USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 834 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 23 ASN : amide:sc= -0.509! C(o=0.74!,f=-9.4!) USER MOD Set 1.2: B 205 LYS NZ :NH3+ 177:sc= 1.25 (180deg=-0.0193) USER MOD Set 2.1: A 46 ASN : amide:sc= -0.169 K(o=-0.053,f=-5.5!) USER MOD Set 2.2: A 47 SER OG : rot 41:sc= 0.116 USER MOD Single : A 1 SER N :NH3+ -168:sc= 1.14 (180deg=1) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 CYS SG : rot 82:sc= 1.27 USER MOD Single : A 8 LYS NZ :NH3+ -157:sc= 1.26 (180deg=1.18) USER MOD Single : A 10 MET CE :methyl 172:sc= -3.17 (180deg=-3.64) USER MOD Single : A 11 SER OG : rot -82:sc= 1.19 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ -178:sc= 1.26 (180deg=1.17) USER MOD Single : A 17 GLN : amide:sc= -1.28 K(o=-1.3,f=-5.9!) USER MOD Single : A 19 SER OG : rot -51:sc= 1.18 USER MOD Single : A 24 LYS NZ :NH3+ -165:sc= -0.0077 (180deg=-0.205) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 38 GLN : amide:sc= -3.58! C(o=-3.6!,f=-7.7!) USER MOD Single : A 39 SER OG : rot -74:sc= 1.22 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0358 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot -7:sc= -1.23! USER MOD Single : A 60 LYS NZ :NH3+ -163:sc= 2.09 (180deg=1.46) USER MOD Single : A 62 SER OG : rot 180:sc= 0.0963 USER MOD Single : A 63 THR OG1 : rot 161:sc= 1.29 USER MOD Single : A 70 TYR OH : rot 171:sc= 1.24 USER MOD Single : A 72 THR OG1 : rot -14:sc= 1.27 USER MOD Single : A 73 SER OG : rot -56:sc= 1.23 USER MOD Single : A 74 CYS SG : rot 180:sc= -1.2 USER MOD Single : A 77 LYS NZ :NH3+ 171:sc= -0.0157 (180deg=-0.147) USER MOD Single : A 78 LYS NZ :NH3+ 160:sc= -0.114 (180deg=-0.504) USER MOD Single : A 80 LYS NZ :NH3+ -145:sc= 1.28 (180deg=0.792) USER MOD Single : A 82 GLN : amide:sc= -3.09! C(o=-3.1!,f=-11!) USER MOD Single : B 204 LYS NZ :NH3+ 156:sc= 0.182 (180deg=-0.446!) USER MOD Single : B 206 LYS NZ :NH3+ -169:sc= -0.0102 (180deg=-0.135) USER MOD Single : B 208 LYS NZ :NH3+ 167:sc= 2.55 (180deg=1.92) USER MOD Single : B 209 LYS NZ :NH3+ 148:sc= 1.25 (180deg=1.17) USER MOD Single : B 211 GLN : amide:sc= 0.331 X(o=0.33,f=0.017) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -21.765 1.751 9.053 1.00 0.00 N ATOM 2 CA SER A 1 -22.050 1.908 7.612 1.00 0.00 C ATOM 3 C SER A 1 -21.432 3.185 7.070 1.00 0.00 C ATOM 4 O SER A 1 -21.158 3.293 5.873 1.00 0.00 O ATOM 5 CB SER A 1 -23.559 1.914 7.374 1.00 0.00 C ATOM 6 OG SER A 1 -24.183 0.835 8.051 1.00 0.00 O ATOM 0 H1 SER A 1 -22.016 0.788 9.354 1.00 0.00 H new ATOM 0 H2 SER A 1 -20.753 1.915 9.227 1.00 0.00 H new ATOM 0 H3 SER A 1 -22.325 2.440 9.595 1.00 0.00 H new ATOM 0 HA SER A 1 -21.607 1.064 7.083 1.00 0.00 H new ATOM 0 HB2 SER A 1 -23.982 2.858 7.719 1.00 0.00 H new ATOM 0 HB3 SER A 1 -23.763 1.845 6.305 1.00 0.00 H new ATOM 0 HG SER A 1 -25.149 0.860 7.886 1.00 0.00 H new ATOM 14 N GLU A 2 -21.188 4.143 7.952 1.00 0.00 N ATOM 15 CA GLU A 2 -20.580 5.399 7.554 1.00 0.00 C ATOM 16 C GLU A 2 -19.166 5.187 7.037 1.00 0.00 C ATOM 17 O GLU A 2 -18.647 6.006 6.285 1.00 0.00 O ATOM 18 CB GLU A 2 -20.556 6.379 8.717 1.00 0.00 C ATOM 19 CG GLU A 2 -21.771 7.290 8.769 1.00 0.00 C ATOM 20 CD GLU A 2 -23.052 6.562 9.114 1.00 0.00 C ATOM 21 OE1 GLU A 2 -23.343 6.395 10.316 1.00 0.00 O ATOM 22 OE2 GLU A 2 -23.781 6.163 8.186 1.00 0.00 O ATOM 0 H GLU A 2 -21.402 4.072 8.947 1.00 0.00 H new ATOM 0 HA GLU A 2 -21.187 5.814 6.749 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -20.491 5.820 9.651 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -19.656 6.990 8.648 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -21.597 8.074 9.506 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -21.889 7.781 7.803 1.00 0.00 H new ATOM 29 N GLU A 3 -18.558 4.072 7.426 1.00 0.00 N ATOM 30 CA GLU A 3 -17.200 3.748 7.010 1.00 0.00 C ATOM 31 C GLU A 3 -17.103 3.674 5.488 1.00 0.00 C ATOM 32 O GLU A 3 -16.051 3.943 4.909 1.00 0.00 O ATOM 33 CB GLU A 3 -16.746 2.412 7.614 1.00 0.00 C ATOM 34 CG GLU A 3 -16.702 2.386 9.139 1.00 0.00 C ATOM 35 CD GLU A 3 -18.078 2.402 9.779 1.00 0.00 C ATOM 36 OE1 GLU A 3 -19.037 1.880 9.165 1.00 0.00 O ATOM 37 OE2 GLU A 3 -18.215 2.944 10.894 1.00 0.00 O ATOM 0 H GLU A 3 -18.988 3.374 8.033 1.00 0.00 H new ATOM 0 HA GLU A 3 -16.547 4.542 7.372 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -17.418 1.626 7.270 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -15.754 2.174 7.231 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -16.167 1.494 9.465 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -16.134 3.246 9.494 1.00 0.00 H new ATOM 44 N GLU A 4 -18.210 3.321 4.846 1.00 0.00 N ATOM 45 CA GLU A 4 -18.243 3.173 3.398 1.00 0.00 C ATOM 46 C GLU A 4 -18.293 4.532 2.703 1.00 0.00 C ATOM 47 O GLU A 4 -17.837 4.673 1.570 1.00 0.00 O ATOM 48 CB GLU A 4 -19.445 2.326 2.977 1.00 0.00 C ATOM 49 CG GLU A 4 -19.423 0.913 3.537 1.00 0.00 C ATOM 50 CD GLU A 4 -18.193 0.139 3.113 1.00 0.00 C ATOM 51 OE1 GLU A 4 -18.169 -0.372 1.973 1.00 0.00 O ATOM 52 OE2 GLU A 4 -17.245 0.035 3.918 1.00 0.00 O ATOM 0 H GLU A 4 -19.099 3.132 5.308 1.00 0.00 H new ATOM 0 HA GLU A 4 -17.326 2.669 3.094 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -20.360 2.822 3.302 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -19.479 2.276 1.889 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -19.463 0.957 4.625 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -20.315 0.381 3.206 1.00 0.00 H new ATOM 59 N ASP A 5 -18.837 5.533 3.384 1.00 0.00 N ATOM 60 CA ASP A 5 -18.960 6.862 2.796 1.00 0.00 C ATOM 61 C ASP A 5 -17.839 7.775 3.280 1.00 0.00 C ATOM 62 O ASP A 5 -17.419 8.696 2.575 1.00 0.00 O ATOM 63 CB ASP A 5 -20.327 7.472 3.112 1.00 0.00 C ATOM 64 CG ASP A 5 -20.536 8.815 2.444 1.00 0.00 C ATOM 65 OD1 ASP A 5 -21.009 8.842 1.287 1.00 0.00 O ATOM 66 OD2 ASP A 5 -20.243 9.851 3.075 1.00 0.00 O ATOM 0 H ASP A 5 -19.197 5.452 4.335 1.00 0.00 H new ATOM 0 HA ASP A 5 -18.874 6.761 1.714 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -21.110 6.785 2.791 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -20.428 7.588 4.191 1.00 0.00 H new ATOM 71 N LYS A 6 -17.356 7.505 4.486 1.00 0.00 N ATOM 72 CA LYS A 6 -16.237 8.247 5.061 1.00 0.00 C ATOM 73 C LYS A 6 -14.989 8.065 4.205 1.00 0.00 C ATOM 74 O LYS A 6 -14.199 8.994 4.027 1.00 0.00 O ATOM 75 CB LYS A 6 -15.963 7.773 6.495 1.00 0.00 C ATOM 76 CG LYS A 6 -14.911 8.586 7.237 1.00 0.00 C ATOM 77 CD LYS A 6 -15.359 10.021 7.465 1.00 0.00 C ATOM 78 CE LYS A 6 -14.343 10.788 8.294 1.00 0.00 C ATOM 79 NZ LYS A 6 -14.797 12.170 8.594 1.00 0.00 N ATOM 0 H LYS A 6 -17.724 6.771 5.091 1.00 0.00 H new ATOM 0 HA LYS A 6 -16.498 9.305 5.085 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -16.895 7.806 7.060 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -15.645 6.731 6.465 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -14.699 8.115 8.197 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -13.981 8.582 6.668 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -15.499 10.518 6.505 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -16.324 10.027 7.971 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -14.161 10.256 9.228 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -13.394 10.827 7.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -14.074 12.657 9.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -14.946 12.687 7.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -15.689 12.134 9.127 1.00 0.00 H new ATOM 93 N CYS A 7 -14.828 6.862 3.670 1.00 0.00 N ATOM 94 CA CYS A 7 -13.701 6.557 2.807 1.00 0.00 C ATOM 95 C CYS A 7 -13.988 7.016 1.385 1.00 0.00 C ATOM 96 O CYS A 7 -15.018 6.665 0.804 1.00 0.00 O ATOM 97 CB CYS A 7 -13.417 5.058 2.813 1.00 0.00 C ATOM 98 SG CYS A 7 -13.169 4.366 4.464 1.00 0.00 S ATOM 0 H CYS A 7 -15.467 6.081 3.821 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.826 7.086 3.185 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -14.247 4.539 2.333 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.529 4.864 2.211 1.00 0.00 H new ATOM 0 HG CYS A 7 -14.323 4.132 5.014 1.00 0.00 H new ATOM 104 N LYS A 8 -13.090 7.806 0.832 1.00 0.00 N ATOM 105 CA LYS A 8 -13.241 8.286 -0.529 1.00 0.00 C ATOM 106 C LYS A 8 -12.546 7.351 -1.498 1.00 0.00 C ATOM 107 O LYS A 8 -11.439 6.871 -1.238 1.00 0.00 O ATOM 108 CB LYS A 8 -12.704 9.711 -0.661 1.00 0.00 C ATOM 109 CG LYS A 8 -13.765 10.779 -0.448 1.00 0.00 C ATOM 110 CD LYS A 8 -14.605 10.503 0.788 1.00 0.00 C ATOM 111 CE LYS A 8 -15.689 11.547 0.976 1.00 0.00 C ATOM 112 NZ LYS A 8 -16.518 11.274 2.178 1.00 0.00 N ATOM 0 H LYS A 8 -12.246 8.130 1.304 1.00 0.00 H new ATOM 0 HA LYS A 8 -14.303 8.304 -0.775 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -11.902 9.857 0.062 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -12.267 9.836 -1.652 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.286 11.753 -0.351 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -14.412 10.828 -1.324 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.061 9.516 0.705 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -13.962 10.484 1.668 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -15.232 12.533 1.066 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -16.327 11.571 0.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -17.444 11.736 2.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -16.653 10.248 2.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -16.039 11.647 3.022 1.00 0.00 H new ATOM 126 N PRO A 9 -13.201 7.092 -2.634 1.00 0.00 N ATOM 127 CA PRO A 9 -12.741 6.112 -3.613 1.00 0.00 C ATOM 128 C PRO A 9 -11.420 6.523 -4.244 1.00 0.00 C ATOM 129 O PRO A 9 -11.223 7.687 -4.593 1.00 0.00 O ATOM 130 CB PRO A 9 -13.861 6.077 -4.660 1.00 0.00 C ATOM 131 CG PRO A 9 -14.600 7.360 -4.496 1.00 0.00 C ATOM 132 CD PRO A 9 -14.435 7.772 -3.056 1.00 0.00 C ATOM 0 HA PRO A 9 -12.554 5.138 -3.161 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -13.454 5.985 -5.667 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -14.519 5.222 -4.502 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -14.203 8.124 -5.165 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -15.654 7.234 -4.745 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -14.349 8.854 -2.957 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -15.288 7.464 -2.452 1.00 0.00 H new ATOM 140 N MET A 10 -10.509 5.573 -4.372 1.00 0.00 N ATOM 141 CA MET A 10 -9.197 5.863 -4.921 1.00 0.00 C ATOM 142 C MET A 10 -9.197 5.615 -6.431 1.00 0.00 C ATOM 143 O MET A 10 -9.439 4.493 -6.878 1.00 0.00 O ATOM 144 CB MET A 10 -8.124 4.999 -4.255 1.00 0.00 C ATOM 145 CG MET A 10 -6.710 5.386 -4.649 1.00 0.00 C ATOM 146 SD MET A 10 -6.006 6.660 -3.592 1.00 0.00 S ATOM 147 CE MET A 10 -5.968 5.795 -2.034 1.00 0.00 C ATOM 0 H MET A 10 -10.653 4.599 -4.105 1.00 0.00 H new ATOM 0 HA MET A 10 -8.968 6.910 -4.725 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.226 5.076 -3.173 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.294 3.955 -4.518 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.074 4.501 -4.614 1.00 0.00 H new ATOM 0 HG3 MET A 10 -6.710 5.738 -5.681 1.00 0.00 H new ATOM 0 HE1 MET A 10 -5.428 6.392 -1.299 1.00 0.00 H new ATOM 0 HE2 MET A 10 -6.987 5.627 -1.686 1.00 0.00 H new ATOM 0 HE3 MET A 10 -5.465 4.836 -2.162 1.00 0.00 H new ATOM 157 N SER A 11 -8.933 6.655 -7.207 1.00 0.00 N ATOM 158 CA SER A 11 -8.981 6.556 -8.664 1.00 0.00 C ATOM 159 C SER A 11 -7.725 5.877 -9.236 1.00 0.00 C ATOM 160 O SER A 11 -6.796 5.555 -8.490 1.00 0.00 O ATOM 161 CB SER A 11 -9.163 7.949 -9.275 1.00 0.00 C ATOM 162 OG SER A 11 -8.177 8.853 -8.800 1.00 0.00 O ATOM 0 H SER A 11 -8.683 7.579 -6.855 1.00 0.00 H new ATOM 0 HA SER A 11 -9.834 5.931 -8.928 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.105 7.882 -10.361 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.155 8.329 -9.031 1.00 0.00 H new ATOM 0 HG SER A 11 -8.446 9.200 -7.924 1.00 0.00 H new ATOM 168 N TYR A 12 -7.695 5.671 -10.555 1.00 0.00 N ATOM 169 CA TYR A 12 -6.577 4.991 -11.214 1.00 0.00 C ATOM 170 C TYR A 12 -5.269 5.763 -11.022 1.00 0.00 C ATOM 171 O TYR A 12 -4.250 5.190 -10.623 1.00 0.00 O ATOM 172 CB TYR A 12 -6.905 4.783 -12.708 1.00 0.00 C ATOM 173 CG TYR A 12 -5.757 5.024 -13.677 1.00 0.00 C ATOM 174 CD1 TYR A 12 -4.692 4.139 -13.772 1.00 0.00 C ATOM 175 CD2 TYR A 12 -5.759 6.133 -14.515 1.00 0.00 C ATOM 176 CE1 TYR A 12 -3.662 4.352 -14.667 1.00 0.00 C ATOM 177 CE2 TYR A 12 -4.732 6.353 -15.411 1.00 0.00 C ATOM 178 CZ TYR A 12 -3.687 5.461 -15.484 1.00 0.00 C ATOM 179 OH TYR A 12 -2.664 5.676 -16.381 1.00 0.00 O ATOM 0 H TYR A 12 -8.436 5.967 -11.190 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.435 4.013 -10.754 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.262 3.762 -12.844 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -7.727 5.446 -12.976 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.668 3.268 -13.134 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -6.578 6.835 -14.464 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -2.841 3.653 -14.726 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -4.749 7.222 -16.052 1.00 0.00 H new ATOM 0 HH TYR A 12 -2.835 6.501 -16.881 1.00 0.00 H new ATOM 189 N GLU A 13 -5.314 7.063 -11.283 1.00 0.00 N ATOM 190 CA GLU A 13 -4.155 7.939 -11.118 1.00 0.00 C ATOM 191 C GLU A 13 -3.629 7.883 -9.691 1.00 0.00 C ATOM 192 O GLU A 13 -2.427 8.014 -9.449 1.00 0.00 O ATOM 193 CB GLU A 13 -4.564 9.372 -11.460 1.00 0.00 C ATOM 194 CG GLU A 13 -4.846 9.586 -12.940 1.00 0.00 C ATOM 195 CD GLU A 13 -3.594 9.901 -13.724 1.00 0.00 C ATOM 196 OE1 GLU A 13 -2.895 10.876 -13.370 1.00 0.00 O ATOM 197 OE2 GLU A 13 -3.290 9.170 -14.686 1.00 0.00 O ATOM 0 H GLU A 13 -6.152 7.542 -11.614 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.361 7.604 -11.786 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -5.454 9.634 -10.887 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.772 10.052 -11.147 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -5.314 8.691 -13.351 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -5.560 10.401 -13.057 1.00 0.00 H new ATOM 204 N GLU A 14 -4.538 7.675 -8.756 1.00 0.00 N ATOM 205 CA GLU A 14 -4.208 7.638 -7.350 1.00 0.00 C ATOM 206 C GLU A 14 -3.593 6.301 -6.962 1.00 0.00 C ATOM 207 O GLU A 14 -2.559 6.263 -6.311 1.00 0.00 O ATOM 208 CB GLU A 14 -5.458 7.891 -6.536 1.00 0.00 C ATOM 209 CG GLU A 14 -5.909 9.338 -6.530 1.00 0.00 C ATOM 210 CD GLU A 14 -7.172 9.540 -5.719 1.00 0.00 C ATOM 211 OE1 GLU A 14 -8.257 9.134 -6.189 1.00 0.00 O ATOM 212 OE2 GLU A 14 -7.088 10.103 -4.605 1.00 0.00 O ATOM 0 H GLU A 14 -5.527 7.527 -8.955 1.00 0.00 H new ATOM 0 HA GLU A 14 -3.471 8.415 -7.146 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.265 7.271 -6.927 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -5.281 7.572 -5.509 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -5.114 9.963 -6.123 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.081 9.668 -7.555 1.00 0.00 H new ATOM 219 N LYS A 15 -4.236 5.205 -7.365 1.00 0.00 N ATOM 220 CA LYS A 15 -3.699 3.865 -7.110 1.00 0.00 C ATOM 221 C LYS A 15 -2.282 3.744 -7.672 1.00 0.00 C ATOM 222 O LYS A 15 -1.437 3.047 -7.111 1.00 0.00 O ATOM 223 CB LYS A 15 -4.583 2.784 -7.722 1.00 0.00 C ATOM 224 CG LYS A 15 -5.917 2.608 -7.039 1.00 0.00 C ATOM 225 CD LYS A 15 -6.938 2.091 -8.022 1.00 0.00 C ATOM 226 CE LYS A 15 -7.964 1.221 -7.335 1.00 0.00 C ATOM 227 NZ LYS A 15 -8.909 0.599 -8.301 1.00 0.00 N ATOM 0 H LYS A 15 -5.124 5.216 -7.866 1.00 0.00 H new ATOM 0 HA LYS A 15 -3.677 3.721 -6.030 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -4.755 3.023 -8.771 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -4.047 1.835 -7.695 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.819 1.913 -6.205 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -6.250 3.559 -6.623 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -7.436 2.930 -8.509 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -6.438 1.520 -8.804 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -7.456 0.439 -6.771 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -8.523 1.820 -6.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -9.616 0.038 -7.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -9.389 1.344 -8.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -8.384 -0.021 -8.950 1.00 0.00 H new ATOM 241 N ARG A 16 -2.036 4.428 -8.790 1.00 0.00 N ATOM 242 CA ARG A 16 -0.698 4.495 -9.366 1.00 0.00 C ATOM 243 C ARG A 16 0.253 5.202 -8.411 1.00 0.00 C ATOM 244 O ARG A 16 1.286 4.650 -8.039 1.00 0.00 O ATOM 245 CB ARG A 16 -0.704 5.224 -10.706 1.00 0.00 C ATOM 246 CG ARG A 16 0.679 5.314 -11.315 1.00 0.00 C ATOM 247 CD ARG A 16 0.734 6.286 -12.467 1.00 0.00 C ATOM 248 NE ARG A 16 0.405 7.647 -12.051 1.00 0.00 N ATOM 249 CZ ARG A 16 -0.497 8.411 -12.655 1.00 0.00 C ATOM 250 NH1 ARG A 16 -1.137 7.966 -13.728 1.00 0.00 N ATOM 251 NH2 ARG A 16 -0.746 9.630 -12.196 1.00 0.00 N ATOM 0 H ARG A 16 -2.746 4.942 -9.312 1.00 0.00 H new ATOM 0 HA ARG A 16 -0.360 3.472 -9.530 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -1.370 4.706 -11.396 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -1.105 6.228 -10.569 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.392 5.621 -10.549 1.00 0.00 H new ATOM 0 HG3 ARG A 16 0.987 4.327 -11.660 1.00 0.00 H new ATOM 0 HD2 ARG A 16 1.732 6.272 -12.906 1.00 0.00 H new ATOM 0 HD3 ARG A 16 0.040 5.967 -13.244 1.00 0.00 H new ATOM 0 HE ARG A 16 0.899 8.034 -11.247 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -0.937 7.034 -14.091 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -1.830 8.556 -14.190 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -0.245 9.980 -11.380 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -1.439 10.218 -12.659 1.00 0.00 H new ATOM 265 N GLN A 17 -0.113 6.421 -8.018 1.00 0.00 N ATOM 266 CA GLN A 17 0.682 7.205 -7.079 1.00 0.00 C ATOM 267 C GLN A 17 0.920 6.412 -5.801 1.00 0.00 C ATOM 268 O GLN A 17 2.023 6.393 -5.264 1.00 0.00 O ATOM 269 CB GLN A 17 -0.026 8.523 -6.762 1.00 0.00 C ATOM 270 CG GLN A 17 0.813 9.479 -5.932 1.00 0.00 C ATOM 271 CD GLN A 17 1.985 10.061 -6.699 1.00 0.00 C ATOM 272 OE1 GLN A 17 2.544 9.422 -7.590 1.00 0.00 O ATOM 273 NE2 GLN A 17 2.361 11.284 -6.364 1.00 0.00 N ATOM 0 H GLN A 17 -0.961 6.888 -8.339 1.00 0.00 H new ATOM 0 HA GLN A 17 1.647 7.427 -7.535 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -0.301 9.012 -7.696 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -0.952 8.309 -6.229 1.00 0.00 H new ATOM 0 HG2 GLN A 17 0.181 10.292 -5.575 1.00 0.00 H new ATOM 0 HG3 GLN A 17 1.186 8.955 -5.052 1.00 0.00 H new ATOM 0 HE21 GLN A 17 1.873 11.782 -5.620 1.00 0.00 H new ATOM 0 HE22 GLN A 17 3.139 11.729 -6.850 1.00 0.00 H new ATOM 282 N LEU A 18 -0.128 5.739 -5.360 1.00 0.00 N ATOM 283 CA LEU A 18 -0.089 4.876 -4.186 1.00 0.00 C ATOM 284 C LEU A 18 0.965 3.785 -4.360 1.00 0.00 C ATOM 285 O LEU A 18 1.814 3.569 -3.505 1.00 0.00 O ATOM 286 CB LEU A 18 -1.463 4.239 -4.003 1.00 0.00 C ATOM 287 CG LEU A 18 -1.885 3.881 -2.582 1.00 0.00 C ATOM 288 CD1 LEU A 18 -3.196 3.141 -2.632 1.00 0.00 C ATOM 289 CD2 LEU A 18 -0.844 3.049 -1.860 1.00 0.00 C ATOM 0 H LEU A 18 -1.042 5.775 -5.810 1.00 0.00 H new ATOM 0 HA LEU A 18 0.171 5.468 -3.309 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.208 4.920 -4.414 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.496 3.330 -4.604 1.00 0.00 H new ATOM 0 HG LEU A 18 -1.992 4.808 -2.019 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -3.506 2.881 -1.620 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.954 3.775 -3.092 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -3.078 2.231 -3.221 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -1.194 2.822 -0.853 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -0.679 2.120 -2.405 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.091 3.606 -1.802 1.00 0.00 H new ATOM 301 N SER A 19 0.913 3.097 -5.482 1.00 0.00 N ATOM 302 CA SER A 19 1.847 2.019 -5.738 1.00 0.00 C ATOM 303 C SER A 19 3.276 2.565 -5.806 1.00 0.00 C ATOM 304 O SER A 19 4.249 1.849 -5.557 1.00 0.00 O ATOM 305 CB SER A 19 1.450 1.298 -7.027 1.00 0.00 C ATOM 306 OG SER A 19 1.955 1.953 -8.179 1.00 0.00 O ATOM 0 H SER A 19 0.238 3.263 -6.228 1.00 0.00 H new ATOM 0 HA SER A 19 1.814 1.297 -4.922 1.00 0.00 H new ATOM 0 HB2 SER A 19 1.823 0.274 -6.999 1.00 0.00 H new ATOM 0 HB3 SER A 19 0.363 1.240 -7.090 1.00 0.00 H new ATOM 0 HG SER A 19 1.724 2.905 -8.142 1.00 0.00 H new ATOM 312 N LEU A 20 3.381 3.853 -6.098 1.00 0.00 N ATOM 313 CA LEU A 20 4.663 4.524 -6.195 1.00 0.00 C ATOM 314 C LEU A 20 5.128 5.012 -4.820 1.00 0.00 C ATOM 315 O LEU A 20 6.325 5.013 -4.529 1.00 0.00 O ATOM 316 CB LEU A 20 4.562 5.677 -7.190 1.00 0.00 C ATOM 317 CG LEU A 20 4.234 5.257 -8.619 1.00 0.00 C ATOM 318 CD1 LEU A 20 4.313 6.448 -9.543 1.00 0.00 C ATOM 319 CD2 LEU A 20 5.164 4.151 -9.080 1.00 0.00 C ATOM 0 H LEU A 20 2.580 4.459 -6.274 1.00 0.00 H new ATOM 0 HA LEU A 20 5.410 3.817 -6.557 1.00 0.00 H new ATOM 0 HB2 LEU A 20 3.796 6.371 -6.845 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.507 6.221 -7.193 1.00 0.00 H new ATOM 0 HG LEU A 20 3.216 4.869 -8.643 1.00 0.00 H new ATOM 0 HD11 LEU A 20 4.077 6.136 -10.560 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.599 7.206 -9.221 1.00 0.00 H new ATOM 0 HD13 LEU A 20 5.320 6.864 -9.516 1.00 0.00 H new ATOM 0 HD21 LEU A 20 4.913 3.866 -10.102 1.00 0.00 H new ATOM 0 HD22 LEU A 20 6.195 4.504 -9.045 1.00 0.00 H new ATOM 0 HD23 LEU A 20 5.054 3.287 -8.425 1.00 0.00 H new ATOM 331 N ASP A 21 4.183 5.414 -3.974 1.00 0.00 N ATOM 332 CA ASP A 21 4.499 5.825 -2.605 1.00 0.00 C ATOM 333 C ASP A 21 4.780 4.606 -1.724 1.00 0.00 C ATOM 334 O ASP A 21 5.630 4.652 -0.833 1.00 0.00 O ATOM 335 CB ASP A 21 3.410 6.744 -2.023 1.00 0.00 C ATOM 336 CG ASP A 21 2.028 6.129 -1.887 1.00 0.00 C ATOM 337 OD1 ASP A 21 1.898 5.050 -1.284 1.00 0.00 O ATOM 338 OD2 ASP A 21 1.058 6.771 -2.352 1.00 0.00 O ATOM 0 H ASP A 21 3.192 5.465 -4.210 1.00 0.00 H new ATOM 0 HA ASP A 21 5.413 6.419 -2.628 1.00 0.00 H new ATOM 0 HB2 ASP A 21 3.735 7.082 -1.039 1.00 0.00 H new ATOM 0 HB3 ASP A 21 3.332 7.629 -2.655 1.00 0.00 H new ATOM 343 N ILE A 22 4.108 3.502 -2.008 1.00 0.00 N ATOM 344 CA ILE A 22 4.425 2.230 -1.380 1.00 0.00 C ATOM 345 C ILE A 22 5.827 1.781 -1.764 1.00 0.00 C ATOM 346 O ILE A 22 6.564 1.222 -0.953 1.00 0.00 O ATOM 347 CB ILE A 22 3.391 1.163 -1.787 1.00 0.00 C ATOM 348 CG1 ILE A 22 2.254 1.149 -0.772 1.00 0.00 C ATOM 349 CG2 ILE A 22 4.017 -0.217 -1.938 1.00 0.00 C ATOM 350 CD1 ILE A 22 1.079 0.291 -1.180 1.00 0.00 C ATOM 0 H ILE A 22 3.336 3.462 -2.673 1.00 0.00 H new ATOM 0 HA ILE A 22 4.388 2.358 -0.298 1.00 0.00 H new ATOM 0 HB ILE A 22 2.994 1.426 -2.768 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.638 0.792 0.184 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.908 2.171 -0.615 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.249 -0.935 -2.226 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.789 -0.184 -2.706 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.461 -0.521 -0.990 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.312 0.333 -0.407 1.00 0.00 H new ATOM 0 HD12 ILE A 22 0.668 0.660 -2.119 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.409 -0.740 -1.309 1.00 0.00 H new ATOM 362 N ASN A 23 6.194 2.054 -3.005 1.00 0.00 N ATOM 363 CA ASN A 23 7.498 1.681 -3.518 1.00 0.00 C ATOM 364 C ASN A 23 8.595 2.525 -2.860 1.00 0.00 C ATOM 365 O ASN A 23 9.777 2.192 -2.916 1.00 0.00 O ATOM 366 CB ASN A 23 7.503 1.864 -5.034 1.00 0.00 C ATOM 367 CG ASN A 23 8.733 1.286 -5.710 1.00 0.00 C ATOM 368 OD1 ASN A 23 8.758 0.103 -6.061 1.00 0.00 O ATOM 369 ND2 ASN A 23 9.744 2.110 -5.929 1.00 0.00 N ATOM 0 H ASN A 23 5.600 2.537 -3.679 1.00 0.00 H new ATOM 0 HA ASN A 23 7.701 0.636 -3.282 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.613 1.393 -5.452 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.438 2.928 -5.264 1.00 0.00 H new ATOM 0 HD21 ASN A 23 10.582 1.774 -6.403 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.685 3.081 -5.624 1.00 0.00 H new ATOM 376 N LYS A 24 8.184 3.620 -2.231 1.00 0.00 N ATOM 377 CA LYS A 24 9.100 4.503 -1.522 1.00 0.00 C ATOM 378 C LYS A 24 9.404 3.979 -0.120 1.00 0.00 C ATOM 379 O LYS A 24 10.418 4.347 0.480 1.00 0.00 O ATOM 380 CB LYS A 24 8.497 5.900 -1.414 1.00 0.00 C ATOM 381 CG LYS A 24 8.713 6.778 -2.635 1.00 0.00 C ATOM 382 CD LYS A 24 7.901 8.062 -2.534 1.00 0.00 C ATOM 383 CE LYS A 24 8.320 9.090 -3.575 1.00 0.00 C ATOM 384 NZ LYS A 24 9.683 9.620 -3.314 1.00 0.00 N ATOM 0 H LYS A 24 7.209 3.919 -2.199 1.00 0.00 H new ATOM 0 HA LYS A 24 10.031 4.541 -2.088 1.00 0.00 H new ATOM 0 HB2 LYS A 24 7.426 5.806 -1.235 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.923 6.399 -0.544 1.00 0.00 H new ATOM 0 HG2 LYS A 24 9.772 7.020 -2.731 1.00 0.00 H new ATOM 0 HG3 LYS A 24 8.428 6.233 -3.535 1.00 0.00 H new ATOM 0 HD2 LYS A 24 6.843 7.832 -2.659 1.00 0.00 H new ATOM 0 HD3 LYS A 24 8.019 8.487 -1.537 1.00 0.00 H new ATOM 0 HE2 LYS A 24 8.291 8.636 -4.566 1.00 0.00 H new ATOM 0 HE3 LYS A 24 7.605 9.913 -3.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 9.834 10.482 -3.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 9.781 9.844 -2.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 10.390 8.906 -3.580 1.00 0.00 H new ATOM 398 N LEU A 25 8.518 3.137 0.397 1.00 0.00 N ATOM 399 CA LEU A 25 8.655 2.609 1.751 1.00 0.00 C ATOM 400 C LEU A 25 9.807 1.616 1.865 1.00 0.00 C ATOM 401 O LEU A 25 9.948 0.716 1.036 1.00 0.00 O ATOM 402 CB LEU A 25 7.361 1.939 2.203 1.00 0.00 C ATOM 403 CG LEU A 25 6.197 2.883 2.477 1.00 0.00 C ATOM 404 CD1 LEU A 25 5.137 2.149 3.253 1.00 0.00 C ATOM 405 CD2 LEU A 25 6.658 4.093 3.256 1.00 0.00 C ATOM 0 H LEU A 25 7.693 2.803 -0.102 1.00 0.00 H new ATOM 0 HA LEU A 25 8.872 3.458 2.399 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.055 1.225 1.438 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.565 1.368 3.109 1.00 0.00 H new ATOM 0 HG LEU A 25 5.790 3.226 1.526 1.00 0.00 H new ATOM 0 HD11 LEU A 25 4.301 2.820 3.452 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.787 1.295 2.673 1.00 0.00 H new ATOM 0 HD13 LEU A 25 5.554 1.799 4.197 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.810 4.752 3.440 1.00 0.00 H new ATOM 0 HD22 LEU A 25 7.082 3.773 4.208 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.416 4.628 2.683 1.00 0.00 H new ATOM 417 N PRO A 26 10.648 1.771 2.907 1.00 0.00 N ATOM 418 CA PRO A 26 11.755 0.851 3.165 1.00 0.00 C ATOM 419 C PRO A 26 11.258 -0.513 3.630 1.00 0.00 C ATOM 420 O PRO A 26 10.125 -0.627 4.097 1.00 0.00 O ATOM 421 CB PRO A 26 12.556 1.537 4.274 1.00 0.00 C ATOM 422 CG PRO A 26 11.588 2.447 4.949 1.00 0.00 C ATOM 423 CD PRO A 26 10.577 2.852 3.908 1.00 0.00 C ATOM 0 HA PRO A 26 12.343 0.659 2.268 1.00 0.00 H new ATOM 0 HB2 PRO A 26 12.964 0.808 4.974 1.00 0.00 H new ATOM 0 HB3 PRO A 26 13.399 2.093 3.864 1.00 0.00 H new ATOM 0 HG2 PRO A 26 11.102 1.944 5.785 1.00 0.00 H new ATOM 0 HG3 PRO A 26 12.097 3.321 5.355 1.00 0.00 H new ATOM 0 HD2 PRO A 26 9.577 2.938 4.334 1.00 0.00 H new ATOM 0 HD3 PRO A 26 10.821 3.820 3.469 1.00 0.00 H new ATOM 431 N GLY A 27 12.109 -1.526 3.517 1.00 0.00 N ATOM 432 CA GLY A 27 11.699 -2.902 3.763 1.00 0.00 C ATOM 433 C GLY A 27 10.919 -3.103 5.052 1.00 0.00 C ATOM 434 O GLY A 27 9.911 -3.813 5.069 1.00 0.00 O ATOM 0 H GLY A 27 13.089 -1.419 3.256 1.00 0.00 H new ATOM 0 HA2 GLY A 27 11.089 -3.242 2.926 1.00 0.00 H new ATOM 0 HA3 GLY A 27 12.587 -3.534 3.787 1.00 0.00 H new ATOM 438 N GLU A 28 11.370 -2.477 6.127 1.00 0.00 N ATOM 439 CA GLU A 28 10.706 -2.621 7.415 1.00 0.00 C ATOM 440 C GLU A 28 9.342 -1.923 7.429 1.00 0.00 C ATOM 441 O GLU A 28 8.349 -2.481 7.910 1.00 0.00 O ATOM 442 CB GLU A 28 11.591 -2.126 8.571 1.00 0.00 C ATOM 443 CG GLU A 28 12.422 -0.886 8.283 1.00 0.00 C ATOM 444 CD GLU A 28 13.663 -1.172 7.459 1.00 0.00 C ATOM 445 OE1 GLU A 28 14.664 -1.653 8.028 1.00 0.00 O ATOM 446 OE2 GLU A 28 13.646 -0.905 6.243 1.00 0.00 O ATOM 0 H GLU A 28 12.188 -1.868 6.135 1.00 0.00 H new ATOM 0 HA GLU A 28 10.534 -3.687 7.565 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.953 -1.921 9.430 1.00 0.00 H new ATOM 0 HB3 GLU A 28 12.265 -2.933 8.859 1.00 0.00 H new ATOM 0 HG2 GLU A 28 11.805 -0.158 7.756 1.00 0.00 H new ATOM 0 HG3 GLU A 28 12.719 -0.429 9.227 1.00 0.00 H new ATOM 453 N LYS A 29 9.276 -0.729 6.857 1.00 0.00 N ATOM 454 CA LYS A 29 8.038 0.045 6.874 1.00 0.00 C ATOM 455 C LYS A 29 7.031 -0.519 5.875 1.00 0.00 C ATOM 456 O LYS A 29 5.824 -0.421 6.069 1.00 0.00 O ATOM 457 CB LYS A 29 8.317 1.517 6.543 1.00 0.00 C ATOM 458 CG LYS A 29 8.488 2.436 7.765 1.00 0.00 C ATOM 459 CD LYS A 29 9.555 1.915 8.726 1.00 0.00 C ATOM 460 CE LYS A 29 10.573 2.981 9.151 1.00 0.00 C ATOM 461 NZ LYS A 29 11.780 2.369 9.768 1.00 0.00 N ATOM 0 H LYS A 29 10.056 -0.277 6.379 1.00 0.00 H new ATOM 0 HA LYS A 29 7.617 -0.023 7.877 1.00 0.00 H new ATOM 0 HB2 LYS A 29 9.221 1.573 5.936 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.499 1.898 5.932 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.759 3.438 7.431 1.00 0.00 H new ATOM 0 HG3 LYS A 29 7.537 2.522 8.291 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.067 1.516 9.615 1.00 0.00 H new ATOM 0 HD3 LYS A 29 10.084 1.087 8.254 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.867 3.571 8.283 1.00 0.00 H new ATOM 0 HE3 LYS A 29 10.109 3.666 9.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.447 3.118 10.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 11.502 1.826 10.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 12.236 1.734 9.082 1.00 0.00 H new ATOM 475 N LEU A 30 7.521 -1.155 4.823 1.00 0.00 N ATOM 476 CA LEU A 30 6.631 -1.669 3.795 1.00 0.00 C ATOM 477 C LEU A 30 6.014 -3.000 4.218 1.00 0.00 C ATOM 478 O LEU A 30 5.041 -3.460 3.628 1.00 0.00 O ATOM 479 CB LEU A 30 7.345 -1.722 2.428 1.00 0.00 C ATOM 480 CG LEU A 30 7.447 -3.068 1.694 1.00 0.00 C ATOM 481 CD1 LEU A 30 8.087 -2.842 0.341 1.00 0.00 C ATOM 482 CD2 LEU A 30 8.269 -4.081 2.471 1.00 0.00 C ATOM 0 H LEU A 30 8.513 -1.326 4.660 1.00 0.00 H new ATOM 0 HA LEU A 30 5.795 -0.980 3.672 1.00 0.00 H new ATOM 0 HB2 LEU A 30 6.837 -1.022 1.764 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.359 -1.347 2.571 1.00 0.00 H new ATOM 0 HG LEU A 30 6.440 -3.470 1.587 1.00 0.00 H new ATOM 0 HD11 LEU A 30 8.164 -3.792 -0.188 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.476 -2.151 -0.240 1.00 0.00 H new ATOM 0 HD13 LEU A 30 9.083 -2.420 0.476 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.314 -5.017 1.914 1.00 0.00 H new ATOM 0 HD22 LEU A 30 9.278 -3.696 2.616 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.805 -4.258 3.442 1.00 0.00 H new ATOM 494 N GLY A 31 6.559 -3.597 5.268 1.00 0.00 N ATOM 495 CA GLY A 31 5.926 -4.768 5.845 1.00 0.00 C ATOM 496 C GLY A 31 4.605 -4.403 6.497 1.00 0.00 C ATOM 497 O GLY A 31 3.761 -5.263 6.734 1.00 0.00 O ATOM 0 H GLY A 31 7.419 -3.297 5.728 1.00 0.00 H new ATOM 0 HA2 GLY A 31 5.759 -5.516 5.069 1.00 0.00 H new ATOM 0 HA3 GLY A 31 6.589 -5.218 6.584 1.00 0.00 H new ATOM 501 N ARG A 32 4.421 -3.118 6.794 1.00 0.00 N ATOM 502 CA ARG A 32 3.145 -2.649 7.322 1.00 0.00 C ATOM 503 C ARG A 32 2.068 -2.654 6.247 1.00 0.00 C ATOM 504 O ARG A 32 0.941 -3.047 6.518 1.00 0.00 O ATOM 505 CB ARG A 32 3.247 -1.249 7.916 1.00 0.00 C ATOM 506 CG ARG A 32 1.930 -0.735 8.473 1.00 0.00 C ATOM 507 CD ARG A 32 2.054 -0.360 9.939 1.00 0.00 C ATOM 508 NE ARG A 32 2.302 -1.524 10.790 1.00 0.00 N ATOM 509 CZ ARG A 32 2.729 -1.448 12.049 1.00 0.00 C ATOM 510 NH1 ARG A 32 2.953 -0.265 12.611 1.00 0.00 N ATOM 511 NH2 ARG A 32 2.922 -2.556 12.750 1.00 0.00 N ATOM 0 H ARG A 32 5.129 -2.393 6.680 1.00 0.00 H new ATOM 0 HA ARG A 32 2.871 -3.344 8.116 1.00 0.00 H new ATOM 0 HB2 ARG A 32 3.993 -1.253 8.711 1.00 0.00 H new ATOM 0 HB3 ARG A 32 3.602 -0.561 7.149 1.00 0.00 H new ATOM 0 HG2 ARG A 32 1.606 0.134 7.900 1.00 0.00 H new ATOM 0 HG3 ARG A 32 1.161 -1.499 8.356 1.00 0.00 H new ATOM 0 HD2 ARG A 32 2.866 0.356 10.061 1.00 0.00 H new ATOM 0 HD3 ARG A 32 1.140 0.137 10.264 1.00 0.00 H new ATOM 0 HE ARG A 32 2.138 -2.450 10.395 1.00 0.00 H new ATOM 0 HH11 ARG A 32 2.798 0.591 12.078 1.00 0.00 H new ATOM 0 HH12 ARG A 32 3.280 -0.212 13.576 1.00 0.00 H new ATOM 0 HH21 ARG A 32 2.744 -3.466 12.325 1.00 0.00 H new ATOM 0 HH22 ARG A 32 3.249 -2.499 13.714 1.00 0.00 H new ATOM 525 N VAL A 33 2.399 -2.209 5.034 1.00 0.00 N ATOM 526 CA VAL A 33 1.416 -2.209 3.950 1.00 0.00 C ATOM 527 C VAL A 33 0.943 -3.621 3.671 1.00 0.00 C ATOM 528 O VAL A 33 -0.257 -3.866 3.603 1.00 0.00 O ATOM 529 CB VAL A 33 1.918 -1.558 2.640 1.00 0.00 C ATOM 530 CG1 VAL A 33 1.218 -0.233 2.425 1.00 0.00 C ATOM 531 CG2 VAL A 33 3.411 -1.330 2.639 1.00 0.00 C ATOM 0 H VAL A 33 3.320 -1.851 4.780 1.00 0.00 H new ATOM 0 HA VAL A 33 0.589 -1.591 4.301 1.00 0.00 H new ATOM 0 HB VAL A 33 1.687 -2.252 1.832 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.575 0.221 1.501 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.142 -0.397 2.357 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.432 0.431 3.262 1.00 0.00 H new ATOM 0 HG21 VAL A 33 3.708 -0.871 1.696 1.00 0.00 H new ATOM 0 HG22 VAL A 33 3.679 -0.670 3.464 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.925 -2.284 2.756 1.00 0.00 H new ATOM 541 N VAL A 34 1.888 -4.542 3.532 1.00 0.00 N ATOM 542 CA VAL A 34 1.564 -5.973 3.443 1.00 0.00 C ATOM 543 C VAL A 34 0.604 -6.364 4.571 1.00 0.00 C ATOM 544 O VAL A 34 -0.369 -7.070 4.345 1.00 0.00 O ATOM 545 CB VAL A 34 2.838 -6.880 3.507 1.00 0.00 C ATOM 546 CG1 VAL A 34 4.086 -6.125 3.099 1.00 0.00 C ATOM 547 CG2 VAL A 34 3.024 -7.521 4.874 1.00 0.00 C ATOM 0 H VAL A 34 2.885 -4.332 3.478 1.00 0.00 H new ATOM 0 HA VAL A 34 1.092 -6.134 2.474 1.00 0.00 H new ATOM 0 HB VAL A 34 2.676 -7.683 2.788 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.948 -6.789 3.157 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.975 -5.763 2.077 1.00 0.00 H new ATOM 0 HG13 VAL A 34 4.235 -5.278 3.769 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.921 -8.140 4.867 1.00 0.00 H new ATOM 0 HG22 VAL A 34 3.127 -6.742 5.630 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.158 -8.140 5.106 1.00 0.00 H new ATOM 557 N HIS A 35 0.860 -5.853 5.775 1.00 0.00 N ATOM 558 CA HIS A 35 0.079 -6.219 6.945 1.00 0.00 C ATOM 559 C HIS A 35 -1.308 -5.593 6.890 1.00 0.00 C ATOM 560 O HIS A 35 -2.304 -6.270 7.130 1.00 0.00 O ATOM 561 CB HIS A 35 0.812 -5.799 8.223 1.00 0.00 C ATOM 562 CG HIS A 35 0.087 -6.161 9.480 1.00 0.00 C ATOM 563 ND1 HIS A 35 0.218 -7.384 10.101 1.00 0.00 N ATOM 564 CD2 HIS A 35 -0.781 -5.448 10.233 1.00 0.00 C ATOM 565 CE1 HIS A 35 -0.541 -7.408 11.179 1.00 0.00 C ATOM 566 NE2 HIS A 35 -1.155 -6.247 11.282 1.00 0.00 N ATOM 0 H HIS A 35 1.606 -5.182 5.961 1.00 0.00 H new ATOM 0 HA HIS A 35 -0.042 -7.302 6.953 1.00 0.00 H new ATOM 0 HB2 HIS A 35 1.797 -6.265 8.236 1.00 0.00 H new ATOM 0 HB3 HIS A 35 0.970 -4.721 8.203 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -1.116 -4.439 10.043 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -0.642 -8.239 11.862 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -1.805 -5.985 12.023 1.00 0.00 H new ATOM 575 N ILE A 36 -1.369 -4.303 6.580 1.00 0.00 N ATOM 576 CA ILE A 36 -2.642 -3.609 6.430 1.00 0.00 C ATOM 577 C ILE A 36 -3.474 -4.303 5.372 1.00 0.00 C ATOM 578 O ILE A 36 -4.653 -4.577 5.560 1.00 0.00 O ATOM 579 CB ILE A 36 -2.444 -2.138 6.014 1.00 0.00 C ATOM 580 CG1 ILE A 36 -1.650 -1.401 7.092 1.00 0.00 C ATOM 581 CG2 ILE A 36 -3.797 -1.474 5.779 1.00 0.00 C ATOM 582 CD1 ILE A 36 -1.145 -0.046 6.664 1.00 0.00 C ATOM 0 H ILE A 36 -0.549 -3.716 6.427 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.147 -3.631 7.396 1.00 0.00 H new ATOM 0 HB ILE A 36 -1.881 -2.096 5.082 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.279 -1.281 7.974 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -0.801 -2.017 7.388 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.646 -0.435 5.486 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.328 -2.001 4.987 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.384 -1.510 6.696 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.592 0.412 7.484 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.488 -0.158 5.802 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -1.989 0.589 6.396 1.00 0.00 H new ATOM 594 N ILE A 37 -2.821 -4.597 4.271 1.00 0.00 N ATOM 595 CA ILE A 37 -3.437 -5.285 3.164 1.00 0.00 C ATOM 596 C ILE A 37 -3.914 -6.681 3.574 1.00 0.00 C ATOM 597 O ILE A 37 -5.095 -6.946 3.543 1.00 0.00 O ATOM 598 CB ILE A 37 -2.449 -5.341 1.992 1.00 0.00 C ATOM 599 CG1 ILE A 37 -2.363 -3.974 1.326 1.00 0.00 C ATOM 600 CG2 ILE A 37 -2.838 -6.407 0.996 1.00 0.00 C ATOM 601 CD1 ILE A 37 -1.082 -3.758 0.578 1.00 0.00 C ATOM 0 H ILE A 37 -1.840 -4.363 4.119 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.323 -4.736 2.847 1.00 0.00 H new ATOM 0 HB ILE A 37 -1.465 -5.606 2.379 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -3.201 -3.859 0.638 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.467 -3.200 2.086 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -2.118 -6.421 0.178 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.846 -7.379 1.488 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -3.831 -6.191 0.602 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.086 -2.765 0.128 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.241 -3.841 1.266 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.986 -4.511 -0.205 1.00 0.00 H new ATOM 613 N GLN A 38 -3.002 -7.552 3.987 1.00 0.00 N ATOM 614 CA GLN A 38 -3.360 -8.912 4.429 1.00 0.00 C ATOM 615 C GLN A 38 -4.479 -8.914 5.480 1.00 0.00 C ATOM 616 O GLN A 38 -5.335 -9.799 5.481 1.00 0.00 O ATOM 617 CB GLN A 38 -2.143 -9.629 5.023 1.00 0.00 C ATOM 618 CG GLN A 38 -1.048 -9.942 4.025 1.00 0.00 C ATOM 619 CD GLN A 38 0.146 -10.612 4.677 1.00 0.00 C ATOM 620 OE1 GLN A 38 1.283 -10.425 4.256 1.00 0.00 O ATOM 621 NE2 GLN A 38 -0.105 -11.411 5.702 1.00 0.00 N ATOM 0 H GLN A 38 -2.003 -7.349 4.029 1.00 0.00 H new ATOM 0 HA GLN A 38 -3.715 -9.434 3.540 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -1.726 -9.011 5.818 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -2.475 -10.560 5.483 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -1.445 -10.591 3.244 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -0.726 -9.020 3.541 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -1.064 -11.542 6.024 1.00 0.00 H new ATOM 0 HE22 GLN A 38 0.661 -11.896 6.170 1.00 0.00 H new ATOM 630 N SER A 39 -4.460 -7.939 6.385 1.00 0.00 N ATOM 631 CA SER A 39 -5.438 -7.886 7.469 1.00 0.00 C ATOM 632 C SER A 39 -6.790 -7.380 6.972 1.00 0.00 C ATOM 633 O SER A 39 -7.836 -7.953 7.288 1.00 0.00 O ATOM 634 CB SER A 39 -4.924 -6.995 8.606 1.00 0.00 C ATOM 635 OG SER A 39 -4.666 -5.676 8.159 1.00 0.00 O ATOM 0 H SER A 39 -3.781 -7.178 6.390 1.00 0.00 H new ATOM 0 HA SER A 39 -5.576 -8.899 7.846 1.00 0.00 H new ATOM 0 HB2 SER A 39 -5.659 -6.970 9.410 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.012 -7.424 9.021 1.00 0.00 H new ATOM 0 HG SER A 39 -3.846 -5.667 7.622 1.00 0.00 H new ATOM 641 N ARG A 40 -6.764 -6.303 6.198 1.00 0.00 N ATOM 642 CA ARG A 40 -7.984 -5.718 5.655 1.00 0.00 C ATOM 643 C ARG A 40 -8.498 -6.539 4.483 1.00 0.00 C ATOM 644 O ARG A 40 -9.685 -6.527 4.169 1.00 0.00 O ATOM 645 CB ARG A 40 -7.737 -4.259 5.255 1.00 0.00 C ATOM 646 CG ARG A 40 -7.423 -3.400 6.454 1.00 0.00 C ATOM 647 CD ARG A 40 -7.189 -1.955 6.088 1.00 0.00 C ATOM 648 NE ARG A 40 -8.444 -1.208 6.069 1.00 0.00 N ATOM 649 CZ ARG A 40 -8.643 -0.067 6.728 1.00 0.00 C ATOM 650 NH1 ARG A 40 -7.630 0.548 7.328 1.00 0.00 N ATOM 651 NH2 ARG A 40 -9.859 0.457 6.785 1.00 0.00 N ATOM 0 H ARG A 40 -5.909 -5.815 5.931 1.00 0.00 H new ATOM 0 HA ARG A 40 -8.755 -5.730 6.425 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -6.911 -4.211 4.546 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -8.617 -3.867 4.746 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -8.246 -3.462 7.166 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -6.538 -3.792 6.955 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -6.503 -1.502 6.804 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -6.713 -1.897 5.109 1.00 0.00 H new ATOM 0 HE ARG A 40 -9.216 -1.583 5.517 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -6.693 0.147 7.286 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.789 1.421 7.831 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -10.639 -0.013 6.325 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -10.015 1.330 7.289 1.00 0.00 H new ATOM 665 N GLU A 41 -7.594 -7.267 3.859 1.00 0.00 N ATOM 666 CA GLU A 41 -7.929 -8.158 2.764 1.00 0.00 C ATOM 667 C GLU A 41 -7.632 -9.600 3.167 1.00 0.00 C ATOM 668 O GLU A 41 -6.626 -10.169 2.736 1.00 0.00 O ATOM 669 CB GLU A 41 -7.087 -7.833 1.536 1.00 0.00 C ATOM 670 CG GLU A 41 -6.965 -6.358 1.232 1.00 0.00 C ATOM 671 CD GLU A 41 -8.254 -5.737 0.717 1.00 0.00 C ATOM 672 OE1 GLU A 41 -9.118 -6.478 0.193 1.00 0.00 O ATOM 673 OE2 GLU A 41 -8.423 -4.505 0.857 1.00 0.00 O ATOM 0 H GLU A 41 -6.602 -7.258 4.097 1.00 0.00 H new ATOM 0 HA GLU A 41 -8.987 -8.031 2.534 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.088 -8.246 1.677 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.520 -8.335 0.671 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.654 -5.833 2.135 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.179 -6.211 0.491 1.00 0.00 H new ATOM 680 N PRO A 42 -8.484 -10.229 3.987 1.00 0.00 N ATOM 681 CA PRO A 42 -8.224 -11.581 4.484 1.00 0.00 C ATOM 682 C PRO A 42 -8.304 -12.627 3.375 1.00 0.00 C ATOM 683 O PRO A 42 -8.066 -13.812 3.602 1.00 0.00 O ATOM 684 CB PRO A 42 -9.326 -11.816 5.525 1.00 0.00 C ATOM 685 CG PRO A 42 -9.950 -10.481 5.760 1.00 0.00 C ATOM 686 CD PRO A 42 -9.752 -9.698 4.496 1.00 0.00 C ATOM 0 HA PRO A 42 -7.218 -11.671 4.895 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -10.062 -12.534 5.161 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -8.913 -12.223 6.448 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -11.010 -10.582 5.993 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -9.484 -9.977 6.607 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -10.569 -9.853 3.791 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -9.695 -8.626 4.687 1.00 0.00 H new ATOM 694 N SER A 43 -8.641 -12.179 2.177 1.00 0.00 N ATOM 695 CA SER A 43 -8.683 -13.045 1.015 1.00 0.00 C ATOM 696 C SER A 43 -7.274 -13.299 0.483 1.00 0.00 C ATOM 697 O SER A 43 -7.049 -14.233 -0.291 1.00 0.00 O ATOM 698 CB SER A 43 -9.560 -12.408 -0.060 1.00 0.00 C ATOM 699 OG SER A 43 -9.235 -11.037 -0.227 1.00 0.00 O ATOM 0 H SER A 43 -8.892 -11.209 1.985 1.00 0.00 H new ATOM 0 HA SER A 43 -9.110 -14.007 1.300 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.427 -12.936 -1.004 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.610 -12.507 0.215 1.00 0.00 H new ATOM 0 HG SER A 43 -9.807 -10.648 -0.921 1.00 0.00 H new ATOM 705 N LEU A 44 -6.322 -12.470 0.905 1.00 0.00 N ATOM 706 CA LEU A 44 -4.934 -12.644 0.502 1.00 0.00 C ATOM 707 C LEU A 44 -4.050 -12.946 1.709 1.00 0.00 C ATOM 708 O LEU A 44 -2.838 -12.747 1.672 1.00 0.00 O ATOM 709 CB LEU A 44 -4.429 -11.414 -0.277 1.00 0.00 C ATOM 710 CG LEU A 44 -4.486 -10.067 0.428 1.00 0.00 C ATOM 711 CD1 LEU A 44 -3.171 -9.761 1.107 1.00 0.00 C ATOM 712 CD2 LEU A 44 -4.832 -8.977 -0.573 1.00 0.00 C ATOM 0 H LEU A 44 -6.488 -11.676 1.523 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.879 -13.502 -0.168 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -3.394 -11.600 -0.566 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -5.008 -11.337 -1.197 1.00 0.00 H new ATOM 0 HG LEU A 44 -5.260 -10.106 1.194 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -3.235 -8.793 1.604 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.953 -10.534 1.844 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -2.375 -9.735 0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.872 -8.014 -0.063 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -4.071 -8.944 -1.352 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.802 -9.190 -1.022 1.00 0.00 H new ATOM 724 N LYS A 45 -4.661 -13.473 2.766 1.00 0.00 N ATOM 725 CA LYS A 45 -3.930 -13.817 3.982 1.00 0.00 C ATOM 726 C LYS A 45 -3.007 -15.012 3.733 1.00 0.00 C ATOM 727 O LYS A 45 -2.108 -15.289 4.528 1.00 0.00 O ATOM 728 CB LYS A 45 -4.897 -14.132 5.127 1.00 0.00 C ATOM 729 CG LYS A 45 -5.725 -15.388 4.909 1.00 0.00 C ATOM 730 CD LYS A 45 -6.612 -15.690 6.098 1.00 0.00 C ATOM 731 CE LYS A 45 -5.773 -16.076 7.295 1.00 0.00 C ATOM 732 NZ LYS A 45 -6.590 -16.695 8.371 1.00 0.00 N ATOM 0 H LYS A 45 -5.661 -13.671 2.805 1.00 0.00 H new ATOM 0 HA LYS A 45 -3.324 -12.957 4.266 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -4.328 -14.240 6.050 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -5.569 -13.285 5.264 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -6.341 -15.267 4.018 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.062 -16.233 4.726 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -7.220 -14.817 6.338 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -7.299 -16.499 5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -4.996 -16.774 6.983 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -5.270 -15.192 7.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.976 -16.945 9.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.316 -16.021 8.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -7.050 -17.554 8.007 1.00 0.00 H new ATOM 746 N ASN A 46 -3.245 -15.722 2.628 1.00 0.00 N ATOM 747 CA ASN A 46 -2.403 -16.850 2.231 1.00 0.00 C ATOM 748 C ASN A 46 -1.037 -16.369 1.759 1.00 0.00 C ATOM 749 O ASN A 46 -0.094 -17.154 1.639 1.00 0.00 O ATOM 750 CB ASN A 46 -3.079 -17.672 1.112 1.00 0.00 C ATOM 751 CG ASN A 46 -3.524 -16.830 -0.078 1.00 0.00 C ATOM 752 OD1 ASN A 46 -2.925 -15.805 -0.413 1.00 0.00 O ATOM 753 ND2 ASN A 46 -4.591 -17.261 -0.725 1.00 0.00 N ATOM 0 H ASN A 46 -4.018 -15.533 1.990 1.00 0.00 H new ATOM 0 HA ASN A 46 -2.269 -17.486 3.106 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -2.385 -18.438 0.766 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -3.945 -18.189 1.525 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -4.944 -16.742 -1.529 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.062 -18.113 -0.421 1.00 0.00 H new ATOM 760 N SER A 47 -0.942 -15.078 1.490 1.00 0.00 N ATOM 761 CA SER A 47 0.287 -14.482 1.008 1.00 0.00 C ATOM 762 C SER A 47 1.196 -14.134 2.180 1.00 0.00 C ATOM 763 O SER A 47 0.726 -13.737 3.248 1.00 0.00 O ATOM 764 CB SER A 47 -0.044 -13.243 0.177 1.00 0.00 C ATOM 765 OG SER A 47 -0.869 -13.591 -0.925 1.00 0.00 O ATOM 0 H SER A 47 -1.712 -14.418 1.600 1.00 0.00 H new ATOM 0 HA SER A 47 0.818 -15.193 0.375 1.00 0.00 H new ATOM 0 HB2 SER A 47 -0.550 -12.505 0.799 1.00 0.00 H new ATOM 0 HB3 SER A 47 0.876 -12.781 -0.181 1.00 0.00 H new ATOM 0 HG SER A 47 -1.538 -14.247 -0.638 1.00 0.00 H new ATOM 771 N ASN A 48 2.492 -14.312 1.986 1.00 0.00 N ATOM 772 CA ASN A 48 3.462 -14.085 3.048 1.00 0.00 C ATOM 773 C ASN A 48 3.835 -12.615 3.129 1.00 0.00 C ATOM 774 O ASN A 48 3.939 -11.932 2.113 1.00 0.00 O ATOM 775 CB ASN A 48 4.714 -14.928 2.819 1.00 0.00 C ATOM 776 CG ASN A 48 4.452 -16.414 2.964 1.00 0.00 C ATOM 777 OD1 ASN A 48 4.082 -17.091 2.002 1.00 0.00 O ATOM 778 ND2 ASN A 48 4.647 -16.937 4.165 1.00 0.00 N ATOM 0 H ASN A 48 2.899 -14.614 1.101 1.00 0.00 H new ATOM 0 HA ASN A 48 3.005 -14.382 3.992 1.00 0.00 H new ATOM 0 HB2 ASN A 48 5.105 -14.728 1.821 1.00 0.00 H new ATOM 0 HB3 ASN A 48 5.484 -14.628 3.529 1.00 0.00 H new ATOM 0 HD21 ASN A 48 4.491 -17.933 4.319 1.00 0.00 H new ATOM 0 HD22 ASN A 48 4.953 -16.344 4.936 1.00 0.00 H new ATOM 785 N PRO A 49 4.061 -12.126 4.356 1.00 0.00 N ATOM 786 CA PRO A 49 4.289 -10.701 4.630 1.00 0.00 C ATOM 787 C PRO A 49 5.557 -10.141 3.993 1.00 0.00 C ATOM 788 O PRO A 49 5.699 -8.931 3.836 1.00 0.00 O ATOM 789 CB PRO A 49 4.402 -10.646 6.154 1.00 0.00 C ATOM 790 CG PRO A 49 4.775 -12.024 6.564 1.00 0.00 C ATOM 791 CD PRO A 49 4.096 -12.931 5.587 1.00 0.00 C ATOM 0 HA PRO A 49 3.487 -10.094 4.210 1.00 0.00 H new ATOM 0 HB2 PRO A 49 5.156 -9.924 6.468 1.00 0.00 H new ATOM 0 HB3 PRO A 49 3.459 -10.341 6.609 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.856 -12.161 6.540 1.00 0.00 H new ATOM 0 HG3 PRO A 49 4.450 -12.232 7.583 1.00 0.00 H new ATOM 0 HD2 PRO A 49 4.650 -13.859 5.446 1.00 0.00 H new ATOM 0 HD3 PRO A 49 3.094 -13.204 5.919 1.00 0.00 H new ATOM 799 N ASP A 50 6.486 -11.010 3.647 1.00 0.00 N ATOM 800 CA ASP A 50 7.727 -10.571 3.022 1.00 0.00 C ATOM 801 C ASP A 50 7.699 -10.867 1.532 1.00 0.00 C ATOM 802 O ASP A 50 8.678 -10.634 0.822 1.00 0.00 O ATOM 803 CB ASP A 50 8.933 -11.257 3.668 1.00 0.00 C ATOM 804 CG ASP A 50 9.051 -10.959 5.145 1.00 0.00 C ATOM 805 OD1 ASP A 50 9.558 -9.873 5.498 1.00 0.00 O ATOM 806 OD2 ASP A 50 8.643 -11.812 5.963 1.00 0.00 O ATOM 0 H ASP A 50 6.411 -12.018 3.785 1.00 0.00 H new ATOM 0 HA ASP A 50 7.821 -9.495 3.170 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.853 -12.335 3.524 1.00 0.00 H new ATOM 0 HB3 ASP A 50 9.843 -10.934 3.163 1.00 0.00 H new ATOM 811 N GLU A 51 6.564 -11.370 1.064 1.00 0.00 N ATOM 812 CA GLU A 51 6.417 -11.768 -0.325 1.00 0.00 C ATOM 813 C GLU A 51 5.046 -11.349 -0.829 1.00 0.00 C ATOM 814 O GLU A 51 4.472 -11.982 -1.720 1.00 0.00 O ATOM 815 CB GLU A 51 6.596 -13.287 -0.494 1.00 0.00 C ATOM 816 CG GLU A 51 7.936 -13.836 -0.015 1.00 0.00 C ATOM 817 CD GLU A 51 7.838 -14.584 1.299 1.00 0.00 C ATOM 818 OE1 GLU A 51 7.900 -13.946 2.370 1.00 0.00 O ATOM 819 OE2 GLU A 51 7.717 -15.826 1.265 1.00 0.00 O ATOM 0 H GLU A 51 5.729 -11.512 1.632 1.00 0.00 H new ATOM 0 HA GLU A 51 7.193 -11.272 -0.908 1.00 0.00 H new ATOM 0 HB2 GLU A 51 5.798 -13.794 0.048 1.00 0.00 H new ATOM 0 HB3 GLU A 51 6.474 -13.537 -1.548 1.00 0.00 H new ATOM 0 HG2 GLU A 51 8.341 -14.503 -0.776 1.00 0.00 H new ATOM 0 HG3 GLU A 51 8.641 -13.012 0.095 1.00 0.00 H new ATOM 826 N ILE A 52 4.524 -10.284 -0.245 1.00 0.00 N ATOM 827 CA ILE A 52 3.176 -9.841 -0.532 1.00 0.00 C ATOM 828 C ILE A 52 3.059 -9.269 -1.935 1.00 0.00 C ATOM 829 O ILE A 52 4.024 -8.766 -2.512 1.00 0.00 O ATOM 830 CB ILE A 52 2.695 -8.803 0.507 1.00 0.00 C ATOM 831 CG1 ILE A 52 1.183 -8.897 0.701 1.00 0.00 C ATOM 832 CG2 ILE A 52 3.063 -7.398 0.077 1.00 0.00 C ATOM 833 CD1 ILE A 52 0.722 -10.244 1.161 1.00 0.00 C ATOM 0 H ILE A 52 5.020 -9.708 0.435 1.00 0.00 H new ATOM 0 HA ILE A 52 2.533 -10.719 -0.470 1.00 0.00 H new ATOM 0 HB ILE A 52 3.192 -9.024 1.452 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.871 -8.147 1.428 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.688 -8.654 -0.240 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.714 -6.686 0.824 1.00 0.00 H new ATOM 0 HG22 ILE A 52 4.146 -7.319 -0.021 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.595 -7.177 -0.882 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.362 -10.237 1.278 1.00 0.00 H new ATOM 0 HD12 ILE A 52 1.003 -10.996 0.424 1.00 0.00 H new ATOM 0 HD13 ILE A 52 1.188 -10.481 2.117 1.00 0.00 H new ATOM 845 N GLU A 53 1.871 -9.394 -2.478 1.00 0.00 N ATOM 846 CA GLU A 53 1.534 -8.795 -3.750 1.00 0.00 C ATOM 847 C GLU A 53 0.391 -7.817 -3.538 1.00 0.00 C ATOM 848 O GLU A 53 -0.771 -8.215 -3.429 1.00 0.00 O ATOM 849 CB GLU A 53 1.135 -9.870 -4.763 1.00 0.00 C ATOM 850 CG GLU A 53 2.264 -10.817 -5.139 1.00 0.00 C ATOM 851 CD GLU A 53 3.318 -10.164 -6.011 1.00 0.00 C ATOM 852 OE1 GLU A 53 3.040 -9.942 -7.210 1.00 0.00 O ATOM 853 OE2 GLU A 53 4.434 -9.901 -5.514 1.00 0.00 O ATOM 0 H GLU A 53 1.107 -9.916 -2.049 1.00 0.00 H new ATOM 0 HA GLU A 53 2.402 -8.269 -4.147 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.309 -10.451 -4.354 1.00 0.00 H new ATOM 0 HB3 GLU A 53 0.766 -9.384 -5.666 1.00 0.00 H new ATOM 0 HG2 GLU A 53 2.734 -11.193 -4.230 1.00 0.00 H new ATOM 0 HG3 GLU A 53 1.849 -11.678 -5.663 1.00 0.00 H new ATOM 860 N ILE A 54 0.729 -6.544 -3.431 1.00 0.00 N ATOM 861 CA ILE A 54 -0.255 -5.510 -3.216 1.00 0.00 C ATOM 862 C ILE A 54 -1.105 -5.336 -4.467 1.00 0.00 C ATOM 863 O ILE A 54 -0.665 -4.747 -5.459 1.00 0.00 O ATOM 864 CB ILE A 54 0.427 -4.178 -2.874 1.00 0.00 C ATOM 865 CG1 ILE A 54 1.358 -4.343 -1.669 1.00 0.00 C ATOM 866 CG2 ILE A 54 -0.605 -3.102 -2.616 1.00 0.00 C ATOM 867 CD1 ILE A 54 1.964 -3.040 -1.206 1.00 0.00 C ATOM 0 H ILE A 54 1.689 -6.204 -3.491 1.00 0.00 H new ATOM 0 HA ILE A 54 -0.889 -5.807 -2.381 1.00 0.00 H new ATOM 0 HB ILE A 54 1.030 -3.871 -3.728 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.801 -4.791 -0.846 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.158 -5.037 -1.928 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.102 -2.166 -2.375 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -1.219 -2.966 -3.506 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -1.239 -3.399 -1.780 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.613 -3.224 -0.350 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.547 -2.602 -2.016 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.170 -2.352 -0.917 1.00 0.00 H new ATOM 879 N ASP A 55 -2.310 -5.870 -4.427 1.00 0.00 N ATOM 880 CA ASP A 55 -3.208 -5.791 -5.566 1.00 0.00 C ATOM 881 C ASP A 55 -4.176 -4.639 -5.371 1.00 0.00 C ATOM 882 O ASP A 55 -5.212 -4.789 -4.720 1.00 0.00 O ATOM 883 CB ASP A 55 -3.972 -7.105 -5.747 1.00 0.00 C ATOM 884 CG ASP A 55 -4.755 -7.152 -7.048 1.00 0.00 C ATOM 885 OD1 ASP A 55 -5.425 -6.158 -7.393 1.00 0.00 O ATOM 886 OD2 ASP A 55 -4.699 -8.189 -7.739 1.00 0.00 O ATOM 0 H ASP A 55 -2.691 -6.363 -3.620 1.00 0.00 H new ATOM 0 HA ASP A 55 -2.620 -5.617 -6.467 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.268 -7.937 -5.721 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.657 -7.241 -4.910 1.00 0.00 H new ATOM 891 N PHE A 56 -3.840 -3.497 -5.955 1.00 0.00 N ATOM 892 CA PHE A 56 -4.585 -2.264 -5.738 1.00 0.00 C ATOM 893 C PHE A 56 -5.993 -2.321 -6.323 1.00 0.00 C ATOM 894 O PHE A 56 -6.818 -1.454 -6.045 1.00 0.00 O ATOM 895 CB PHE A 56 -3.817 -1.080 -6.316 1.00 0.00 C ATOM 896 CG PHE A 56 -2.484 -0.870 -5.657 1.00 0.00 C ATOM 897 CD1 PHE A 56 -2.410 -0.283 -4.409 1.00 0.00 C ATOM 898 CD2 PHE A 56 -1.311 -1.269 -6.270 1.00 0.00 C ATOM 899 CE1 PHE A 56 -1.210 -0.092 -3.782 1.00 0.00 C ATOM 900 CE2 PHE A 56 -0.096 -1.078 -5.644 1.00 0.00 C ATOM 901 CZ PHE A 56 -0.049 -0.485 -4.395 1.00 0.00 C ATOM 0 H PHE A 56 -3.047 -3.399 -6.589 1.00 0.00 H new ATOM 0 HA PHE A 56 -4.694 -2.137 -4.661 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -3.668 -1.237 -7.384 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.417 -0.176 -6.207 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -3.319 0.032 -3.918 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -1.346 -1.733 -7.245 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -1.177 0.368 -2.805 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.817 -1.391 -6.129 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.901 -0.332 -3.904 1.00 0.00 H new ATOM 911 N GLU A 57 -6.268 -3.344 -7.117 1.00 0.00 N ATOM 912 CA GLU A 57 -7.593 -3.529 -7.684 1.00 0.00 C ATOM 913 C GLU A 57 -8.489 -4.271 -6.704 1.00 0.00 C ATOM 914 O GLU A 57 -9.691 -4.021 -6.634 1.00 0.00 O ATOM 915 CB GLU A 57 -7.501 -4.288 -9.007 1.00 0.00 C ATOM 916 CG GLU A 57 -6.918 -3.455 -10.133 1.00 0.00 C ATOM 917 CD GLU A 57 -7.754 -2.226 -10.432 1.00 0.00 C ATOM 918 OE1 GLU A 57 -8.698 -2.330 -11.242 1.00 0.00 O ATOM 919 OE2 GLU A 57 -7.477 -1.153 -9.854 1.00 0.00 O ATOM 0 H GLU A 57 -5.591 -4.059 -7.383 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.031 -2.550 -7.877 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.887 -5.178 -8.866 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -8.496 -4.629 -9.293 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -5.906 -3.148 -9.868 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -6.841 -4.067 -11.032 1.00 0.00 H new ATOM 926 N THR A 58 -7.895 -5.175 -5.943 1.00 0.00 N ATOM 927 CA THR A 58 -8.638 -5.923 -4.943 1.00 0.00 C ATOM 928 C THR A 58 -8.686 -5.171 -3.618 1.00 0.00 C ATOM 929 O THR A 58 -9.616 -5.348 -2.832 1.00 0.00 O ATOM 930 CB THR A 58 -8.031 -7.319 -4.720 1.00 0.00 C ATOM 931 OG1 THR A 58 -6.660 -7.209 -4.314 1.00 0.00 O ATOM 932 CG2 THR A 58 -8.122 -8.154 -5.988 1.00 0.00 C ATOM 0 H THR A 58 -6.904 -5.408 -5.998 1.00 0.00 H new ATOM 0 HA THR A 58 -9.653 -6.040 -5.322 1.00 0.00 H new ATOM 0 HB THR A 58 -8.600 -7.812 -3.932 1.00 0.00 H new ATOM 0 HG1 THR A 58 -6.373 -6.275 -4.382 1.00 0.00 H new ATOM 0 HG21 THR A 58 -7.687 -9.137 -5.808 1.00 0.00 H new ATOM 0 HG22 THR A 58 -9.167 -8.267 -6.275 1.00 0.00 H new ATOM 0 HG23 THR A 58 -7.577 -7.657 -6.791 1.00 0.00 H new ATOM 940 N LEU A 59 -7.682 -4.328 -3.381 1.00 0.00 N ATOM 941 CA LEU A 59 -7.619 -3.538 -2.163 1.00 0.00 C ATOM 942 C LEU A 59 -8.804 -2.601 -2.076 1.00 0.00 C ATOM 943 O LEU A 59 -9.102 -1.864 -3.019 1.00 0.00 O ATOM 944 CB LEU A 59 -6.323 -2.754 -2.098 1.00 0.00 C ATOM 945 CG LEU A 59 -5.084 -3.626 -2.061 1.00 0.00 C ATOM 946 CD1 LEU A 59 -3.838 -2.787 -1.942 1.00 0.00 C ATOM 947 CD2 LEU A 59 -5.182 -4.620 -0.922 1.00 0.00 C ATOM 0 H LEU A 59 -6.902 -4.178 -4.021 1.00 0.00 H new ATOM 0 HA LEU A 59 -7.652 -4.220 -1.314 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.265 -2.093 -2.962 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.337 -2.120 -1.212 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.020 -4.179 -2.998 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.963 -3.436 -1.917 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.768 -2.116 -2.798 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -3.880 -2.201 -1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -4.287 -5.242 -0.904 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.270 -4.083 0.023 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.059 -5.251 -1.064 1.00 0.00 H new ATOM 959 N LYS A 60 -9.496 -2.661 -0.959 1.00 0.00 N ATOM 960 CA LYS A 60 -10.634 -1.798 -0.723 1.00 0.00 C ATOM 961 C LYS A 60 -10.178 -0.354 -0.569 1.00 0.00 C ATOM 962 O LYS A 60 -9.048 -0.115 -0.133 1.00 0.00 O ATOM 963 CB LYS A 60 -11.387 -2.260 0.523 1.00 0.00 C ATOM 964 CG LYS A 60 -12.122 -3.569 0.327 1.00 0.00 C ATOM 965 CD LYS A 60 -12.642 -4.128 1.639 1.00 0.00 C ATOM 966 CE LYS A 60 -11.523 -4.788 2.456 1.00 0.00 C ATOM 967 NZ LYS A 60 -11.214 -6.157 1.969 1.00 0.00 N ATOM 0 H LYS A 60 -9.289 -3.303 -0.194 1.00 0.00 H new ATOM 0 HA LYS A 60 -11.307 -1.855 -1.579 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -10.681 -2.367 1.347 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -12.102 -1.490 0.814 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -12.955 -3.418 -0.359 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -11.454 -4.294 -0.137 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -13.095 -3.326 2.223 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -13.426 -4.858 1.439 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -10.625 -4.173 2.404 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -11.818 -4.834 3.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -10.679 -6.672 2.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -12.101 -6.663 1.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.646 -6.096 1.100 1.00 0.00 H new ATOM 981 N PRO A 61 -11.015 0.625 -0.960 1.00 0.00 N ATOM 982 CA PRO A 61 -10.702 2.043 -0.785 1.00 0.00 C ATOM 983 C PRO A 61 -10.145 2.337 0.604 1.00 0.00 C ATOM 984 O PRO A 61 -9.204 3.116 0.756 1.00 0.00 O ATOM 985 CB PRO A 61 -12.052 2.728 -0.982 1.00 0.00 C ATOM 986 CG PRO A 61 -12.796 1.833 -1.904 1.00 0.00 C ATOM 987 CD PRO A 61 -12.310 0.427 -1.637 1.00 0.00 C ATOM 0 HA PRO A 61 -9.934 2.386 -1.478 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -12.578 2.847 -0.035 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.932 3.724 -1.407 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -13.870 1.909 -1.734 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.617 2.113 -2.942 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.009 -0.125 -1.009 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -12.196 -0.139 -2.561 1.00 0.00 H new ATOM 995 N SER A 62 -10.720 1.678 1.603 1.00 0.00 N ATOM 996 CA SER A 62 -10.266 1.790 2.980 1.00 0.00 C ATOM 997 C SER A 62 -8.783 1.439 3.111 1.00 0.00 C ATOM 998 O SER A 62 -7.999 2.232 3.635 1.00 0.00 O ATOM 999 CB SER A 62 -11.109 0.867 3.862 1.00 0.00 C ATOM 1000 OG SER A 62 -11.518 -0.279 3.133 1.00 0.00 O ATOM 0 H SER A 62 -11.515 1.051 1.479 1.00 0.00 H new ATOM 0 HA SER A 62 -10.387 2.824 3.304 1.00 0.00 H new ATOM 0 HB2 SER A 62 -10.533 0.563 4.736 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.984 1.404 4.228 1.00 0.00 H new ATOM 0 HG SER A 62 -12.055 -0.860 3.711 1.00 0.00 H new ATOM 1006 N THR A 63 -8.402 0.255 2.628 1.00 0.00 N ATOM 1007 CA THR A 63 -7.011 -0.170 2.677 1.00 0.00 C ATOM 1008 C THR A 63 -6.150 0.796 1.887 1.00 0.00 C ATOM 1009 O THR A 63 -5.154 1.281 2.393 1.00 0.00 O ATOM 1010 CB THR A 63 -6.819 -1.598 2.115 1.00 0.00 C ATOM 1011 OG1 THR A 63 -7.974 -2.393 2.417 1.00 0.00 O ATOM 1012 CG2 THR A 63 -5.577 -2.269 2.703 1.00 0.00 C ATOM 0 H THR A 63 -9.037 -0.420 2.202 1.00 0.00 H new ATOM 0 HA THR A 63 -6.710 -0.177 3.725 1.00 0.00 H new ATOM 0 HB THR A 63 -6.687 -1.519 1.036 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.001 -3.170 1.821 1.00 0.00 H new ATOM 0 HG21 THR A 63 -5.473 -3.271 2.286 1.00 0.00 H new ATOM 0 HG22 THR A 63 -4.694 -1.680 2.456 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.678 -2.335 3.786 1.00 0.00 H new ATOM 1020 N LEU A 64 -6.573 1.109 0.666 1.00 0.00 N ATOM 1021 CA LEU A 64 -5.808 1.986 -0.210 1.00 0.00 C ATOM 1022 C LEU A 64 -5.574 3.349 0.435 1.00 0.00 C ATOM 1023 O LEU A 64 -4.461 3.868 0.404 1.00 0.00 O ATOM 1024 CB LEU A 64 -6.522 2.152 -1.552 1.00 0.00 C ATOM 1025 CG LEU A 64 -6.653 0.879 -2.380 1.00 0.00 C ATOM 1026 CD1 LEU A 64 -7.543 1.120 -3.585 1.00 0.00 C ATOM 1027 CD2 LEU A 64 -5.284 0.397 -2.816 1.00 0.00 C ATOM 0 H LEU A 64 -7.444 0.766 0.261 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.836 1.523 -0.380 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.520 2.550 -1.368 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.986 2.896 -2.141 1.00 0.00 H new ATOM 0 HG LEU A 64 -7.113 0.106 -1.764 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.626 0.201 -4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.533 1.428 -3.250 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -7.110 1.904 -4.206 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.390 -0.513 -3.407 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.802 1.167 -3.419 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.674 0.190 -1.937 1.00 0.00 H new ATOM 1039 N ARG A 65 -6.616 3.922 1.029 1.00 0.00 N ATOM 1040 CA ARG A 65 -6.490 5.205 1.707 1.00 0.00 C ATOM 1041 C ARG A 65 -5.597 5.075 2.933 1.00 0.00 C ATOM 1042 O ARG A 65 -4.909 6.023 3.308 1.00 0.00 O ATOM 1043 CB ARG A 65 -7.859 5.758 2.104 1.00 0.00 C ATOM 1044 CG ARG A 65 -8.698 6.243 0.928 1.00 0.00 C ATOM 1045 CD ARG A 65 -8.043 7.420 0.214 1.00 0.00 C ATOM 1046 NE ARG A 65 -8.812 7.867 -0.947 1.00 0.00 N ATOM 1047 CZ ARG A 65 -8.307 8.626 -1.922 1.00 0.00 C ATOM 1048 NH1 ARG A 65 -7.049 9.052 -1.860 1.00 0.00 N ATOM 1049 NH2 ARG A 65 -9.053 8.962 -2.967 1.00 0.00 N ATOM 0 H ARG A 65 -7.553 3.519 1.054 1.00 0.00 H new ATOM 0 HA ARG A 65 -6.031 5.907 1.011 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -8.412 4.984 2.636 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -7.717 6.584 2.801 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -8.843 5.425 0.223 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -9.686 6.537 1.283 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.931 8.249 0.913 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -7.041 7.135 -0.106 1.00 0.00 H new ATOM 0 HE ARG A 65 -9.789 7.583 -1.015 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -6.464 8.799 -1.064 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -6.669 9.632 -2.609 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.019 8.640 -3.029 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -8.660 9.542 -3.708 1.00 0.00 H new ATOM 1063 N GLU A 66 -5.607 3.897 3.544 1.00 0.00 N ATOM 1064 CA GLU A 66 -4.736 3.610 4.670 1.00 0.00 C ATOM 1065 C GLU A 66 -3.289 3.486 4.199 1.00 0.00 C ATOM 1066 O GLU A 66 -2.424 4.184 4.699 1.00 0.00 O ATOM 1067 CB GLU A 66 -5.189 2.324 5.366 1.00 0.00 C ATOM 1068 CG GLU A 66 -4.260 1.850 6.469 1.00 0.00 C ATOM 1069 CD GLU A 66 -4.218 2.793 7.649 1.00 0.00 C ATOM 1070 OE1 GLU A 66 -5.262 2.966 8.312 1.00 0.00 O ATOM 1071 OE2 GLU A 66 -3.147 3.374 7.918 1.00 0.00 O ATOM 0 H GLU A 66 -6.214 3.123 3.274 1.00 0.00 H new ATOM 0 HA GLU A 66 -4.795 4.431 5.384 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.182 2.483 5.787 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.281 1.534 4.620 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.581 0.865 6.809 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.254 1.736 6.066 1.00 0.00 H new ATOM 1078 N LEU A 67 -3.045 2.595 3.234 1.00 0.00 N ATOM 1079 CA LEU A 67 -1.722 2.428 2.622 1.00 0.00 C ATOM 1080 C LEU A 67 -1.146 3.795 2.240 1.00 0.00 C ATOM 1081 O LEU A 67 -0.052 4.157 2.665 1.00 0.00 O ATOM 1082 CB LEU A 67 -1.837 1.530 1.378 1.00 0.00 C ATOM 1083 CG LEU A 67 -2.710 0.295 1.566 1.00 0.00 C ATOM 1084 CD1 LEU A 67 -2.942 -0.391 0.245 1.00 0.00 C ATOM 1085 CD2 LEU A 67 -2.065 -0.672 2.537 1.00 0.00 C ATOM 0 H LEU A 67 -3.757 1.970 2.855 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.050 1.955 3.339 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.239 2.121 0.555 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.837 1.211 1.083 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.668 0.617 1.974 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.567 -1.271 0.397 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.441 0.295 -0.439 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.985 -0.695 -0.180 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -2.704 -1.547 2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.094 -0.982 2.151 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.932 -0.184 3.503 1.00 0.00 H new ATOM 1097 N GLU A 68 -1.925 4.557 1.475 1.00 0.00 N ATOM 1098 CA GLU A 68 -1.539 5.901 1.039 1.00 0.00 C ATOM 1099 C GLU A 68 -1.222 6.813 2.231 1.00 0.00 C ATOM 1100 O GLU A 68 -0.141 7.380 2.317 1.00 0.00 O ATOM 1101 CB GLU A 68 -2.674 6.511 0.210 1.00 0.00 C ATOM 1102 CG GLU A 68 -2.390 7.903 -0.322 1.00 0.00 C ATOM 1103 CD GLU A 68 -3.624 8.565 -0.903 1.00 0.00 C ATOM 1104 OE1 GLU A 68 -4.662 8.636 -0.203 1.00 0.00 O ATOM 1105 OE2 GLU A 68 -3.560 9.051 -2.048 1.00 0.00 O ATOM 0 H GLU A 68 -2.842 4.262 1.139 1.00 0.00 H new ATOM 0 HA GLU A 68 -0.636 5.816 0.435 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -2.887 5.851 -0.631 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -3.575 6.547 0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -1.994 8.522 0.483 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -1.618 7.845 -1.089 1.00 0.00 H new ATOM 1112 N ARG A 69 -2.158 6.937 3.164 1.00 0.00 N ATOM 1113 CA ARG A 69 -1.972 7.840 4.309 1.00 0.00 C ATOM 1114 C ARG A 69 -0.848 7.330 5.202 1.00 0.00 C ATOM 1115 O ARG A 69 -0.153 8.100 5.867 1.00 0.00 O ATOM 1116 CB ARG A 69 -3.261 7.978 5.123 1.00 0.00 C ATOM 1117 CG ARG A 69 -3.107 8.862 6.354 1.00 0.00 C ATOM 1118 CD ARG A 69 -4.415 9.444 6.837 1.00 0.00 C ATOM 1119 NE ARG A 69 -5.098 8.566 7.786 1.00 0.00 N ATOM 1120 CZ ARG A 69 -6.269 8.850 8.352 1.00 0.00 C ATOM 1121 NH1 ARG A 69 -6.904 9.976 8.045 1.00 0.00 N ATOM 1122 NH2 ARG A 69 -6.806 8.004 9.225 1.00 0.00 N ATOM 0 H ARG A 69 -3.045 6.434 3.158 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.708 8.824 3.921 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -4.043 8.390 4.485 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -3.593 6.988 5.435 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -2.657 8.279 7.158 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -2.418 9.675 6.126 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -4.228 10.409 7.308 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -5.066 9.627 5.982 1.00 0.00 H new ATOM 0 HE ARG A 69 -4.650 7.682 8.029 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -6.494 10.626 7.374 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -7.801 10.191 8.480 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -6.321 7.138 9.461 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -7.703 8.221 9.659 1.00 0.00 H new ATOM 1136 N TYR A 70 -0.648 6.031 5.181 1.00 0.00 N ATOM 1137 CA TYR A 70 0.385 5.416 5.976 1.00 0.00 C ATOM 1138 C TYR A 70 1.749 5.800 5.435 1.00 0.00 C ATOM 1139 O TYR A 70 2.614 6.266 6.180 1.00 0.00 O ATOM 1140 CB TYR A 70 0.237 3.901 5.982 1.00 0.00 C ATOM 1141 CG TYR A 70 1.468 3.220 6.493 1.00 0.00 C ATOM 1142 CD1 TYR A 70 1.915 3.420 7.792 1.00 0.00 C ATOM 1143 CD2 TYR A 70 2.204 2.415 5.656 1.00 0.00 C ATOM 1144 CE1 TYR A 70 3.071 2.822 8.242 1.00 0.00 C ATOM 1145 CE2 TYR A 70 3.361 1.817 6.087 1.00 0.00 C ATOM 1146 CZ TYR A 70 3.796 2.024 7.386 1.00 0.00 C ATOM 1147 OH TYR A 70 4.963 1.446 7.826 1.00 0.00 O ATOM 0 H TYR A 70 -1.193 5.378 4.617 1.00 0.00 H new ATOM 0 HA TYR A 70 0.288 5.774 7.001 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -0.615 3.622 6.602 1.00 0.00 H new ATOM 0 HB3 TYR A 70 0.023 3.553 4.971 1.00 0.00 H new ATOM 0 HD1 TYR A 70 1.348 4.053 8.459 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.866 2.251 4.643 1.00 0.00 H new ATOM 0 HE1 TYR A 70 3.406 2.978 9.257 1.00 0.00 H new ATOM 0 HE2 TYR A 70 3.929 1.188 5.418 1.00 0.00 H new ATOM 0 HH TYR A 70 5.280 0.801 7.160 1.00 0.00 H new ATOM 1157 N VAL A 71 1.939 5.633 4.134 1.00 0.00 N ATOM 1158 CA VAL A 71 3.215 5.956 3.531 1.00 0.00 C ATOM 1159 C VAL A 71 3.513 7.429 3.739 1.00 0.00 C ATOM 1160 O VAL A 71 4.652 7.808 3.944 1.00 0.00 O ATOM 1161 CB VAL A 71 3.274 5.660 2.019 1.00 0.00 C ATOM 1162 CG1 VAL A 71 2.794 4.263 1.693 1.00 0.00 C ATOM 1163 CG2 VAL A 71 2.492 6.677 1.233 1.00 0.00 C ATOM 0 H VAL A 71 1.234 5.280 3.487 1.00 0.00 H new ATOM 0 HA VAL A 71 3.954 5.321 4.019 1.00 0.00 H new ATOM 0 HB VAL A 71 4.322 5.727 1.728 1.00 0.00 H new ATOM 0 HG11 VAL A 71 2.853 4.100 0.617 1.00 0.00 H new ATOM 0 HG12 VAL A 71 3.421 3.534 2.206 1.00 0.00 H new ATOM 0 HG13 VAL A 71 1.761 4.147 2.021 1.00 0.00 H new ATOM 0 HG21 VAL A 71 2.553 6.441 0.171 1.00 0.00 H new ATOM 0 HG22 VAL A 71 1.449 6.658 1.550 1.00 0.00 H new ATOM 0 HG23 VAL A 71 2.907 7.670 1.408 1.00 0.00 H new ATOM 1173 N THR A 72 2.472 8.260 3.723 1.00 0.00 N ATOM 1174 CA THR A 72 2.668 9.695 3.794 1.00 0.00 C ATOM 1175 C THR A 72 3.253 10.105 5.139 1.00 0.00 C ATOM 1176 O THR A 72 3.928 11.128 5.245 1.00 0.00 O ATOM 1177 CB THR A 72 1.379 10.482 3.507 1.00 0.00 C ATOM 1178 OG1 THR A 72 0.366 10.195 4.475 1.00 0.00 O ATOM 1179 CG2 THR A 72 0.884 10.138 2.122 1.00 0.00 C ATOM 0 H THR A 72 1.498 7.963 3.662 1.00 0.00 H new ATOM 0 HA THR A 72 3.382 9.947 3.010 1.00 0.00 H new ATOM 0 HB THR A 72 1.603 11.547 3.567 1.00 0.00 H new ATOM 0 HG1 THR A 72 0.617 9.396 4.984 1.00 0.00 H new ATOM 0 HG21 THR A 72 -0.030 10.694 1.914 1.00 0.00 H new ATOM 0 HG22 THR A 72 1.645 10.403 1.388 1.00 0.00 H new ATOM 0 HG23 THR A 72 0.680 9.069 2.064 1.00 0.00 H new ATOM 1187 N SER A 73 3.019 9.279 6.154 1.00 0.00 N ATOM 1188 CA SER A 73 3.594 9.509 7.469 1.00 0.00 C ATOM 1189 C SER A 73 5.104 9.279 7.416 1.00 0.00 C ATOM 1190 O SER A 73 5.868 9.864 8.183 1.00 0.00 O ATOM 1191 CB SER A 73 2.942 8.581 8.500 1.00 0.00 C ATOM 1192 OG SER A 73 3.432 7.255 8.398 1.00 0.00 O ATOM 0 H SER A 73 2.435 8.445 6.088 1.00 0.00 H new ATOM 0 HA SER A 73 3.406 10.540 7.770 1.00 0.00 H new ATOM 0 HB2 SER A 73 3.131 8.962 9.503 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.861 8.581 8.357 1.00 0.00 H new ATOM 0 HG SER A 73 3.296 6.925 7.485 1.00 0.00 H new ATOM 1198 N CYS A 74 5.520 8.430 6.482 1.00 0.00 N ATOM 1199 CA CYS A 74 6.930 8.084 6.321 1.00 0.00 C ATOM 1200 C CYS A 74 7.575 8.880 5.184 1.00 0.00 C ATOM 1201 O CYS A 74 8.781 9.114 5.186 1.00 0.00 O ATOM 1202 CB CYS A 74 7.083 6.576 6.073 1.00 0.00 C ATOM 1203 SG CYS A 74 8.787 6.037 5.829 1.00 0.00 S ATOM 0 H CYS A 74 4.897 7.966 5.821 1.00 0.00 H new ATOM 0 HA CYS A 74 7.447 8.346 7.245 1.00 0.00 H new ATOM 0 HB2 CYS A 74 6.660 6.035 6.920 1.00 0.00 H new ATOM 0 HB3 CYS A 74 6.498 6.302 5.195 1.00 0.00 H new ATOM 0 HG CYS A 74 8.812 4.753 5.630 1.00 0.00 H new ATOM 1209 N LEU A 75 6.763 9.294 4.221 1.00 0.00 N ATOM 1210 CA LEU A 75 7.254 9.933 3.009 1.00 0.00 C ATOM 1211 C LEU A 75 7.095 11.444 3.059 1.00 0.00 C ATOM 1212 O LEU A 75 8.055 12.190 2.879 1.00 0.00 O ATOM 1213 CB LEU A 75 6.491 9.379 1.807 1.00 0.00 C ATOM 1214 CG LEU A 75 6.530 7.866 1.659 1.00 0.00 C ATOM 1215 CD1 LEU A 75 5.965 7.468 0.311 1.00 0.00 C ATOM 1216 CD2 LEU A 75 7.951 7.348 1.829 1.00 0.00 C ATOM 0 H LEU A 75 5.748 9.197 4.258 1.00 0.00 H new ATOM 0 HA LEU A 75 8.318 9.716 2.920 1.00 0.00 H new ATOM 0 HB2 LEU A 75 5.450 9.695 1.880 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.897 9.828 0.900 1.00 0.00 H new ATOM 0 HG LEU A 75 5.916 7.417 2.440 1.00 0.00 H new ATOM 0 HD11 LEU A 75 5.995 6.383 0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 75 4.933 7.811 0.233 1.00 0.00 H new ATOM 0 HD13 LEU A 75 6.559 7.923 -0.481 1.00 0.00 H new ATOM 0 HD21 LEU A 75 7.958 6.264 1.720 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.594 7.794 1.070 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.320 7.615 2.819 1.00 0.00 H new ATOM 1228 N ARG A 76 5.879 11.895 3.318 1.00 0.00 N ATOM 1229 CA ARG A 76 5.576 13.317 3.284 1.00 0.00 C ATOM 1230 C ARG A 76 5.890 13.965 4.622 1.00 0.00 C ATOM 1231 O ARG A 76 5.543 15.119 4.868 1.00 0.00 O ATOM 1232 CB ARG A 76 4.124 13.542 2.900 1.00 0.00 C ATOM 1233 CG ARG A 76 3.807 13.017 1.522 1.00 0.00 C ATOM 1234 CD ARG A 76 2.402 13.369 1.113 1.00 0.00 C ATOM 1235 NE ARG A 76 2.029 12.755 -0.161 1.00 0.00 N ATOM 1236 CZ ARG A 76 0.777 12.669 -0.610 1.00 0.00 C ATOM 1237 NH1 ARG A 76 -0.221 13.198 0.087 1.00 0.00 N ATOM 1238 NH2 ARG A 76 0.523 12.052 -1.756 1.00 0.00 N ATOM 0 H ARG A 76 5.086 11.298 3.554 1.00 0.00 H new ATOM 0 HA ARG A 76 6.205 13.786 2.527 1.00 0.00 H new ATOM 0 HB2 ARG A 76 3.478 13.054 3.630 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.901 14.608 2.940 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.512 13.431 0.802 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.933 11.934 1.505 1.00 0.00 H new ATOM 0 HD2 ARG A 76 1.707 13.045 1.888 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.309 14.452 1.034 1.00 0.00 H new ATOM 0 HE ARG A 76 2.773 12.369 -0.742 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -0.031 13.673 0.970 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -1.178 13.130 -0.260 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.286 11.643 -2.295 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -0.436 11.987 -2.099 1.00 0.00 H new ATOM 1252 N LYS A 77 6.536 13.200 5.488 1.00 0.00 N ATOM 1253 CA LYS A 77 6.939 13.684 6.794 1.00 0.00 C ATOM 1254 C LYS A 77 8.430 13.424 7.004 1.00 0.00 C ATOM 1255 O LYS A 77 9.020 13.865 7.988 1.00 0.00 O ATOM 1256 CB LYS A 77 6.117 12.985 7.875 1.00 0.00 C ATOM 1257 CG LYS A 77 5.987 13.789 9.158 1.00 0.00 C ATOM 1258 CD LYS A 77 5.126 15.040 8.982 1.00 0.00 C ATOM 1259 CE LYS A 77 3.688 14.717 8.580 1.00 0.00 C ATOM 1260 NZ LYS A 77 3.024 13.791 9.537 1.00 0.00 N ATOM 0 H LYS A 77 6.794 12.230 5.304 1.00 0.00 H new ATOM 0 HA LYS A 77 6.761 14.758 6.856 1.00 0.00 H new ATOM 0 HB2 LYS A 77 5.121 12.777 7.484 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.577 12.024 8.104 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.553 13.160 9.935 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.979 14.081 9.502 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.120 15.605 9.914 1.00 0.00 H new ATOM 0 HD3 LYS A 77 5.575 15.681 8.223 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.115 15.642 8.517 1.00 0.00 H new ATOM 0 HE3 LYS A 77 3.683 14.271 7.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.012 13.723 9.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.459 12.849 9.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.136 14.153 10.505 1.00 0.00 H new ATOM 1274 N LYS A 78 9.032 12.707 6.062 1.00 0.00 N ATOM 1275 CA LYS A 78 10.448 12.378 6.123 1.00 0.00 C ATOM 1276 C LYS A 78 10.976 12.115 4.718 1.00 0.00 C ATOM 1277 O LYS A 78 10.443 11.271 3.999 1.00 0.00 O ATOM 1278 CB LYS A 78 10.670 11.136 6.987 1.00 0.00 C ATOM 1279 CG LYS A 78 12.137 10.812 7.228 1.00 0.00 C ATOM 1280 CD LYS A 78 12.725 11.644 8.358 1.00 0.00 C ATOM 1281 CE LYS A 78 12.171 11.224 9.712 1.00 0.00 C ATOM 1282 NZ LYS A 78 12.467 9.797 10.016 1.00 0.00 N ATOM 0 H LYS A 78 8.554 12.340 5.239 1.00 0.00 H new ATOM 0 HA LYS A 78 10.982 13.219 6.565 1.00 0.00 H new ATOM 0 HB2 LYS A 78 10.176 11.280 7.948 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.192 10.281 6.508 1.00 0.00 H new ATOM 0 HG2 LYS A 78 12.240 9.753 7.465 1.00 0.00 H new ATOM 0 HG3 LYS A 78 12.703 10.990 6.314 1.00 0.00 H new ATOM 0 HD2 LYS A 78 13.810 11.540 8.360 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.506 12.698 8.186 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.597 11.857 10.490 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.093 11.382 9.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 12.389 9.637 11.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 11.788 9.188 9.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 13.432 9.568 9.703 1.00 0.00 H new ATOM 1296 N ARG A 79 12.012 12.834 4.320 1.00 0.00 N ATOM 1297 CA ARG A 79 12.571 12.652 2.990 1.00 0.00 C ATOM 1298 C ARG A 79 13.519 11.450 2.967 1.00 0.00 C ATOM 1299 O ARG A 79 14.428 11.350 3.793 1.00 0.00 O ATOM 1300 CB ARG A 79 13.268 13.940 2.509 1.00 0.00 C ATOM 1301 CG ARG A 79 14.542 14.313 3.255 1.00 0.00 C ATOM 1302 CD ARG A 79 15.777 13.739 2.578 1.00 0.00 C ATOM 1303 NE ARG A 79 17.000 14.043 3.313 1.00 0.00 N ATOM 1304 CZ ARG A 79 18.133 13.354 3.187 1.00 0.00 C ATOM 1305 NH1 ARG A 79 18.200 12.322 2.354 1.00 0.00 N ATOM 1306 NH2 ARG A 79 19.203 13.699 3.890 1.00 0.00 N ATOM 0 H ARG A 79 12.478 13.540 4.889 1.00 0.00 H new ATOM 0 HA ARG A 79 11.758 12.444 2.295 1.00 0.00 H new ATOM 0 HB2 ARG A 79 13.506 13.830 1.451 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.563 14.767 2.593 1.00 0.00 H new ATOM 0 HG2 ARG A 79 14.628 15.398 3.309 1.00 0.00 H new ATOM 0 HG3 ARG A 79 14.485 13.946 4.280 1.00 0.00 H new ATOM 0 HD2 ARG A 79 15.670 12.658 2.486 1.00 0.00 H new ATOM 0 HD3 ARG A 79 15.854 14.139 1.567 1.00 0.00 H new ATOM 0 HE ARG A 79 16.987 14.830 3.962 1.00 0.00 H new ATOM 0 HH11 ARG A 79 17.382 12.054 1.807 1.00 0.00 H new ATOM 0 HH12 ARG A 79 19.070 11.797 2.261 1.00 0.00 H new ATOM 0 HH21 ARG A 79 19.159 14.493 4.529 1.00 0.00 H new ATOM 0 HH22 ARG A 79 20.070 13.170 3.792 1.00 0.00 H new ATOM 1320 N LYS A 80 13.265 10.529 2.036 1.00 0.00 N ATOM 1321 CA LYS A 80 14.099 9.340 1.840 1.00 0.00 C ATOM 1322 C LYS A 80 14.306 8.569 3.151 1.00 0.00 C ATOM 1323 O LYS A 80 15.356 8.676 3.788 1.00 0.00 O ATOM 1324 CB LYS A 80 15.454 9.724 1.229 1.00 0.00 C ATOM 1325 CG LYS A 80 15.356 10.522 -0.068 1.00 0.00 C ATOM 1326 CD LYS A 80 14.497 9.834 -1.124 1.00 0.00 C ATOM 1327 CE LYS A 80 14.998 8.437 -1.463 1.00 0.00 C ATOM 1328 NZ LYS A 80 14.152 7.787 -2.498 1.00 0.00 N ATOM 0 H LYS A 80 12.474 10.586 1.395 1.00 0.00 H new ATOM 0 HA LYS A 80 13.572 8.683 1.147 1.00 0.00 H new ATOM 0 HB2 LYS A 80 16.016 10.307 1.959 1.00 0.00 H new ATOM 0 HB3 LYS A 80 16.025 8.815 1.040 1.00 0.00 H new ATOM 0 HG2 LYS A 80 14.940 11.506 0.147 1.00 0.00 H new ATOM 0 HG3 LYS A 80 16.358 10.680 -0.468 1.00 0.00 H new ATOM 0 HD2 LYS A 80 13.469 9.771 -0.767 1.00 0.00 H new ATOM 0 HD3 LYS A 80 14.484 10.441 -2.029 1.00 0.00 H new ATOM 0 HE2 LYS A 80 16.027 8.495 -1.818 1.00 0.00 H new ATOM 0 HE3 LYS A 80 15.006 7.824 -0.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 14.093 6.766 -2.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 13.198 8.200 -2.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 14.573 7.940 -3.437 1.00 0.00 H new ATOM 1342 N PRO A 81 13.310 7.768 3.562 1.00 0.00 N ATOM 1343 CA PRO A 81 13.353 7.028 4.834 1.00 0.00 C ATOM 1344 C PRO A 81 14.306 5.833 4.813 1.00 0.00 C ATOM 1345 O PRO A 81 14.497 5.162 5.829 1.00 0.00 O ATOM 1346 CB PRO A 81 11.914 6.548 4.999 1.00 0.00 C ATOM 1347 CG PRO A 81 11.414 6.408 3.605 1.00 0.00 C ATOM 1348 CD PRO A 81 12.049 7.526 2.833 1.00 0.00 C ATOM 0 HA PRO A 81 13.721 7.655 5.646 1.00 0.00 H new ATOM 0 HB2 PRO A 81 11.869 5.600 5.535 1.00 0.00 H new ATOM 0 HB3 PRO A 81 11.318 7.263 5.566 1.00 0.00 H new ATOM 0 HG2 PRO A 81 11.686 5.439 3.187 1.00 0.00 H new ATOM 0 HG3 PRO A 81 10.327 6.476 3.570 1.00 0.00 H new ATOM 0 HD2 PRO A 81 12.231 7.246 1.796 1.00 0.00 H new ATOM 0 HD3 PRO A 81 11.417 8.414 2.817 1.00 0.00 H new ATOM 1356 N GLN A 82 14.890 5.561 3.656 1.00 0.00 N ATOM 1357 CA GLN A 82 15.848 4.472 3.525 1.00 0.00 C ATOM 1358 C GLN A 82 17.276 5.004 3.502 1.00 0.00 C ATOM 1359 O GLN A 82 18.234 4.243 3.359 1.00 0.00 O ATOM 1360 CB GLN A 82 15.563 3.632 2.269 1.00 0.00 C ATOM 1361 CG GLN A 82 15.056 4.423 1.065 1.00 0.00 C ATOM 1362 CD GLN A 82 15.978 5.548 0.643 1.00 0.00 C ATOM 1363 OE1 GLN A 82 15.834 6.679 1.096 1.00 0.00 O ATOM 1364 NE2 GLN A 82 16.929 5.244 -0.219 1.00 0.00 N ATOM 0 H GLN A 82 14.718 6.079 2.794 1.00 0.00 H new ATOM 0 HA GLN A 82 15.738 3.826 4.396 1.00 0.00 H new ATOM 0 HB2 GLN A 82 16.477 3.111 1.984 1.00 0.00 H new ATOM 0 HB3 GLN A 82 14.826 2.869 2.520 1.00 0.00 H new ATOM 0 HG2 GLN A 82 14.921 3.742 0.225 1.00 0.00 H new ATOM 0 HG3 GLN A 82 14.076 4.838 1.301 1.00 0.00 H new ATOM 0 HE21 GLN A 82 17.013 4.290 -0.571 1.00 0.00 H new ATOM 0 HE22 GLN A 82 17.581 5.963 -0.534 1.00 0.00 H new ATOM 1373 N ALA A 83 17.412 6.314 3.642 1.00 0.00 N ATOM 1374 CA ALA A 83 18.719 6.943 3.646 1.00 0.00 C ATOM 1375 C ALA A 83 19.300 6.948 5.052 1.00 0.00 C ATOM 1376 O ALA A 83 19.123 7.949 5.775 1.00 0.00 O ATOM 1377 CB ALA A 83 18.627 8.356 3.091 1.00 0.00 C ATOM 1378 OXT ALA A 83 19.917 5.938 5.439 1.00 0.00 O ATOM 0 H ALA A 83 16.631 6.960 3.754 1.00 0.00 H new ATOM 0 HA ALA A 83 19.387 6.368 3.005 1.00 0.00 H new ATOM 0 HB1 ALA A 83 19.615 8.816 3.100 1.00 0.00 H new ATOM 0 HB2 ALA A 83 18.252 8.321 2.068 1.00 0.00 H new ATOM 0 HB3 ALA A 83 17.947 8.945 3.707 1.00 0.00 H new TER 1384 ALA A 83 ATOM 1385 N VAL B 201 -5.198 -0.208 -15.968 1.00 0.00 N ATOM 1386 CA VAL B 201 -5.047 -0.993 -14.723 1.00 0.00 C ATOM 1387 C VAL B 201 -3.666 -0.769 -14.115 1.00 0.00 C ATOM 1388 O VAL B 201 -2.654 -0.790 -14.820 1.00 0.00 O ATOM 1389 CB VAL B 201 -5.239 -2.504 -14.983 1.00 0.00 C ATOM 1390 CG1 VAL B 201 -5.166 -3.295 -13.686 1.00 0.00 C ATOM 1391 CG2 VAL B 201 -6.557 -2.765 -15.693 1.00 0.00 C ATOM 0 HA VAL B 201 -5.817 -0.652 -14.030 1.00 0.00 H new ATOM 0 HB VAL B 201 -4.428 -2.838 -15.630 1.00 0.00 H new ATOM 0 HG11 VAL B 201 -5.304 -4.355 -13.898 1.00 0.00 H new ATOM 0 HG12 VAL B 201 -4.192 -3.142 -13.221 1.00 0.00 H new ATOM 0 HG13 VAL B 201 -5.949 -2.955 -13.008 1.00 0.00 H new ATOM 0 HG21 VAL B 201 -6.671 -3.835 -15.866 1.00 0.00 H new ATOM 0 HG22 VAL B 201 -7.380 -2.407 -15.075 1.00 0.00 H new ATOM 0 HG23 VAL B 201 -6.566 -2.240 -16.648 1.00 0.00 H new ATOM 1403 N VAL B 202 -3.633 -0.528 -12.812 1.00 0.00 N ATOM 1404 CA VAL B 202 -2.379 -0.403 -12.085 1.00 0.00 C ATOM 1405 C VAL B 202 -1.733 -1.776 -11.914 1.00 0.00 C ATOM 1406 O VAL B 202 -2.377 -2.715 -11.440 1.00 0.00 O ATOM 1407 CB VAL B 202 -2.599 0.248 -10.700 1.00 0.00 C ATOM 1408 CG1 VAL B 202 -1.320 0.237 -9.873 1.00 0.00 C ATOM 1409 CG2 VAL B 202 -3.106 1.670 -10.862 1.00 0.00 C ATOM 0 H VAL B 202 -4.466 -0.415 -12.234 1.00 0.00 H new ATOM 0 HA VAL B 202 -1.716 0.240 -12.664 1.00 0.00 H new ATOM 0 HB VAL B 202 -3.348 -0.339 -10.169 1.00 0.00 H new ATOM 0 HG11 VAL B 202 -1.508 0.702 -8.905 1.00 0.00 H new ATOM 0 HG12 VAL B 202 -0.992 -0.792 -9.724 1.00 0.00 H new ATOM 0 HG13 VAL B 202 -0.543 0.793 -10.397 1.00 0.00 H new ATOM 0 HG21 VAL B 202 -3.257 2.117 -9.879 1.00 0.00 H new ATOM 0 HG22 VAL B 202 -2.375 2.256 -11.419 1.00 0.00 H new ATOM 0 HG23 VAL B 202 -4.051 1.660 -11.405 1.00 0.00 H new ATOM 1419 N PRO B 203 -0.460 -1.913 -12.323 1.00 0.00 N ATOM 1420 CA PRO B 203 0.274 -3.176 -12.220 1.00 0.00 C ATOM 1421 C PRO B 203 0.371 -3.666 -10.781 1.00 0.00 C ATOM 1422 O PRO B 203 0.646 -2.886 -9.863 1.00 0.00 O ATOM 1423 CB PRO B 203 1.667 -2.846 -12.770 1.00 0.00 C ATOM 1424 CG PRO B 203 1.764 -1.360 -12.734 1.00 0.00 C ATOM 1425 CD PRO B 203 0.366 -0.848 -12.915 1.00 0.00 C ATOM 0 HA PRO B 203 -0.225 -3.977 -12.766 1.00 0.00 H new ATOM 0 HB2 PRO B 203 2.448 -3.306 -12.164 1.00 0.00 H new ATOM 0 HB3 PRO B 203 1.788 -3.223 -13.785 1.00 0.00 H new ATOM 0 HG2 PRO B 203 2.184 -1.020 -11.788 1.00 0.00 H new ATOM 0 HG3 PRO B 203 2.419 -0.993 -13.524 1.00 0.00 H new ATOM 0 HD2 PRO B 203 0.217 0.106 -12.408 1.00 0.00 H new ATOM 0 HD3 PRO B 203 0.127 -0.691 -13.967 1.00 0.00 H new ATOM 1433 N LYS B 204 0.129 -4.959 -10.600 1.00 0.00 N ATOM 1434 CA LYS B 204 0.170 -5.583 -9.285 1.00 0.00 C ATOM 1435 C LYS B 204 1.556 -5.402 -8.674 1.00 0.00 C ATOM 1436 O LYS B 204 2.564 -5.741 -9.300 1.00 0.00 O ATOM 1437 CB LYS B 204 -0.157 -7.077 -9.396 1.00 0.00 C ATOM 1438 CG LYS B 204 -1.337 -7.397 -10.310 1.00 0.00 C ATOM 1439 CD LYS B 204 -2.644 -6.807 -9.803 1.00 0.00 C ATOM 1440 CE LYS B 204 -3.805 -7.192 -10.712 1.00 0.00 C ATOM 1441 NZ LYS B 204 -5.123 -6.792 -10.149 1.00 0.00 N ATOM 0 H LYS B 204 -0.100 -5.602 -11.358 1.00 0.00 H new ATOM 0 HA LYS B 204 -0.573 -5.107 -8.645 1.00 0.00 H new ATOM 0 HB2 LYS B 204 0.724 -7.603 -9.763 1.00 0.00 H new ATOM 0 HB3 LYS B 204 -0.369 -7.465 -8.400 1.00 0.00 H new ATOM 0 HG2 LYS B 204 -1.133 -7.013 -11.310 1.00 0.00 H new ATOM 0 HG3 LYS B 204 -1.441 -8.478 -10.399 1.00 0.00 H new ATOM 0 HD2 LYS B 204 -2.838 -7.160 -8.790 1.00 0.00 H new ATOM 0 HD3 LYS B 204 -2.562 -5.721 -9.752 1.00 0.00 H new ATOM 0 HE2 LYS B 204 -3.671 -6.722 -11.686 1.00 0.00 H new ATOM 0 HE3 LYS B 204 -3.794 -8.270 -10.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 204 -5.813 -6.690 -10.920 1.00 0.00 H new ATOM 0 HZ2 LYS B 204 -5.452 -7.520 -9.484 1.00 0.00 H new ATOM 0 HZ3 LYS B 204 -5.026 -5.885 -9.649 1.00 0.00 H new ATOM 1455 N LYS B 205 1.610 -4.868 -7.462 1.00 0.00 N ATOM 1456 CA LYS B 205 2.886 -4.542 -6.843 1.00 0.00 C ATOM 1457 C LYS B 205 3.591 -5.803 -6.369 1.00 0.00 C ATOM 1458 O LYS B 205 3.122 -6.486 -5.457 1.00 0.00 O ATOM 1459 CB LYS B 205 2.695 -3.594 -5.663 1.00 0.00 C ATOM 1460 CG LYS B 205 3.931 -2.767 -5.342 1.00 0.00 C ATOM 1461 CD LYS B 205 4.189 -1.716 -6.409 1.00 0.00 C ATOM 1462 CE LYS B 205 5.459 -0.928 -6.133 1.00 0.00 C ATOM 1463 NZ LYS B 205 6.685 -1.735 -6.368 1.00 0.00 N ATOM 0 H LYS B 205 0.792 -4.653 -6.892 1.00 0.00 H new ATOM 0 HA LYS B 205 3.501 -4.049 -7.596 1.00 0.00 H new ATOM 0 HB2 LYS B 205 1.864 -2.922 -5.878 1.00 0.00 H new ATOM 0 HB3 LYS B 205 2.417 -4.174 -4.783 1.00 0.00 H new ATOM 0 HG2 LYS B 205 3.804 -2.281 -4.374 1.00 0.00 H new ATOM 0 HG3 LYS B 205 4.798 -3.423 -5.258 1.00 0.00 H new ATOM 0 HD2 LYS B 205 4.266 -2.199 -7.383 1.00 0.00 H new ATOM 0 HD3 LYS B 205 3.341 -1.033 -6.458 1.00 0.00 H new ATOM 0 HE2 LYS B 205 5.481 -0.044 -6.770 1.00 0.00 H new ATOM 0 HE3 LYS B 205 5.450 -0.577 -5.101 1.00 0.00 H new ATOM 0 HZ1 LYS B 205 7.526 -1.142 -6.216 1.00 0.00 H new ATOM 0 HZ2 LYS B 205 6.704 -2.538 -5.707 1.00 0.00 H new ATOM 0 HZ3 LYS B 205 6.684 -2.091 -7.345 1.00 0.00 H new ATOM 1477 N LYS B 206 4.720 -6.092 -6.989 1.00 0.00 N ATOM 1478 CA LYS B 206 5.509 -7.261 -6.651 1.00 0.00 C ATOM 1479 C LYS B 206 6.447 -6.921 -5.494 1.00 0.00 C ATOM 1480 O LYS B 206 7.472 -6.265 -5.682 1.00 0.00 O ATOM 1481 CB LYS B 206 6.286 -7.719 -7.895 1.00 0.00 C ATOM 1482 CG LYS B 206 6.941 -9.092 -7.781 1.00 0.00 C ATOM 1483 CD LYS B 206 8.315 -9.031 -7.127 1.00 0.00 C ATOM 1484 CE LYS B 206 9.308 -8.210 -7.942 1.00 0.00 C ATOM 1485 NZ LYS B 206 9.518 -8.760 -9.310 1.00 0.00 N ATOM 0 H LYS B 206 5.115 -5.524 -7.739 1.00 0.00 H new ATOM 0 HA LYS B 206 4.864 -8.080 -6.331 1.00 0.00 H new ATOM 0 HB2 LYS B 206 5.605 -7.728 -8.746 1.00 0.00 H new ATOM 0 HB3 LYS B 206 7.059 -6.982 -8.113 1.00 0.00 H new ATOM 0 HG2 LYS B 206 6.295 -9.752 -7.201 1.00 0.00 H new ATOM 0 HG3 LYS B 206 7.034 -9.530 -8.775 1.00 0.00 H new ATOM 0 HD2 LYS B 206 8.222 -8.599 -6.130 1.00 0.00 H new ATOM 0 HD3 LYS B 206 8.700 -10.043 -7.001 1.00 0.00 H new ATOM 0 HE2 LYS B 206 8.949 -7.184 -8.018 1.00 0.00 H new ATOM 0 HE3 LYS B 206 10.263 -8.176 -7.417 1.00 0.00 H new ATOM 0 HZ1 LYS B 206 10.330 -8.285 -9.754 1.00 0.00 H new ATOM 0 HZ2 LYS B 206 9.705 -9.781 -9.249 1.00 0.00 H new ATOM 0 HZ3 LYS B 206 8.666 -8.598 -9.884 1.00 0.00 H new ATOM 1499 N ILE B 207 6.077 -7.342 -4.295 1.00 0.00 N ATOM 1500 CA ILE B 207 6.866 -7.047 -3.104 1.00 0.00 C ATOM 1501 C ILE B 207 7.626 -8.296 -2.658 1.00 0.00 C ATOM 1502 O ILE B 207 7.194 -9.021 -1.765 1.00 0.00 O ATOM 1503 CB ILE B 207 5.972 -6.532 -1.948 1.00 0.00 C ATOM 1504 CG1 ILE B 207 5.090 -5.367 -2.420 1.00 0.00 C ATOM 1505 CG2 ILE B 207 6.817 -6.103 -0.753 1.00 0.00 C ATOM 1506 CD1 ILE B 207 5.842 -4.075 -2.667 1.00 0.00 C ATOM 0 H ILE B 207 5.235 -7.890 -4.118 1.00 0.00 H new ATOM 0 HA ILE B 207 7.577 -6.260 -3.358 1.00 0.00 H new ATOM 0 HB ILE B 207 5.326 -7.353 -1.635 1.00 0.00 H new ATOM 0 HG12 ILE B 207 4.583 -5.660 -3.339 1.00 0.00 H new ATOM 0 HG13 ILE B 207 4.317 -5.186 -1.673 1.00 0.00 H new ATOM 0 HG21 ILE B 207 6.165 -5.746 0.044 1.00 0.00 H new ATOM 0 HG22 ILE B 207 7.397 -6.953 -0.394 1.00 0.00 H new ATOM 0 HG23 ILE B 207 7.494 -5.303 -1.054 1.00 0.00 H new ATOM 0 HD11 ILE B 207 5.144 -3.305 -2.997 1.00 0.00 H new ATOM 0 HD12 ILE B 207 6.327 -3.754 -1.745 1.00 0.00 H new ATOM 0 HD13 ILE B 207 6.597 -4.235 -3.437 1.00 0.00 H new ATOM 1518 N LYS B 208 8.755 -8.552 -3.305 1.00 0.00 N ATOM 1519 CA LYS B 208 9.546 -9.747 -3.026 1.00 0.00 C ATOM 1520 C LYS B 208 10.818 -9.395 -2.260 1.00 0.00 C ATOM 1521 O LYS B 208 11.903 -9.859 -2.613 1.00 0.00 O ATOM 1522 CB LYS B 208 9.918 -10.451 -4.336 1.00 0.00 C ATOM 1523 CG LYS B 208 9.477 -11.908 -4.427 1.00 0.00 C ATOM 1524 CD LYS B 208 8.023 -12.057 -4.870 1.00 0.00 C ATOM 1525 CE LYS B 208 7.046 -11.614 -3.795 1.00 0.00 C ATOM 1526 NZ LYS B 208 5.632 -11.814 -4.204 1.00 0.00 N ATOM 0 H LYS B 208 9.146 -7.948 -4.028 1.00 0.00 H new ATOM 0 HA LYS B 208 8.942 -10.414 -2.411 1.00 0.00 H new ATOM 0 HB2 LYS B 208 9.476 -9.900 -5.166 1.00 0.00 H new ATOM 0 HB3 LYS B 208 11.000 -10.405 -4.462 1.00 0.00 H new ATOM 0 HG2 LYS B 208 10.122 -12.436 -5.129 1.00 0.00 H new ATOM 0 HG3 LYS B 208 9.607 -12.384 -3.455 1.00 0.00 H new ATOM 0 HD2 LYS B 208 7.858 -11.469 -5.773 1.00 0.00 H new ATOM 0 HD3 LYS B 208 7.829 -13.098 -5.128 1.00 0.00 H new ATOM 0 HE2 LYS B 208 7.240 -12.172 -2.879 1.00 0.00 H new ATOM 0 HE3 LYS B 208 7.211 -10.561 -3.568 1.00 0.00 H new ATOM 0 HZ1 LYS B 208 5.013 -11.710 -3.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 208 5.374 -11.105 -4.920 1.00 0.00 H new ATOM 0 HZ3 LYS B 208 5.518 -12.767 -4.604 1.00 0.00 H new ATOM 1540 N LYS B 209 10.669 -8.569 -1.222 1.00 0.00 N ATOM 1541 CA LYS B 209 11.793 -8.129 -0.382 1.00 0.00 C ATOM 1542 C LYS B 209 12.730 -7.182 -1.143 1.00 0.00 C ATOM 1543 O LYS B 209 13.105 -7.441 -2.289 1.00 0.00 O ATOM 1544 CB LYS B 209 12.575 -9.336 0.161 1.00 0.00 C ATOM 1545 CG LYS B 209 13.668 -8.981 1.162 1.00 0.00 C ATOM 1546 CD LYS B 209 13.117 -8.319 2.419 1.00 0.00 C ATOM 1547 CE LYS B 209 12.153 -9.226 3.171 1.00 0.00 C ATOM 1548 NZ LYS B 209 11.757 -8.647 4.482 1.00 0.00 N ATOM 0 H LYS B 209 9.768 -8.185 -0.938 1.00 0.00 H new ATOM 0 HA LYS B 209 11.374 -7.578 0.460 1.00 0.00 H new ATOM 0 HB2 LYS B 209 11.875 -10.023 0.635 1.00 0.00 H new ATOM 0 HB3 LYS B 209 13.026 -9.868 -0.677 1.00 0.00 H new ATOM 0 HG2 LYS B 209 14.209 -9.885 1.439 1.00 0.00 H new ATOM 0 HG3 LYS B 209 14.386 -8.312 0.688 1.00 0.00 H new ATOM 0 HD2 LYS B 209 13.943 -8.046 3.076 1.00 0.00 H new ATOM 0 HD3 LYS B 209 12.607 -7.395 2.147 1.00 0.00 H new ATOM 0 HE2 LYS B 209 11.263 -9.393 2.564 1.00 0.00 H new ATOM 0 HE3 LYS B 209 12.618 -10.199 3.329 1.00 0.00 H new ATOM 0 HZ1 LYS B 209 10.784 -8.936 4.710 1.00 0.00 H new ATOM 0 HZ2 LYS B 209 12.402 -8.990 5.222 1.00 0.00 H new ATOM 0 HZ3 LYS B 209 11.807 -7.609 4.432 1.00 0.00 H new ATOM 1562 N GLU B 210 13.096 -6.081 -0.487 1.00 0.00 N ATOM 1563 CA GLU B 210 13.984 -5.070 -1.062 1.00 0.00 C ATOM 1564 C GLU B 210 13.369 -4.472 -2.324 1.00 0.00 C ATOM 1565 O GLU B 210 13.824 -4.726 -3.438 1.00 0.00 O ATOM 1566 CB GLU B 210 15.367 -5.663 -1.359 1.00 0.00 C ATOM 1567 CG GLU B 210 16.430 -4.619 -1.664 1.00 0.00 C ATOM 1568 CD GLU B 210 16.590 -3.610 -0.545 1.00 0.00 C ATOM 1569 OE1 GLU B 210 17.018 -4.002 0.560 1.00 0.00 O ATOM 1570 OE2 GLU B 210 16.289 -2.420 -0.761 1.00 0.00 O ATOM 0 H GLU B 210 12.785 -5.864 0.460 1.00 0.00 H new ATOM 0 HA GLU B 210 14.110 -4.271 -0.331 1.00 0.00 H new ATOM 0 HB2 GLU B 210 15.689 -6.256 -0.503 1.00 0.00 H new ATOM 0 HB3 GLU B 210 15.286 -6.344 -2.206 1.00 0.00 H new ATOM 0 HG2 GLU B 210 17.384 -5.117 -1.839 1.00 0.00 H new ATOM 0 HG3 GLU B 210 16.169 -4.097 -2.585 1.00 0.00 H new ATOM 1577 N GLN B 211 12.318 -3.690 -2.138 1.00 0.00 N ATOM 1578 CA GLN B 211 11.628 -3.053 -3.252 1.00 0.00 C ATOM 1579 C GLN B 211 11.532 -1.551 -3.036 1.00 0.00 C ATOM 1580 O GLN B 211 10.756 -0.867 -3.703 1.00 0.00 O ATOM 1581 CB GLN B 211 10.230 -3.654 -3.423 1.00 0.00 C ATOM 1582 CG GLN B 211 10.241 -5.049 -4.029 1.00 0.00 C ATOM 1583 CD GLN B 211 10.738 -5.057 -5.462 1.00 0.00 C ATOM 1584 OE1 GLN B 211 11.936 -5.157 -5.717 1.00 0.00 O ATOM 1585 NE2 GLN B 211 9.820 -4.982 -6.408 1.00 0.00 N ATOM 0 H GLN B 211 11.921 -3.479 -1.222 1.00 0.00 H new ATOM 0 HA GLN B 211 12.202 -3.234 -4.161 1.00 0.00 H new ATOM 0 HB2 GLN B 211 9.738 -3.692 -2.451 1.00 0.00 H new ATOM 0 HB3 GLN B 211 9.635 -2.996 -4.056 1.00 0.00 H new ATOM 0 HG2 GLN B 211 10.874 -5.699 -3.425 1.00 0.00 H new ATOM 0 HG3 GLN B 211 9.234 -5.464 -3.995 1.00 0.00 H new ATOM 0 HE21 GLN B 211 8.835 -4.900 -6.157 1.00 0.00 H new ATOM 0 HE22 GLN B 211 10.096 -5.006 -7.390 1.00 0.00 H new ATOM 1594 N VAL B 212 12.337 -1.042 -2.116 1.00 0.00 N ATOM 1595 CA VAL B 212 12.300 0.372 -1.773 1.00 0.00 C ATOM 1596 C VAL B 212 13.143 1.203 -2.737 1.00 0.00 C ATOM 1597 O VAL B 212 14.294 0.865 -3.037 1.00 0.00 O ATOM 1598 CB VAL B 212 12.770 0.619 -0.320 1.00 0.00 C ATOM 1599 CG1 VAL B 212 14.153 0.034 -0.076 1.00 0.00 C ATOM 1600 CG2 VAL B 212 12.755 2.105 0.000 1.00 0.00 C ATOM 0 H VAL B 212 13.024 -1.586 -1.594 1.00 0.00 H new ATOM 0 HA VAL B 212 11.260 0.688 -1.858 1.00 0.00 H new ATOM 0 HB VAL B 212 12.072 0.111 0.346 1.00 0.00 H new ATOM 0 HG11 VAL B 212 14.452 0.225 0.954 1.00 0.00 H new ATOM 0 HG12 VAL B 212 14.130 -1.041 -0.253 1.00 0.00 H new ATOM 0 HG13 VAL B 212 14.869 0.498 -0.754 1.00 0.00 H new ATOM 0 HG21 VAL B 212 13.089 2.260 1.026 1.00 0.00 H new ATOM 0 HG22 VAL B 212 13.423 2.631 -0.682 1.00 0.00 H new ATOM 0 HG23 VAL B 212 11.742 2.492 -0.114 1.00 0.00 H new ATOM 1610 N GLU B 213 12.550 2.276 -3.237 1.00 0.00 N ATOM 1611 CA GLU B 213 13.244 3.206 -4.106 1.00 0.00 C ATOM 1612 C GLU B 213 12.974 4.637 -3.653 1.00 0.00 C ATOM 1613 O GLU B 213 11.981 5.232 -4.114 1.00 0.00 O ATOM 1614 CB GLU B 213 12.802 3.007 -5.557 1.00 0.00 C ATOM 1615 CG GLU B 213 13.570 3.853 -6.558 1.00 0.00 C ATOM 1616 CD GLU B 213 15.064 3.647 -6.456 1.00 0.00 C ATOM 1617 OE1 GLU B 213 15.545 2.548 -6.802 1.00 0.00 O ATOM 1618 OE2 GLU B 213 15.768 4.587 -6.028 1.00 0.00 O ATOM 1619 OXT GLU B 213 13.755 5.154 -2.823 1.00 0.00 O ATOM 0 H GLU B 213 11.578 2.524 -3.051 1.00 0.00 H new ATOM 0 HA GLU B 213 14.316 3.017 -4.047 1.00 0.00 H new ATOM 0 HB2 GLU B 213 12.918 1.956 -5.821 1.00 0.00 H new ATOM 0 HB3 GLU B 213 11.740 3.241 -5.638 1.00 0.00 H new ATOM 0 HG2 GLU B 213 13.240 3.607 -7.567 1.00 0.00 H new ATOM 0 HG3 GLU B 213 13.339 4.905 -6.394 1.00 0.00 H new TER 1626 GLU B 213