 1.137 -7.548 -10.080 1.00 0.00 H new ATOM 0 HG2 ARG A 78 2.451 -5.858 -8.780 1.00 0.00 H new ATOM 0 HG3 ARG A 78 3.804 -6.970 -8.714 1.00 0.00 H new ATOM 0 HD2 ARG A 78 3.959 -7.009 -11.184 1.00 0.00 H new ATOM 0 HD3 ARG A 78 2.512 -6.030 -11.326 1.00 0.00 H new ATOM 0 HE ARG A 78 5.234 -5.094 -10.643 1.00 0.00 H new ATOM 0 HH11 ARG A 78 1.800 -4.156 -10.335 1.00 0.00 H new ATOM 0 HH12 ARG A 78 2.201 -2.443 -10.496 1.00 0.00 H new ATOM 0 HH21 ARG A 78 5.570 -2.958 -10.994 1.00 0.00 H new ATOM 0 HH22 ARG A 78 4.245 -1.797 -10.854 1.00 0.00 H new ATOM 1245 N LEU A 79 1.034 -6.688 -6.488 1.00 0.00 N ATOM 1246 CA LEU A 79 0.309 -5.566 -5.817 1.00 0.00 C ATOM 1247 C LEU A 79 0.146 -4.451 -6.910 1.00 0.00 C ATOM 1248 O LEU A 79 1.112 -3.844 -7.390 1.00 0.00 O ATOM 1249 CB LEU A 79 1.121 -5.120 -4.584 1.00 0.00 C ATOM 1250 CG LEU A 79 0.472 -4.062 -3.645 1.00 0.00 C ATOM 1251 CD1 LEU A 79 0.847 -4.278 -2.166 1.00 0.00 C ATOM 1252 CD2 LEU A 79 0.842 -2.623 -4.032 1.00 0.00 C ATOM 0 H LEU A 79 2.013 -6.772 -6.215 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.678 -5.837 -5.441 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.345 -6.006 -3.990 1.00 0.00 H new ATOM 0 HB3 LEU A 79 2.073 -4.721 -4.934 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.602 -4.202 -3.769 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.368 -3.514 -1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.509 -5.264 -1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.929 -4.210 -2.051 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.362 -1.927 -3.344 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.924 -2.499 -3.979 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.503 -2.421 -5.048 1.00 0.00 H new ATOM 1264 N GLN A 80 -1.102 -4.284 -7.337 1.00 0.00 N ATOM 1265 CA GLN A 80 -1.462 -3.455 -8.520 1.00 0.00 C ATOM 1266 C GLN A 80 -2.583 -2.404 -8.221 1.00 0.00 C ATOM 1267 O GLN A 80 -3.692 -2.701 -7.743 1.00 0.00 O ATOM 1268 CB GLN A 80 -1.892 -4.454 -9.629 1.00 0.00 C ATOM 1269 CG GLN A 80 -1.931 -3.893 -11.076 1.00 0.00 C ATOM 1270 CD GLN A 80 -0.608 -3.982 -11.845 1.00 0.00 C ATOM 1271 OE1 GLN A 80 0.148 -4.948 -11.757 1.00 0.00 O ATOM 1272 NE2 GLN A 80 -0.286 -3.000 -12.652 1.00 0.00 N ATOM 0 H GLN A 80 -1.907 -4.715 -6.882 1.00 0.00 H new ATOM 0 HA GLN A 80 -0.607 -2.853 -8.829 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -1.209 -5.304 -9.609 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -2.883 -4.835 -9.382 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -2.696 -4.430 -11.637 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -2.240 -2.849 -11.036 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -0.899 -2.190 -12.739 1.00 0.00 H new ATOM 0 HE22 GLN A 80 0.578 -3.046 -13.192 1.00 0.00 H new ATOM 1281 N LEU A 81 -2.241 -1.161 -8.595 1.00 0.00 N ATOM 1282 CA LEU A 81 -3.079 0.042 -8.394 1.00 0.00 C ATOM 1283 C LEU A 81 -3.647 0.540 -9.765 1.00 0.00 C ATOM 1284 O LEU A 81 -2.874 0.972 -10.628 1.00 0.00 O ATOM 1285 CB LEU A 81 -2.158 1.120 -7.737 1.00 0.00 C ATOM 1286 CG LEU A 81 -1.854 1.059 -6.214 1.00 0.00 C ATOM 1287 CD1 LEU A 81 -1.201 -0.237 -5.713 1.00 0.00 C ATOM 1288 CD2 LEU A 81 -0.933 2.232 -5.832 1.00 0.00 C ATOM 0 H LEU A 81 -1.355 -0.955 -9.056 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.936 -0.169 -7.755 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -1.202 1.092 -8.260 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -2.603 2.094 -7.940 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.832 1.110 -5.735 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.035 -0.169 -4.638 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.857 -1.081 -5.926 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.247 -0.383 -6.219 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -0.718 2.193 -4.764 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -0.001 2.161 -6.393 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.427 3.174 -6.068 1.00 0.00 H new ATOM 1300 N GLU A 82 -4.976 0.504 -9.985 1.00 0.00 N ATOM 1301 CA GLU A 82 -5.594 1.000 -11.257 1.00 0.00 C ATOM 1302 C GLU A 82 -5.834 2.553 -11.236 1.00 0.00 C ATOM 1303 O GLU A 82 -6.148 3.131 -10.194 1.00 0.00 O ATOM 1304 CB GLU A 82 -6.905 0.190 -11.424 1.00 0.00 C ATOM 1305 CG GLU A 82 -7.669 0.366 -12.758 1.00 0.00 C ATOM 1306 CD GLU A 82 -8.856 -0.575 -12.885 1.00 0.00 C ATOM 1307 OE1 GLU A 82 -8.671 -1.703 -13.388 1.00 0.00 O ATOM 1308 OE2 GLU A 82 -9.974 -0.191 -12.484 1.00 0.00 O ATOM 0 H GLU A 82 -5.649 0.141 -9.310 1.00 0.00 H new ATOM 0 HA GLU A 82 -4.932 0.848 -12.109 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -6.668 -0.867 -11.305 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.577 0.460 -10.609 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.017 1.396 -12.839 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -6.985 0.195 -13.589 1.00 0.00 H new ATOM 1315 N ALA A 83 -5.759 3.247 -12.390 1.00 0.00 N ATOM 1316 CA ALA A 83 -5.931 4.730 -12.440 1.00 0.00 C ATOM 1317 C ALA A 83 -7.428 5.143 -12.255 1.00 0.00 C ATOM 1318 O ALA A 83 -8.294 4.776 -13.056 1.00 0.00 O ATOM 1319 CB ALA A 83 -5.389 5.203 -13.802 1.00 0.00 C ATOM 0 H ALA A 83 -5.582 2.817 -13.298 1.00 0.00 H new ATOM 0 HA ALA A 83 -5.384 5.200 -11.623 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.496 6.285 -13.880 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.336 4.935 -13.887 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.951 4.724 -14.604 1.00 0.00 H new ATOM 1325 N VAL A 84 -7.726 5.889 -11.171 1.00 0.00 N ATOM 1326 CA VAL A 84 -9.135 6.235 -10.803 1.00 0.00 C ATOM 1327 C VAL A 84 -9.283 7.707 -10.285 1.00 0.00 C ATOM 1328 O VAL A 84 -8.380 8.298 -9.683 1.00 0.00 O ATOM 1329 CB VAL A 84 -9.632 5.165 -9.757 1.00 0.00 C ATOM 1330 CG1 VAL A 84 -8.984 5.211 -8.351 1.00 0.00 C ATOM 1331 CG2 VAL A 84 -11.168 5.142 -9.587 1.00 0.00 C ATOM 0 H VAL A 84 -7.024 6.265 -10.534 1.00 0.00 H new ATOM 0 HA VAL A 84 -9.766 6.200 -11.691 1.00 0.00 H new ATOM 0 HB VAL A 84 -9.287 4.244 -10.227 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -9.411 4.426 -7.728 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -7.909 5.058 -8.441 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -9.176 6.182 -7.894 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -11.442 4.384 -8.853 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -11.511 6.118 -9.245 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -11.636 4.908 -10.543 1.00 0.00 H new ATOM 1341 N ASN A 85 -10.465 8.293 -10.538 1.00 0.00 N ATOM 1342 CA ASN A 85 -10.839 9.656 -10.068 1.00 0.00 C ATOM 1343 C ASN A 85 -12.148 9.582 -9.202 1.00 0.00 C ATOM 1344 O ASN A 85 -13.072 8.821 -9.511 1.00 0.00 O ATOM 1345 CB ASN A 85 -10.968 10.603 -11.300 1.00 0.00 C ATOM 1346 CG ASN A 85 -12.109 10.371 -12.307 1.00 0.00 C ATOM 1347 OD1 ASN A 85 -13.203 10.905 -12.173 1.00 0.00 O ATOM 1348 ND2 ASN A 85 -11.893 9.600 -13.346 1.00 0.00 N ATOM 0 H ASN A 85 -11.201 7.838 -11.078 1.00 0.00 H new ATOM 0 HA ASN A 85 -10.065 10.069 -9.422 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -11.065 11.621 -10.923 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -10.029 10.555 -11.851 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -12.632 9.450 -14.032 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -10.986 9.150 -13.468 1.00 0.00 H new ATOM 1355 N ILE A 86 -12.230 10.364 -8.106 1.00 0.00 N ATOM 1356 CA ILE A 86 -13.444 10.393 -7.229 1.00 0.00 C ATOM 1357 C ILE A 86 -14.464 11.454 -7.786 1.00 0.00 C ATOM 1358 O ILE A 86 -14.157 12.646 -7.881 1.00 0.00 O ATOM 1359 CB ILE A 86 -13.002 10.618 -5.727 1.00 0.00 C ATOM 1360 CG1 ILE A 86 -14.148 10.280 -4.727 1.00 0.00 C ATOM 1361 CG2 ILE A 86 -12.533 12.066 -5.413 1.00 0.00 C ATOM 1362 CD1 ILE A 86 -14.507 8.786 -4.625 1.00 0.00 C ATOM 0 H ILE A 86 -11.481 10.984 -7.799 1.00 0.00 H new ATOM 0 HA ILE A 86 -13.972 9.440 -7.241 1.00 0.00 H new ATOM 0 HB ILE A 86 -12.158 9.940 -5.602 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -13.863 10.638 -3.738 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -15.040 10.833 -5.021 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -12.247 12.136 -4.363 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -11.677 12.315 -6.040 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -13.346 12.764 -5.616 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -15.314 8.654 -3.904 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -14.828 8.422 -5.601 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -13.633 8.223 -4.298 1.00 0.00 H new ATOM 1374 N THR A 87 -15.669 11.007 -8.170 1.00 0.00 N ATOM 1375 CA THR A 87 -16.757 11.909 -8.691 1.00 0.00 C ATOM 1376 C THR A 87 -18.031 11.968 -7.776 1.00 0.00 C ATOM 1377 O THR A 87 -18.658 13.027 -7.677 1.00 0.00 O ATOM 1378 CB THR A 87 -17.172 11.422 -10.138 1.00 0.00 C ATOM 1379 OG1 THR A 87 -18.397 12.035 -10.555 1.00 0.00 O ATOM 1380 CG2 THR A 87 -17.424 9.910 -10.337 1.00 0.00 C ATOM 0 H THR A 87 -15.935 10.023 -8.136 1.00 0.00 H new ATOM 0 HA THR A 87 -16.348 12.919 -8.708 1.00 0.00 H new ATOM 0 HB THR A 87 -16.291 11.704 -10.714 1.00 0.00 H new ATOM 0 HG1 THR A 87 -19.136 11.403 -10.435 1.00 0.00 H new ATOM 0 HG21 THR A 87 -17.700 9.721 -11.374 1.00 0.00 H new ATOM 0 HG22 THR A 87 -16.517 9.355 -10.096 1.00 0.00 H new ATOM 0 HG23 THR A 87 -18.233 9.587 -9.682 1.00 0.00 H new ATOM 1388 N ASP A 88 -18.349 10.887 -7.044 1.00 0.00 N ATOM 1389 CA ASP A 88 -19.623 10.748 -6.285 1.00 0.00 C ATOM 1390 C ASP A 88 -19.404 10.045 -4.893 1.00 0.00 C ATOM 1391 O ASP A 88 -20.167 9.151 -4.508 1.00 0.00 O ATOM 1392 CB ASP A 88 -20.567 9.954 -7.252 1.00 0.00 C ATOM 1393 CG ASP A 88 -21.122 10.709 -8.474 1.00 0.00 C ATOM 1394 OD1 ASP A 88 -20.360 10.969 -9.439 1.00 0.00 O ATOM 1395 OD2 ASP A 88 -22.329 11.029 -8.475 1.00 0.00 O ATOM 0 H ASP A 88 -17.734 10.078 -6.956 1.00 0.00 H new ATOM 0 HA ASP A 88 -20.061 11.709 -6.014 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -20.023 9.081 -7.613 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -21.412 9.585 -6.671 1.00 0.00 H new ATOM 1400 N LEU A 89 -18.346 10.439 -4.133 1.00 0.00 N ATOM 1401 CA LEU A 89 -17.978 9.894 -2.774 1.00 0.00 C ATOM 1402 C LEU A 89 -18.137 8.335 -2.543 1.00 0.00 C ATOM 1403 O LEU A 89 -18.405 7.875 -1.426 1.00 0.00 O ATOM 1404 CB LEU A 89 -18.806 10.697 -1.716 1.00 0.00 C ATOM 1405 CG LEU A 89 -18.609 12.234 -1.605 1.00 0.00 C ATOM 1406 CD1 LEU A 89 -19.592 12.818 -0.573 1.00 0.00 C ATOM 1407 CD2 LEU A 89 -17.171 12.652 -1.245 1.00 0.00 C ATOM 0 H LEU A 89 -17.701 11.164 -4.447 1.00 0.00 H new ATOM 0 HA LEU A 89 -16.901 10.030 -2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -19.861 10.516 -1.919 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.592 10.268 -0.737 1.00 0.00 H new ATOM 0 HG LEU A 89 -18.810 12.638 -2.597 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -19.447 13.896 -0.502 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -20.615 12.610 -0.886 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -19.411 12.362 0.400 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -17.112 13.739 -1.186 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -16.897 12.221 -0.282 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -16.485 12.293 -2.012 1.00 0.00 H new ATOM 1419 N SER A 90 -17.859 7.521 -3.575 1.00 0.00 N ATOM 1420 CA SER A 90 -18.116 6.056 -3.562 1.00 0.00 C ATOM 1421 C SER A 90 -16.893 5.208 -3.087 1.00 0.00 C ATOM 1422 O SER A 90 -15.727 5.535 -3.342 1.00 0.00 O ATOM 1423 CB SER A 90 -18.564 5.712 -5.001 1.00 0.00 C ATOM 1424 OG SER A 90 -19.811 6.347 -5.314 1.00 0.00 O ATOM 0 H SER A 90 -17.449 7.853 -4.448 1.00 0.00 H new ATOM 0 HA SER A 90 -18.883 5.803 -2.830 1.00 0.00 H new ATOM 0 HB2 SER A 90 -17.800 6.032 -5.710 1.00 0.00 H new ATOM 0 HB3 SER A 90 -18.665 4.632 -5.106 1.00 0.00 H new ATOM 0 HG SER A 90 -19.797 7.272 -4.990 1.00 0.00 H new ATOM 1430 N GLU A 91 -17.196 4.120 -2.361 1.00 0.00 N ATOM 1431 CA GLU A 91 -16.190 3.224 -1.721 1.00 0.00 C ATOM 1432 C GLU A 91 -16.767 1.773 -1.653 1.00 0.00 C ATOM 1433 O GLU A 91 -17.796 1.527 -1.012 1.00 0.00 O ATOM 1434 CB GLU A 91 -15.807 3.762 -0.299 1.00 0.00 C ATOM 1435 CG GLU A 91 -16.948 4.262 0.646 1.00 0.00 C ATOM 1436 CD GLU A 91 -16.521 5.179 1.777 1.00 0.00 C ATOM 1437 OE1 GLU A 91 -16.471 6.413 1.568 1.00 0.00 O ATOM 1438 OE2 GLU A 91 -16.248 4.686 2.888 1.00 0.00 O ATOM 0 H GLU A 91 -18.158 3.824 -2.193 1.00 0.00 H new ATOM 0 HA GLU A 91 -15.277 3.206 -2.316 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -15.271 2.969 0.221 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -15.105 4.585 -0.435 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -17.690 4.784 0.042 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -17.443 3.392 1.077 1.00 0.00 H new ATOM 1445 N ASN A 92 -16.095 0.793 -2.294 1.00 0.00 N ATOM 1446 CA ASN A 92 -16.576 -0.620 -2.320 1.00 0.00 C ATOM 1447 C ASN A 92 -16.154 -1.417 -1.034 1.00 0.00 C ATOM 1448 O ASN A 92 -15.263 -2.271 -1.058 1.00 0.00 O ATOM 1449 CB ASN A 92 -16.042 -1.247 -3.643 1.00 0.00 C ATOM 1450 CG ASN A 92 -16.619 -2.631 -3.983 1.00 0.00 C ATOM 1451 OD1 ASN A 92 -17.683 -2.760 -4.577 1.00 0.00 O ATOM 1452 ND2 ASN A 92 -15.959 -3.699 -3.601 1.00 0.00 N ATOM 0 H ASN A 92 -15.222 0.945 -2.800 1.00 0.00 H new ATOM 0 HA ASN A 92 -17.665 -0.663 -2.305 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -16.262 -0.566 -4.465 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -14.957 -1.328 -3.577 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -16.332 -4.627 -3.799 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -15.073 -3.601 -3.106 1.00 0.00 H new ATOM 1459 N ARG A 93 -16.877 -1.200 0.077 1.00 0.00 N ATOM 1460 CA ARG A 93 -16.634 -1.926 1.365 1.00 0.00 C ATOM 1461 C ARG A 93 -17.529 -3.220 1.458 1.00 0.00 C ATOM 1462 O ARG A 93 -18.248 -3.435 2.438 1.00 0.00 O ATOM 1463 CB ARG A 93 -16.902 -0.884 2.497 1.00 0.00 C ATOM 1464 CG ARG A 93 -15.852 0.256 2.599 1.00 0.00 C ATOM 1465 CD ARG A 93 -16.282 1.532 3.340 1.00 0.00 C ATOM 1466 NE ARG A 93 -16.497 1.357 4.804 1.00 0.00 N ATOM 1467 CZ ARG A 93 -16.722 2.366 5.650 1.00 0.00 C ATOM 1468 NH1 ARG A 93 -16.706 3.638 5.313 1.00 0.00 N ATOM 1469 NH2 ARG A 93 -16.980 2.086 6.891 1.00 0.00 N ATOM 0 H ARG A 93 -17.642 -0.527 0.123 1.00 0.00 H new ATOM 0 HA ARG A 93 -15.614 -2.300 1.451 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -17.884 -0.440 2.337 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -16.941 -1.409 3.452 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -14.966 -0.142 3.094 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -15.554 0.535 1.588 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -15.522 2.299 3.187 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -17.204 1.903 2.893 1.00 0.00 H new ATOM 0 HE ARG A 93 -16.471 0.410 5.183 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -16.512 3.908 4.349 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -16.888 4.354 6.016 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -17.007 1.114 7.200 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -17.155 2.838 7.558 1.00 0.00 H new ATOM 1483 N LYS A 94 -17.476 -4.101 0.430 1.00 0.00 N ATOM 1484 CA LYS A 94 -18.349 -5.305 0.319 1.00 0.00 C ATOM 1485 C LYS A 94 -17.810 -6.291 -0.777 1.00 0.00 C ATOM 1486 O LYS A 94 -17.476 -5.863 -1.886 1.00 0.00 O ATOM 1487 CB LYS A 94 -19.787 -4.809 -0.048 1.00 0.00 C ATOM 1488 CG LYS A 94 -20.919 -5.860 -0.013 1.00 0.00 C ATOM 1489 CD LYS A 94 -22.281 -5.240 -0.394 1.00 0.00 C ATOM 1490 CE LYS A 94 -23.425 -6.269 -0.363 1.00 0.00 C ATOM 1491 NZ LYS A 94 -24.711 -5.613 -0.729 1.00 0.00 N ATOM 0 H LYS A 94 -16.826 -4.000 -0.350 1.00 0.00 H new ATOM 0 HA LYS A 94 -18.360 -5.850 1.263 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -20.052 -4.002 0.635 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -19.753 -4.381 -1.050 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -20.683 -6.673 -0.700 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -20.982 -6.294 0.985 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -22.511 -4.425 0.293 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -22.213 -4.807 -1.392 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -23.212 -7.083 -1.056 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -23.502 -6.709 0.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -25.478 -6.315 -0.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -24.918 -4.852 -0.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -24.637 -5.213 -1.686 1.00 0.00 H new ATOM 1505 N GLN A 95 -17.807 -7.612 -0.476 1.00 0.00 N ATOM 1506 CA GLN A 95 -17.385 -8.727 -1.398 1.00 0.00 C ATOM 1507 C GLN A 95 -15.852 -8.743 -1.743 1.00 0.00 C ATOM 1508 O GLN A 95 -15.264 -7.736 -2.148 1.00 0.00 O ATOM 1509 CB GLN A 95 -18.219 -8.746 -2.725 1.00 0.00 C ATOM 1510 CG GLN A 95 -19.682 -9.244 -2.604 1.00 0.00 C ATOM 1511 CD GLN A 95 -19.829 -10.755 -2.381 1.00 0.00 C ATOM 1512 OE1 GLN A 95 -19.394 -11.569 -3.192 1.00 0.00 O ATOM 1513 NE2 GLN A 95 -20.435 -11.188 -1.303 1.00 0.00 N ATOM 0 H GLN A 95 -18.104 -7.955 0.437 1.00 0.00 H new ATOM 0 HA GLN A 95 -17.591 -9.631 -0.825 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -18.233 -7.736 -3.136 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -17.700 -9.377 -3.447 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -20.162 -8.720 -1.778 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -20.221 -8.970 -3.511 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -20.801 -10.523 -0.622 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -20.541 -12.190 -1.145 1.00 0.00 H new ATOM 1522 N ASP A 96 -15.233 -9.938 -1.643 1.00 0.00 N ATOM 1523 CA ASP A 96 -13.783 -10.136 -1.924 1.00 0.00 C ATOM 1524 C ASP A 96 -13.520 -11.465 -2.712 1.00 0.00 C ATOM 1525 O ASP A 96 -14.083 -12.527 -2.422 1.00 0.00 O ATOM 1526 CB ASP A 96 -13.035 -10.166 -0.560 1.00 0.00 C ATOM 1527 CG ASP A 96 -11.501 -10.114 -0.604 1.00 0.00 C ATOM 1528 OD1 ASP A 96 -10.856 -10.784 -1.440 1.00 0.00 O ATOM 1529 OD2 ASP A 96 -10.928 -9.386 0.220 1.00 0.00 O ATOM 0 H ASP A 96 -15.716 -10.793 -1.367 1.00 0.00 H new ATOM 0 HA ASP A 96 -13.422 -9.319 -2.549 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -13.385 -9.324 0.037 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -13.328 -11.074 -0.033 1.00 0.00 H new ATOM 1534 N LYS A 97 -12.666 -11.369 -3.741 1.00 0.00 N ATOM 1535 CA LYS A 97 -12.113 -12.549 -4.478 1.00 0.00 C ATOM 1536 C LYS A 97 -10.583 -12.292 -4.814 1.00 0.00 C ATOM 1537 O LYS A 97 -10.141 -12.492 -5.949 1.00 0.00 O ATOM 1538 CB LYS A 97 -13.041 -12.834 -5.705 1.00 0.00 C ATOM 1539 CG LYS A 97 -14.152 -13.894 -5.443 1.00 0.00 C ATOM 1540 CD LYS A 97 -15.592 -13.497 -5.843 1.00 0.00 C ATOM 1541 CE LYS A 97 -16.321 -12.646 -4.782 1.00 0.00 C ATOM 1542 NZ LYS A 97 -17.732 -12.419 -5.193 1.00 0.00 N ATOM 0 H LYS A 97 -12.329 -10.475 -4.098 1.00 0.00 H new ATOM 0 HA LYS A 97 -12.115 -13.460 -3.880 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -13.513 -11.901 -6.012 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -12.426 -13.170 -6.540 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -13.888 -14.805 -5.980 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -14.148 -14.137 -4.381 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -15.559 -12.942 -6.780 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -16.170 -14.402 -6.029 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -16.292 -13.151 -3.816 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -15.812 -11.690 -4.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -18.238 -11.918 -4.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -17.753 -11.846 -6.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -18.193 -13.334 -5.371 1.00 0.00 H new ATOM 1556 N ARG A 98 -9.801 -11.946 -3.757 1.00 0.00 N ATOM 1557 CA ARG A 98 -8.344 -11.557 -3.706 1.00 0.00 C ATOM 1558 C ARG A 98 -8.191 -9.977 -3.694 1.00 0.00 C ATOM 1559 O ARG A 98 -7.373 -9.406 -4.418 1.00 0.00 O ATOM 1560 CB ARG A 98 -7.439 -12.308 -4.746 1.00 0.00 C ATOM 1561 CG ARG A 98 -7.220 -11.699 -6.162 1.00 0.00 C ATOM 1562 CD ARG A 98 -6.774 -12.692 -7.246 1.00 0.00 C ATOM 1563 NE ARG A 98 -7.945 -13.540 -7.583 1.00 0.00 N ATOM 1564 CZ ARG A 98 -7.947 -14.568 -8.424 1.00 0.00 C ATOM 1565 NH1 ARG A 98 -6.892 -14.952 -9.098 1.00 0.00 N ATOM 1566 NH2 ARG A 98 -9.059 -15.223 -8.581 1.00 0.00 N ATOM 0 H ARG A 98 -10.204 -11.927 -2.820 1.00 0.00 H new ATOM 0 HA ARG A 98 -7.941 -11.914 -2.758 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -6.457 -12.435 -4.291 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -7.858 -13.305 -4.882 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -8.149 -11.229 -6.484 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -6.473 -10.909 -6.087 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -6.418 -12.161 -8.129 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -5.947 -13.305 -6.888 1.00 0.00 H new ATOM 0 HE ARG A 98 -8.829 -13.312 -7.127 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -6.009 -14.453 -8.991 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -6.953 -15.750 -9.730 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -9.894 -14.942 -8.066 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -9.097 -16.018 -9.219 1.00 0.00 H new ATOM 1580 N PHE A 99 -8.909 -9.258 -2.802 1.00 0.00 N ATOM 1581 CA PHE A 99 -8.946 -7.760 -2.801 1.00 0.00 C ATOM 1582 C PHE A 99 -8.658 -7.037 -1.449 1.00 0.00 C ATOM 1583 O PHE A 99 -8.318 -5.851 -1.563 1.00 0.00 O ATOM 1584 CB PHE A 99 -10.378 -7.360 -3.306 1.00 0.00 C ATOM 1585 CG PHE A 99 -10.625 -7.385 -4.831 1.00 0.00 C ATOM 1586 CD1 PHE A 99 -10.817 -8.595 -5.505 1.00 0.00 C ATOM 1587 CD2 PHE A 99 -10.668 -6.192 -5.561 1.00 0.00 C ATOM 1588 CE1 PHE A 99 -11.008 -8.618 -6.884 1.00 0.00 C ATOM 1589 CE2 PHE A 99 -10.867 -6.210 -6.940 1.00 0.00 C ATOM 1590 CZ PHE A 99 -11.032 -7.425 -7.600 1.00 0.00 C ATOM 0 H PHE A 99 -9.475 -9.683 -2.068 1.00 0.00 H new ATOM 0 HA PHE A 99 -8.125 -7.431 -3.437 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -11.100 -8.028 -2.837 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -10.594 -6.354 -2.946 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -10.817 -9.522 -4.950 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -10.546 -5.248 -5.051 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -11.137 -9.560 -7.397 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -10.893 -5.284 -7.495 1.00 0.00 H new ATOM 0 HZ PHE A 99 -11.179 -7.441 -8.670 1.00 0.00 H new ATOM 1600 N ALA A 100 -8.762 -7.597 -0.214 1.00 0.00 N ATOM 1601 CA ALA A 100 -8.530 -6.778 0.996 1.00 0.00 C ATOM 1602 C ALA A 100 -7.050 -6.887 1.441 1.00 0.00 C ATOM 1603 O ALA A 100 -6.532 -7.966 1.749 1.00 0.00 O ATOM 1604 CB ALA A 100 -9.511 -7.214 2.102 1.00 0.00 C ATOM 0 H ALA A 100 -8.996 -8.574 -0.037 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.718 -5.726 0.779 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -9.343 -6.612 2.995 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -10.535 -7.072 1.757 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -9.350 -8.266 2.337 1.00 0.00 H new ATOM 1610 N PHE A 101 -6.361 -5.737 1.440 1.00 0.00 N ATOM 1611 CA PHE A 101 -4.980 -5.625 1.949 1.00 0.00 C ATOM 1612 C PHE A 101 -5.085 -5.283 3.451 1.00 0.00 C ATOM 1613 O PHE A 101 -5.719 -4.285 3.835 1.00 0.00 O ATOM 1614 CB PHE A 101 -4.107 -4.548 1.268 1.00 0.00 C ATOM 1615 CG PHE A 101 -3.775 -4.781 -0.206 1.00 0.00 C ATOM 1616 CD1 PHE A 101 -2.610 -5.464 -0.563 1.00 0.00 C ATOM 1617 CD2 PHE A 101 -4.591 -4.246 -1.205 1.00 0.00 C ATOM 1618 CE1 PHE A 101 -2.285 -5.633 -1.905 1.00 0.00 C ATOM 1619 CE2 PHE A 101 -4.239 -4.382 -2.541 1.00 0.00 C ATOM 1620 CZ PHE A 101 -3.093 -5.085 -2.893 1.00 0.00 C ATOM 0 H PHE A 101 -6.741 -4.858 1.088 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.487 -6.574 1.738 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.616 -3.588 1.357 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -3.171 -4.465 1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -1.961 -5.861 0.203 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -5.498 -3.725 -0.938 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.402 -6.192 -2.179 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.857 -3.940 -3.309 1.00 0.00 H new ATOM 0 HZ PHE A 101 -2.831 -5.205 -3.934 1.00 0.00 H new ATOM 1630 N ILE A 102 -4.475 -6.149 4.270 1.00 0.00 N ATOM 1631 CA ILE A 102 -4.535 -6.007 5.748 1.00 0.00 C ATOM 1632 C ILE A 102 -3.177 -5.406 6.210 1.00 0.00 C ATOM 1633 O ILE A 102 -2.109 -6.008 6.037 1.00 0.00 O ATOM 1634 CB ILE A 102 -4.865 -7.360 6.494 1.00 0.00 C ATOM 1635 CG1 ILE A 102 -5.972 -8.250 5.846 1.00 0.00 C ATOM 1636 CG2 ILE A 102 -5.270 -7.071 7.965 1.00 0.00 C ATOM 1637 CD1 ILE A 102 -7.359 -7.635 5.576 1.00 0.00 C ATOM 0 H ILE A 102 -3.936 -6.952 3.947 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.360 -5.345 6.012 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.941 -7.934 6.421 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.584 -8.619 4.896 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.116 -9.118 6.490 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.496 -8.010 8.471 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -4.448 -6.571 8.477 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.151 -6.429 7.980 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -8.008 -8.385 5.124 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.796 -7.295 6.515 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -7.256 -6.789 4.897 1.00 0.00 H new ATOM 1649 N ARG A 103 -3.236 -4.201 6.808 1.00 0.00 N ATOM 1650 CA ARG A 103 -2.026 -3.582 7.415 1.00 0.00 C ATOM 1651 C ARG A 103 -1.925 -4.098 8.884 1.00 0.00 C ATOM 1652 O ARG A 103 -2.564 -3.550 9.789 1.00 0.00 O ATOM 1653 CB ARG A 103 -2.113 -2.035 7.373 1.00 0.00 C ATOM 1654 CG ARG A 103 -2.098 -1.380 5.969 1.00 0.00 C ATOM 1655 CD ARG A 103 -1.999 0.155 6.013 1.00 0.00 C ATOM 1656 NE ARG A 103 -3.221 0.761 6.615 1.00 0.00 N ATOM 1657 CZ ARG A 103 -3.274 1.958 7.200 1.00 0.00 C ATOM 1658 NH1 ARG A 103 -2.235 2.720 7.410 1.00 0.00 N ATOM 1659 NH2 ARG A 103 -4.433 2.426 7.531 1.00 0.00 N ATOM 0 H ARG A 103 -4.085 -3.641 6.887 1.00 0.00 H new ATOM 0 HA ARG A 103 -1.134 -3.861 6.853 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -3.028 -1.731 7.882 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -1.279 -1.631 7.947 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -1.256 -1.775 5.401 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -3.005 -1.663 5.434 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -1.123 0.448 6.591 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -1.859 0.541 5.003 1.00 0.00 H new ATOM 0 HE ARG A 103 -4.083 0.218 6.576 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -1.308 2.409 7.120 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -2.350 3.626 7.864 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.275 1.882 7.343 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -4.505 3.339 7.980 1.00 0.00 H new ATOM 1673 N SER A 104 -1.140 -5.164 9.127 1.00 0.00 N ATOM 1674 CA SER A 104 -0.974 -5.728 10.498 1.00 0.00 C ATOM 1675 C SER A 104 0.101 -4.928 11.306 1.00 0.00 C ATOM 1676 O SER A 104 1.229 -5.388 11.514 1.00 0.00 O ATOM 1677 CB SER A 104 -0.638 -7.227 10.319 1.00 0.00 C ATOM 1678 OG SER A 104 -0.349 -7.833 11.578 1.00 0.00 O ATOM 0 H SER A 104 -0.611 -5.655 8.406 1.00 0.00 H new ATOM 0 HA SER A 104 -1.883 -5.636 11.092 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.477 -7.739 9.847 1.00 0.00 H new ATOM 0 HB3 SER A 104 0.218 -7.336 9.652 1.00 0.00 H new ATOM 0 HG SER A 104 -0.140 -8.781 11.444 1.00 0.00 H new ATOM 1684 N ASP A 105 -0.261 -3.713 11.763 1.00 0.00 N ATOM 1685 CA ASP A 105 0.663 -2.824 12.507 1.00 0.00 C ATOM 1686 C ASP A 105 0.752 -3.164 14.030 1.00 0.00 C ATOM 1687 O ASP A 105 -0.232 -3.367 14.747 1.00 0.00 O ATOM 1688 CB ASP A 105 0.249 -1.348 12.239 1.00 0.00 C ATOM 1689 CG ASP A 105 -1.078 -0.822 12.788 1.00 0.00 C ATOM 1690 OD1 ASP A 105 -2.109 -0.976 12.100 1.00 0.00 O ATOM 1691 OD2 ASP A 105 -1.078 -0.221 13.883 1.00 0.00 O ATOM 0 H ASP A 105 -1.193 -3.320 11.630 1.00 0.00 H new ATOM 0 HA ASP A 105 1.677 -2.984 12.141 1.00 0.00 H new ATOM 0 HB2 ASP A 105 1.040 -0.711 12.634 1.00 0.00 H new ATOM 0 HB3 ASP A 105 0.234 -1.205 11.159 1.00 0.00 H new ATOM 1696 N SER A 106 2.002 -3.224 14.500 1.00 0.00 N ATOM 1697 CA SER A 106 2.341 -3.411 15.940 1.00 0.00 C ATOM 1698 C SER A 106 2.572 -2.056 16.711 1.00 0.00 C ATOM 1699 O SER A 106 3.291 -2.027 17.714 1.00 0.00 O ATOM 1700 CB SER A 106 3.617 -4.301 15.930 1.00 0.00 C ATOM 1701 OG SER A 106 4.743 -3.667 15.302 1.00 0.00 O ATOM 0 H SER A 106 2.822 -3.145 13.899 1.00 0.00 H new ATOM 0 HA SER A 106 1.514 -3.873 16.480 1.00 0.00 H new ATOM 0 HB2 SER A 106 3.879 -4.560 16.956 1.00 0.00 H new ATOM 0 HB3 SER A 106 3.397 -5.234 15.411 1.00 0.00 H new ATOM 0 HG SER A 106 4.470 -3.300 14.435 1.00 0.00 H new ATOM 1707 N GLY A 107 1.942 -0.943 16.276 1.00 0.00 N ATOM 1708 CA GLY A 107 2.218 0.417 16.797 1.00 0.00 C ATOM 1709 C GLY A 107 3.343 1.045 15.923 1.00 0.00 C ATOM 1710 O GLY A 107 2.997 1.594 14.872 1.00 0.00 O ATOM 0 H GLY A 107 1.225 -0.961 15.551 1.00 0.00 H new ATOM 0 HA2 GLY A 107 1.318 1.030 16.758 1.00 0.00 H new ATOM 0 HA3 GLY A 107 2.527 0.370 17.841 1.00 0.00 H new ATOM 1714 N PRO A 108 4.672 0.936 16.230 1.00 0.00 N ATOM 1715 CA PRO A 108 5.743 1.484 15.352 1.00 0.00 C ATOM 1716 C PRO A 108 6.002 0.775 13.975 1.00 0.00 C ATOM 1717 O PRO A 108 6.437 1.475 13.060 1.00 0.00 O ATOM 1718 CB PRO A 108 6.993 1.406 16.262 1.00 0.00 C ATOM 1719 CG PRO A 108 6.477 1.182 17.682 1.00 0.00 C ATOM 1720 CD PRO A 108 5.201 0.367 17.486 1.00 0.00 C ATOM 0 HA PRO A 108 5.454 2.477 15.009 1.00 0.00 H new ATOM 0 HB2 PRO A 108 7.648 0.591 15.953 1.00 0.00 H new ATOM 0 HB3 PRO A 108 7.576 2.325 16.201 1.00 0.00 H new ATOM 0 HG2 PRO A 108 7.204 0.645 18.291 1.00 0.00 H new ATOM 0 HG3 PRO A 108 6.274 2.127 18.187 1.00 0.00 H new ATOM 0 HD2 PRO A 108 5.406 -0.700 17.397 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.505 0.490 18.316 1.00 0.00 H new ATOM 1728 N THR A 109 5.809 -0.560 13.813 1.00 0.00 N ATOM 1729 CA THR A 109 6.133 -1.286 12.532 1.00 0.00 C ATOM 1730 C THR A 109 4.970 -2.203 12.002 1.00 0.00 C ATOM 1731 O THR A 109 4.238 -2.817 12.788 1.00 0.00 O ATOM 1732 CB THR A 109 7.421 -2.172 12.690 1.00 0.00 C ATOM 1733 OG1 THR A 109 7.268 -3.120 13.741 1.00 0.00 O ATOM 1734 CG2 THR A 109 8.709 -1.388 12.997 1.00 0.00 C ATOM 0 H THR A 109 5.433 -1.164 14.544 1.00 0.00 H new ATOM 0 HA THR A 109 6.293 -0.493 11.801 1.00 0.00 H new ATOM 0 HB THR A 109 7.526 -2.647 11.714 1.00 0.00 H new ATOM 0 HG1 THR A 109 6.372 -3.037 14.128 1.00 0.00 H new ATOM 0 HG21 THR A 109 9.544 -2.082 13.089 1.00 0.00 H new ATOM 0 HG22 THR A 109 8.909 -0.685 12.188 1.00 0.00 H new ATOM 0 HG23 THR A 109 8.588 -0.841 13.932 1.00 0.00 H new ATOM 1742 N THR A 110 4.851 -2.331 10.656 1.00 0.00 N ATOM 1743 CA THR A 110 3.792 -3.154 9.982 1.00 0.00 C ATOM 1744 C THR A 110 4.339 -4.080 8.812 1.00 0.00 C ATOM 1745 O THR A 110 5.542 -4.297 8.616 1.00 0.00 O ATOM 1746 CB THR A 110 2.651 -2.155 9.537 1.00 0.00 C ATOM 1747 OG1 THR A 110 1.433 -2.873 9.349 1.00 0.00 O ATOM 1748 CG2 THR A 110 2.877 -1.429 8.204 1.00 0.00 C ATOM 0 H THR A 110 5.482 -1.870 10.000 1.00 0.00 H new ATOM 0 HA THR A 110 3.390 -3.888 10.680 1.00 0.00 H new ATOM 0 HB THR A 110 2.634 -1.416 10.338 1.00 0.00 H new ATOM 0 HG1 THR A 110 0.726 -2.252 9.075 1.00 0.00 H new ATOM 0 HG21 THR A 110 2.032 -0.771 8.000 1.00 0.00 H new ATOM 0 HG22 THR A 110 3.791 -0.838 8.262 1.00 0.00 H new ATOM 0 HG23 THR A 110 2.968 -2.161 7.402 1.00 0.00 H new ATOM 1756 N SER A 111 3.352 -4.677 8.117 1.00 0.00 N ATOM 1757 CA SER A 111 3.490 -5.633 6.975 1.00 0.00 C ATOM 1758 C SER A 111 2.314 -5.443 5.941 1.00 0.00 C ATOM 1759 O SER A 111 1.298 -4.806 6.257 1.00 0.00 O ATOM 1760 CB SER A 111 3.502 -7.082 7.535 1.00 0.00 C ATOM 1761 OG SER A 111 2.338 -7.404 8.305 1.00 0.00 O ATOM 0 H SER A 111 2.373 -4.502 8.343 1.00 0.00 H new ATOM 0 HA SER A 111 4.424 -5.438 6.448 1.00 0.00 H new ATOM 0 HB2 SER A 111 3.585 -7.784 6.705 1.00 0.00 H new ATOM 0 HB3 SER A 111 4.388 -7.216 8.156 1.00 0.00 H new ATOM 0 HG SER A 111 1.549 -7.399 7.723 1.00 0.00 H new ATOM 1767 N PHE A 112 2.439 -5.946 4.686 1.00 0.00 N ATOM 1768 CA PHE A 112 1.346 -5.809 3.667 1.00 0.00 C ATOM 1769 C PHE A 112 0.756 -7.207 3.305 1.00 0.00 C ATOM 1770 O PHE A 112 1.272 -7.932 2.445 1.00 0.00 O ATOM 1771 CB PHE A 112 1.902 -5.051 2.417 1.00 0.00 C ATOM 1772 CG PHE A 112 1.928 -3.499 2.394 1.00 0.00 C ATOM 1773 CD1 PHE A 112 1.472 -2.678 3.439 1.00 0.00 C ATOM 1774 CD2 PHE A 112 2.414 -2.894 1.229 1.00 0.00 C ATOM 1775 CE1 PHE A 112 1.515 -1.290 3.322 1.00 0.00 C ATOM 1776 CE2 PHE A 112 2.451 -1.506 1.111 1.00 0.00 C ATOM 1777 CZ PHE A 112 2.004 -0.708 2.157 1.00 0.00 C ATOM 0 H PHE A 112 3.265 -6.442 4.352 1.00 0.00 H new ATOM 0 HA PHE A 112 0.524 -5.223 4.077 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.925 -5.394 2.259 1.00 0.00 H new ATOM 0 HB3 PHE A 112 1.320 -5.378 1.555 1.00 0.00 H new ATOM 0 HD1 PHE A 112 1.084 -3.127 4.342 1.00 0.00 H new ATOM 0 HD2 PHE A 112 2.764 -3.509 0.413 1.00 0.00 H new ATOM 0 HE1 PHE A 112 1.169 -0.668 4.134 1.00 0.00 H new ATOM 0 HE2 PHE A 112 2.827 -1.051 0.207 1.00 0.00 H new ATOM 0 HZ PHE A 112 2.036 0.368 2.065 1.00 0.00 H new ATOM 1787 N GLU A 113 -0.383 -7.539 3.938 1.00 0.00 N ATOM 1788 CA GLU A 113 -1.153 -8.785 3.644 1.00 0.00 C ATOM 1789 C GLU A 113 -2.206 -8.488 2.509 1.00 0.00 C ATOM 1790 O GLU A 113 -2.488 -7.320 2.241 1.00 0.00 O ATOM 1791 CB GLU A 113 -1.764 -9.269 4.989 1.00 0.00 C ATOM 1792 CG GLU A 113 -0.835 -9.982 6.019 1.00 0.00 C ATOM 1793 CD GLU A 113 0.489 -9.313 6.392 1.00 0.00 C ATOM 1794 OE1 GLU A 113 0.485 -8.287 7.105 1.00 0.00 O ATOM 1795 OE2 GLU A 113 1.549 -9.821 5.974 1.00 0.00 O ATOM 0 H GLU A 113 -0.803 -6.962 4.666 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.533 -9.593 3.255 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -2.203 -8.402 5.484 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -2.582 -9.950 4.755 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -1.405 -10.124 6.937 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -0.607 -10.974 5.629 1.00 0.00 H new ATOM 1802 N SER A 114 -2.786 -9.486 1.804 1.00 0.00 N ATOM 1803 CA SER A 114 -3.692 -9.262 0.634 1.00 0.00 C ATOM 1804 C SER A 114 -4.566 -10.525 0.379 1.00 0.00 C ATOM 1805 O SER A 114 -4.095 -11.664 0.463 1.00 0.00 O ATOM 1806 CB SER A 114 -2.909 -8.905 -0.648 1.00 0.00 C ATOM 1807 OG SER A 114 -3.791 -8.237 -1.548 1.00 0.00 O ATOM 0 H SER A 114 -2.645 -10.472 2.023 1.00 0.00 H new ATOM 0 HA SER A 114 -4.332 -8.415 0.881 1.00 0.00 H new ATOM 0 HB2 SER A 114 -2.059 -8.266 -0.407 1.00 0.00 H new ATOM 0 HB3 SER A 114 -2.508 -9.807 -1.110 1.00 0.00 H new ATOM 0 HG SER A 114 -3.610 -7.274 -1.529 1.00 0.00 H new ATOM 1813 N ALA A 115 -5.827 -10.283 -0.047 1.00 0.00 N ATOM 1814 CA ALA A 115 -6.940 -11.296 -0.071 1.00 0.00 C ATOM 1815 C ALA A 115 -7.466 -11.057 1.348 1.00 0.00 C ATOM 1816 O ALA A 115 -8.293 -10.146 1.492 1.00 0.00 O ATOM 1817 CB ALA A 115 -6.600 -12.710 -0.582 1.00 0.00 C ATOM 0 H ALA A 115 -6.118 -9.368 -0.392 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.711 -11.186 -0.834 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -7.492 -13.335 -0.545 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -6.242 -12.649 -1.610 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -5.825 -13.147 0.047 1.00 0.00 H new ATOM 1823 N ALA A 116 -6.907 -11.780 2.336 1.00 0.00 N ATOM 1824 CA ALA A 116 -6.924 -11.250 3.732 1.00 0.00 C ATOM 1825 C ALA A 116 -5.869 -11.952 4.635 1.00 0.00 C ATOM 1826 O ALA A 116 -4.821 -11.370 4.925 1.00 0.00 O ATOM 1827 CB ALA A 116 -8.364 -11.252 4.327 1.00 0.00 C ATOM 0 H ALA A 116 -6.457 -12.688 2.217 1.00 0.00 H new ATOM 0 HA ALA A 116 -6.620 -10.204 3.697 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -8.338 -10.860 5.344 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -9.012 -10.626 3.713 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -8.751 -12.271 4.341 1.00 0.00 H new ATOM 1833 N CYS A 117 -6.191 -13.136 5.162 1.00 0.00 N ATOM 1834 CA CYS A 117 -5.239 -13.972 5.944 1.00 0.00 C ATOM 1835 C CYS A 117 -4.622 -14.928 4.871 1.00 0.00 C ATOM 1836 O CYS A 117 -3.450 -14.695 4.554 1.00 0.00 O ATOM 1837 CB CYS A 117 -5.948 -14.586 7.169 1.00 0.00 C ATOM 1838 SG CYS A 117 -4.835 -15.766 8.005 1.00 0.00 S ATOM 0 H CYS A 117 -7.116 -13.554 5.066 1.00 0.00 H new ATOM 0 HA CYS A 117 -4.416 -13.449 6.431 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -6.243 -13.798 7.862 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -6.860 -15.093 6.855 1.00 0.00 H new ATOM 0 HG CYS A 117 -5.439 -16.276 9.037 1.00 0.00 H new ATOM 1844 N PRO A 118 -5.310 -15.923 4.223 1.00 0.00 N ATOM 1845 CA PRO A 118 -4.748 -16.600 3.037 1.00 0.00 C ATOM 1846 C PRO A 118 -4.768 -15.669 1.766 1.00 0.00 C ATOM 1847 O PRO A 118 -5.336 -14.553 1.747 1.00 0.00 O ATOM 1848 CB PRO A 118 -5.659 -17.844 2.947 1.00 0.00 C ATOM 1849 CG PRO A 118 -7.027 -17.355 3.430 1.00 0.00 C ATOM 1850 CD PRO A 118 -6.692 -16.349 4.532 1.00 0.00 C ATOM 0 HA PRO A 118 -3.692 -16.862 3.103 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -5.711 -18.224 1.927 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.285 -18.656 3.571 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -7.592 -16.889 2.623 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -7.633 -18.177 3.811 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -7.381 -15.504 4.524 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -6.757 -16.804 5.520 1.00 0.00 H new ATOM 1858 N GLY A 119 -4.104 -16.211 0.730 1.00 0.00 N ATOM 1859 CA GLY A 119 -3.984 -15.580 -0.600 1.00 0.00 C ATOM 1860 C GLY A 119 -2.565 -15.119 -0.951 1.00 0.00 C ATOM 1861 O GLY A 119 -1.773 -15.900 -1.475 1.00 0.00 O ATOM 0 H GLY A 119 -3.629 -17.111 0.792 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -4.322 -16.288 -1.357 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.654 -14.722 -0.644 1.00 0.00 H new ATOM 1865 N TRP A 120 -2.272 -13.837 -0.722 1.00 0.00 N ATOM 1866 CA TRP A 120 -0.955 -13.233 -1.080 1.00 0.00 C ATOM 1867 C TRP A 120 -0.556 -12.242 0.055 1.00 0.00 C ATOM 1868 O TRP A 120 -1.292 -11.312 0.369 1.00 0.00 O ATOM 1869 CB TRP A 120 -1.077 -12.549 -2.483 1.00 0.00 C ATOM 1870 CG TRP A 120 -1.062 -13.517 -3.679 1.00 0.00 C ATOM 1871 CD1 TRP A 120 -2.196 -14.077 -4.308 1.00 0.00 C ATOM 1872 CD2 TRP A 120 0.028 -14.035 -4.357 1.00 0.00 C ATOM 1873 NE1 TRP A 120 -1.837 -14.951 -5.354 1.00 0.00 N ATOM 1874 CE2 TRP A 120 -0.454 -14.902 -5.370 1.00 0.00 C ATOM 1875 CE3 TRP A 120 1.419 -13.823 -4.200 1.00 0.00 C ATOM 1876 CZ2 TRP A 120 0.454 -15.557 -6.237 1.00 0.00 C ATOM 1877 CZ3 TRP A 120 2.297 -14.473 -5.069 1.00 0.00 C ATOM 1878 CH2 TRP A 120 1.821 -15.326 -6.074 1.00 0.00 C ATOM 0 H TRP A 120 -2.923 -13.182 -0.289 1.00 0.00 H new ATOM 0 HA TRP A 120 -0.166 -13.981 -1.161 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.002 -11.974 -2.511 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -0.257 -11.840 -2.598 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -3.215 -13.862 -4.022 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -2.454 -15.494 -5.959 1.00 0.00 H new ATOM 0 HE3 TRP A 120 1.793 -13.172 -3.424 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 0.096 -16.222 -7.009 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 3.360 -14.316 -4.965 1.00 0.00 H new ATOM 0 HH2 TRP A 120 2.524 -15.813 -6.734 1.00 0.00 H new ATOM 1889 N PHE A 121 0.625 -12.393 0.668 1.00 0.00 N ATOM 1890 CA PHE A 121 1.053 -11.535 1.813 1.00 0.00 C ATOM 1891 C PHE A 121 2.601 -11.471 1.961 1.00 0.00 C ATOM 1892 O PHE A 121 3.231 -12.530 2.010 1.00 0.00 O ATOM 1893 CB PHE A 121 0.405 -12.072 3.136 1.00 0.00 C ATOM 1894 CG PHE A 121 0.525 -13.566 3.516 1.00 0.00 C ATOM 1895 CD1 PHE A 121 1.603 -14.026 4.278 1.00 0.00 C ATOM 1896 CD2 PHE A 121 -0.465 -14.470 3.112 1.00 0.00 C ATOM 1897 CE1 PHE A 121 1.697 -15.373 4.620 1.00 0.00 C ATOM 1898 CE2 PHE A 121 -0.371 -15.815 3.456 1.00 0.00 C ATOM 1899 CZ PHE A 121 0.708 -16.265 4.213 1.00 0.00 C ATOM 0 H PHE A 121 1.311 -13.098 0.400 1.00 0.00 H new ATOM 0 HA PHE A 121 0.711 -10.519 1.613 1.00 0.00 H new ATOM 0 HB2 PHE A 121 0.828 -11.495 3.959 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -0.658 -11.835 3.093 1.00 0.00 H new ATOM 0 HD1 PHE A 121 2.366 -13.334 4.603 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.306 -14.122 2.530 1.00 0.00 H new ATOM 0 HE1 PHE A 121 2.537 -15.726 5.201 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -1.134 -16.509 3.136 1.00 0.00 H new ATOM 0 HZ PHE A 121 0.778 -17.308 4.485 1.00 0.00 H new ATOM 1909 N LEU A 122 3.222 -10.263 1.938 1.00 0.00 N ATOM 1910 CA LEU A 122 4.674 -10.091 2.269 1.00 0.00 C ATOM 1911 C LEU A 122 5.027 -8.548 2.401 1.00 0.00 C ATOM 1912 O LEU A 122 4.506 -7.872 3.306 1.00 0.00 O ATOM 1913 CB LEU A 122 5.645 -10.931 1.343 1.00 0.00 C ATOM 1914 CG LEU A 122 7.053 -11.280 1.907 1.00 0.00 C ATOM 1915 CD1 LEU A 122 7.043 -11.943 3.300 1.00 0.00 C ATOM 1916 CD2 LEU A 122 7.768 -12.244 0.943 1.00 0.00 C ATOM 0 H LEU A 122 2.748 -9.393 1.696 1.00 0.00 H new ATOM 0 HA LEU A 122 4.854 -10.533 3.249 1.00 0.00 H new ATOM 0 HB2 LEU A 122 5.143 -11.865 1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 122 5.783 -10.380 0.413 1.00 0.00 H new ATOM 0 HG LEU A 122 7.567 -10.324 2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 122 8.067 -12.150 3.612 1.00 0.00 H new ATOM 0 HD12 LEU A 122 6.573 -11.272 4.019 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.482 -12.876 3.255 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.754 -12.488 1.338 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.182 -13.157 0.840 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.875 -11.770 -0.033 1.00 0.00 H new ATOM 1928 N CYS A 123 5.971 -8.003 1.588 1.00 0.00 N ATOM 1929 CA CYS A 123 6.524 -6.628 1.748 1.00 0.00 C ATOM 1930 C CYS A 123 7.174 -6.103 0.407 1.00 0.00 C ATOM 1931 O CYS A 123 6.470 -5.663 -0.504 1.00 0.00 O ATOM 1932 CB CYS A 123 7.468 -6.687 2.968 1.00 0.00 C ATOM 1933 SG CYS A 123 8.755 -7.967 2.798 1.00 0.00 S ATOM 0 H CYS A 123 6.373 -8.507 0.798 1.00 0.00 H new ATOM 0 HA CYS A 123 5.752 -5.884 1.944 1.00 0.00 H new ATOM 0 HB2 CYS A 123 7.943 -5.715 3.102 1.00 0.00 H new ATOM 0 HB3 CYS A 123 6.883 -6.883 3.866 1.00 0.00 H new ATOM 0 HG CYS A 123 9.912 -7.399 2.628 1.00 0.00 H new ATOM 1939 N THR A 124 8.516 -6.121 0.298 1.00 0.00 N ATOM 1940 CA THR A 124 9.313 -5.668 -0.885 1.00 0.00 C ATOM 1941 C THR A 124 10.348 -6.776 -1.264 1.00 0.00 C ATOM 1942 O THR A 124 10.790 -7.571 -0.428 1.00 0.00 O ATOM 1943 CB THR A 124 10.036 -4.299 -0.616 1.00 0.00 C ATOM 1944 OG1 THR A 124 10.242 -4.035 0.769 1.00 0.00 O ATOM 1945 CG2 THR A 124 9.226 -3.120 -1.169 1.00 0.00 C ATOM 0 H THR A 124 9.109 -6.463 1.055 1.00 0.00 H new ATOM 0 HA THR A 124 8.630 -5.505 -1.718 1.00 0.00 H new ATOM 0 HB THR A 124 10.999 -4.394 -1.118 1.00 0.00 H new ATOM 0 HG1 THR A 124 10.696 -3.173 0.874 1.00 0.00 H new ATOM 0 HG21 THR A 124 9.754 -2.188 -0.966 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.100 -3.238 -2.245 1.00 0.00 H new ATOM 0 HG23 THR A 124 8.248 -3.094 -0.689 1.00 0.00 H new ATOM 1953 N ALA A 125 10.779 -6.805 -2.537 1.00 0.00 N ATOM 1954 CA ALA A 125 11.651 -7.891 -3.056 1.00 0.00 C ATOM 1955 C ALA A 125 13.170 -7.905 -2.650 1.00 0.00 C ATOM 1956 O ALA A 125 14.079 -7.492 -3.369 1.00 0.00 O ATOM 1957 CB ALA A 125 11.484 -7.817 -4.575 1.00 0.00 C ATOM 0 H ALA A 125 10.542 -6.094 -3.229 1.00 0.00 H new ATOM 0 HA ALA A 125 11.325 -8.821 -2.591 1.00 0.00 H new ATOM 0 HB1 ALA A 125 12.095 -8.587 -5.046 1.00 0.00 H new ATOM 0 HB2 ALA A 125 10.437 -7.976 -4.834 1.00 0.00 H new ATOM 0 HB3 ALA A 125 11.801 -6.836 -4.928 1.00 0.00 H new ATOM 1963 N MET A 126 13.389 -8.577 -1.514 1.00 0.00 N ATOM 1964 CA MET A 126 14.704 -8.980 -0.904 1.00 0.00 C ATOM 1965 C MET A 126 15.606 -7.854 -0.311 1.00 0.00 C ATOM 1966 O MET A 126 16.329 -8.114 0.654 1.00 0.00 O ATOM 1967 CB MET A 126 15.570 -9.804 -1.919 1.00 0.00 C ATOM 1968 CG MET A 126 14.937 -11.067 -2.540 1.00 0.00 C ATOM 1969 SD MET A 126 14.507 -12.267 -1.268 1.00 0.00 S ATOM 1970 CE MET A 126 13.778 -13.548 -2.305 1.00 0.00 C ATOM 0 H MET A 126 12.606 -8.886 -0.938 1.00 0.00 H new ATOM 0 HA MET A 126 14.378 -9.571 -0.048 1.00 0.00 H new ATOM 0 HB2 MET A 126 15.858 -9.138 -2.733 1.00 0.00 H new ATOM 0 HB3 MET A 126 16.487 -10.103 -1.412 1.00 0.00 H new ATOM 0 HG2 MET A 126 14.044 -10.792 -3.102 1.00 0.00 H new ATOM 0 HG3 MET A 126 15.633 -11.516 -3.248 1.00 0.00 H new ATOM 0 HE1 MET A 126 13.451 -14.379 -1.680 1.00 0.00 H new ATOM 0 HE2 MET A 126 12.922 -13.139 -2.841 1.00 0.00 H new ATOM 0 HE3 MET A 126 14.519 -13.902 -3.021 1.00 0.00 H new ATOM 1980 N GLU A 127 15.621 -6.663 -0.917 1.00 0.00 N ATOM 1981 CA GLU A 127 16.564 -5.564 -0.529 1.00 0.00 C ATOM 1982 C GLU A 127 16.010 -4.125 -0.827 1.00 0.00 C ATOM 1983 O GLU A 127 14.973 -3.919 -1.466 1.00 0.00 O ATOM 1984 CB GLU A 127 17.914 -5.876 -1.275 1.00 0.00 C ATOM 1985 CG GLU A 127 19.173 -5.013 -0.969 1.00 0.00 C ATOM 1986 CD GLU A 127 19.547 -4.828 0.498 1.00 0.00 C ATOM 1987 OE1 GLU A 127 18.928 -3.968 1.166 1.00 0.00 O ATOM 1988 OE2 GLU A 127 20.459 -5.525 0.985 1.00 0.00 O ATOM 0 H GLU A 127 14.995 -6.417 -1.684 1.00 0.00 H new ATOM 0 HA GLU A 127 16.709 -5.546 0.551 1.00 0.00 H new ATOM 0 HB2 GLU A 127 18.171 -6.915 -1.066 1.00 0.00 H new ATOM 0 HB3 GLU A 127 17.720 -5.804 -2.345 1.00 0.00 H new ATOM 0 HG2 GLU A 127 20.024 -5.462 -1.481 1.00 0.00 H new ATOM 0 HG3 GLU A 127 19.022 -4.026 -1.407 1.00 0.00 H new ATOM 1995 N ALA A 128 16.741 -3.114 -0.320 1.00 0.00 N ATOM 1996 CA ALA A 128 16.446 -1.663 -0.472 1.00 0.00 C ATOM 1997 C ALA A 128 16.606 -1.017 -1.897 1.00 0.00 C ATOM 1998 O ALA A 128 17.121 0.099 -2.038 1.00 0.00 O ATOM 1999 CB ALA A 128 17.447 -1.037 0.531 1.00 0.00 C ATOM 0 H ALA A 128 17.585 -3.284 0.227 1.00 0.00 H new ATOM 0 HA ALA A 128 15.385 -1.484 -0.297 1.00 0.00 H new ATOM 0 HB1 ALA A 128 17.339 0.048 0.524 1.00 0.00 H new ATOM 0 HB2 ALA A 128 17.243 -1.415 1.533 1.00 0.00 H new ATOM 0 HB3 ALA A 128 18.464 -1.302 0.243 1.00 0.00 H new ATOM 2005 N ASP A 129 16.057 -1.660 -2.933 1.00 0.00 N ATOM 2006 CA ASP A 129 16.182 -1.220 -4.358 1.00 0.00 C ATOM 2007 C ASP A 129 15.110 -1.777 -5.351 1.00 0.00 C ATOM 2008 O ASP A 129 14.740 -1.075 -6.296 1.00 0.00 O ATOM 2009 CB ASP A 129 17.617 -1.624 -4.844 1.00 0.00 C ATOM 2010 CG ASP A 129 18.083 -3.097 -4.771 1.00 0.00 C ATOM 2011 OD1 ASP A 129 17.306 -4.001 -4.387 1.00 0.00 O ATOM 2012 OD2 ASP A 129 19.250 -3.348 -5.133 1.00 0.00 O ATOM 0 H ASP A 129 15.505 -2.510 -2.822 1.00 0.00 H new ATOM 0 HA ASP A 129 16.009 -0.144 -4.367 1.00 0.00 H new ATOM 0 HB2 ASP A 129 17.705 -1.309 -5.884 1.00 0.00 H new ATOM 0 HB3 ASP A 129 18.330 -1.032 -4.270 1.00 0.00 H new ATOM 2017 N GLN A 130 14.595 -2.997 -5.156 1.00 0.00 N ATOM 2018 CA GLN A 130 13.638 -3.646 -6.089 1.00 0.00 C ATOM 2019 C GLN A 130 12.121 -3.313 -5.798 1.00 0.00 C ATOM 2020 O GLN A 130 11.806 -2.759 -4.737 1.00 0.00 O ATOM 2021 CB GLN A 130 13.963 -5.165 -5.976 1.00 0.00 C ATOM 2022 CG GLN A 130 15.305 -5.606 -6.631 1.00 0.00 C ATOM 2023 CD GLN A 130 15.925 -6.857 -6.003 1.00 0.00 C ATOM 2024 OE1 GLN A 130 15.577 -7.989 -6.325 1.00 0.00 O ATOM 2025 NE2 GLN A 130 16.858 -6.691 -5.094 1.00 0.00 N ATOM 0 H GLN A 130 14.825 -3.572 -4.346 1.00 0.00 H new ATOM 0 HA GLN A 130 13.761 -3.270 -7.105 1.00 0.00 H new ATOM 0 HB2 GLN A 130 13.985 -5.438 -4.921 1.00 0.00 H new ATOM 0 HB3 GLN A 130 13.151 -5.729 -6.434 1.00 0.00 H new ATOM 0 HG2 GLN A 130 15.136 -5.791 -7.692 1.00 0.00 H new ATOM 0 HG3 GLN A 130 16.019 -4.785 -6.560 1.00 0.00 H new ATOM 0 HE21 GLN A 130 17.147 -5.750 -4.826 1.00 0.00 H new ATOM 0 HE22 GLN A 130 17.293 -7.503 -4.656 1.00 0.00 H new ATOM 2034 N PRO A 131 11.130 -3.634 -6.689 1.00 0.00 N ATOM 2035 CA PRO A 131 9.687 -3.345 -6.438 1.00 0.00 C ATOM 2036 C PRO A 131 8.979 -4.174 -5.308 1.00 0.00 C ATOM 2037 O PRO A 131 9.480 -5.182 -4.796 1.00 0.00 O ATOM 2038 CB PRO A 131 9.060 -3.635 -7.828 1.00 0.00 C ATOM 2039 CG PRO A 131 10.210 -3.653 -8.830 1.00 0.00 C ATOM 2040 CD PRO A 131 11.368 -4.228 -8.022 1.00 0.00 C ATOM 0 HA PRO A 131 9.562 -2.332 -6.055 1.00 0.00 H new ATOM 0 HB2 PRO A 131 8.534 -4.590 -7.824 1.00 0.00 H new ATOM 0 HB3 PRO A 131 8.329 -2.870 -8.091 1.00 0.00 H new ATOM 0 HG2 PRO A 131 9.978 -4.271 -9.697 1.00 0.00 H new ATOM 0 HG3 PRO A 131 10.436 -2.654 -9.202 1.00 0.00 H new ATOM 0 HD2 PRO A 131 11.346 -5.317 -7.994 1.00 0.00 H new ATOM 0 HD3 PRO A 131 12.336 -3.939 -8.432 1.00 0.00 H new ATOM 2048 N VAL A 132 7.738 -3.761 -5.005 1.00 0.00 N ATOM 2049 CA VAL A 132 6.814 -4.453 -4.051 1.00 0.00 C ATOM 2050 C VAL A 132 6.541 -5.964 -4.395 1.00 0.00 C ATOM 2051 O VAL A 132 6.410 -6.331 -5.570 1.00 0.00 O ATOM 2052 CB VAL A 132 5.487 -3.616 -4.040 1.00 0.00 C ATOM 2053 CG1 VAL A 132 4.702 -3.544 -5.380 1.00 0.00 C ATOM 2054 CG2 VAL A 132 4.502 -4.051 -2.942 1.00 0.00 C ATOM 0 H VAL A 132 7.328 -2.923 -5.416 1.00 0.00 H new ATOM 0 HA VAL A 132 7.281 -4.494 -3.067 1.00 0.00 H new ATOM 0 HB VAL A 132 5.876 -2.618 -3.839 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.806 -2.939 -5.245 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.332 -3.093 -6.147 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.417 -4.550 -5.689 1.00 0.00 H new ATOM 0 HG21 VAL A 132 3.606 -3.432 -2.991 1.00 0.00 H new ATOM 0 HG22 VAL A 132 4.229 -5.096 -3.091 1.00 0.00 H new ATOM 0 HG23 VAL A 132 4.971 -3.934 -1.965 1.00 0.00 H new ATOM 2064 N SER A 133 6.458 -6.841 -3.372 1.00 0.00 N ATOM 2065 CA SER A 133 6.195 -8.291 -3.595 1.00 0.00 C ATOM 2066 C SER A 133 5.438 -8.956 -2.396 1.00 0.00 C ATOM 2067 O SER A 133 5.628 -8.624 -1.222 1.00 0.00 O ATOM 2068 CB SER A 133 7.551 -8.996 -3.858 1.00 0.00 C ATOM 2069 OG SER A 133 7.340 -10.345 -4.275 1.00 0.00 O ATOM 0 H SER A 133 6.567 -6.581 -2.392 1.00 0.00 H new ATOM 0 HA SER A 133 5.538 -8.399 -4.458 1.00 0.00 H new ATOM 0 HB2 SER A 133 8.106 -8.455 -4.624 1.00 0.00 H new ATOM 0 HB3 SER A 133 8.158 -8.980 -2.953 1.00 0.00 H new ATOM 0 HG SER A 133 8.186 -10.726 -4.591 1.00 0.00 H new ATOM 2075 N LEU A 134 4.565 -9.912 -2.746 1.00 0.00 N ATOM 2076 CA LEU A 134 3.704 -10.683 -1.801 1.00 0.00 C ATOM 2077 C LEU A 134 3.975 -12.225 -1.957 1.00 0.00 C ATOM 2078 O LEU A 134 4.517 -12.679 -2.973 1.00 0.00 O ATOM 2079 CB LEU A 134 2.222 -10.353 -2.163 1.00 0.00 C ATOM 2080 CG LEU A 134 1.731 -8.878 -2.105 1.00 0.00 C ATOM 2081 CD1 LEU A 134 0.390 -8.742 -2.842 1.00 0.00 C ATOM 2082 CD2 LEU A 134 1.586 -8.357 -0.668 1.00 0.00 C ATOM 0 H LEU A 134 4.425 -10.187 -3.718 1.00 0.00 H new ATOM 0 HA LEU A 134 3.919 -10.413 -0.767 1.00 0.00 H new ATOM 0 HB2 LEU A 134 2.044 -10.717 -3.175 1.00 0.00 H new ATOM 0 HB3 LEU A 134 1.585 -10.936 -1.497 1.00 0.00 H new ATOM 0 HG LEU A 134 2.492 -8.270 -2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 134 0.053 -7.706 -2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 134 0.516 -9.037 -3.884 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -0.352 -9.386 -2.369 1.00 0.00 H new ATOM 0 HD21 LEU A 134 1.241 -7.323 -0.689 1.00 0.00 H new ATOM 0 HD22 LEU A 134 0.863 -8.970 -0.130 1.00 0.00 H new ATOM 0 HD23 LEU A 134 2.551 -8.407 -0.164 1.00 0.00 H new ATOM 2094 N THR A 135 3.581 -13.088 -0.996 1.00 0.00 N ATOM 2095 CA THR A 135 3.795 -14.576 -1.112 1.00 0.00 C ATOM 2096 C THR A 135 2.634 -15.375 -0.417 1.00 0.00 C ATOM 2097 O THR A 135 1.982 -14.896 0.511 1.00 0.00 O ATOM 2098 CB THR A 135 5.225 -14.881 -0.549 1.00 0.00 C ATOM 2099 OG1 THR A 135 6.196 -14.206 -1.351 1.00 0.00 O ATOM 2100 CG2 THR A 135 5.666 -16.352 -0.576 1.00 0.00 C ATOM 0 H THR A 135 3.117 -12.800 -0.135 1.00 0.00 H new ATOM 0 HA THR A 135 3.757 -14.911 -2.149 1.00 0.00 H new ATOM 0 HB THR A 135 5.165 -14.559 0.491 1.00 0.00 H new ATOM 0 HG1 THR A 135 7.093 -14.391 -1.003 1.00 0.00 H new ATOM 0 HG21 THR A 135 6.671 -16.438 -0.162 1.00 0.00 H new ATOM 0 HG22 THR A 135 4.976 -16.950 0.019 1.00 0.00 H new ATOM 0 HG23 THR A 135 5.665 -16.713 -1.604 1.00 0.00 H new ATOM 2108 N ASN A 136 2.371 -16.622 -0.860 1.00 0.00 N ATOM 2109 CA ASN A 136 1.292 -17.489 -0.265 1.00 0.00 C ATOM 2110 C ASN A 136 1.633 -18.140 1.130 1.00 0.00 C ATOM 2111 O ASN A 136 0.711 -18.545 1.843 1.00 0.00 O ATOM 2112 CB ASN A 136 0.988 -18.633 -1.283 1.00 0.00 C ATOM 2113 CG ASN A 136 -0.004 -18.318 -2.405 1.00 0.00 C ATOM 2114 OD1 ASN A 136 -1.163 -18.713 -2.370 1.00 0.00 O ATOM 2115 ND2 ASN A 136 0.406 -17.644 -3.448 1.00 0.00 N ATOM 0 H ASN A 136 2.881 -17.064 -1.625 1.00 0.00 H new ATOM 0 HA ASN A 136 0.442 -16.832 -0.078 1.00 0.00 H new ATOM 0 HB2 ASN A 136 1.929 -18.940 -1.739 1.00 0.00 H new ATOM 0 HB3 ASN A 136 0.609 -19.490 -0.726 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -0.236 -17.454 -4.217 1.00 0.00 H new ATOM 0 HD22 ASN A 136 1.368 -17.308 -3.492 1.00 0.00 H new ATOM 2122 N MET A 137 2.916 -18.289 1.493 1.00 0.00 N ATOM 2123 CA MET A 137 3.373 -18.864 2.787 1.00 0.00 C ATOM 2124 C MET A 137 4.407 -17.905 3.496 1.00 0.00 C ATOM 2125 O MET A 137 5.107 -17.159 2.797 1.00 0.00 O ATOM 2126 CB MET A 137 3.975 -20.275 2.502 1.00 0.00 C ATOM 2127 CG MET A 137 5.284 -20.354 1.678 1.00 0.00 C ATOM 2128 SD MET A 137 5.829 -22.067 1.550 1.00 0.00 S ATOM 2129 CE MET A 137 7.420 -21.813 0.743 1.00 0.00 C ATOM 0 H MET A 137 3.689 -18.010 0.889 1.00 0.00 H new ATOM 0 HA MET A 137 2.535 -18.966 3.476 1.00 0.00 H new ATOM 0 HB2 MET A 137 4.154 -20.762 3.461 1.00 0.00 H new ATOM 0 HB3 MET A 137 3.218 -20.863 1.983 1.00 0.00 H new ATOM 0 HG2 MET A 137 5.123 -19.940 0.683 1.00 0.00 H new ATOM 0 HG3 MET A 137 6.059 -19.752 2.152 1.00 0.00 H new ATOM 0 HE1 MET A 137 7.905 -22.776 0.583 1.00 0.00 H new ATOM 0 HE2 MET A 137 7.266 -21.320 -0.217 1.00 0.00 H new ATOM 0 HE3 MET A 137 8.053 -21.189 1.374 1.00 0.00 H new ATOM 2139 N PRO A 138 4.585 -17.890 4.854 1.00 0.00 N ATOM 2140 CA PRO A 138 5.600 -17.024 5.518 1.00 0.00 C ATOM 2141 C PRO A 138 7.071 -17.496 5.243 1.00 0.00 C ATOM 2142 O PRO A 138 7.419 -18.657 5.487 1.00 0.00 O ATOM 2143 CB PRO A 138 5.179 -17.113 6.997 1.00 0.00 C ATOM 2144 CG PRO A 138 4.524 -18.491 7.138 1.00 0.00 C ATOM 2145 CD PRO A 138 3.808 -18.713 5.804 1.00 0.00 C ATOM 0 HA PRO A 138 5.618 -15.999 5.148 1.00 0.00 H new ATOM 0 HB2 PRO A 138 6.039 -17.015 7.659 1.00 0.00 H new ATOM 0 HB3 PRO A 138 4.483 -16.316 7.258 1.00 0.00 H new ATOM 0 HG2 PRO A 138 5.267 -19.267 7.324 1.00 0.00 H new ATOM 0 HG3 PRO A 138 3.824 -18.514 7.973 1.00 0.00 H new ATOM 0 HD2 PRO A 138 3.809 -19.765 5.518 1.00 0.00 H new ATOM 0 HD3 PRO A 138 2.766 -18.396 5.850 1.00 0.00 H new ATOM 2153 N ASP A 139 7.928 -16.584 4.754 1.00 0.00 N ATOM 2154 CA ASP A 139 9.333 -16.918 4.374 1.00 0.00 C ATOM 2155 C ASP A 139 10.327 -17.005 5.601 1.00 0.00 C ATOM 2156 O ASP A 139 9.938 -16.856 6.766 1.00 0.00 O ATOM 2157 CB ASP A 139 9.711 -15.856 3.295 1.00 0.00 C ATOM 2158 CG ASP A 139 10.669 -16.385 2.227 1.00 0.00 C ATOM 2159 OD1 ASP A 139 11.744 -16.913 2.582 1.00 0.00 O ATOM 2160 OD2 ASP A 139 10.357 -16.253 1.025 1.00 0.00 O ATOM 0 H ASP A 139 7.682 -15.605 4.608 1.00 0.00 H new ATOM 0 HA ASP A 139 9.416 -17.927 3.971 1.00 0.00 H new ATOM 0 HB2 ASP A 139 8.801 -15.501 2.812 1.00 0.00 H new ATOM 0 HB3 ASP A 139 10.167 -14.996 3.787 1.00 0.00 H new ATOM 2165 N GLU A 140 11.619 -17.301 5.348 1.00 0.00 N ATOM 2166 CA GLU A 140 12.636 -17.521 6.432 1.00 0.00 C ATOM 2167 C GLU A 140 13.515 -16.255 6.730 1.00 0.00 C ATOM 2168 O GLU A 140 14.745 -16.322 6.825 1.00 0.00 O ATOM 2169 CB GLU A 140 13.495 -18.753 6.005 1.00 0.00 C ATOM 2170 CG GLU A 140 12.765 -20.123 5.985 1.00 0.00 C ATOM 2171 CD GLU A 140 13.672 -21.315 5.715 1.00 0.00 C ATOM 2172 OE1 GLU A 140 14.230 -21.872 6.684 1.00 0.00 O ATOM 2173 OE2 GLU A 140 13.811 -21.712 4.540 1.00 0.00 O ATOM 0 H GLU A 140 11.996 -17.396 4.405 1.00 0.00 H new ATOM 0 HA GLU A 140 12.128 -17.713 7.377 1.00 0.00 H new ATOM 0 HB2 GLU A 140 13.895 -18.563 5.009 1.00 0.00 H new ATOM 0 HB3 GLU A 140 14.346 -18.828 6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 140 12.268 -20.270 6.944 1.00 0.00 H new ATOM 0 HG3 GLU A 140 11.986 -20.095 5.223 1.00 0.00 H new ATOM 2180 N GLY A 141 12.873 -15.095 6.976 1.00 0.00 N ATOM 2181 CA GLY A 141 13.595 -13.800 7.191 1.00 0.00 C ATOM 2182 C GLY A 141 14.401 -13.284 5.969 1.00 0.00 C ATOM 2183 O GLY A 141 15.520 -12.792 6.113 1.00 0.00 O ATOM 0 H GLY A 141 11.858 -15.016 7.033 1.00 0.00 H new ATOM 0 HA2 GLY A 141 12.868 -13.039 7.474 1.00 0.00 H new ATOM 0 HA3 GLY A 141 14.277 -13.918 8.033 1.00 0.00 H new ATOM 2187 N VAL A 142 13.782 -13.366 4.785 1.00 0.00 N ATOM 2188 CA VAL A 142 14.435 -13.068 3.476 1.00 0.00 C ATOM 2189 C VAL A 142 14.107 -11.606 3.018 1.00 0.00 C ATOM 2190 O VAL A 142 15.001 -10.781 2.824 1.00 0.00 O ATOM 2191 CB VAL A 142 13.992 -14.252 2.515 1.00 0.00 C ATOM 2192 CG1 VAL A 142 12.906 -13.997 1.444 1.00 0.00 C ATOM 2193 CG2 VAL A 142 15.212 -14.806 1.743 1.00 0.00 C ATOM 0 H VAL A 142 12.805 -13.642 4.693 1.00 0.00 H new ATOM 0 HA VAL A 142 15.525 -13.054 3.500 1.00 0.00 H new ATOM 0 HB VAL A 142 13.542 -14.932 3.238 1.00 0.00 H new ATOM 0 HG11 VAL A 142 12.729 -14.913 0.880 1.00 0.00 H new ATOM 0 HG12 VAL A 142 11.981 -13.686 1.930 1.00 0.00 H new ATOM 0 HG13 VAL A 142 13.241 -13.212 0.766 1.00 0.00 H new ATOM 0 HG21 VAL A 142 14.891 -15.617 1.089 1.00 0.00 H new ATOM 0 HG22 VAL A 142 15.655 -14.011 1.144 1.00 0.00 H new ATOM 0 HG23 VAL A 142 15.951 -15.182 2.451 1.00 0.00 H new ATOM 2203 N MET A 143 12.808 -11.304 2.892 1.00 0.00 N ATOM 2204 CA MET A 143 12.295 -9.952 2.530 1.00 0.00 C ATOM 2205 C MET A 143 12.036 -9.107 3.827 1.00 0.00 C ATOM 2206 O MET A 143 11.660 -9.636 4.881 1.00 0.00 O ATOM 2207 CB MET A 143 10.998 -10.098 1.684 1.00 0.00 C ATOM 2208 CG MET A 143 11.155 -10.855 0.347 1.00 0.00 C ATOM 2209 SD MET A 143 9.844 -10.409 -0.802 1.00 0.00 S ATOM 2210 CE MET A 143 10.231 -11.580 -2.114 1.00 0.00 C ATOM 0 H MET A 143 12.067 -11.990 3.037 1.00 0.00 H new ATOM 0 HA MET A 143 13.040 -9.426 1.933 1.00 0.00 H new ATOM 0 HB2 MET A 143 10.249 -10.612 2.286 1.00 0.00 H new ATOM 0 HB3 MET A 143 10.609 -9.102 1.473 1.00 0.00 H new ATOM 0 HG2 MET A 143 12.125 -10.624 -0.094 1.00 0.00 H new ATOM 0 HG3 MET A 143 11.135 -11.930 0.528 1.00 0.00 H new ATOM 0 HE1 MET A 143 9.519 -11.459 -2.931 1.00 0.00 H new ATOM 0 HE2 MET A 143 11.240 -11.394 -2.482 1.00 0.00 H new ATOM 0 HE3 MET A 143 10.168 -12.596 -1.725 1.00 0.00 H new ATOM 2220 N VAL A 144 12.183 -7.769 3.746 1.00 0.00 N ATOM 2221 CA VAL A 144 12.011 -6.860 4.931 1.00 0.00 C ATOM 2222 C VAL A 144 10.494 -6.583 5.258 1.00 0.00 C ATOM 2223 O VAL A 144 9.944 -5.513 4.989 1.00 0.00 O ATOM 2224 CB VAL A 144 12.830 -5.531 4.708 1.00 0.00 C ATOM 2225 CG1 VAL A 144 14.355 -5.745 4.826 1.00 0.00 C ATOM 2226 CG2 VAL A 144 12.541 -4.720 3.417 1.00 0.00 C ATOM 0 H VAL A 144 12.420 -7.281 2.882 1.00 0.00 H new ATOM 0 HA VAL A 144 12.411 -7.364 5.811 1.00 0.00 H new ATOM 0 HB VAL A 144 12.454 -4.919 5.528 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.869 -4.798 4.664 1.00 0.00 H new ATOM 0 HG12 VAL A 144 14.594 -6.121 5.821 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.680 -6.467 4.077 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.174 -3.833 3.395 1.00 0.00 H new ATOM 0 HG22 VAL A 144 12.752 -5.338 2.544 1.00 0.00 H new ATOM 0 HG23 VAL A 144 11.494 -4.418 3.404 1.00 0.00 H new ATOM 2236 N THR A 145 9.828 -7.552 5.915 1.00 0.00 N ATOM 2237 CA THR A 145 8.375 -7.456 6.284 1.00 0.00 C ATOM 2238 C THR A 145 8.049 -6.825 7.691 1.00 0.00 C ATOM 2239 O THR A 145 6.951 -7.044 8.212 1.00 0.00 O ATOM 2240 CB THR A 145 7.777 -8.895 6.113 1.00 0.00 C ATOM 2241 OG1 THR A 145 6.368 -8.824 6.293 1.00 0.00 O ATOM 2242 CG2 THR A 145 8.278 -9.972 7.096 1.00 0.00 C ATOM 0 H THR A 145 10.266 -8.425 6.210 1.00 0.00 H new ATOM 0 HA THR A 145 7.905 -6.734 5.616 1.00 0.00 H new ATOM 0 HB THR A 145 8.101 -9.202 5.118 1.00 0.00 H new ATOM 0 HG1 THR A 145 6.163 -8.213 7.031 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.791 -10.922 6.875 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.357 -10.085 6.993 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.041 -9.672 8.117 1.00 0.00 H new ATOM 2250 N LYS A 146 8.967 -6.057 8.298 1.00 0.00 N ATOM 2251 CA LYS A 146 8.717 -5.306 9.563 1.00 0.00 C ATOM 2252 C LYS A 146 9.235 -3.857 9.307 1.00 0.00 C ATOM 2253 O LYS A 146 10.355 -3.495 9.684 1.00 0.00 O ATOM 2254 CB LYS A 146 9.409 -5.990 10.775 1.00 0.00 C ATOM 2255 CG LYS A 146 8.778 -7.330 11.227 1.00 0.00 C ATOM 2256 CD LYS A 146 9.265 -7.875 12.590 1.00 0.00 C ATOM 2257 CE LYS A 146 10.711 -8.415 12.648 1.00 0.00 C ATOM 2258 NZ LYS A 146 11.694 -7.323 12.895 1.00 0.00 N ATOM 0 H LYS A 146 9.911 -5.931 7.933 1.00 0.00 H new ATOM 0 HA LYS A 146 7.659 -5.290 9.823 1.00 0.00 H new ATOM 0 HB2 LYS A 146 10.455 -6.166 10.523 1.00 0.00 H new ATOM 0 HB3 LYS A 146 9.396 -5.299 11.618 1.00 0.00 H new ATOM 0 HG2 LYS A 146 7.696 -7.204 11.273 1.00 0.00 H new ATOM 0 HG3 LYS A 146 8.979 -8.081 10.463 1.00 0.00 H new ATOM 0 HD2 LYS A 146 9.170 -7.078 13.328 1.00 0.00 H new ATOM 0 HD3 LYS A 146 8.591 -8.675 12.896 1.00 0.00 H new ATOM 0 HE2 LYS A 146 10.790 -9.162 13.438 1.00 0.00 H new ATOM 0 HE3 LYS A 146 10.951 -8.916 11.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 12.504 -7.433 12.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 11.240 -6.403 12.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 12.025 -7.370 13.880 1.00 0.00 H new ATOM 2272 N PHE A 147 8.406 -3.043 8.637 1.00 0.00 N ATOM 2273 CA PHE A 147 8.774 -1.657 8.219 1.00 0.00 C ATOM 2274 C PHE A 147 8.015 -0.598 9.078 1.00 0.00 C ATOM 2275 O PHE A 147 6.862 -0.780 9.473 1.00 0.00 O ATOM 2276 CB PHE A 147 8.538 -1.528 6.680 1.00 0.00 C ATOM 2277 CG PHE A 147 7.237 -2.049 6.032 1.00 0.00 C ATOM 2278 CD1 PHE A 147 6.094 -1.249 5.973 1.00 0.00 C ATOM 2279 CD2 PHE A 147 7.208 -3.330 5.469 1.00 0.00 C ATOM 2280 CE1 PHE A 147 4.948 -1.711 5.326 1.00 0.00 C ATOM 2281 CE2 PHE A 147 6.056 -3.796 4.845 1.00 0.00 C ATOM 2282 CZ PHE A 147 4.931 -2.984 4.768 1.00 0.00 C ATOM 0 H PHE A 147 7.461 -3.314 8.364 1.00 0.00 H new ATOM 0 HA PHE A 147 9.830 -1.458 8.404 1.00 0.00 H new ATOM 0 HB2 PHE A 147 8.618 -0.470 6.432 1.00 0.00 H new ATOM 0 HB3 PHE A 147 9.367 -2.035 6.186 1.00 0.00 H new ATOM 0 HD1 PHE A 147 6.097 -0.270 6.429 1.00 0.00 H new ATOM 0 HD2 PHE A 147 8.084 -3.959 5.519 1.00 0.00 H new ATOM 0 HE1 PHE A 147 4.074 -1.080 5.259 1.00 0.00 H new ATOM 0 HE2 PHE A 147 6.036 -4.789 4.420 1.00 0.00 H new ATOM 0 HZ PHE A 147 4.041 -3.343 4.273 1.00 0.00 H new ATOM 2292 N TYR A 148 8.686 0.532 9.356 1.00 0.00 N ATOM 2293 CA TYR A 148 8.194 1.597 10.262 1.00 0.00 C ATOM 2294 C TYR A 148 7.036 2.455 9.638 1.00 0.00 C ATOM 2295 O TYR A 148 7.025 2.849 8.469 1.00 0.00 O ATOM 2296 CB TYR A 148 9.433 2.461 10.640 1.00 0.00 C ATOM 2297 CG TYR A 148 9.246 3.311 11.911 1.00 0.00 C ATOM 2298 CD1 TYR A 148 8.602 4.553 11.862 1.00 0.00 C ATOM 2299 CD2 TYR A 148 9.677 2.814 13.148 1.00 0.00 C ATOM 2300 CE1 TYR A 148 8.370 5.276 13.029 1.00 0.00 C ATOM 2301 CE2 TYR A 148 9.459 3.546 14.312 1.00 0.00 C ATOM 2302 CZ TYR A 148 8.799 4.768 14.255 1.00 0.00 C ATOM 2303 OH TYR A 148 8.557 5.460 15.410 1.00 0.00 O ATOM 0 H TYR A 148 9.600 0.740 8.954 1.00 0.00 H new ATOM 0 HA TYR A 148 7.742 1.154 11.149 1.00 0.00 H new ATOM 0 HB2 TYR A 148 10.291 1.804 10.779 1.00 0.00 H new ATOM 0 HB3 TYR A 148 9.669 3.122 9.806 1.00 0.00 H new ATOM 0 HD1 TYR A 148 8.283 4.954 10.911 1.00 0.00 H new ATOM 0 HD2 TYR A 148 10.180 1.860 13.199 1.00 0.00 H new ATOM 0 HE1 TYR A 148 7.860 6.227 12.985 1.00 0.00 H new ATOM 0 HE2 TYR A 148 9.803 3.164 15.261 1.00 0.00 H new ATOM 0 HH TYR A 148 8.922 4.963 16.172 1.00 0.00 H new ATOM 2313 N PHE A 149 6.070 2.743 10.511 1.00 0.00 N ATOM 2314 CA PHE A 149 4.772 3.376 10.182 1.00 0.00 C ATOM 2315 C PHE A 149 4.695 4.899 10.566 1.00 0.00 C ATOM 2316 O PHE A 149 4.559 5.196 11.758 1.00 0.00 O ATOM 2317 CB PHE A 149 3.822 2.431 11.007 1.00 0.00 C ATOM 2318 CG PHE A 149 2.315 2.399 10.736 1.00 0.00 C ATOM 2319 CD1 PHE A 149 1.831 1.777 9.581 1.00 0.00 C ATOM 2320 CD2 PHE A 149 1.414 2.788 11.733 1.00 0.00 C ATOM 2321 CE1 PHE A 149 0.465 1.560 9.418 1.00 0.00 C ATOM 2322 CE2 PHE A 149 0.047 2.574 11.567 1.00 0.00 C ATOM 2323 CZ PHE A 149 -0.426 1.957 10.411 1.00 0.00 C ATOM 0 H PHE A 149 6.164 2.538 11.506 1.00 0.00 H new ATOM 0 HA PHE A 149 4.532 3.440 9.121 1.00 0.00 H new ATOM 0 HB2 PHE A 149 4.192 1.414 10.877 1.00 0.00 H new ATOM 0 HB3 PHE A 149 3.952 2.686 12.059 1.00 0.00 H new ATOM 0 HD1 PHE A 149 2.520 1.463 8.811 1.00 0.00 H new ATOM 0 HD2 PHE A 149 1.779 3.256 12.635 1.00 0.00 H new ATOM 0 HE1 PHE A 149 0.097 1.084 8.521 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -0.646 2.886 12.334 1.00 0.00 H new ATOM 0 HZ PHE A 149 -1.485 1.787 10.285 1.00 0.00 H new ATOM 2333 N GLN A 150 4.782 5.880 9.622 1.00 0.00 N ATOM 2334 CA GLN A 150 4.641 7.334 9.990 1.00 0.00 C ATOM 2335 C GLN A 150 3.809 8.174 8.945 1.00 0.00 C ATOM 2336 O GLN A 150 3.662 7.808 7.776 1.00 0.00 O ATOM 2337 CB GLN A 150 6.056 7.941 10.243 1.00 0.00 C ATOM 2338 CG GLN A 150 7.092 7.907 9.086 1.00 0.00 C ATOM 2339 CD GLN A 150 8.034 9.117 9.027 1.00 0.00 C ATOM 2340 OE1 GLN A 150 7.609 10.268 9.044 1.00 0.00 O ATOM 2341 NE2 GLN A 150 9.325 8.922 8.927 1.00 0.00 N ATOM 0 H GLN A 150 4.944 5.707 8.630 1.00 0.00 H new ATOM 0 HA GLN A 150 4.057 7.388 10.909 1.00 0.00 H new ATOM 0 HB2 GLN A 150 5.923 8.982 10.539 1.00 0.00 H new ATOM 0 HB3 GLN A 150 6.493 7.421 11.095 1.00 0.00 H new ATOM 0 HG2 GLN A 150 7.692 7.002 9.181 1.00 0.00 H new ATOM 0 HG3 GLN A 150 6.556 7.836 8.140 1.00 0.00 H new ATOM 0 HE21 GLN A 150 9.698 7.973 8.911 1.00 0.00 H new ATOM 0 HE22 GLN A 150 9.958 9.719 8.865 1.00 0.00 H new ATOM 2350 N GLU A 151 3.254 9.327 9.373 1.00 0.00 N ATOM 2351 CA GLU A 151 2.411 10.204 8.505 1.00 0.00 C ATOM 2352 C GLU A 151 2.961 11.666 8.429 1.00 0.00 C ATOM 2353 O GLU A 151 3.138 12.322 9.460 1.00 0.00 O ATOM 2354 CB GLU A 151 0.977 10.244 9.102 1.00 0.00 C ATOM 2355 CG GLU A 151 -0.106 10.782 8.129 1.00 0.00 C ATOM 2356 CD GLU A 151 -1.501 10.770 8.722 1.00 0.00 C ATOM 2357 OE1 GLU A 151 -2.201 9.745 8.584 1.00 0.00 O ATOM 2358 OE2 GLU A 151 -1.908 11.786 9.323 1.00 0.00 O ATOM 0 H GLU A 151 3.371 9.683 10.322 1.00 0.00 H new ATOM 0 HA GLU A 151 2.419 9.792 7.496 1.00 0.00 H new ATOM 0 HB2 GLU A 151 0.699 9.238 9.416 1.00 0.00 H new ATOM 0 HB3 GLU A 151 0.986 10.866 9.997 1.00 0.00 H new ATOM 0 HG2 GLU A 151 0.150 11.801 7.839 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -0.099 10.181 7.220 1.00 0.00 H new ATOM 2365 N ASP A 152 3.238 12.141 7.199 1.00 0.00 N ATOM 2366 CA ASP A 152 3.586 13.566 6.867 1.00 0.00 C ATOM 2367 C ASP A 152 4.611 14.343 7.788 1.00 0.00 C ATOM 2368 O ASP A 152 5.347 13.764 8.597 1.00 0.00 O ATOM 2369 CB ASP A 152 2.187 14.272 6.724 1.00 0.00 C ATOM 2370 CG ASP A 152 1.486 13.977 5.399 1.00 0.00 C ATOM 2371 OD1 ASP A 152 1.019 12.839 5.192 1.00 0.00 O ATOM 2372 OD2 ASP A 152 1.506 14.848 4.502 1.00 0.00 O ATOM 0 H ASP A 152 3.230 11.540 6.375 1.00 0.00 H new ATOM 0 HA ASP A 152 4.189 13.576 5.959 1.00 0.00 H new ATOM 0 HB2 ASP A 152 1.544 13.954 7.545 1.00 0.00 H new ATOM 0 HB3 ASP A 152 2.321 15.349 6.823 1.00 0.00 H new ATOM 2377 N GLU A 153 4.760 15.653 7.521 1.00 0.00 N ATOM 2378 CA GLU A 153 5.643 16.590 8.263 1.00 0.00 C ATOM 2379 C GLU A 153 5.137 18.036 7.991 1.00 0.00 C ATOM 2380 O GLU A 153 4.983 18.797 8.975 1.00 0.00 O ATOM 2381 CB GLU A 153 7.150 16.436 7.896 1.00 0.00 C ATOM 2382 CG GLU A 153 7.552 16.466 6.393 1.00 0.00 C ATOM 2383 CD GLU A 153 8.995 16.094 6.099 1.00 0.00 C ATOM 2384 OE1 GLU A 153 9.397 14.953 6.422 1.00 0.00 O ATOM 2385 OE2 GLU A 153 9.724 16.915 5.511 1.00 0.00 O ATOM 2386 OXT GLU A 153 4.890 18.424 6.821 1.00 0.00 O ATOM 0 H GLU A 153 4.256 16.109 6.760 1.00 0.00 H new ATOM 0 HA GLU A 153 5.588 16.356 9.326 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.698 17.231 8.402 1.00 0.00 H new ATOM 0 HB3 GLU A 153 7.499 15.492 8.314 1.00 0.00 H new ATOM 0 HG2 GLU A 153 6.900 15.785 5.846 1.00 0.00 H new ATOM 0 HG3 GLU A 153 7.366 17.467 6.004 1.00 0.00 H new