USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1069 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: B 7 THR OG1 : rot 129:sc= 0.408 USER MOD Set 1.2: B 9 THR OG1 : rot 180:sc= 1.04 USER MOD Set 2.1: B 1 MET CE :methyl -134:sc= -0.115 (180deg=-0.268) USER MOD Set 2.2: B 19 SER OG : rot 180:sc= -0.0175 USER MOD Set 3.1: A 59 GLN : amide:sc= -6.62! C(o=-5.5!,f=-6.4!) USER MOD Set 3.2: B 68 HIS : no HE2:sc= 1.11 K(o=-5.5,f=-16!) USER MOD Single : A 7 LYS NZ :NH3+ -159:sc= 1.12 (180deg=0.812) USER MOD Single : A 12 GLN : amide:sc= -0.516 X(o=-0.52,f=-0.42) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl 159:sc= -0.186 (180deg=-0.867) USER MOD Single : A 19 SER OG : rot -58:sc= 1.21 USER MOD Single : A 20 GLN : amide:sc= -0.885 K(o=-0.89,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0328 USER MOD Single : A 26 LYS NZ :NH3+ -171:sc= 1.27 (180deg=0.755) USER MOD Single : A 27 SER OG : rot 123:sc= 1.15 USER MOD Single : A 30 LYS NZ :NH3+ 135:sc= -0.19 (180deg=-0.692) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -137:sc= -0.438 (180deg=-2.35!) USER MOD Single : A 38 LYS NZ :NH3+ -164:sc= 0.836 (180deg=0.493) USER MOD Single : A 39 SER OG : rot 170:sc= 0.56 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0.47 (180deg=0.47) USER MOD Single : A 44 MET CE :methyl -147:sc= -0.24 (180deg=-0.775) USER MOD Single : A 45 CYS SG : rot 4:sc= -0.105 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.0033) USER MOD Single : A 50 SER OG : rot 150:sc=-0.00754 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 35:sc= 1.16 USER MOD Single : B 1 MET N :NH3+ 146:sc= 1.95 (180deg=1.77) USER MOD Single : B 2 GLN : amide:sc= -1.01 K(o=-1,f=0) USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ -150:sc= 1.22 (180deg=0.736) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0.0501 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.321 USER MOD Single : B 25 ASN : amide:sc= -3.59! C(o=-3.6!,f=-5.6!) USER MOD Single : B 27 LYS NZ :NH3+ 151:sc= 1.05 (180deg=0.614) USER MOD Single : B 28 SER OG : rot -11:sc= 1.23 USER MOD Single : B 29 LYS NZ :NH3+ -166:sc=-0.00911 (180deg=-0.262) USER MOD Single : B 31 GLN : amide:sc= -2.02 K(o=-2,f=-0.63) USER MOD Single : B 33 LYS NZ :NH3+ -176:sc= 1.62 (180deg=1.55) USER MOD Single : B 40 GLN : amide:sc= -3.7! C(o=-3.7!,f=-3.1!) USER MOD Single : B 41 GLN : amide:sc= -2.4 K(o=-2.4,f=-3.6!) USER MOD Single : B 48 LYS NZ :NH3+ -162:sc= -0.0518 (180deg=-0.376) USER MOD Single : B 49 GLN : amide:sc= 2.79 K(o=2.8,f=-4.4!) USER MOD Single : B 55 THR OG1 : rot -63:sc= 1.24 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 180:sc= 0.713 USER MOD Single : B 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 GLN : amide:sc= -1.16 K(o=-1.2,f=-0.013) USER MOD Single : B 63 LYS NZ :NH3+ 159:sc= -0.0421 (180deg=-0.369) USER MOD Single : B 65 SER OG : rot -94:sc= 1.26 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 96 N LYS A 7 -19.753 3.623 0.138 1.00 0.00 N ATOM 97 CA LYS A 7 -19.033 3.791 -1.117 1.00 0.00 C ATOM 98 C LYS A 7 -18.503 2.456 -1.628 1.00 0.00 C ATOM 99 O LYS A 7 -18.129 1.584 -0.843 1.00 0.00 O ATOM 100 CB LYS A 7 -17.888 4.788 -0.930 1.00 0.00 C ATOM 101 CG LYS A 7 -18.352 6.120 -0.367 1.00 0.00 C ATOM 102 CD LYS A 7 -17.216 7.121 -0.242 1.00 0.00 C ATOM 103 CE LYS A 7 -17.717 8.447 0.307 1.00 0.00 C ATOM 104 NZ LYS A 7 -16.635 9.463 0.403 1.00 0.00 N ATOM 0 HA LYS A 7 -19.725 4.181 -1.863 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -17.142 4.357 -0.262 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -17.398 4.955 -1.889 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -19.128 6.533 -1.011 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -18.802 5.961 0.613 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -16.444 6.720 0.414 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.756 7.278 -1.217 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -18.512 8.826 -0.335 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -18.152 8.288 1.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -16.909 10.199 1.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -15.757 9.006 0.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -16.481 9.896 -0.530 1.00 0.00 H new ATOM 118 N ARG A 8 -18.476 2.301 -2.945 1.00 0.00 N ATOM 119 CA ARG A 8 -18.057 1.046 -3.556 1.00 0.00 C ATOM 120 C ARG A 8 -16.709 1.213 -4.245 1.00 0.00 C ATOM 121 O ARG A 8 -16.529 2.127 -5.058 1.00 0.00 O ATOM 122 CB ARG A 8 -19.093 0.578 -4.581 1.00 0.00 C ATOM 123 CG ARG A 8 -20.533 0.787 -4.141 1.00 0.00 C ATOM 124 CD ARG A 8 -21.506 0.277 -5.190 1.00 0.00 C ATOM 125 NE ARG A 8 -22.739 1.058 -5.219 1.00 0.00 N ATOM 126 CZ ARG A 8 -23.868 0.641 -5.787 1.00 0.00 C ATOM 127 NH1 ARG A 8 -23.971 -0.601 -6.247 1.00 0.00 N ATOM 128 NH2 ARG A 8 -24.906 1.459 -5.873 1.00 0.00 N ATOM 0 H ARG A 8 -18.739 3.028 -3.611 1.00 0.00 H new ATOM 0 HA ARG A 8 -17.968 0.299 -2.767 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -18.929 1.110 -5.518 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.936 -0.481 -4.784 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -20.707 0.270 -3.198 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -20.711 1.847 -3.961 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -21.032 0.311 -6.171 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -21.743 -0.767 -4.987 1.00 0.00 H new ATOM 0 HE ARG A 8 -22.735 1.978 -4.778 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -23.182 -1.242 -6.166 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -24.839 -0.914 -6.681 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -24.840 2.408 -5.504 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -25.772 1.140 -6.308 1.00 0.00 H new ATOM 142 N GLY A 9 -15.773 0.333 -3.930 1.00 0.00 N ATOM 143 CA GLY A 9 -14.456 0.411 -4.527 1.00 0.00 C ATOM 144 C GLY A 9 -13.937 -0.942 -4.962 1.00 0.00 C ATOM 145 O GLY A 9 -14.451 -1.979 -4.542 1.00 0.00 O ATOM 0 H GLY A 9 -15.901 -0.435 -3.271 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -14.490 1.078 -5.389 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -13.761 0.850 -3.811 1.00 0.00 H new ATOM 149 N ILE A 10 -12.934 -0.929 -5.826 1.00 0.00 N ATOM 150 CA ILE A 10 -12.288 -2.154 -6.269 1.00 0.00 C ATOM 151 C ILE A 10 -10.786 -2.050 -6.046 1.00 0.00 C ATOM 152 O ILE A 10 -10.171 -1.030 -6.371 1.00 0.00 O ATOM 153 CB ILE A 10 -12.575 -2.451 -7.762 1.00 0.00 C ATOM 154 CG1 ILE A 10 -14.084 -2.602 -7.998 1.00 0.00 C ATOM 155 CG2 ILE A 10 -11.839 -3.708 -8.213 1.00 0.00 C ATOM 156 CD1 ILE A 10 -14.455 -2.873 -9.442 1.00 0.00 C ATOM 0 H ILE A 10 -12.548 -0.078 -6.236 1.00 0.00 H new ATOM 0 HA ILE A 10 -12.697 -2.977 -5.682 1.00 0.00 H new ATOM 0 HB ILE A 10 -12.212 -1.610 -8.353 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -14.459 -3.416 -7.378 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -14.586 -1.692 -7.669 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.054 -3.898 -9.264 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -10.766 -3.568 -8.082 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.170 -4.557 -7.615 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -15.538 -2.967 -9.528 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -14.112 -2.048 -10.067 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -13.983 -3.799 -9.771 1.00 0.00 H new ATOM 168 N VAL A 11 -10.206 -3.090 -5.471 1.00 0.00 N ATOM 169 CA VAL A 11 -8.780 -3.101 -5.187 1.00 0.00 C ATOM 170 C VAL A 11 -7.980 -3.505 -6.428 1.00 0.00 C ATOM 171 O VAL A 11 -8.356 -4.431 -7.155 1.00 0.00 O ATOM 172 CB VAL A 11 -8.450 -4.030 -3.996 1.00 0.00 C ATOM 173 CG1 VAL A 11 -9.045 -5.410 -4.196 1.00 0.00 C ATOM 174 CG2 VAL A 11 -6.952 -4.121 -3.787 1.00 0.00 C ATOM 0 H VAL A 11 -10.700 -3.938 -5.192 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.491 -2.088 -4.908 1.00 0.00 H new ATOM 0 HB VAL A 11 -8.898 -3.598 -3.101 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -8.796 -6.041 -3.343 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -10.128 -5.330 -4.284 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.639 -5.853 -5.105 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -6.742 -4.779 -2.944 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.483 -4.521 -4.686 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -6.553 -3.128 -3.580 1.00 0.00 H new ATOM 184 N GLN A 12 -6.887 -2.792 -6.673 1.00 0.00 N ATOM 185 CA GLN A 12 -6.097 -2.986 -7.885 1.00 0.00 C ATOM 186 C GLN A 12 -4.867 -3.856 -7.636 1.00 0.00 C ATOM 187 O GLN A 12 -4.367 -4.505 -8.553 1.00 0.00 O ATOM 188 CB GLN A 12 -5.669 -1.628 -8.442 1.00 0.00 C ATOM 189 CG GLN A 12 -6.836 -0.687 -8.691 1.00 0.00 C ATOM 190 CD GLN A 12 -7.821 -1.234 -9.707 1.00 0.00 C ATOM 191 OE1 GLN A 12 -7.447 -1.947 -10.639 1.00 0.00 O ATOM 192 NE2 GLN A 12 -9.094 -0.933 -9.516 1.00 0.00 N ATOM 0 H GLN A 12 -6.526 -2.072 -6.047 1.00 0.00 H new ATOM 0 HA GLN A 12 -6.724 -3.506 -8.610 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -4.975 -1.159 -7.744 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -5.128 -1.780 -9.376 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.355 -0.502 -7.751 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -6.456 0.273 -9.040 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.366 -0.339 -8.732 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.805 -1.295 -10.152 1.00 0.00 H new ATOM 201 N TYR A 13 -4.380 -3.871 -6.402 1.00 0.00 N ATOM 202 CA TYR A 13 -3.173 -4.627 -6.068 1.00 0.00 C ATOM 203 C TYR A 13 -3.427 -5.577 -4.909 1.00 0.00 C ATOM 204 O TYR A 13 -4.208 -5.274 -4.012 1.00 0.00 O ATOM 205 CB TYR A 13 -2.023 -3.684 -5.703 1.00 0.00 C ATOM 206 CG TYR A 13 -1.433 -2.942 -6.880 1.00 0.00 C ATOM 207 CD1 TYR A 13 -1.933 -1.707 -7.272 1.00 0.00 C ATOM 208 CD2 TYR A 13 -0.362 -3.471 -7.587 1.00 0.00 C ATOM 209 CE1 TYR A 13 -1.383 -1.022 -8.337 1.00 0.00 C ATOM 210 CE2 TYR A 13 0.191 -2.794 -8.654 1.00 0.00 C ATOM 211 CZ TYR A 13 -0.322 -1.569 -9.025 1.00 0.00 C ATOM 212 OH TYR A 13 0.233 -0.886 -10.082 1.00 0.00 O ATOM 0 H TYR A 13 -4.798 -3.372 -5.617 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.898 -5.206 -6.949 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.381 -2.958 -4.973 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.235 -4.261 -5.219 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -2.765 -1.276 -6.735 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.045 -4.428 -7.297 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -1.782 -0.062 -8.629 1.00 0.00 H new ATOM 0 HE2 TYR A 13 1.022 -3.221 -9.196 1.00 0.00 H new ATOM 0 HH TYR A 13 0.972 -1.409 -10.457 1.00 0.00 H new ATOM 222 N ASP A 14 -2.760 -6.722 -4.927 1.00 0.00 N ATOM 223 CA ASP A 14 -2.904 -7.704 -3.858 1.00 0.00 C ATOM 224 C ASP A 14 -2.202 -7.223 -2.597 1.00 0.00 C ATOM 225 O ASP A 14 -1.036 -6.831 -2.636 1.00 0.00 O ATOM 226 CB ASP A 14 -2.325 -9.060 -4.275 1.00 0.00 C ATOM 227 CG ASP A 14 -3.042 -9.665 -5.463 1.00 0.00 C ATOM 228 OD1 ASP A 14 -4.098 -10.303 -5.271 1.00 0.00 O ATOM 229 OD2 ASP A 14 -2.554 -9.504 -6.599 1.00 0.00 O ATOM 0 H ASP A 14 -2.114 -6.995 -5.668 1.00 0.00 H new ATOM 0 HA ASP A 14 -3.969 -7.823 -3.658 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.269 -8.940 -4.517 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.383 -9.749 -3.432 1.00 0.00 H new ATOM 234 N PHE A 15 -2.915 -7.248 -1.486 1.00 0.00 N ATOM 235 CA PHE A 15 -2.344 -6.861 -0.210 1.00 0.00 C ATOM 236 C PHE A 15 -2.579 -7.952 0.818 1.00 0.00 C ATOM 237 O PHE A 15 -3.711 -8.206 1.229 1.00 0.00 O ATOM 238 CB PHE A 15 -2.931 -5.532 0.272 1.00 0.00 C ATOM 239 CG PHE A 15 -2.433 -5.112 1.628 1.00 0.00 C ATOM 240 CD1 PHE A 15 -1.142 -4.636 1.787 1.00 0.00 C ATOM 241 CD2 PHE A 15 -3.253 -5.207 2.742 1.00 0.00 C ATOM 242 CE1 PHE A 15 -0.678 -4.259 3.033 1.00 0.00 C ATOM 243 CE2 PHE A 15 -2.794 -4.832 3.990 1.00 0.00 C ATOM 244 CZ PHE A 15 -1.503 -4.359 4.136 1.00 0.00 C ATOM 0 H PHE A 15 -3.893 -7.533 -1.442 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.270 -6.726 -0.340 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -2.690 -4.754 -0.452 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -4.018 -5.614 0.302 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -0.491 -4.559 0.928 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -4.261 -5.578 2.633 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.330 -3.886 3.144 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.443 -4.908 4.850 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.140 -4.068 5.111 1.00 0.00 H new ATOM 254 N MET A 16 -1.506 -8.616 1.206 1.00 0.00 N ATOM 255 CA MET A 16 -1.582 -9.653 2.215 1.00 0.00 C ATOM 256 C MET A 16 -1.293 -9.063 3.585 1.00 0.00 C ATOM 257 O MET A 16 -0.209 -8.532 3.826 1.00 0.00 O ATOM 258 CB MET A 16 -0.603 -10.786 1.905 1.00 0.00 C ATOM 259 CG MET A 16 -0.864 -11.464 0.568 1.00 0.00 C ATOM 260 SD MET A 16 0.220 -12.875 0.273 1.00 0.00 S ATOM 261 CE MET A 16 -0.276 -13.961 1.611 1.00 0.00 C ATOM 0 H MET A 16 -0.569 -8.454 0.836 1.00 0.00 H new ATOM 0 HA MET A 16 -2.590 -10.068 2.212 1.00 0.00 H new ATOM 0 HB2 MET A 16 0.412 -10.390 1.911 1.00 0.00 H new ATOM 0 HB3 MET A 16 -0.659 -11.531 2.698 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.902 -11.796 0.531 1.00 0.00 H new ATOM 0 HG3 MET A 16 -0.733 -10.737 -0.234 1.00 0.00 H new ATOM 0 HE1 MET A 16 0.004 -14.986 1.370 1.00 0.00 H new ATOM 0 HE2 MET A 16 0.222 -13.655 2.531 1.00 0.00 H new ATOM 0 HE3 MET A 16 -1.356 -13.902 1.746 1.00 0.00 H new ATOM 271 N ALA A 17 -2.275 -9.144 4.468 1.00 0.00 N ATOM 272 CA ALA A 17 -2.157 -8.584 5.805 1.00 0.00 C ATOM 273 C ALA A 17 -1.183 -9.387 6.654 1.00 0.00 C ATOM 274 O ALA A 17 -1.166 -10.618 6.587 1.00 0.00 O ATOM 275 CB ALA A 17 -3.519 -8.552 6.474 1.00 0.00 C ATOM 0 H ALA A 17 -3.170 -9.596 4.281 1.00 0.00 H new ATOM 0 HA ALA A 17 -1.772 -7.568 5.714 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.423 -8.131 7.475 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.199 -7.936 5.885 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.915 -9.565 6.543 1.00 0.00 H new ATOM 281 N GLU A 18 -0.382 -8.697 7.454 1.00 0.00 N ATOM 282 CA GLU A 18 0.548 -9.370 8.350 1.00 0.00 C ATOM 283 C GLU A 18 -0.034 -9.429 9.754 1.00 0.00 C ATOM 284 O GLU A 18 0.375 -10.253 10.572 1.00 0.00 O ATOM 285 CB GLU A 18 1.918 -8.678 8.362 1.00 0.00 C ATOM 286 CG GLU A 18 1.895 -7.254 8.895 1.00 0.00 C ATOM 287 CD GLU A 18 3.285 -6.683 9.088 1.00 0.00 C ATOM 288 OE1 GLU A 18 3.962 -7.077 10.060 1.00 0.00 O ATOM 289 OE2 GLU A 18 3.708 -5.838 8.274 1.00 0.00 O ATOM 0 H GLU A 18 -0.357 -7.678 7.501 1.00 0.00 H new ATOM 0 HA GLU A 18 0.698 -10.386 7.983 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.605 -9.269 8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.316 -8.667 7.347 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.338 -6.620 8.205 1.00 0.00 H new ATOM 0 HG3 GLU A 18 1.363 -7.234 9.846 1.00 0.00 H new ATOM 296 N SER A 19 -1.002 -8.560 10.022 1.00 0.00 N ATOM 297 CA SER A 19 -1.677 -8.542 11.307 1.00 0.00 C ATOM 298 C SER A 19 -3.186 -8.718 11.131 1.00 0.00 C ATOM 299 O SER A 19 -3.688 -8.739 10.007 1.00 0.00 O ATOM 300 CB SER A 19 -1.367 -7.239 12.047 1.00 0.00 C ATOM 301 OG SER A 19 -1.718 -6.102 11.273 1.00 0.00 O ATOM 0 H SER A 19 -1.335 -7.858 9.362 1.00 0.00 H new ATOM 0 HA SER A 19 -1.309 -9.377 11.903 1.00 0.00 H new ATOM 0 HB2 SER A 19 -1.910 -7.218 12.992 1.00 0.00 H new ATOM 0 HB3 SER A 19 -0.305 -7.201 12.289 1.00 0.00 H new ATOM 0 HG SER A 19 -1.232 -6.123 10.422 1.00 0.00 H new ATOM 307 N GLN A 20 -3.894 -8.857 12.246 1.00 0.00 N ATOM 308 CA GLN A 20 -5.342 -9.056 12.236 1.00 0.00 C ATOM 309 C GLN A 20 -6.083 -7.770 11.866 1.00 0.00 C ATOM 310 O GLN A 20 -7.210 -7.811 11.370 1.00 0.00 O ATOM 311 CB GLN A 20 -5.810 -9.534 13.614 1.00 0.00 C ATOM 312 CG GLN A 20 -5.467 -8.565 14.737 1.00 0.00 C ATOM 313 CD GLN A 20 -5.887 -9.055 16.109 1.00 0.00 C ATOM 314 OE1 GLN A 20 -5.251 -8.733 17.112 1.00 0.00 O ATOM 315 NE2 GLN A 20 -6.960 -9.829 16.169 1.00 0.00 N ATOM 0 H GLN A 20 -3.484 -8.835 13.180 1.00 0.00 H new ATOM 0 HA GLN A 20 -5.570 -9.810 11.482 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -6.889 -9.685 13.591 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -5.357 -10.502 13.828 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -4.392 -8.388 14.737 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -5.948 -7.607 14.539 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -7.461 -10.074 15.315 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -7.286 -10.180 17.070 1.00 0.00 H new ATOM 324 N ASP A 21 -5.443 -6.636 12.119 1.00 0.00 N ATOM 325 CA ASP A 21 -6.044 -5.329 11.881 1.00 0.00 C ATOM 326 C ASP A 21 -6.276 -5.103 10.397 1.00 0.00 C ATOM 327 O ASP A 21 -7.295 -4.550 9.986 1.00 0.00 O ATOM 328 CB ASP A 21 -5.134 -4.225 12.429 1.00 0.00 C ATOM 329 CG ASP A 21 -4.939 -4.315 13.929 1.00 0.00 C ATOM 330 OD1 ASP A 21 -4.333 -5.304 14.400 1.00 0.00 O ATOM 331 OD2 ASP A 21 -5.378 -3.395 14.648 1.00 0.00 O ATOM 0 H ASP A 21 -4.495 -6.595 12.494 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.005 -5.299 12.395 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -4.163 -4.283 11.937 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -5.560 -3.253 12.180 1.00 0.00 H new ATOM 336 N GLU A 22 -5.325 -5.553 9.602 1.00 0.00 N ATOM 337 CA GLU A 22 -5.354 -5.332 8.168 1.00 0.00 C ATOM 338 C GLU A 22 -6.247 -6.358 7.481 1.00 0.00 C ATOM 339 O GLU A 22 -6.479 -7.449 8.006 1.00 0.00 O ATOM 340 CB GLU A 22 -3.938 -5.427 7.620 1.00 0.00 C ATOM 341 CG GLU A 22 -2.932 -4.607 8.403 1.00 0.00 C ATOM 342 CD GLU A 22 -1.511 -5.055 8.148 1.00 0.00 C ATOM 343 OE1 GLU A 22 -1.124 -6.129 8.663 1.00 0.00 O ATOM 344 OE2 GLU A 22 -0.778 -4.346 7.434 1.00 0.00 O ATOM 0 H GLU A 22 -4.515 -6.079 9.929 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.761 -4.340 7.970 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.625 -6.471 7.623 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.936 -5.096 6.581 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.034 -3.556 8.134 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.151 -4.686 9.468 1.00 0.00 H new ATOM 351 N LEU A 23 -6.738 -6.011 6.305 1.00 0.00 N ATOM 352 CA LEU A 23 -7.589 -6.905 5.540 1.00 0.00 C ATOM 353 C LEU A 23 -6.839 -7.450 4.330 1.00 0.00 C ATOM 354 O LEU A 23 -6.388 -6.690 3.475 1.00 0.00 O ATOM 355 CB LEU A 23 -8.857 -6.175 5.091 1.00 0.00 C ATOM 356 CG LEU A 23 -9.862 -7.023 4.310 1.00 0.00 C ATOM 357 CD1 LEU A 23 -10.394 -8.153 5.174 1.00 0.00 C ATOM 358 CD2 LEU A 23 -11.005 -6.156 3.804 1.00 0.00 C ATOM 0 H LEU A 23 -6.561 -5.112 5.857 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.873 -7.742 6.178 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.355 -5.772 5.973 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.567 -5.325 4.473 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.351 -7.460 3.452 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.107 -8.745 4.600 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.567 -8.789 5.491 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.890 -7.738 6.051 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.712 -6.773 3.250 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.513 -5.693 4.650 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.610 -5.380 3.149 1.00 0.00 H new ATOM 370 N THR A 24 -6.689 -8.765 4.283 1.00 0.00 N ATOM 371 CA THR A 24 -6.049 -9.419 3.156 1.00 0.00 C ATOM 372 C THR A 24 -6.949 -9.350 1.923 1.00 0.00 C ATOM 373 O THR A 24 -8.026 -9.946 1.891 1.00 0.00 O ATOM 374 CB THR A 24 -5.722 -10.885 3.482 1.00 0.00 C ATOM 375 OG1 THR A 24 -4.953 -10.952 4.695 1.00 0.00 O ATOM 376 CG2 THR A 24 -4.941 -11.533 2.348 1.00 0.00 C ATOM 0 H THR A 24 -7.004 -9.401 5.016 1.00 0.00 H new ATOM 0 HA THR A 24 -5.116 -8.896 2.949 1.00 0.00 H new ATOM 0 HB THR A 24 -6.660 -11.426 3.610 1.00 0.00 H new ATOM 0 HG1 THR A 24 -4.748 -11.888 4.901 1.00 0.00 H new ATOM 0 HG21 THR A 24 -4.722 -12.570 2.603 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.534 -11.502 1.434 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.007 -10.992 2.194 1.00 0.00 H new ATOM 384 N ILE A 25 -6.503 -8.613 0.917 1.00 0.00 N ATOM 385 CA ILE A 25 -7.304 -8.370 -0.275 1.00 0.00 C ATOM 386 C ILE A 25 -6.616 -8.909 -1.525 1.00 0.00 C ATOM 387 O ILE A 25 -5.383 -8.967 -1.595 1.00 0.00 O ATOM 388 CB ILE A 25 -7.593 -6.864 -0.449 1.00 0.00 C ATOM 389 CG1 ILE A 25 -6.289 -6.061 -0.404 1.00 0.00 C ATOM 390 CG2 ILE A 25 -8.546 -6.387 0.634 1.00 0.00 C ATOM 391 CD1 ILE A 25 -6.490 -4.558 -0.417 1.00 0.00 C ATOM 0 H ILE A 25 -5.584 -8.170 0.902 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.248 -8.899 -0.143 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.061 -6.707 -1.421 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.736 -6.336 0.494 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -5.671 -6.342 -1.257 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -8.743 -5.323 0.502 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -9.482 -6.941 0.565 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -8.097 -6.554 1.613 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.521 -4.061 -0.383 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.014 -4.269 -1.328 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.080 -4.262 0.451 1.00 0.00 H new ATOM 403 N LYS A 26 -7.416 -9.318 -2.502 1.00 0.00 N ATOM 404 CA LYS A 26 -6.897 -9.868 -3.744 1.00 0.00 C ATOM 405 C LYS A 26 -7.283 -8.965 -4.908 1.00 0.00 C ATOM 406 O LYS A 26 -8.357 -8.366 -4.899 1.00 0.00 O ATOM 407 CB LYS A 26 -7.450 -11.280 -3.972 1.00 0.00 C ATOM 408 CG LYS A 26 -7.370 -12.172 -2.741 1.00 0.00 C ATOM 409 CD LYS A 26 -7.944 -13.558 -3.000 1.00 0.00 C ATOM 410 CE LYS A 26 -9.413 -13.507 -3.408 1.00 0.00 C ATOM 411 NZ LYS A 26 -10.264 -12.841 -2.387 1.00 0.00 N ATOM 0 H LYS A 26 -8.434 -9.278 -2.455 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.810 -9.924 -3.678 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.490 -11.207 -4.290 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -6.899 -11.750 -4.787 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.330 -12.264 -2.427 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.911 -11.704 -1.919 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.368 -14.047 -3.785 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.839 -14.166 -2.102 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -9.505 -12.976 -4.356 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.776 -14.521 -3.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -11.266 -12.965 -2.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -10.084 -13.265 -1.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -10.038 -11.826 -2.355 1.00 0.00 H new ATOM 425 N SER A 27 -6.406 -8.860 -5.898 1.00 0.00 N ATOM 426 CA SER A 27 -6.671 -8.036 -7.074 1.00 0.00 C ATOM 427 C SER A 27 -7.973 -8.458 -7.753 1.00 0.00 C ATOM 428 O SER A 27 -8.109 -9.594 -8.214 1.00 0.00 O ATOM 429 CB SER A 27 -5.515 -8.138 -8.069 1.00 0.00 C ATOM 430 OG SER A 27 -4.295 -7.706 -7.489 1.00 0.00 O ATOM 0 H SER A 27 -5.503 -9.335 -5.912 1.00 0.00 H new ATOM 0 HA SER A 27 -6.768 -7.002 -6.744 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.414 -9.169 -8.408 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.736 -7.534 -8.949 1.00 0.00 H new ATOM 0 HG SER A 27 -3.632 -8.425 -7.549 1.00 0.00 H new ATOM 436 N GLY A 28 -8.928 -7.543 -7.801 1.00 0.00 N ATOM 437 CA GLY A 28 -10.195 -7.834 -8.435 1.00 0.00 C ATOM 438 C GLY A 28 -11.330 -7.937 -7.438 1.00 0.00 C ATOM 439 O GLY A 28 -12.502 -7.951 -7.824 1.00 0.00 O ATOM 0 H GLY A 28 -8.848 -6.604 -7.412 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -10.423 -7.053 -9.161 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.115 -8.770 -8.988 1.00 0.00 H new ATOM 443 N ASP A 29 -10.991 -8.011 -6.155 1.00 0.00 N ATOM 444 CA ASP A 29 -12.004 -8.058 -5.108 1.00 0.00 C ATOM 445 C ASP A 29 -12.735 -6.730 -5.011 1.00 0.00 C ATOM 446 O ASP A 29 -12.128 -5.659 -5.113 1.00 0.00 O ATOM 447 CB ASP A 29 -11.399 -8.400 -3.742 1.00 0.00 C ATOM 448 CG ASP A 29 -11.202 -9.888 -3.528 1.00 0.00 C ATOM 449 OD1 ASP A 29 -12.061 -10.681 -3.975 1.00 0.00 O ATOM 450 OD2 ASP A 29 -10.193 -10.272 -2.898 1.00 0.00 O ATOM 0 H ASP A 29 -10.029 -8.040 -5.817 1.00 0.00 H new ATOM 0 HA ASP A 29 -12.706 -8.846 -5.381 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -10.438 -7.895 -3.642 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -12.047 -8.010 -2.957 1.00 0.00 H new ATOM 455 N LYS A 30 -14.041 -6.806 -4.830 1.00 0.00 N ATOM 456 CA LYS A 30 -14.853 -5.622 -4.635 1.00 0.00 C ATOM 457 C LYS A 30 -14.969 -5.334 -3.148 1.00 0.00 C ATOM 458 O LYS A 30 -15.235 -6.240 -2.354 1.00 0.00 O ATOM 459 CB LYS A 30 -16.232 -5.817 -5.242 1.00 0.00 C ATOM 460 CG LYS A 30 -16.180 -6.243 -6.692 1.00 0.00 C ATOM 461 CD LYS A 30 -17.529 -6.089 -7.346 1.00 0.00 C ATOM 462 CE LYS A 30 -17.570 -6.772 -8.700 1.00 0.00 C ATOM 463 NZ LYS A 30 -17.298 -8.232 -8.588 1.00 0.00 N ATOM 0 H LYS A 30 -14.563 -7.682 -4.814 1.00 0.00 H new ATOM 0 HA LYS A 30 -14.379 -4.776 -5.133 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -16.774 -6.568 -4.667 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -16.794 -4.887 -5.161 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -15.442 -5.643 -7.225 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -15.855 -7.281 -6.759 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -18.298 -6.512 -6.700 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -17.759 -5.030 -7.464 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -18.548 -6.618 -9.156 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -16.834 -6.314 -9.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -17.983 -8.758 -9.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -16.334 -8.432 -8.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -17.387 -8.526 -7.594 1.00 0.00 H new ATOM 477 N VAL A 31 -14.765 -4.087 -2.767 1.00 0.00 N ATOM 478 CA VAL A 31 -14.782 -3.717 -1.364 1.00 0.00 C ATOM 479 C VAL A 31 -15.699 -2.529 -1.113 1.00 0.00 C ATOM 480 O VAL A 31 -15.774 -1.600 -1.919 1.00 0.00 O ATOM 481 CB VAL A 31 -13.361 -3.388 -0.842 1.00 0.00 C ATOM 482 CG1 VAL A 31 -12.538 -4.657 -0.688 1.00 0.00 C ATOM 483 CG2 VAL A 31 -12.653 -2.413 -1.770 1.00 0.00 C ATOM 0 H VAL A 31 -14.586 -3.314 -3.408 1.00 0.00 H new ATOM 0 HA VAL A 31 -15.164 -4.581 -0.820 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.465 -2.918 0.136 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.544 -4.403 -0.320 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -13.028 -5.324 0.021 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.452 -5.154 -1.654 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.658 -2.198 -1.381 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -12.567 -2.853 -2.763 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.226 -1.488 -1.831 1.00 0.00 H new ATOM 493 N TYR A 32 -16.424 -2.585 -0.007 1.00 0.00 N ATOM 494 CA TYR A 32 -17.220 -1.455 0.440 1.00 0.00 C ATOM 495 C TYR A 32 -16.374 -0.566 1.331 1.00 0.00 C ATOM 496 O TYR A 32 -15.607 -1.061 2.158 1.00 0.00 O ATOM 497 CB TYR A 32 -18.463 -1.915 1.208 1.00 0.00 C ATOM 498 CG TYR A 32 -19.520 -2.577 0.353 1.00 0.00 C ATOM 499 CD1 TYR A 32 -20.008 -1.957 -0.792 1.00 0.00 C ATOM 500 CD2 TYR A 32 -20.044 -3.813 0.703 1.00 0.00 C ATOM 501 CE1 TYR A 32 -20.987 -2.553 -1.562 1.00 0.00 C ATOM 502 CE2 TYR A 32 -21.021 -4.416 -0.064 1.00 0.00 C ATOM 503 CZ TYR A 32 -21.488 -3.782 -1.195 1.00 0.00 C ATOM 504 OH TYR A 32 -22.461 -4.381 -1.960 1.00 0.00 O ATOM 0 H TYR A 32 -16.477 -3.404 0.599 1.00 0.00 H new ATOM 0 HA TYR A 32 -17.551 -0.902 -0.439 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -18.155 -2.612 1.987 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -18.905 -1.053 1.708 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -19.615 -0.994 -1.084 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -19.682 -4.312 1.590 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -21.358 -2.058 -2.447 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -21.417 -5.379 0.221 1.00 0.00 H new ATOM 0 HH TYR A 32 -22.704 -5.244 -1.564 1.00 0.00 H new ATOM 514 N ILE A 33 -16.498 0.734 1.156 1.00 0.00 N ATOM 515 CA ILE A 33 -15.752 1.683 1.961 1.00 0.00 C ATOM 516 C ILE A 33 -16.566 2.082 3.187 1.00 0.00 C ATOM 517 O ILE A 33 -17.619 2.712 3.071 1.00 0.00 O ATOM 518 CB ILE A 33 -15.376 2.941 1.151 1.00 0.00 C ATOM 519 CG1 ILE A 33 -14.632 2.539 -0.129 1.00 0.00 C ATOM 520 CG2 ILE A 33 -14.524 3.881 1.998 1.00 0.00 C ATOM 521 CD1 ILE A 33 -14.271 3.711 -1.019 1.00 0.00 C ATOM 0 H ILE A 33 -17.111 1.160 0.461 1.00 0.00 H new ATOM 0 HA ILE A 33 -14.829 1.197 2.278 1.00 0.00 H new ATOM 0 HB ILE A 33 -16.288 3.467 0.870 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -13.720 2.007 0.143 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -15.251 1.842 -0.694 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -14.266 4.764 1.414 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -15.085 4.182 2.883 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -13.612 3.369 2.304 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -13.748 3.348 -1.904 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -15.180 4.231 -1.323 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -13.626 4.398 -0.472 1.00 0.00 H new ATOM 533 N LEU A 34 -16.084 1.689 4.356 1.00 0.00 N ATOM 534 CA LEU A 34 -16.769 1.974 5.605 1.00 0.00 C ATOM 535 C LEU A 34 -16.426 3.378 6.082 1.00 0.00 C ATOM 536 O LEU A 34 -17.305 4.225 6.241 1.00 0.00 O ATOM 537 CB LEU A 34 -16.391 0.951 6.685 1.00 0.00 C ATOM 538 CG LEU A 34 -16.910 -0.479 6.478 1.00 0.00 C ATOM 539 CD1 LEU A 34 -18.423 -0.487 6.314 1.00 0.00 C ATOM 540 CD2 LEU A 34 -16.235 -1.143 5.292 1.00 0.00 C ATOM 0 H LEU A 34 -15.214 1.168 4.465 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.842 1.906 5.426 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.304 0.914 6.756 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -16.760 1.314 7.644 1.00 0.00 H new ATOM 0 HG LEU A 34 -16.661 -1.056 7.369 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -18.768 -1.511 6.169 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -18.888 -0.071 7.208 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -18.698 0.115 5.448 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -16.624 -2.154 5.171 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -16.437 -0.567 4.389 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -15.159 -1.186 5.463 1.00 0.00 H new ATOM 552 N ASP A 35 -15.143 3.627 6.310 1.00 0.00 N ATOM 553 CA ASP A 35 -14.705 4.947 6.721 1.00 0.00 C ATOM 554 C ASP A 35 -13.556 5.418 5.851 1.00 0.00 C ATOM 555 O ASP A 35 -12.505 4.767 5.780 1.00 0.00 O ATOM 556 CB ASP A 35 -14.290 4.965 8.191 1.00 0.00 C ATOM 557 CG ASP A 35 -14.229 6.377 8.742 1.00 0.00 C ATOM 558 OD1 ASP A 35 -13.331 7.141 8.344 1.00 0.00 O ATOM 559 OD2 ASP A 35 -15.101 6.732 9.567 1.00 0.00 O ATOM 0 H ASP A 35 -14.397 2.938 6.218 1.00 0.00 H new ATOM 0 HA ASP A 35 -15.548 5.628 6.599 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.998 4.377 8.776 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -13.315 4.490 8.299 1.00 0.00 H new ATOM 564 N ASP A 36 -13.799 6.528 5.169 1.00 0.00 N ATOM 565 CA ASP A 36 -12.802 7.200 4.350 1.00 0.00 C ATOM 566 C ASP A 36 -12.571 8.607 4.895 1.00 0.00 C ATOM 567 O ASP A 36 -12.034 9.477 4.211 1.00 0.00 O ATOM 568 CB ASP A 36 -13.288 7.275 2.895 1.00 0.00 C ATOM 569 CG ASP A 36 -14.521 8.151 2.718 1.00 0.00 C ATOM 570 OD1 ASP A 36 -15.562 7.872 3.351 1.00 0.00 O ATOM 571 OD2 ASP A 36 -14.462 9.117 1.921 1.00 0.00 O ATOM 0 H ASP A 36 -14.707 6.993 5.169 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.867 6.641 4.380 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.483 7.661 2.270 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.512 6.269 2.541 1.00 0.00 H new ATOM 576 N LYS A 37 -12.968 8.812 6.147 1.00 0.00 N ATOM 577 CA LYS A 37 -13.002 10.148 6.733 1.00 0.00 C ATOM 578 C LYS A 37 -11.947 10.316 7.828 1.00 0.00 C ATOM 579 O LYS A 37 -11.450 11.420 8.053 1.00 0.00 O ATOM 580 CB LYS A 37 -14.401 10.425 7.301 1.00 0.00 C ATOM 581 CG LYS A 37 -15.509 10.264 6.269 1.00 0.00 C ATOM 582 CD LYS A 37 -16.902 10.333 6.888 1.00 0.00 C ATOM 583 CE LYS A 37 -17.325 11.754 7.244 1.00 0.00 C ATOM 584 NZ LYS A 37 -16.680 12.256 8.486 1.00 0.00 N ATOM 0 H LYS A 37 -13.271 8.069 6.776 1.00 0.00 H new ATOM 0 HA LYS A 37 -12.774 10.867 5.946 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.588 9.748 8.135 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.430 11.439 7.701 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -15.412 11.043 5.513 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.389 9.308 5.759 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.625 9.908 6.191 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.925 9.717 7.787 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -17.077 12.419 6.417 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -18.408 11.786 7.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -17.385 12.755 9.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -16.293 11.455 9.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -15.911 12.910 8.238 1.00 0.00 H new ATOM 598 N LYS A 38 -11.616 9.227 8.514 1.00 0.00 N ATOM 599 CA LYS A 38 -10.622 9.272 9.586 1.00 0.00 C ATOM 600 C LYS A 38 -9.223 9.489 9.027 1.00 0.00 C ATOM 601 O LYS A 38 -8.390 10.163 9.641 1.00 0.00 O ATOM 602 CB LYS A 38 -10.647 7.978 10.406 1.00 0.00 C ATOM 603 CG LYS A 38 -11.974 7.709 11.093 1.00 0.00 C ATOM 604 CD LYS A 38 -12.317 8.795 12.095 1.00 0.00 C ATOM 605 CE LYS A 38 -13.707 8.596 12.664 1.00 0.00 C ATOM 606 NZ LYS A 38 -14.756 8.684 11.612 1.00 0.00 N ATOM 0 H LYS A 38 -12.019 8.304 8.349 1.00 0.00 H new ATOM 0 HA LYS A 38 -10.878 10.111 10.233 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -10.412 7.140 9.750 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.861 8.022 11.160 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -12.764 7.641 10.345 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.932 6.745 11.601 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -11.586 8.791 12.904 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -12.255 9.771 11.613 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.763 7.623 13.152 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -13.897 9.348 13.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -15.686 8.815 12.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -14.555 9.491 10.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -14.761 7.807 11.053 1.00 0.00 H new ATOM 620 N SER A 39 -8.973 8.927 7.860 1.00 0.00 N ATOM 621 CA SER A 39 -7.658 8.983 7.256 1.00 0.00 C ATOM 622 C SER A 39 -7.782 9.025 5.741 1.00 0.00 C ATOM 623 O SER A 39 -8.859 8.800 5.193 1.00 0.00 O ATOM 624 CB SER A 39 -6.830 7.764 7.694 1.00 0.00 C ATOM 625 OG SER A 39 -5.524 7.789 7.140 1.00 0.00 O ATOM 0 H SER A 39 -9.669 8.424 7.309 1.00 0.00 H new ATOM 0 HA SER A 39 -7.150 9.889 7.588 1.00 0.00 H new ATOM 0 HB2 SER A 39 -6.763 7.741 8.782 1.00 0.00 H new ATOM 0 HB3 SER A 39 -7.338 6.850 7.387 1.00 0.00 H new ATOM 0 HG SER A 39 -4.976 7.094 7.562 1.00 0.00 H new ATOM 631 N LYS A 40 -6.685 9.348 5.077 1.00 0.00 N ATOM 632 CA LYS A 40 -6.608 9.274 3.627 1.00 0.00 C ATOM 633 C LYS A 40 -5.457 8.351 3.252 1.00 0.00 C ATOM 634 O LYS A 40 -5.073 8.235 2.088 1.00 0.00 O ATOM 635 CB LYS A 40 -6.428 10.670 2.999 1.00 0.00 C ATOM 636 CG LYS A 40 -5.094 11.351 3.301 1.00 0.00 C ATOM 637 CD LYS A 40 -4.987 11.806 4.749 1.00 0.00 C ATOM 638 CE LYS A 40 -3.655 12.485 5.017 1.00 0.00 C ATOM 639 NZ LYS A 40 -2.506 11.583 4.738 1.00 0.00 N ATOM 0 H LYS A 40 -5.826 9.668 5.525 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.543 8.874 3.235 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -6.536 10.581 1.918 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -7.234 11.315 3.348 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -4.279 10.662 3.079 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -4.972 12.211 2.643 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -5.801 12.494 4.977 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -5.100 10.948 5.411 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -3.573 13.379 4.399 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -3.616 12.811 6.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -1.616 12.084 4.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -2.570 10.741 5.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -2.528 11.292 3.740 1.00 0.00 H new ATOM 653 N ASP A 41 -4.916 7.694 4.272 1.00 0.00 N ATOM 654 CA ASP A 41 -3.804 6.772 4.106 1.00 0.00 C ATOM 655 C ASP A 41 -4.314 5.337 4.162 1.00 0.00 C ATOM 656 O ASP A 41 -4.056 4.530 3.266 1.00 0.00 O ATOM 657 CB ASP A 41 -2.754 7.000 5.203 1.00 0.00 C ATOM 658 CG ASP A 41 -2.243 8.428 5.235 1.00 0.00 C ATOM 659 OD1 ASP A 41 -1.259 8.734 4.528 1.00 0.00 O ATOM 660 OD2 ASP A 41 -2.829 9.261 5.962 1.00 0.00 O ATOM 0 H ASP A 41 -5.237 7.787 5.236 1.00 0.00 H new ATOM 0 HA ASP A 41 -3.338 6.950 3.137 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -3.187 6.751 6.172 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -1.916 6.322 5.045 1.00 0.00 H new ATOM 665 N TRP A 42 -5.049 5.036 5.220 1.00 0.00 N ATOM 666 CA TRP A 42 -5.656 3.725 5.396 1.00 0.00 C ATOM 667 C TRP A 42 -7.157 3.877 5.588 1.00 0.00 C ATOM 668 O TRP A 42 -7.609 4.769 6.308 1.00 0.00 O ATOM 669 CB TRP A 42 -5.049 3.000 6.601 1.00 0.00 C ATOM 670 CG TRP A 42 -3.688 2.413 6.351 1.00 0.00 C ATOM 671 CD1 TRP A 42 -2.506 3.082 6.192 1.00 0.00 C ATOM 672 CD2 TRP A 42 -3.369 1.018 6.255 1.00 0.00 C ATOM 673 NE1 TRP A 42 -1.481 2.188 6.003 1.00 0.00 N ATOM 674 CE2 TRP A 42 -1.985 0.917 6.039 1.00 0.00 C ATOM 675 CE3 TRP A 42 -4.123 -0.154 6.332 1.00 0.00 C ATOM 676 CZ2 TRP A 42 -1.340 -0.308 5.901 1.00 0.00 C ATOM 677 CZ3 TRP A 42 -3.483 -1.370 6.195 1.00 0.00 C ATOM 678 CH2 TRP A 42 -2.103 -1.440 5.982 1.00 0.00 C ATOM 0 H TRP A 42 -5.242 5.690 5.979 1.00 0.00 H new ATOM 0 HA TRP A 42 -5.460 3.131 4.503 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -4.982 3.699 7.435 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -5.725 2.202 6.908 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -2.395 4.156 6.212 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -0.501 2.432 5.859 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -5.190 -0.111 6.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 -0.274 -0.363 5.736 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -4.058 -2.282 6.253 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -1.631 -2.406 5.880 1.00 0.00 H new ATOM 689 N TRP A 43 -7.922 3.017 4.938 1.00 0.00 N ATOM 690 CA TRP A 43 -9.372 3.087 5.002 1.00 0.00 C ATOM 691 C TRP A 43 -9.967 1.802 5.551 1.00 0.00 C ATOM 692 O TRP A 43 -9.307 0.758 5.577 1.00 0.00 O ATOM 693 CB TRP A 43 -9.959 3.366 3.617 1.00 0.00 C ATOM 694 CG TRP A 43 -9.825 4.794 3.189 1.00 0.00 C ATOM 695 CD1 TRP A 43 -9.651 5.873 4.003 1.00 0.00 C ATOM 696 CD2 TRP A 43 -9.878 5.302 1.852 1.00 0.00 C ATOM 697 NE1 TRP A 43 -9.587 7.020 3.257 1.00 0.00 N ATOM 698 CE2 TRP A 43 -9.727 6.699 1.934 1.00 0.00 C ATOM 699 CE3 TRP A 43 -10.037 4.714 0.593 1.00 0.00 C ATOM 700 CZ2 TRP A 43 -9.730 7.515 0.810 1.00 0.00 C ATOM 701 CZ3 TRP A 43 -10.040 5.527 -0.523 1.00 0.00 C ATOM 702 CH2 TRP A 43 -9.888 6.915 -0.407 1.00 0.00 C ATOM 0 H TRP A 43 -7.562 2.259 4.358 1.00 0.00 H new ATOM 0 HA TRP A 43 -9.627 3.904 5.677 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.463 2.728 2.886 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -11.014 3.092 3.616 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -9.575 5.830 5.079 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -9.456 7.961 3.628 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.155 3.645 0.496 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -9.612 8.585 0.895 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.161 5.086 -1.501 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -9.896 7.524 -1.299 1.00 0.00 H new ATOM 713 N MET A 44 -11.216 1.888 5.992 1.00 0.00 N ATOM 714 CA MET A 44 -11.952 0.707 6.420 1.00 0.00 C ATOM 715 C MET A 44 -12.699 0.146 5.231 1.00 0.00 C ATOM 716 O MET A 44 -13.510 0.848 4.625 1.00 0.00 O ATOM 717 CB MET A 44 -12.966 1.034 7.518 1.00 0.00 C ATOM 718 CG MET A 44 -12.381 1.745 8.725 1.00 0.00 C ATOM 719 SD MET A 44 -11.149 0.753 9.592 1.00 0.00 S ATOM 720 CE MET A 44 -12.104 -0.707 10.006 1.00 0.00 C ATOM 0 H MET A 44 -11.739 2.761 6.062 1.00 0.00 H new ATOM 0 HA MET A 44 -11.236 -0.012 6.819 1.00 0.00 H new ATOM 0 HB2 MET A 44 -13.754 1.655 7.093 1.00 0.00 H new ATOM 0 HB3 MET A 44 -13.434 0.107 7.850 1.00 0.00 H new ATOM 0 HG2 MET A 44 -11.926 2.682 8.404 1.00 0.00 H new ATOM 0 HG3 MET A 44 -13.185 2.002 9.415 1.00 0.00 H new ATOM 0 HE1 MET A 44 -11.757 -1.111 10.957 1.00 0.00 H new ATOM 0 HE2 MET A 44 -13.158 -0.441 10.087 1.00 0.00 H new ATOM 0 HE3 MET A 44 -11.978 -1.458 9.226 1.00 0.00 H new ATOM 730 N CYS A 45 -12.433 -1.095 4.878 1.00 0.00 N ATOM 731 CA CYS A 45 -13.137 -1.700 3.762 1.00 0.00 C ATOM 732 C CYS A 45 -13.614 -3.102 4.092 1.00 0.00 C ATOM 733 O CYS A 45 -13.074 -3.767 4.978 1.00 0.00 O ATOM 734 CB CYS A 45 -12.263 -1.713 2.506 1.00 0.00 C ATOM 735 SG CYS A 45 -11.911 -0.066 1.850 1.00 0.00 S ATOM 0 H CYS A 45 -11.748 -1.696 5.336 1.00 0.00 H new ATOM 0 HA CYS A 45 -14.017 -1.088 3.566 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -11.321 -2.213 2.734 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -12.758 -2.303 1.735 1.00 0.00 H new ATOM 0 HG CYS A 45 -12.425 0.833 2.636 1.00 0.00 H new ATOM 741 N GLN A 46 -14.655 -3.520 3.386 1.00 0.00 N ATOM 742 CA GLN A 46 -15.265 -4.822 3.584 1.00 0.00 C ATOM 743 C GLN A 46 -15.361 -5.561 2.256 1.00 0.00 C ATOM 744 O GLN A 46 -15.831 -5.004 1.264 1.00 0.00 O ATOM 745 CB GLN A 46 -16.661 -4.660 4.192 1.00 0.00 C ATOM 746 CG GLN A 46 -17.422 -5.966 4.340 1.00 0.00 C ATOM 747 CD GLN A 46 -18.817 -5.768 4.897 1.00 0.00 C ATOM 748 OE1 GLN A 46 -19.778 -5.575 4.151 1.00 0.00 O ATOM 749 NE2 GLN A 46 -18.938 -5.823 6.209 1.00 0.00 N ATOM 0 H GLN A 46 -15.100 -2.962 2.658 1.00 0.00 H new ATOM 0 HA GLN A 46 -14.645 -5.401 4.268 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -16.568 -4.192 5.172 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -17.242 -3.981 3.568 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -17.489 -6.455 3.368 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -16.865 -6.635 4.996 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -18.116 -5.985 6.791 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -19.854 -5.704 6.642 1.00 0.00 H new ATOM 758 N LEU A 47 -14.907 -6.805 2.243 1.00 0.00 N ATOM 759 CA LEU A 47 -14.992 -7.639 1.054 1.00 0.00 C ATOM 760 C LEU A 47 -16.450 -7.939 0.737 1.00 0.00 C ATOM 761 O LEU A 47 -17.123 -8.621 1.506 1.00 0.00 O ATOM 762 CB LEU A 47 -14.224 -8.949 1.261 1.00 0.00 C ATOM 763 CG LEU A 47 -12.721 -8.802 1.484 1.00 0.00 C ATOM 764 CD1 LEU A 47 -12.083 -10.163 1.720 1.00 0.00 C ATOM 765 CD2 LEU A 47 -12.070 -8.110 0.299 1.00 0.00 C ATOM 0 H LEU A 47 -14.474 -7.261 3.046 1.00 0.00 H new ATOM 0 HA LEU A 47 -14.544 -7.101 0.218 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -14.652 -9.469 2.118 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -14.384 -9.585 0.390 1.00 0.00 H new ATOM 0 HG LEU A 47 -12.564 -8.187 2.370 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -11.011 -10.040 1.877 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -12.528 -10.626 2.601 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -12.252 -10.799 0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -10.999 -8.014 0.477 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -12.237 -8.699 -0.603 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -12.506 -7.119 0.171 1.00 0.00 H new ATOM 777 N VAL A 48 -16.930 -7.427 -0.391 1.00 0.00 N ATOM 778 CA VAL A 48 -18.324 -7.618 -0.797 1.00 0.00 C ATOM 779 C VAL A 48 -18.655 -9.105 -0.918 1.00 0.00 C ATOM 780 O VAL A 48 -19.787 -9.528 -0.675 1.00 0.00 O ATOM 781 CB VAL A 48 -18.610 -6.916 -2.146 1.00 0.00 C ATOM 782 CG1 VAL A 48 -20.056 -7.121 -2.582 1.00 0.00 C ATOM 783 CG2 VAL A 48 -18.297 -5.432 -2.050 1.00 0.00 C ATOM 0 H VAL A 48 -16.375 -6.874 -1.044 1.00 0.00 H new ATOM 0 HA VAL A 48 -18.954 -7.173 -0.026 1.00 0.00 H new ATOM 0 HB VAL A 48 -17.963 -7.366 -2.899 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.224 -6.616 -3.533 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -20.254 -8.187 -2.698 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -20.726 -6.708 -1.828 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -18.504 -4.954 -3.007 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -18.917 -4.979 -1.277 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -17.245 -5.298 -1.797 1.00 0.00 H new ATOM 793 N ASP A 49 -17.651 -9.886 -1.277 1.00 0.00 N ATOM 794 CA ASP A 49 -17.817 -11.317 -1.482 1.00 0.00 C ATOM 795 C ASP A 49 -18.053 -12.060 -0.166 1.00 0.00 C ATOM 796 O ASP A 49 -19.033 -12.794 -0.024 1.00 0.00 O ATOM 797 CB ASP A 49 -16.579 -11.879 -2.175 1.00 0.00 C ATOM 798 CG ASP A 49 -16.665 -13.374 -2.386 1.00 0.00 C ATOM 799 OD1 ASP A 49 -17.318 -13.802 -3.359 1.00 0.00 O ATOM 800 OD2 ASP A 49 -16.084 -14.125 -1.578 1.00 0.00 O ATOM 0 H ASP A 49 -16.701 -9.549 -1.434 1.00 0.00 H new ATOM 0 HA ASP A 49 -18.698 -11.465 -2.107 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -16.450 -11.386 -3.138 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -15.696 -11.649 -1.578 1.00 0.00 H new ATOM 805 N SER A 50 -17.163 -11.857 0.797 1.00 0.00 N ATOM 806 CA SER A 50 -17.191 -12.632 2.033 1.00 0.00 C ATOM 807 C SER A 50 -17.923 -11.892 3.154 1.00 0.00 C ATOM 808 O SER A 50 -18.683 -12.497 3.914 1.00 0.00 O ATOM 809 CB SER A 50 -15.760 -12.970 2.465 1.00 0.00 C ATOM 810 OG SER A 50 -15.747 -13.774 3.631 1.00 0.00 O ATOM 0 H SER A 50 -16.415 -11.165 0.748 1.00 0.00 H new ATOM 0 HA SER A 50 -17.741 -13.553 1.839 1.00 0.00 H new ATOM 0 HB2 SER A 50 -15.248 -13.491 1.656 1.00 0.00 H new ATOM 0 HB3 SER A 50 -15.207 -12.049 2.650 1.00 0.00 H new ATOM 0 HG SER A 50 -14.956 -14.352 3.621 1.00 0.00 H new ATOM 816 N GLY A 51 -17.703 -10.587 3.252 1.00 0.00 N ATOM 817 CA GLY A 51 -18.300 -9.812 4.328 1.00 0.00 C ATOM 818 C GLY A 51 -17.287 -9.407 5.385 1.00 0.00 C ATOM 819 O GLY A 51 -17.616 -8.685 6.324 1.00 0.00 O ATOM 0 H GLY A 51 -17.123 -10.050 2.608 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.764 -8.917 3.913 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -19.094 -10.396 4.795 1.00 0.00 H new ATOM 823 N LYS A 52 -16.054 -9.870 5.231 1.00 0.00 N ATOM 824 CA LYS A 52 -14.995 -9.551 6.181 1.00 0.00 C ATOM 825 C LYS A 52 -14.491 -8.128 5.962 1.00 0.00 C ATOM 826 O LYS A 52 -14.440 -7.649 4.828 1.00 0.00 O ATOM 827 CB LYS A 52 -13.838 -10.543 6.041 1.00 0.00 C ATOM 828 CG LYS A 52 -14.241 -11.988 6.289 1.00 0.00 C ATOM 829 CD LYS A 52 -13.043 -12.922 6.211 1.00 0.00 C ATOM 830 CE LYS A 52 -13.454 -14.368 6.425 1.00 0.00 C ATOM 831 NZ LYS A 52 -12.298 -15.297 6.343 1.00 0.00 N ATOM 0 H LYS A 52 -15.762 -10.468 4.458 1.00 0.00 H new ATOM 0 HA LYS A 52 -15.404 -9.626 7.189 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -13.418 -10.459 5.039 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -13.049 -10.269 6.742 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -14.707 -12.074 7.271 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -14.987 -12.290 5.554 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -12.562 -12.819 5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -12.307 -12.636 6.963 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -13.930 -14.468 7.400 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -14.197 -14.648 5.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -12.625 -16.272 6.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -11.858 -15.222 5.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -11.600 -15.048 7.073 1.00 0.00 H new ATOM 845 N SER A 53 -14.115 -7.460 7.044 1.00 0.00 N ATOM 846 CA SER A 53 -13.669 -6.080 6.970 1.00 0.00 C ATOM 847 C SER A 53 -12.317 -5.924 7.661 1.00 0.00 C ATOM 848 O SER A 53 -11.875 -6.814 8.392 1.00 0.00 O ATOM 849 CB SER A 53 -14.712 -5.162 7.617 1.00 0.00 C ATOM 850 OG SER A 53 -14.417 -3.794 7.387 1.00 0.00 O ATOM 0 H SER A 53 -14.111 -7.855 7.985 1.00 0.00 H new ATOM 0 HA SER A 53 -13.554 -5.798 5.923 1.00 0.00 H new ATOM 0 HB2 SER A 53 -15.699 -5.394 7.218 1.00 0.00 H new ATOM 0 HB3 SER A 53 -14.749 -5.352 8.690 1.00 0.00 H new ATOM 0 HG SER A 53 -14.019 -3.690 6.498 1.00 0.00 H new ATOM 856 N GLY A 54 -11.663 -4.800 7.418 1.00 0.00 N ATOM 857 CA GLY A 54 -10.376 -4.544 8.025 1.00 0.00 C ATOM 858 C GLY A 54 -9.718 -3.306 7.458 1.00 0.00 C ATOM 859 O GLY A 54 -10.339 -2.557 6.693 1.00 0.00 O ATOM 0 H GLY A 54 -12.003 -4.057 6.808 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -10.500 -4.428 9.102 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.725 -5.404 7.870 1.00 0.00 H new ATOM 863 N LEU A 55 -8.463 -3.095 7.836 1.00 0.00 N ATOM 864 CA LEU A 55 -7.699 -1.944 7.381 1.00 0.00 C ATOM 865 C LEU A 55 -7.010 -2.239 6.056 1.00 0.00 C ATOM 866 O LEU A 55 -6.345 -3.265 5.906 1.00 0.00 O ATOM 867 CB LEU A 55 -6.660 -1.557 8.436 1.00 0.00 C ATOM 868 CG LEU A 55 -7.227 -0.904 9.697 1.00 0.00 C ATOM 869 CD1 LEU A 55 -6.152 -0.784 10.762 1.00 0.00 C ATOM 870 CD2 LEU A 55 -7.792 0.467 9.368 1.00 0.00 C ATOM 0 H LEU A 55 -7.950 -3.714 8.463 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.388 -1.112 7.231 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.109 -2.452 8.726 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.942 -0.873 7.983 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.029 -1.533 10.082 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.573 -0.317 11.653 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.778 -1.776 11.015 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.333 -0.172 10.384 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -8.193 0.922 10.274 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -7.001 1.099 8.964 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.588 0.365 8.630 1.00 0.00 H new ATOM 882 N VAL A 56 -7.183 -1.344 5.094 1.00 0.00 N ATOM 883 CA VAL A 56 -6.530 -1.472 3.797 1.00 0.00 C ATOM 884 C VAL A 56 -5.930 -0.136 3.367 1.00 0.00 C ATOM 885 O VAL A 56 -6.454 0.925 3.710 1.00 0.00 O ATOM 886 CB VAL A 56 -7.506 -1.965 2.702 1.00 0.00 C ATOM 887 CG1 VAL A 56 -7.980 -3.380 2.993 1.00 0.00 C ATOM 888 CG2 VAL A 56 -8.690 -1.021 2.572 1.00 0.00 C ATOM 0 H VAL A 56 -7.773 -0.517 5.187 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.740 -2.214 3.912 1.00 0.00 H new ATOM 0 HB VAL A 56 -6.969 -1.976 1.753 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.665 -3.703 2.209 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.122 -4.052 3.025 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -8.493 -3.401 3.954 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.363 -1.387 1.797 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -9.223 -0.972 3.522 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -8.334 -0.026 2.304 1.00 0.00 H new ATOM 898 N PRO A 57 -4.806 -0.170 2.635 1.00 0.00 N ATOM 899 CA PRO A 57 -4.161 1.039 2.123 1.00 0.00 C ATOM 900 C PRO A 57 -5.022 1.736 1.070 1.00 0.00 C ATOM 901 O PRO A 57 -5.425 1.127 0.076 1.00 0.00 O ATOM 902 CB PRO A 57 -2.851 0.528 1.504 1.00 0.00 C ATOM 903 CG PRO A 57 -2.680 -0.857 2.033 1.00 0.00 C ATOM 904 CD PRO A 57 -4.067 -1.381 2.261 1.00 0.00 C ATOM 0 HA PRO A 57 -4.001 1.781 2.906 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.903 0.530 0.415 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -2.010 1.163 1.784 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -2.137 -1.482 1.324 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -2.106 -0.854 2.960 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -4.477 -1.846 1.365 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -4.092 -2.132 3.050 1.00 0.00 H new ATOM 912 N ALA A 58 -5.279 3.021 1.284 1.00 0.00 N ATOM 913 CA ALA A 58 -6.176 3.789 0.424 1.00 0.00 C ATOM 914 C ALA A 58 -5.632 3.937 -0.995 1.00 0.00 C ATOM 915 O ALA A 58 -6.367 4.281 -1.920 1.00 0.00 O ATOM 916 CB ALA A 58 -6.431 5.159 1.037 1.00 0.00 C ATOM 0 H ALA A 58 -4.876 3.558 2.052 1.00 0.00 H new ATOM 0 HA ALA A 58 -7.114 3.239 0.352 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -7.101 5.728 0.392 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.889 5.039 2.019 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.486 5.693 1.140 1.00 0.00 H new ATOM 922 N GLN A 59 -4.350 3.658 -1.171 1.00 0.00 N ATOM 923 CA GLN A 59 -3.709 3.809 -2.470 1.00 0.00 C ATOM 924 C GLN A 59 -4.015 2.619 -3.381 1.00 0.00 C ATOM 925 O GLN A 59 -3.689 2.639 -4.566 1.00 0.00 O ATOM 926 CB GLN A 59 -2.196 3.957 -2.300 1.00 0.00 C ATOM 927 CG GLN A 59 -1.531 2.740 -1.681 1.00 0.00 C ATOM 928 CD GLN A 59 -0.022 2.845 -1.672 1.00 0.00 C ATOM 929 OE1 GLN A 59 0.642 2.442 -2.622 1.00 0.00 O ATOM 930 NE2 GLN A 59 0.532 3.372 -0.595 1.00 0.00 N ATOM 0 H GLN A 59 -3.732 3.326 -0.431 1.00 0.00 H new ATOM 0 HA GLN A 59 -4.109 4.709 -2.937 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -1.747 4.150 -3.274 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.992 4.828 -1.677 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.889 2.615 -0.659 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -1.826 1.848 -2.234 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.055 3.696 0.174 1.00 0.00 H new ATOM 0 HE22 GLN A 59 1.547 3.455 -0.532 1.00 0.00 H new ATOM 939 N PHE A 60 -4.641 1.584 -2.831 1.00 0.00 N ATOM 940 CA PHE A 60 -4.917 0.378 -3.605 1.00 0.00 C ATOM 941 C PHE A 60 -6.406 0.219 -3.868 1.00 0.00 C ATOM 942 O PHE A 60 -6.820 -0.634 -4.655 1.00 0.00 O ATOM 943 CB PHE A 60 -4.379 -0.865 -2.890 1.00 0.00 C ATOM 944 CG PHE A 60 -2.880 -0.892 -2.758 1.00 0.00 C ATOM 945 CD1 PHE A 60 -2.067 -0.656 -3.856 1.00 0.00 C ATOM 946 CD2 PHE A 60 -2.284 -1.163 -1.538 1.00 0.00 C ATOM 947 CE1 PHE A 60 -0.689 -0.686 -3.737 1.00 0.00 C ATOM 948 CE2 PHE A 60 -0.906 -1.197 -1.413 1.00 0.00 C ATOM 949 CZ PHE A 60 -0.108 -0.959 -2.515 1.00 0.00 C ATOM 0 H PHE A 60 -4.964 1.554 -1.864 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.407 0.482 -4.563 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -4.822 -0.921 -1.896 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -4.702 -1.753 -3.433 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.515 -0.446 -4.816 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -2.902 -1.350 -0.673 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -0.068 -0.496 -4.600 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.455 -1.409 -0.455 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.968 -0.986 -2.421 1.00 0.00 H new ATOM 959 N ILE A 61 -7.206 1.046 -3.215 1.00 0.00 N ATOM 960 CA ILE A 61 -8.651 0.976 -3.355 1.00 0.00 C ATOM 961 C ILE A 61 -9.144 2.064 -4.300 1.00 0.00 C ATOM 962 O ILE A 61 -9.023 3.252 -4.004 1.00 0.00 O ATOM 963 CB ILE A 61 -9.357 1.130 -1.990 1.00 0.00 C ATOM 964 CG1 ILE A 61 -8.855 0.068 -1.003 1.00 0.00 C ATOM 965 CG2 ILE A 61 -10.871 1.042 -2.156 1.00 0.00 C ATOM 966 CD1 ILE A 61 -9.096 -1.358 -1.456 1.00 0.00 C ATOM 0 H ILE A 61 -6.878 1.775 -2.581 1.00 0.00 H new ATOM 0 HA ILE A 61 -8.894 -0.005 -3.764 1.00 0.00 H new ATOM 0 HB ILE A 61 -9.116 2.113 -1.586 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.786 0.212 -0.843 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.345 0.220 -0.041 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.351 1.153 -1.184 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -11.211 1.836 -2.821 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.135 0.074 -2.582 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.713 -2.048 -0.704 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -10.165 -1.522 -1.588 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -8.583 -1.531 -2.402 1.00 0.00 H new ATOM 978 N GLU A 62 -9.684 1.662 -5.439 1.00 0.00 N ATOM 979 CA GLU A 62 -10.204 2.615 -6.408 1.00 0.00 C ATOM 980 C GLU A 62 -11.727 2.558 -6.443 1.00 0.00 C ATOM 981 O GLU A 62 -12.306 1.591 -6.942 1.00 0.00 O ATOM 982 CB GLU A 62 -9.644 2.320 -7.802 1.00 0.00 C ATOM 983 CG GLU A 62 -9.983 3.381 -8.839 1.00 0.00 C ATOM 984 CD GLU A 62 -9.314 4.711 -8.558 1.00 0.00 C ATOM 985 OE1 GLU A 62 -8.141 4.881 -8.955 1.00 0.00 O ATOM 986 OE2 GLU A 62 -9.957 5.596 -7.954 1.00 0.00 O ATOM 0 H GLU A 62 -9.774 0.684 -5.716 1.00 0.00 H new ATOM 0 HA GLU A 62 -9.892 3.615 -6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.560 2.224 -7.735 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -10.028 1.358 -8.141 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -9.681 3.028 -9.825 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -11.063 3.522 -8.868 1.00 0.00 H new ATOM 993 N PRO A 63 -12.398 3.569 -5.875 1.00 0.00 N ATOM 994 CA PRO A 63 -13.857 3.679 -5.933 1.00 0.00 C ATOM 995 C PRO A 63 -14.342 3.900 -7.360 1.00 0.00 C ATOM 996 O PRO A 63 -13.818 4.756 -8.080 1.00 0.00 O ATOM 997 CB PRO A 63 -14.176 4.896 -5.060 1.00 0.00 C ATOM 998 CG PRO A 63 -12.939 5.139 -4.258 1.00 0.00 C ATOM 999 CD PRO A 63 -11.798 4.675 -5.115 1.00 0.00 C ATOM 0 HA PRO A 63 -14.351 2.770 -5.589 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -14.426 5.764 -5.671 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -15.032 4.703 -4.414 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -12.836 6.195 -4.008 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -12.969 4.590 -3.317 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -11.435 5.467 -5.770 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -10.950 4.342 -4.516 1.00 0.00 H new ATOM 1007 N VAL A 64 -15.342 3.127 -7.764 1.00 0.00 N ATOM 1008 CA VAL A 64 -15.834 3.177 -9.131 1.00 0.00 C ATOM 1009 C VAL A 64 -16.731 4.384 -9.362 1.00 0.00 C ATOM 1010 O VAL A 64 -16.601 5.084 -10.368 1.00 0.00 O ATOM 1011 CB VAL A 64 -16.575 1.879 -9.525 1.00 0.00 C ATOM 1012 CG1 VAL A 64 -15.585 0.737 -9.668 1.00 0.00 C ATOM 1013 CG2 VAL A 64 -17.653 1.520 -8.508 1.00 0.00 C ATOM 0 H VAL A 64 -15.826 2.459 -7.164 1.00 0.00 H new ATOM 0 HA VAL A 64 -14.957 3.274 -9.771 1.00 0.00 H new ATOM 0 HB VAL A 64 -17.066 2.050 -10.483 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -16.117 -0.173 -9.946 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -14.856 0.982 -10.441 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -15.070 0.581 -8.720 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -18.153 0.602 -8.817 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -17.196 1.372 -7.530 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -18.382 2.329 -8.449 1.00 0.00 H new ATOM 1152 N MET B 1 21.305 1.571 -8.574 1.00 0.00 N ATOM 1153 CA MET B 1 20.339 2.003 -9.604 1.00 0.00 C ATOM 1154 C MET B 1 19.262 2.866 -9.006 1.00 0.00 C ATOM 1155 O MET B 1 19.161 3.023 -7.791 1.00 0.00 O ATOM 1156 CB MET B 1 19.663 0.826 -10.313 1.00 0.00 C ATOM 1157 CG MET B 1 19.047 -0.211 -9.384 1.00 0.00 C ATOM 1158 SD MET B 1 20.270 -1.278 -8.602 1.00 0.00 S ATOM 1159 CE MET B 1 19.201 -2.335 -7.626 1.00 0.00 C ATOM 0 H1 MET B 1 21.648 0.615 -8.799 1.00 0.00 H new ATOM 0 H2 MET B 1 22.109 2.231 -8.553 1.00 0.00 H new ATOM 0 H3 MET B 1 20.840 1.562 -7.644 1.00 0.00 H new ATOM 0 HA MET B 1 20.920 2.566 -10.334 1.00 0.00 H new ATOM 0 HB2 MET B 1 18.884 1.214 -10.969 1.00 0.00 H new ATOM 0 HB3 MET B 1 20.398 0.333 -10.949 1.00 0.00 H new ATOM 0 HG2 MET B 1 18.472 0.299 -8.611 1.00 0.00 H new ATOM 0 HG3 MET B 1 18.346 -0.826 -9.949 1.00 0.00 H new ATOM 0 HE1 MET B 1 19.605 -2.430 -6.618 1.00 0.00 H new ATOM 0 HE2 MET B 1 18.203 -1.899 -7.578 1.00 0.00 H new ATOM 0 HE3 MET B 1 19.144 -3.321 -8.088 1.00 0.00 H new ATOM 1171 N GLN B 2 18.438 3.381 -9.886 1.00 0.00 N ATOM 1172 CA GLN B 2 17.344 4.251 -9.501 1.00 0.00 C ATOM 1173 C GLN B 2 16.057 3.452 -9.396 1.00 0.00 C ATOM 1174 O GLN B 2 15.694 2.746 -10.330 1.00 0.00 O ATOM 1175 CB GLN B 2 17.166 5.373 -10.530 1.00 0.00 C ATOM 1176 CG GLN B 2 18.408 6.226 -10.742 1.00 0.00 C ATOM 1177 CD GLN B 2 18.208 7.296 -11.798 1.00 0.00 C ATOM 1178 OE1 GLN B 2 19.152 7.697 -12.477 1.00 0.00 O ATOM 1179 NE2 GLN B 2 16.982 7.774 -11.937 1.00 0.00 N ATOM 0 H GLN B 2 18.504 3.211 -10.890 1.00 0.00 H new ATOM 0 HA GLN B 2 17.578 4.691 -8.532 1.00 0.00 H new ATOM 0 HB2 GLN B 2 16.873 4.933 -11.484 1.00 0.00 H new ATOM 0 HB3 GLN B 2 16.346 6.017 -10.211 1.00 0.00 H new ATOM 0 HG2 GLN B 2 18.685 6.698 -9.800 1.00 0.00 H new ATOM 0 HG3 GLN B 2 19.239 5.584 -11.033 1.00 0.00 H new ATOM 0 HE21 GLN B 2 16.226 7.415 -11.354 1.00 0.00 H new ATOM 0 HE22 GLN B 2 16.793 8.501 -12.627 1.00 0.00 H new ATOM 1188 N ILE B 3 15.396 3.529 -8.257 1.00 0.00 N ATOM 1189 CA ILE B 3 14.062 2.968 -8.119 1.00 0.00 C ATOM 1190 C ILE B 3 13.079 4.080 -7.808 1.00 0.00 C ATOM 1191 O ILE B 3 13.456 5.110 -7.246 1.00 0.00 O ATOM 1192 CB ILE B 3 13.969 1.874 -7.026 1.00 0.00 C ATOM 1193 CG1 ILE B 3 14.469 2.396 -5.670 1.00 0.00 C ATOM 1194 CG2 ILE B 3 14.740 0.632 -7.453 1.00 0.00 C ATOM 1195 CD1 ILE B 3 14.293 1.410 -4.530 1.00 0.00 C ATOM 0 H ILE B 3 15.759 3.974 -7.414 1.00 0.00 H new ATOM 0 HA ILE B 3 13.819 2.488 -9.067 1.00 0.00 H new ATOM 0 HB ILE B 3 12.920 1.603 -6.904 1.00 0.00 H new ATOM 0 HG12 ILE B 3 15.525 2.652 -5.757 1.00 0.00 H new ATOM 0 HG13 ILE B 3 13.937 3.316 -5.427 1.00 0.00 H new ATOM 0 HG21 ILE B 3 14.666 -0.128 -6.675 1.00 0.00 H new ATOM 0 HG22 ILE B 3 14.320 0.244 -8.381 1.00 0.00 H new ATOM 0 HG23 ILE B 3 15.787 0.890 -7.609 1.00 0.00 H new ATOM 0 HD11 ILE B 3 14.669 1.850 -3.607 1.00 0.00 H new ATOM 0 HD12 ILE B 3 13.235 1.173 -4.414 1.00 0.00 H new ATOM 0 HD13 ILE B 3 14.848 0.498 -4.749 1.00 0.00 H new ATOM 1207 N PHE B 4 11.832 3.882 -8.185 1.00 0.00 N ATOM 1208 CA PHE B 4 10.812 4.888 -7.975 1.00 0.00 C ATOM 1209 C PHE B 4 9.924 4.488 -6.812 1.00 0.00 C ATOM 1210 O PHE B 4 9.018 3.669 -6.962 1.00 0.00 O ATOM 1211 CB PHE B 4 9.973 5.073 -9.243 1.00 0.00 C ATOM 1212 CG PHE B 4 10.782 5.442 -10.455 1.00 0.00 C ATOM 1213 CD1 PHE B 4 11.372 6.690 -10.554 1.00 0.00 C ATOM 1214 CD2 PHE B 4 10.954 4.537 -11.493 1.00 0.00 C ATOM 1215 CE1 PHE B 4 12.114 7.036 -11.666 1.00 0.00 C ATOM 1216 CE2 PHE B 4 11.695 4.877 -12.610 1.00 0.00 C ATOM 1217 CZ PHE B 4 12.279 6.128 -12.694 1.00 0.00 C ATOM 0 H PHE B 4 11.500 3.031 -8.639 1.00 0.00 H new ATOM 0 HA PHE B 4 11.297 5.836 -7.742 1.00 0.00 H new ATOM 0 HB2 PHE B 4 9.430 4.150 -9.447 1.00 0.00 H new ATOM 0 HB3 PHE B 4 9.228 5.848 -9.065 1.00 0.00 H new ATOM 0 HD1 PHE B 4 11.251 7.402 -9.751 1.00 0.00 H new ATOM 0 HD2 PHE B 4 10.505 3.557 -11.428 1.00 0.00 H new ATOM 0 HE1 PHE B 4 12.565 8.015 -11.732 1.00 0.00 H new ATOM 0 HE2 PHE B 4 11.817 4.167 -13.415 1.00 0.00 H new ATOM 0 HZ PHE B 4 12.863 6.395 -13.562 1.00 0.00 H new ATOM 1227 N VAL B 5 10.200 5.043 -5.645 1.00 0.00 N ATOM 1228 CA VAL B 5 9.405 4.738 -4.474 1.00 0.00 C ATOM 1229 C VAL B 5 8.187 5.658 -4.411 1.00 0.00 C ATOM 1230 O VAL B 5 8.293 6.857 -4.147 1.00 0.00 O ATOM 1231 CB VAL B 5 10.235 4.798 -3.164 1.00 0.00 C ATOM 1232 CG1 VAL B 5 10.996 6.105 -3.041 1.00 0.00 C ATOM 1233 CG2 VAL B 5 9.347 4.572 -1.950 1.00 0.00 C ATOM 0 H VAL B 5 10.962 5.702 -5.486 1.00 0.00 H new ATOM 0 HA VAL B 5 9.059 3.709 -4.567 1.00 0.00 H new ATOM 0 HB VAL B 5 10.970 3.995 -3.206 1.00 0.00 H new ATOM 0 HG11 VAL B 5 11.565 6.109 -2.111 1.00 0.00 H new ATOM 0 HG12 VAL B 5 11.679 6.209 -3.884 1.00 0.00 H new ATOM 0 HG13 VAL B 5 10.292 6.937 -3.039 1.00 0.00 H new ATOM 0 HG21 VAL B 5 9.951 4.619 -1.044 1.00 0.00 H new ATOM 0 HG22 VAL B 5 8.578 5.343 -1.913 1.00 0.00 H new ATOM 0 HG23 VAL B 5 8.875 3.592 -2.022 1.00 0.00 H new ATOM 1243 N LYS B 6 7.040 5.078 -4.717 1.00 0.00 N ATOM 1244 CA LYS B 6 5.778 5.788 -4.738 1.00 0.00 C ATOM 1245 C LYS B 6 5.091 5.643 -3.386 1.00 0.00 C ATOM 1246 O LYS B 6 4.601 4.563 -3.042 1.00 0.00 O ATOM 1247 CB LYS B 6 4.902 5.227 -5.866 1.00 0.00 C ATOM 1248 CG LYS B 6 3.510 5.830 -5.941 1.00 0.00 C ATOM 1249 CD LYS B 6 2.688 5.208 -7.063 1.00 0.00 C ATOM 1250 CE LYS B 6 3.255 5.549 -8.435 1.00 0.00 C ATOM 1251 NZ LYS B 6 2.411 5.019 -9.541 1.00 0.00 N ATOM 0 H LYS B 6 6.960 4.091 -4.960 1.00 0.00 H new ATOM 0 HA LYS B 6 5.946 6.849 -4.924 1.00 0.00 H new ATOM 0 HB2 LYS B 6 5.407 5.392 -6.818 1.00 0.00 H new ATOM 0 HB3 LYS B 6 4.811 4.149 -5.736 1.00 0.00 H new ATOM 0 HG2 LYS B 6 2.998 5.684 -4.990 1.00 0.00 H new ATOM 0 HG3 LYS B 6 3.587 6.906 -6.099 1.00 0.00 H new ATOM 0 HD2 LYS B 6 2.664 4.125 -6.939 1.00 0.00 H new ATOM 0 HD3 LYS B 6 1.658 5.560 -6.997 1.00 0.00 H new ATOM 0 HE2 LYS B 6 3.340 6.631 -8.532 1.00 0.00 H new ATOM 0 HE3 LYS B 6 4.262 5.141 -8.521 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 2.836 5.275 -10.455 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 2.350 3.984 -9.466 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 1.457 5.428 -9.476 1.00 0.00 H new ATOM 1265 N THR B 7 5.089 6.715 -2.610 1.00 0.00 N ATOM 1266 CA THR B 7 4.526 6.685 -1.272 1.00 0.00 C ATOM 1267 C THR B 7 3.003 6.678 -1.314 1.00 0.00 C ATOM 1268 O THR B 7 2.395 6.888 -2.365 1.00 0.00 O ATOM 1269 CB THR B 7 4.993 7.894 -0.438 1.00 0.00 C ATOM 1270 OG1 THR B 7 4.487 9.106 -1.009 1.00 0.00 O ATOM 1271 CG2 THR B 7 6.511 7.961 -0.373 1.00 0.00 C ATOM 0 H THR B 7 5.473 7.619 -2.886 1.00 0.00 H new ATOM 0 HA THR B 7 4.880 5.767 -0.804 1.00 0.00 H new ATOM 0 HB THR B 7 4.607 7.774 0.574 1.00 0.00 H new ATOM 0 HG1 THR B 7 4.041 9.634 -0.314 1.00 0.00 H new ATOM 0 HG21 THR B 7 6.812 8.824 0.222 1.00 0.00 H new ATOM 0 HG22 THR B 7 6.896 7.051 0.087 1.00 0.00 H new ATOM 0 HG23 THR B 7 6.914 8.057 -1.381 1.00 0.00 H new ATOM 1279 N LEU B 8 2.399 6.446 -0.158 1.00 0.00 N ATOM 1280 CA LEU B 8 0.949 6.458 -0.022 1.00 0.00 C ATOM 1281 C LEU B 8 0.397 7.841 -0.372 1.00 0.00 C ATOM 1282 O LEU B 8 -0.714 7.972 -0.882 1.00 0.00 O ATOM 1283 CB LEU B 8 0.579 6.075 1.417 1.00 0.00 C ATOM 1284 CG LEU B 8 -0.757 5.349 1.600 1.00 0.00 C ATOM 1285 CD1 LEU B 8 -0.841 4.762 3.000 1.00 0.00 C ATOM 1286 CD2 LEU B 8 -1.931 6.285 1.351 1.00 0.00 C ATOM 0 H LEU B 8 2.897 6.245 0.709 1.00 0.00 H new ATOM 0 HA LEU B 8 0.509 5.736 -0.710 1.00 0.00 H new ATOM 0 HB2 LEU B 8 1.371 5.442 1.818 1.00 0.00 H new ATOM 0 HB3 LEU B 8 0.561 6.983 2.020 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.809 4.543 0.868 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.794 4.247 3.122 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -0.025 4.054 3.147 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -0.764 5.563 3.735 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -2.866 5.741 1.488 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -1.889 7.117 2.054 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -1.881 6.668 0.332 1.00 0.00 H new ATOM 1298 N THR B 9 1.201 8.863 -0.123 1.00 0.00 N ATOM 1299 CA THR B 9 0.798 10.237 -0.362 1.00 0.00 C ATOM 1300 C THR B 9 0.955 10.626 -1.832 1.00 0.00 C ATOM 1301 O THR B 9 0.625 11.744 -2.227 1.00 0.00 O ATOM 1302 CB THR B 9 1.621 11.192 0.518 1.00 0.00 C ATOM 1303 OG1 THR B 9 2.997 10.780 0.529 1.00 0.00 O ATOM 1304 CG2 THR B 9 1.084 11.218 1.940 1.00 0.00 C ATOM 0 H THR B 9 2.146 8.763 0.248 1.00 0.00 H new ATOM 0 HA THR B 9 -0.258 10.319 -0.103 1.00 0.00 H new ATOM 0 HB THR B 9 1.543 12.196 0.100 1.00 0.00 H new ATOM 0 HG1 THR B 9 3.517 11.393 1.090 1.00 0.00 H new ATOM 0 HG21 THR B 9 1.683 11.901 2.543 1.00 0.00 H new ATOM 0 HG22 THR B 9 0.048 11.555 1.931 1.00 0.00 H new ATOM 0 HG23 THR B 9 1.136 10.216 2.367 1.00 0.00 H new ATOM 1312 N GLY B 10 1.462 9.699 -2.640 1.00 0.00 N ATOM 1313 CA GLY B 10 1.634 9.961 -4.055 1.00 0.00 C ATOM 1314 C GLY B 10 2.998 10.535 -4.377 1.00 0.00 C ATOM 1315 O GLY B 10 3.299 10.831 -5.536 1.00 0.00 O ATOM 0 H GLY B 10 1.757 8.770 -2.338 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.492 9.035 -4.612 1.00 0.00 H new ATOM 0 HA3 GLY B 10 0.863 10.655 -4.389 1.00 0.00 H new ATOM 1319 N LYS B 11 3.825 10.689 -3.354 1.00 0.00 N ATOM 1320 CA LYS B 11 5.167 11.225 -3.521 1.00 0.00 C ATOM 1321 C LYS B 11 6.071 10.156 -4.130 1.00 0.00 C ATOM 1322 O LYS B 11 6.327 9.123 -3.516 1.00 0.00 O ATOM 1323 CB LYS B 11 5.718 11.693 -2.165 1.00 0.00 C ATOM 1324 CG LYS B 11 7.067 12.393 -2.235 1.00 0.00 C ATOM 1325 CD LYS B 11 6.978 13.716 -2.980 1.00 0.00 C ATOM 1326 CE LYS B 11 8.264 14.521 -2.848 1.00 0.00 C ATOM 1327 NZ LYS B 11 8.527 14.934 -1.443 1.00 0.00 N ATOM 0 H LYS B 11 3.587 10.448 -2.392 1.00 0.00 H new ATOM 0 HA LYS B 11 5.135 12.083 -4.193 1.00 0.00 H new ATOM 0 HB2 LYS B 11 4.996 12.370 -1.709 1.00 0.00 H new ATOM 0 HB3 LYS B 11 5.806 10.829 -1.506 1.00 0.00 H new ATOM 0 HG2 LYS B 11 7.438 12.569 -1.225 1.00 0.00 H new ATOM 0 HG3 LYS B 11 7.788 11.744 -2.732 1.00 0.00 H new ATOM 0 HD2 LYS B 11 6.772 13.528 -4.034 1.00 0.00 H new ATOM 0 HD3 LYS B 11 6.142 14.298 -2.591 1.00 0.00 H new ATOM 0 HE2 LYS B 11 9.102 13.927 -3.213 1.00 0.00 H new ATOM 0 HE3 LYS B 11 8.202 15.407 -3.480 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 9.050 15.833 -1.438 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 7.624 15.056 -0.942 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 9.092 14.202 -0.966 1.00 0.00 H new ATOM 1341 N THR B 12 6.518 10.390 -5.351 1.00 0.00 N ATOM 1342 CA THR B 12 7.378 9.444 -6.036 1.00 0.00 C ATOM 1343 C THR B 12 8.828 9.906 -5.963 1.00 0.00 C ATOM 1344 O THR B 12 9.225 10.858 -6.635 1.00 0.00 O ATOM 1345 CB THR B 12 6.944 9.277 -7.503 1.00 0.00 C ATOM 1346 OG1 THR B 12 5.520 9.111 -7.555 1.00 0.00 O ATOM 1347 CG2 THR B 12 7.622 8.071 -8.137 1.00 0.00 C ATOM 0 H THR B 12 6.299 11.229 -5.889 1.00 0.00 H new ATOM 0 HA THR B 12 7.290 8.477 -5.541 1.00 0.00 H new ATOM 0 HB THR B 12 7.239 10.167 -8.060 1.00 0.00 H new ATOM 0 HG1 THR B 12 5.237 9.006 -8.487 1.00 0.00 H new ATOM 0 HG21 THR B 12 7.299 7.975 -9.173 1.00 0.00 H new ATOM 0 HG22 THR B 12 8.703 8.203 -8.105 1.00 0.00 H new ATOM 0 HG23 THR B 12 7.350 7.170 -7.587 1.00 0.00 H new ATOM 1355 N ILE B 13 9.605 9.247 -5.120 1.00 0.00 N ATOM 1356 CA ILE B 13 10.987 9.634 -4.899 1.00 0.00 C ATOM 1357 C ILE B 13 11.929 8.749 -5.708 1.00 0.00 C ATOM 1358 O ILE B 13 11.763 7.528 -5.758 1.00 0.00 O ATOM 1359 CB ILE B 13 11.355 9.540 -3.400 1.00 0.00 C ATOM 1360 CG1 ILE B 13 10.346 10.318 -2.551 1.00 0.00 C ATOM 1361 CG2 ILE B 13 12.767 10.057 -3.156 1.00 0.00 C ATOM 1362 CD1 ILE B 13 10.553 10.156 -1.058 1.00 0.00 C ATOM 0 H ILE B 13 9.301 8.439 -4.576 1.00 0.00 H new ATOM 0 HA ILE B 13 11.096 10.668 -5.226 1.00 0.00 H new ATOM 0 HB ILE B 13 11.320 8.491 -3.106 1.00 0.00 H new ATOM 0 HG12 ILE B 13 10.410 11.376 -2.805 1.00 0.00 H new ATOM 0 HG13 ILE B 13 9.339 9.989 -2.807 1.00 0.00 H new ATOM 0 HG21 ILE B 13 13.004 9.981 -2.095 1.00 0.00 H new ATOM 0 HG22 ILE B 13 13.477 9.461 -3.730 1.00 0.00 H new ATOM 0 HG23 ILE B 13 12.832 11.099 -3.469 1.00 0.00 H new ATOM 0 HD11 ILE B 13 9.802 10.735 -0.522 1.00 0.00 H new ATOM 0 HD12 ILE B 13 10.459 9.104 -0.790 1.00 0.00 H new ATOM 0 HD13 ILE B 13 11.547 10.512 -0.788 1.00 0.00 H new ATOM 1374 N THR B 14 12.902 9.369 -6.357 1.00 0.00 N ATOM 1375 CA THR B 14 13.921 8.629 -7.073 1.00 0.00 C ATOM 1376 C THR B 14 15.005 8.184 -6.094 1.00 0.00 C ATOM 1377 O THR B 14 15.749 9.007 -5.552 1.00 0.00 O ATOM 1378 CB THR B 14 14.537 9.487 -8.191 1.00 0.00 C ATOM 1379 OG1 THR B 14 13.490 10.075 -8.977 1.00 0.00 O ATOM 1380 CG2 THR B 14 15.436 8.652 -9.089 1.00 0.00 C ATOM 0 H THR B 14 13.005 10.383 -6.401 1.00 0.00 H new ATOM 0 HA THR B 14 13.463 7.754 -7.533 1.00 0.00 H new ATOM 0 HB THR B 14 15.141 10.269 -7.730 1.00 0.00 H new ATOM 0 HG1 THR B 14 13.883 10.623 -9.688 1.00 0.00 H new ATOM 0 HG21 THR B 14 15.858 9.284 -9.870 1.00 0.00 H new ATOM 0 HG22 THR B 14 16.243 8.221 -8.496 1.00 0.00 H new ATOM 0 HG23 THR B 14 14.853 7.852 -9.545 1.00 0.00 H new ATOM 1388 N LEU B 15 15.082 6.886 -5.861 1.00 0.00 N ATOM 1389 CA LEU B 15 15.967 6.348 -4.843 1.00 0.00 C ATOM 1390 C LEU B 15 17.144 5.609 -5.472 1.00 0.00 C ATOM 1391 O LEU B 15 16.956 4.720 -6.301 1.00 0.00 O ATOM 1392 CB LEU B 15 15.182 5.411 -3.924 1.00 0.00 C ATOM 1393 CG LEU B 15 15.345 5.667 -2.423 1.00 0.00 C ATOM 1394 CD1 LEU B 15 16.797 5.529 -2.006 1.00 0.00 C ATOM 1395 CD2 LEU B 15 14.813 7.044 -2.050 1.00 0.00 C ATOM 0 H LEU B 15 14.541 6.183 -6.364 1.00 0.00 H new ATOM 0 HA LEU B 15 16.367 7.177 -4.259 1.00 0.00 H new ATOM 0 HB2 LEU B 15 14.124 5.488 -4.175 1.00 0.00 H new ATOM 0 HB3 LEU B 15 15.486 4.386 -4.135 1.00 0.00 H new ATOM 0 HG LEU B 15 14.763 4.916 -1.888 1.00 0.00 H new ATOM 0 HD11 LEU B 15 16.888 5.715 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU B 15 17.145 4.521 -2.229 1.00 0.00 H new ATOM 0 HD13 LEU B 15 17.403 6.252 -2.553 1.00 0.00 H new ATOM 0 HD21 LEU B 15 14.939 7.205 -0.979 1.00 0.00 H new ATOM 0 HD22 LEU B 15 15.364 7.808 -2.599 1.00 0.00 H new ATOM 0 HD23 LEU B 15 13.755 7.106 -2.304 1.00 0.00 H new ATOM 1407 N GLU B 16 18.355 5.996 -5.085 1.00 0.00 N ATOM 1408 CA GLU B 16 19.563 5.333 -5.557 1.00 0.00 C ATOM 1409 C GLU B 16 19.957 4.211 -4.599 1.00 0.00 C ATOM 1410 O GLU B 16 20.466 4.465 -3.505 1.00 0.00 O ATOM 1411 CB GLU B 16 20.706 6.343 -5.692 1.00 0.00 C ATOM 1412 CG GLU B 16 21.959 5.770 -6.338 1.00 0.00 C ATOM 1413 CD GLU B 16 21.699 5.210 -7.722 1.00 0.00 C ATOM 1414 OE1 GLU B 16 21.115 5.931 -8.563 1.00 0.00 O ATOM 1415 OE2 GLU B 16 22.082 4.048 -7.979 1.00 0.00 O ATOM 0 H GLU B 16 18.525 6.770 -4.442 1.00 0.00 H new ATOM 0 HA GLU B 16 19.364 4.901 -6.538 1.00 0.00 H new ATOM 0 HB2 GLU B 16 20.360 7.192 -6.282 1.00 0.00 H new ATOM 0 HB3 GLU B 16 20.960 6.724 -4.703 1.00 0.00 H new ATOM 0 HG2 GLU B 16 22.718 6.549 -6.402 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.363 4.983 -5.702 1.00 0.00 H new ATOM 1422 N VAL B 17 19.701 2.979 -5.012 1.00 0.00 N ATOM 1423 CA VAL B 17 19.964 1.811 -4.179 1.00 0.00 C ATOM 1424 C VAL B 17 20.649 0.716 -4.989 1.00 0.00 C ATOM 1425 O VAL B 17 20.511 0.663 -6.211 1.00 0.00 O ATOM 1426 CB VAL B 17 18.658 1.245 -3.581 1.00 0.00 C ATOM 1427 CG1 VAL B 17 18.024 2.231 -2.613 1.00 0.00 C ATOM 1428 CG2 VAL B 17 17.686 0.886 -4.694 1.00 0.00 C ATOM 0 H VAL B 17 19.308 2.759 -5.927 1.00 0.00 H new ATOM 0 HA VAL B 17 20.618 2.133 -3.369 1.00 0.00 H new ATOM 0 HB VAL B 17 18.902 0.342 -3.022 1.00 0.00 H new ATOM 0 HG11 VAL B 17 17.106 1.804 -2.208 1.00 0.00 H new ATOM 0 HG12 VAL B 17 18.718 2.438 -1.798 1.00 0.00 H new ATOM 0 HG13 VAL B 17 17.793 3.158 -3.137 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.768 0.488 -4.261 1.00 0.00 H new ATOM 0 HG22 VAL B 17 17.455 1.778 -5.277 1.00 0.00 H new ATOM 0 HG23 VAL B 17 18.137 0.135 -5.343 1.00 0.00 H new ATOM 1438 N GLU B 18 21.391 -0.144 -4.312 1.00 0.00 N ATOM 1439 CA GLU B 18 22.032 -1.271 -4.966 1.00 0.00 C ATOM 1440 C GLU B 18 21.429 -2.587 -4.483 1.00 0.00 C ATOM 1441 O GLU B 18 20.879 -2.659 -3.385 1.00 0.00 O ATOM 1442 CB GLU B 18 23.533 -1.246 -4.706 1.00 0.00 C ATOM 1443 CG GLU B 18 24.242 -0.068 -5.355 1.00 0.00 C ATOM 1444 CD GLU B 18 25.733 -0.076 -5.105 1.00 0.00 C ATOM 1445 OE1 GLU B 18 26.171 0.482 -4.081 1.00 0.00 O ATOM 1446 OE2 GLU B 18 26.476 -0.632 -5.940 1.00 0.00 O ATOM 0 H GLU B 18 21.564 -0.083 -3.309 1.00 0.00 H new ATOM 0 HA GLU B 18 21.862 -1.191 -6.040 1.00 0.00 H new ATOM 0 HB2 GLU B 18 23.707 -1.217 -3.630 1.00 0.00 H new ATOM 0 HB3 GLU B 18 23.973 -2.173 -5.075 1.00 0.00 H new ATOM 0 HG2 GLU B 18 24.058 -0.085 -6.429 1.00 0.00 H new ATOM 0 HG3 GLU B 18 23.819 0.861 -4.973 1.00 0.00 H new ATOM 1453 N SER B 19 21.549 -3.627 -5.303 1.00 0.00 N ATOM 1454 CA SER B 19 20.957 -4.926 -5.004 1.00 0.00 C ATOM 1455 C SER B 19 21.617 -5.571 -3.784 1.00 0.00 C ATOM 1456 O SER B 19 21.014 -6.403 -3.103 1.00 0.00 O ATOM 1457 CB SER B 19 21.102 -5.852 -6.215 1.00 0.00 C ATOM 1458 OG SER B 19 20.665 -5.219 -7.408 1.00 0.00 O ATOM 0 H SER B 19 22.056 -3.594 -6.188 1.00 0.00 H new ATOM 0 HA SER B 19 19.902 -4.772 -4.779 1.00 0.00 H new ATOM 0 HB2 SER B 19 22.144 -6.153 -6.322 1.00 0.00 H new ATOM 0 HB3 SER B 19 20.523 -6.761 -6.051 1.00 0.00 H new ATOM 0 HG SER B 19 20.772 -5.835 -8.163 1.00 0.00 H new ATOM 1464 N SER B 20 22.851 -5.168 -3.509 1.00 0.00 N ATOM 1465 CA SER B 20 23.627 -5.740 -2.419 1.00 0.00 C ATOM 1466 C SER B 20 23.273 -5.107 -1.072 1.00 0.00 C ATOM 1467 O SER B 20 23.831 -5.478 -0.037 1.00 0.00 O ATOM 1468 CB SER B 20 25.117 -5.573 -2.715 1.00 0.00 C ATOM 1469 OG SER B 20 25.395 -4.265 -3.193 1.00 0.00 O ATOM 0 H SER B 20 23.338 -4.440 -4.032 1.00 0.00 H new ATOM 0 HA SER B 20 23.384 -6.800 -2.347 1.00 0.00 H new ATOM 0 HB2 SER B 20 25.695 -5.765 -1.811 1.00 0.00 H new ATOM 0 HB3 SER B 20 25.430 -6.309 -3.455 1.00 0.00 H new ATOM 0 HG SER B 20 26.354 -4.180 -3.374 1.00 0.00 H new ATOM 1475 N ASP B 21 22.352 -4.155 -1.082 1.00 0.00 N ATOM 1476 CA ASP B 21 21.926 -3.504 0.149 1.00 0.00 C ATOM 1477 C ASP B 21 20.619 -4.102 0.644 1.00 0.00 C ATOM 1478 O ASP B 21 19.927 -4.804 -0.098 1.00 0.00 O ATOM 1479 CB ASP B 21 21.786 -1.991 -0.052 1.00 0.00 C ATOM 1480 CG ASP B 21 23.133 -1.303 -0.163 1.00 0.00 C ATOM 1481 OD1 ASP B 21 23.897 -1.335 0.826 1.00 0.00 O ATOM 1482 OD2 ASP B 21 23.442 -0.747 -1.240 1.00 0.00 O ATOM 0 H ASP B 21 21.887 -3.817 -1.924 1.00 0.00 H new ATOM 0 HA ASP B 21 22.692 -3.675 0.906 1.00 0.00 H new ATOM 0 HB2 ASP B 21 21.205 -1.798 -0.954 1.00 0.00 H new ATOM 0 HB3 ASP B 21 21.229 -1.565 0.783 1.00 0.00 H new ATOM 1487 N THR B 22 20.289 -3.839 1.898 1.00 0.00 N ATOM 1488 CA THR B 22 19.078 -4.379 2.493 1.00 0.00 C ATOM 1489 C THR B 22 17.915 -3.416 2.302 1.00 0.00 C ATOM 1490 O THR B 22 18.116 -2.242 1.985 1.00 0.00 O ATOM 1491 CB THR B 22 19.265 -4.649 4.000 1.00 0.00 C ATOM 1492 OG1 THR B 22 19.584 -3.427 4.679 1.00 0.00 O ATOM 1493 CG2 THR B 22 20.369 -5.669 4.242 1.00 0.00 C ATOM 0 H THR B 22 20.843 -3.254 2.524 1.00 0.00 H new ATOM 0 HA THR B 22 18.862 -5.322 1.990 1.00 0.00 H new ATOM 0 HB THR B 22 18.331 -5.053 4.390 1.00 0.00 H new ATOM 0 HG1 THR B 22 19.700 -3.605 5.636 1.00 0.00 H new ATOM 0 HG21 THR B 22 20.478 -5.840 5.313 1.00 0.00 H new ATOM 0 HG22 THR B 22 20.112 -6.607 3.750 1.00 0.00 H new ATOM 0 HG23 THR B 22 21.308 -5.292 3.837 1.00 0.00 H new ATOM 1501 N ILE B 23 16.700 -3.910 2.498 1.00 0.00 N ATOM 1502 CA ILE B 23 15.517 -3.060 2.437 1.00 0.00 C ATOM 1503 C ILE B 23 15.554 -2.046 3.574 1.00 0.00 C ATOM 1504 O ILE B 23 15.049 -0.931 3.452 1.00 0.00 O ATOM 1505 CB ILE B 23 14.216 -3.892 2.513 1.00 0.00 C ATOM 1506 CG1 ILE B 23 14.187 -4.930 1.386 1.00 0.00 C ATOM 1507 CG2 ILE B 23 12.988 -2.991 2.444 1.00 0.00 C ATOM 1508 CD1 ILE B 23 14.317 -4.336 -0.001 1.00 0.00 C ATOM 0 H ILE B 23 16.507 -4.891 2.700 1.00 0.00 H new ATOM 0 HA ILE B 23 15.524 -2.539 1.480 1.00 0.00 H new ATOM 0 HB ILE B 23 14.196 -4.413 3.470 1.00 0.00 H new ATOM 0 HG12 ILE B 23 14.996 -5.643 1.542 1.00 0.00 H new ATOM 0 HG13 ILE B 23 13.253 -5.489 1.445 1.00 0.00 H new ATOM 0 HG21 ILE B 23 12.086 -3.600 2.499 1.00 0.00 H new ATOM 0 HG22 ILE B 23 13.004 -2.290 3.278 1.00 0.00 H new ATOM 0 HG23 ILE B 23 12.995 -2.438 1.505 1.00 0.00 H new ATOM 0 HD11 ILE B 23 14.288 -5.134 -0.743 1.00 0.00 H new ATOM 0 HD12 ILE B 23 13.494 -3.645 -0.179 1.00 0.00 H new ATOM 0 HD13 ILE B 23 15.263 -3.801 -0.081 1.00 0.00 H new ATOM 1520 N ASP B 24 16.184 -2.442 4.673 1.00 0.00 N ATOM 1521 CA ASP B 24 16.392 -1.554 5.809 1.00 0.00 C ATOM 1522 C ASP B 24 17.292 -0.388 5.415 1.00 0.00 C ATOM 1523 O ASP B 24 17.046 0.759 5.790 1.00 0.00 O ATOM 1524 CB ASP B 24 17.009 -2.324 6.974 1.00 0.00 C ATOM 1525 CG ASP B 24 17.526 -1.409 8.062 1.00 0.00 C ATOM 1526 OD1 ASP B 24 16.704 -0.802 8.773 1.00 0.00 O ATOM 1527 OD2 ASP B 24 18.763 -1.297 8.210 1.00 0.00 O ATOM 0 H ASP B 24 16.562 -3.380 4.801 1.00 0.00 H new ATOM 0 HA ASP B 24 15.426 -1.158 6.121 1.00 0.00 H new ATOM 0 HB2 ASP B 24 16.264 -2.999 7.395 1.00 0.00 H new ATOM 0 HB3 ASP B 24 17.827 -2.942 6.604 1.00 0.00 H new ATOM 1532 N ASN B 25 18.331 -0.686 4.649 1.00 0.00 N ATOM 1533 CA ASN B 25 19.221 0.347 4.144 1.00 0.00 C ATOM 1534 C ASN B 25 18.447 1.295 3.229 1.00 0.00 C ATOM 1535 O ASN B 25 18.592 2.516 3.316 1.00 0.00 O ATOM 1536 CB ASN B 25 20.404 -0.279 3.402 1.00 0.00 C ATOM 1537 CG ASN B 25 21.440 0.746 2.992 1.00 0.00 C ATOM 1538 OD1 ASN B 25 21.363 1.320 1.912 1.00 0.00 O ATOM 1539 ND2 ASN B 25 22.421 0.978 3.852 1.00 0.00 N ATOM 0 H ASN B 25 18.578 -1.634 4.364 1.00 0.00 H new ATOM 0 HA ASN B 25 19.616 0.917 4.985 1.00 0.00 H new ATOM 0 HB2 ASN B 25 20.872 -1.029 4.039 1.00 0.00 H new ATOM 0 HB3 ASN B 25 20.039 -0.797 2.515 1.00 0.00 H new ATOM 0 HD21 ASN B 25 23.149 1.656 3.625 1.00 0.00 H new ATOM 0 HD22 ASN B 25 22.449 0.479 4.741 1.00 0.00 H new ATOM 1546 N VAL B 26 17.595 0.730 2.377 1.00 0.00 N ATOM 1547 CA VAL B 26 16.722 1.528 1.533 1.00 0.00 C ATOM 1548 C VAL B 26 15.827 2.425 2.389 1.00 0.00 C ATOM 1549 O VAL B 26 15.638 3.601 2.077 1.00 0.00 O ATOM 1550 CB VAL B 26 15.846 0.642 0.619 1.00 0.00 C ATOM 1551 CG1 VAL B 26 14.946 1.499 -0.247 1.00 0.00 C ATOM 1552 CG2 VAL B 26 16.707 -0.257 -0.253 1.00 0.00 C ATOM 0 H VAL B 26 17.494 -0.278 2.256 1.00 0.00 H new ATOM 0 HA VAL B 26 17.358 2.146 0.900 1.00 0.00 H new ATOM 0 HB VAL B 26 15.226 0.012 1.256 1.00 0.00 H new ATOM 0 HG11 VAL B 26 14.336 0.858 -0.884 1.00 0.00 H new ATOM 0 HG12 VAL B 26 14.297 2.102 0.388 1.00 0.00 H new ATOM 0 HG13 VAL B 26 15.556 2.154 -0.869 1.00 0.00 H new ATOM 0 HG21 VAL B 26 16.067 -0.870 -0.887 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.356 0.356 -0.878 1.00 0.00 H new ATOM 0 HG23 VAL B 26 17.316 -0.902 0.380 1.00 0.00 H new ATOM 1562 N LYS B 27 15.301 1.868 3.482 1.00 0.00 N ATOM 1563 CA LYS B 27 14.468 2.628 4.412 1.00 0.00 C ATOM 1564 C LYS B 27 15.181 3.892 4.883 1.00 0.00 C ATOM 1565 O LYS B 27 14.598 4.980 4.872 1.00 0.00 O ATOM 1566 CB LYS B 27 14.079 1.786 5.632 1.00 0.00 C ATOM 1567 CG LYS B 27 13.076 0.677 5.348 1.00 0.00 C ATOM 1568 CD LYS B 27 12.620 0.018 6.641 1.00 0.00 C ATOM 1569 CE LYS B 27 11.558 -1.041 6.395 1.00 0.00 C ATOM 1570 NZ LYS B 27 10.946 -1.521 7.665 1.00 0.00 N ATOM 0 H LYS B 27 15.438 0.892 3.744 1.00 0.00 H new ATOM 0 HA LYS B 27 13.563 2.906 3.871 1.00 0.00 H new ATOM 0 HB2 LYS B 27 14.981 1.342 6.052 1.00 0.00 H new ATOM 0 HB3 LYS B 27 13.664 2.446 6.394 1.00 0.00 H new ATOM 0 HG2 LYS B 27 12.215 1.086 4.819 1.00 0.00 H new ATOM 0 HG3 LYS B 27 13.527 -0.069 4.694 1.00 0.00 H new ATOM 0 HD2 LYS B 27 13.477 -0.436 7.138 1.00 0.00 H new ATOM 0 HD3 LYS B 27 12.225 0.778 7.316 1.00 0.00 H new ATOM 0 HE2 LYS B 27 10.781 -0.632 5.750 1.00 0.00 H new ATOM 0 HE3 LYS B 27 12.002 -1.884 5.865 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 9.968 -1.826 7.485 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 11.497 -2.322 8.035 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 10.945 -0.750 8.363 1.00 0.00 H new ATOM 1584 N SER B 28 16.439 3.750 5.289 1.00 0.00 N ATOM 1585 CA SER B 28 17.206 4.885 5.785 1.00 0.00 C ATOM 1586 C SER B 28 17.455 5.904 4.675 1.00 0.00 C ATOM 1587 O SER B 28 17.452 7.110 4.919 1.00 0.00 O ATOM 1588 CB SER B 28 18.526 4.414 6.408 1.00 0.00 C ATOM 1589 OG SER B 28 19.369 3.787 5.459 1.00 0.00 O ATOM 0 H SER B 28 16.946 2.865 5.284 1.00 0.00 H new ATOM 0 HA SER B 28 16.621 5.377 6.562 1.00 0.00 H new ATOM 0 HB2 SER B 28 19.045 5.267 6.845 1.00 0.00 H new ATOM 0 HB3 SER B 28 18.315 3.719 7.220 1.00 0.00 H new ATOM 0 HG SER B 28 18.867 3.624 4.633 1.00 0.00 H new ATOM 1595 N LYS B 29 17.642 5.418 3.449 1.00 0.00 N ATOM 1596 CA LYS B 29 17.846 6.299 2.305 1.00 0.00 C ATOM 1597 C LYS B 29 16.574 7.087 1.987 1.00 0.00 C ATOM 1598 O LYS B 29 16.639 8.204 1.469 1.00 0.00 O ATOM 1599 CB LYS B 29 18.274 5.509 1.067 1.00 0.00 C ATOM 1600 CG LYS B 29 19.636 4.843 1.171 1.00 0.00 C ATOM 1601 CD LYS B 29 19.966 4.093 -0.111 1.00 0.00 C ATOM 1602 CE LYS B 29 21.368 3.503 -0.087 1.00 0.00 C ATOM 1603 NZ LYS B 29 22.411 4.552 0.033 1.00 0.00 N ATOM 0 H LYS B 29 17.656 4.423 3.225 1.00 0.00 H new ATOM 0 HA LYS B 29 18.641 6.995 2.573 1.00 0.00 H new ATOM 0 HB2 LYS B 29 17.525 4.742 0.867 1.00 0.00 H new ATOM 0 HB3 LYS B 29 18.279 6.181 0.209 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.400 5.595 1.365 1.00 0.00 H new ATOM 0 HG3 LYS B 29 19.646 4.153 2.015 1.00 0.00 H new ATOM 0 HD2 LYS B 29 19.240 3.294 -0.260 1.00 0.00 H new ATOM 0 HD3 LYS B 29 19.873 4.770 -0.960 1.00 0.00 H new ATOM 0 HE2 LYS B 29 21.455 2.808 0.749 1.00 0.00 H new ATOM 0 HE3 LYS B 29 21.535 2.928 -0.998 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 23.341 4.144 -0.190 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 22.204 5.325 -0.631 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 22.420 4.923 1.005 1.00 0.00 H new ATOM 1617 N ILE B 30 15.417 6.500 2.285 1.00 0.00 N ATOM 1618 CA ILE B 30 14.145 7.176 2.064 1.00 0.00 C ATOM 1619 C ILE B 30 13.917 8.235 3.139 1.00 0.00 C ATOM 1620 O ILE B 30 13.469 9.346 2.845 1.00 0.00 O ATOM 1621 CB ILE B 30 12.953 6.193 2.048 1.00 0.00 C ATOM 1622 CG1 ILE B 30 13.168 5.107 0.992 1.00 0.00 C ATOM 1623 CG2 ILE B 30 11.653 6.942 1.775 1.00 0.00 C ATOM 1624 CD1 ILE B 30 12.097 4.037 0.995 1.00 0.00 C ATOM 0 H ILE B 30 15.336 5.562 2.678 1.00 0.00 H new ATOM 0 HA ILE B 30 14.201 7.647 1.083 1.00 0.00 H new ATOM 0 HB ILE B 30 12.885 5.717 3.026 1.00 0.00 H new ATOM 0 HG12 ILE B 30 13.202 5.572 0.007 1.00 0.00 H new ATOM 0 HG13 ILE B 30 14.138 4.638 1.157 1.00 0.00 H new ATOM 0 HG21 ILE B 30 10.822 6.237 1.767 1.00 0.00 H new ATOM 0 HG22 ILE B 30 11.491 7.685 2.556 1.00 0.00 H new ATOM 0 HG23 ILE B 30 11.716 7.440 0.807 1.00 0.00 H new ATOM 0 HD11 ILE B 30 12.315 3.302 0.221 1.00 0.00 H new ATOM 0 HD12 ILE B 30 12.077 3.545 1.967 1.00 0.00 H new ATOM 0 HD13 ILE B 30 11.127 4.493 0.799 1.00 0.00 H new ATOM 1636 N GLN B 31 14.243 7.900 4.386 1.00 0.00 N ATOM 1637 CA GLN B 31 14.158 8.866 5.478 1.00 0.00 C ATOM 1638 C GLN B 31 15.138 10.009 5.237 1.00 0.00 C ATOM 1639 O GLN B 31 14.860 11.164 5.557 1.00 0.00 O ATOM 1640 CB GLN B 31 14.433 8.202 6.829 1.00 0.00 C ATOM 1641 CG GLN B 31 14.527 9.201 7.974 1.00 0.00 C ATOM 1642 CD GLN B 31 14.576 8.542 9.335 1.00 0.00 C ATOM 1643 OE1 GLN B 31 15.648 8.199 9.835 1.00 0.00 O ATOM 1644 NE2 GLN B 31 13.416 8.380 9.950 1.00 0.00 N ATOM 0 H GLN B 31 14.566 6.973 4.664 1.00 0.00 H new ATOM 0 HA GLN B 31 13.144 9.264 5.504 1.00 0.00 H new ATOM 0 HB2 GLN B 31 13.640 7.485 7.044 1.00 0.00 H new ATOM 0 HB3 GLN B 31 15.364 7.639 6.768 1.00 0.00 H new ATOM 0 HG2 GLN B 31 15.419 9.814 7.841 1.00 0.00 H new ATOM 0 HG3 GLN B 31 13.670 9.873 7.933 1.00 0.00 H new ATOM 0 HE21 GLN B 31 12.552 8.679 9.497 1.00 0.00 H new ATOM 0 HE22 GLN B 31 13.385 7.956 10.877 1.00 0.00 H new ATOM 1653 N ASP B 32 16.277 9.672 4.649 1.00 0.00 N ATOM 1654 CA ASP B 32 17.268 10.660 4.236 1.00 0.00 C ATOM 1655 C ASP B 32 16.634 11.712 3.324 1.00 0.00 C ATOM 1656 O ASP B 32 17.037 12.875 3.316 1.00 0.00 O ATOM 1657 CB ASP B 32 18.421 9.950 3.520 1.00 0.00 C ATOM 1658 CG ASP B 32 19.378 10.899 2.833 1.00 0.00 C ATOM 1659 OD1 ASP B 32 20.352 11.340 3.474 1.00 0.00 O ATOM 1660 OD2 ASP B 32 19.177 11.182 1.634 1.00 0.00 O ATOM 0 H ASP B 32 16.541 8.708 4.444 1.00 0.00 H new ATOM 0 HA ASP B 32 17.653 11.172 5.118 1.00 0.00 H new ATOM 0 HB2 ASP B 32 18.973 9.350 4.243 1.00 0.00 H new ATOM 0 HB3 ASP B 32 18.011 9.262 2.781 1.00 0.00 H new ATOM 1665 N LYS B 33 15.619 11.296 2.579 1.00 0.00 N ATOM 1666 CA LYS B 33 14.910 12.196 1.685 1.00 0.00 C ATOM 1667 C LYS B 33 13.723 12.842 2.398 1.00 0.00 C ATOM 1668 O LYS B 33 13.738 14.036 2.703 1.00 0.00 O ATOM 1669 CB LYS B 33 14.405 11.438 0.452 1.00 0.00 C ATOM 1670 CG LYS B 33 15.460 10.585 -0.231 1.00 0.00 C ATOM 1671 CD LYS B 33 16.596 11.424 -0.789 1.00 0.00 C ATOM 1672 CE LYS B 33 17.687 10.548 -1.383 1.00 0.00 C ATOM 1673 NZ LYS B 33 18.322 9.681 -0.357 1.00 0.00 N ATOM 0 H LYS B 33 15.269 10.338 2.577 1.00 0.00 H new ATOM 0 HA LYS B 33 15.606 12.974 1.373 1.00 0.00 H new ATOM 0 HB2 LYS B 33 13.573 10.799 0.748 1.00 0.00 H new ATOM 0 HB3 LYS B 33 14.014 12.157 -0.268 1.00 0.00 H new ATOM 0 HG2 LYS B 33 15.859 9.862 0.481 1.00 0.00 H new ATOM 0 HG3 LYS B 33 14.999 10.016 -1.038 1.00 0.00 H new ATOM 0 HD2 LYS B 33 16.211 12.099 -1.554 1.00 0.00 H new ATOM 0 HD3 LYS B 33 17.015 12.045 0.002 1.00 0.00 H new ATOM 0 HE2 LYS B 33 17.264 9.926 -2.172 1.00 0.00 H new ATOM 0 HE3 LYS B 33 18.446 11.178 -1.846 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 19.105 9.149 -0.788 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 18.689 10.271 0.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 17.617 9.015 0.019 1.00 0.00 H new ATOM 1687 N GLU B 34 12.712 12.031 2.691 1.00 0.00 N ATOM 1688 CA GLU B 34 11.448 12.539 3.200 1.00 0.00 C ATOM 1689 C GLU B 34 11.469 12.656 4.724 1.00 0.00 C ATOM 1690 O GLU B 34 11.094 13.687 5.281 1.00 0.00 O ATOM 1691 CB GLU B 34 10.308 11.623 2.753 1.00 0.00 C ATOM 1692 CG GLU B 34 9.007 12.359 2.496 1.00 0.00 C ATOM 1693 CD GLU B 34 9.162 13.461 1.466 1.00 0.00 C ATOM 1694 OE1 GLU B 34 9.417 13.150 0.282 1.00 0.00 O ATOM 1695 OE2 GLU B 34 9.034 14.645 1.836 1.00 0.00 O ATOM 0 H GLU B 34 12.746 11.017 2.584 1.00 0.00 H new ATOM 0 HA GLU B 34 11.291 13.538 2.794 1.00 0.00 H new ATOM 0 HB2 GLU B 34 10.607 11.101 1.844 1.00 0.00 H new ATOM 0 HB3 GLU B 34 10.142 10.863 3.517 1.00 0.00 H new ATOM 0 HG2 GLU B 34 8.252 11.650 2.155 1.00 0.00 H new ATOM 0 HG3 GLU B 34 8.644 12.787 3.430 1.00 0.00 H new ATOM 1702 N GLY B 35 11.911 11.600 5.398 1.00 0.00 N ATOM 1703 CA GLY B 35 12.047 11.659 6.843 1.00 0.00 C ATOM 1704 C GLY B 35 11.181 10.651 7.574 1.00 0.00 C ATOM 1705 O GLY B 35 11.255 10.543 8.799 1.00 0.00 O ATOM 0 H GLY B 35 12.176 10.711 4.975 1.00 0.00 H new ATOM 0 HA2 GLY B 35 13.090 11.490 7.109 1.00 0.00 H new ATOM 0 HA3 GLY B 35 11.790 12.662 7.184 1.00 0.00 H new ATOM 1709 N ILE B 36 10.371 9.910 6.832 1.00 0.00 N ATOM 1710 CA ILE B 36 9.465 8.932 7.429 1.00 0.00 C ATOM 1711 C ILE B 36 10.252 7.842 8.172 1.00 0.00 C ATOM 1712 O ILE B 36 11.197 7.272 7.629 1.00 0.00 O ATOM 1713 CB ILE B 36 8.559 8.283 6.355 1.00 0.00 C ATOM 1714 CG1 ILE B 36 7.912 9.366 5.484 1.00 0.00 C ATOM 1715 CG2 ILE B 36 7.488 7.416 7.010 1.00 0.00 C ATOM 1716 CD1 ILE B 36 7.098 8.814 4.333 1.00 0.00 C ATOM 0 H ILE B 36 10.321 9.965 5.815 1.00 0.00 H new ATOM 0 HA ILE B 36 8.834 9.462 8.143 1.00 0.00 H new ATOM 0 HB ILE B 36 9.175 7.646 5.720 1.00 0.00 H new ATOM 0 HG12 ILE B 36 7.269 9.986 6.108 1.00 0.00 H new ATOM 0 HG13 ILE B 36 8.692 10.015 5.087 1.00 0.00 H new ATOM 0 HG21 ILE B 36 6.861 6.968 6.239 1.00 0.00 H new ATOM 0 HG22 ILE B 36 7.964 6.628 7.593 1.00 0.00 H new ATOM 0 HG23 ILE B 36 6.873 8.032 7.666 1.00 0.00 H new ATOM 0 HD11 ILE B 36 6.671 9.638 3.761 1.00 0.00 H new ATOM 0 HD12 ILE B 36 7.741 8.218 3.685 1.00 0.00 H new ATOM 0 HD13 ILE B 36 6.295 8.188 4.722 1.00 0.00 H new ATOM 1728 N PRO B 37 9.892 7.570 9.442 1.00 0.00 N ATOM 1729 CA PRO B 37 10.563 6.556 10.266 1.00 0.00 C ATOM 1730 C PRO B 37 10.572 5.169 9.619 1.00 0.00 C ATOM 1731 O PRO B 37 9.538 4.689 9.146 1.00 0.00 O ATOM 1732 CB PRO B 37 9.734 6.527 11.554 1.00 0.00 C ATOM 1733 CG PRO B 37 9.064 7.853 11.608 1.00 0.00 C ATOM 1734 CD PRO B 37 8.817 8.255 10.180 1.00 0.00 C ATOM 0 HA PRO B 37 11.613 6.805 10.417 1.00 0.00 H new ATOM 0 HB2 PRO B 37 9.005 5.717 11.537 1.00 0.00 H new ATOM 0 HB3 PRO B 37 10.366 6.368 12.427 1.00 0.00 H new ATOM 0 HG2 PRO B 37 8.128 7.794 12.164 1.00 0.00 H new ATOM 0 HG3 PRO B 37 9.691 8.586 12.116 1.00 0.00 H new ATOM 0 HD2 PRO B 37 7.831 7.940 9.839 1.00 0.00 H new ATOM 0 HD3 PRO B 37 8.868 9.336 10.052 1.00 0.00 H new ATOM 1742 N PRO B 38 11.740 4.501 9.613 1.00 0.00 N ATOM 1743 CA PRO B 38 11.912 3.172 9.005 1.00 0.00 C ATOM 1744 C PRO B 38 11.015 2.108 9.642 1.00 0.00 C ATOM 1745 O PRO B 38 10.654 1.121 8.997 1.00 0.00 O ATOM 1746 CB PRO B 38 13.389 2.841 9.260 1.00 0.00 C ATOM 1747 CG PRO B 38 14.039 4.157 9.518 1.00 0.00 C ATOM 1748 CD PRO B 38 12.999 4.996 10.197 1.00 0.00 C ATOM 0 HA PRO B 38 11.637 3.180 7.950 1.00 0.00 H new ATOM 0 HB2 PRO B 38 13.502 2.171 10.112 1.00 0.00 H new ATOM 0 HB3 PRO B 38 13.836 2.342 8.400 1.00 0.00 H new ATOM 0 HG2 PRO B 38 14.921 4.041 10.148 1.00 0.00 H new ATOM 0 HG3 PRO B 38 14.370 4.620 8.588 1.00 0.00 H new ATOM 0 HD2 PRO B 38 13.020 4.867 11.279 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.145 6.058 10.000 1.00 0.00 H new ATOM 1756 N ASP B 39 10.660 2.317 10.909 1.00 0.00 N ATOM 1757 CA ASP B 39 9.763 1.406 11.625 1.00 0.00 C ATOM 1758 C ASP B 39 8.367 1.450 11.016 1.00 0.00 C ATOM 1759 O ASP B 39 7.609 0.483 11.079 1.00 0.00 O ATOM 1760 CB ASP B 39 9.661 1.792 13.105 1.00 0.00 C ATOM 1761 CG ASP B 39 11.006 1.933 13.780 1.00 0.00 C ATOM 1762 OD1 ASP B 39 11.623 3.010 13.655 1.00 0.00 O ATOM 1763 OD2 ASP B 39 11.444 0.979 14.458 1.00 0.00 O ATOM 0 H ASP B 39 10.980 3.111 11.464 1.00 0.00 H new ATOM 0 HA ASP B 39 10.176 0.401 11.539 1.00 0.00 H new ATOM 0 HB2 ASP B 39 9.118 2.733 13.191 1.00 0.00 H new ATOM 0 HB3 ASP B 39 9.076 1.038 13.631 1.00 0.00 H new ATOM 1768 N GLN B 40 8.045 2.587 10.422 1.00 0.00 N ATOM 1769 CA GLN B 40 6.715 2.835 9.891 1.00 0.00 C ATOM 1770 C GLN B 40 6.665 2.530 8.399 1.00 0.00 C ATOM 1771 O GLN B 40 5.622 2.158 7.864 1.00 0.00 O ATOM 1772 CB GLN B 40 6.350 4.292 10.135 1.00 0.00 C ATOM 1773 CG GLN B 40 4.889 4.613 9.897 1.00 0.00 C ATOM 1774 CD GLN B 40 4.581 6.062 10.188 1.00 0.00 C ATOM 1775 OE1 GLN B 40 3.481 6.395 10.623 1.00 0.00 O ATOM 1776 NE2 GLN B 40 5.548 6.928 9.931 1.00 0.00 N ATOM 0 H GLN B 40 8.696 3.362 10.295 1.00 0.00 H new ATOM 0 HA GLN B 40 6.001 2.183 10.395 1.00 0.00 H new ATOM 0 HB2 GLN B 40 6.605 4.552 11.162 1.00 0.00 H new ATOM 0 HB3 GLN B 40 6.959 4.921 9.486 1.00 0.00 H new ATOM 0 HG2 GLN B 40 4.631 4.387 8.863 1.00 0.00 H new ATOM 0 HG3 GLN B 40 4.269 3.975 10.527 1.00 0.00 H new ATOM 0 HE21 GLN B 40 6.444 6.600 9.571 1.00 0.00 H new ATOM 0 HE22 GLN B 40 5.397 7.924 10.093 1.00 0.00 H new ATOM 1785 N GLN B 41 7.798 2.697 7.739 1.00 0.00 N ATOM 1786 CA GLN B 41 7.892 2.504 6.298 1.00 0.00 C ATOM 1787 C GLN B 41 7.830 1.026 5.919 1.00 0.00 C ATOM 1788 O GLN B 41 8.689 0.237 6.316 1.00 0.00 O ATOM 1789 CB GLN B 41 9.196 3.114 5.784 1.00 0.00 C ATOM 1790 CG GLN B 41 9.207 4.632 5.786 1.00 0.00 C ATOM 1791 CD GLN B 41 10.521 5.214 5.293 1.00 0.00 C ATOM 1792 OE1 GLN B 41 10.552 6.298 4.718 1.00 0.00 O ATOM 1793 NE2 GLN B 41 11.616 4.501 5.519 1.00 0.00 N ATOM 0 H GLN B 41 8.676 2.969 8.182 1.00 0.00 H new ATOM 0 HA GLN B 41 7.039 3.002 5.837 1.00 0.00 H new ATOM 0 HB2 GLN B 41 10.021 2.754 6.398 1.00 0.00 H new ATOM 0 HB3 GLN B 41 9.376 2.760 4.769 1.00 0.00 H new ATOM 0 HG2 GLN B 41 8.395 4.997 5.157 1.00 0.00 H new ATOM 0 HG3 GLN B 41 9.013 4.990 6.797 1.00 0.00 H new ATOM 0 HE21 GLN B 41 11.550 3.604 6.000 1.00 0.00 H new ATOM 0 HE22 GLN B 41 12.524 4.850 5.212 1.00 0.00 H new ATOM 1802 N ARG B 42 6.804 0.662 5.160 1.00 0.00 N ATOM 1803 CA ARG B 42 6.665 -0.687 4.622 1.00 0.00 C ATOM 1804 C ARG B 42 6.598 -0.621 3.103 1.00 0.00 C ATOM 1805 O ARG B 42 5.780 0.110 2.545 1.00 0.00 O ATOM 1806 CB ARG B 42 5.396 -1.350 5.161 1.00 0.00 C ATOM 1807 CG ARG B 42 5.385 -1.524 6.670 1.00 0.00 C ATOM 1808 CD ARG B 42 3.983 -1.786 7.192 1.00 0.00 C ATOM 1809 NE ARG B 42 3.411 -3.040 6.703 1.00 0.00 N ATOM 1810 CZ ARG B 42 2.119 -3.354 6.818 1.00 0.00 C ATOM 1811 NH1 ARG B 42 1.263 -2.494 7.352 1.00 0.00 N ATOM 1812 NH2 ARG B 42 1.671 -4.524 6.400 1.00 0.00 N ATOM 0 H ARG B 42 6.045 1.292 4.900 1.00 0.00 H new ATOM 0 HA ARG B 42 7.527 -1.279 4.929 1.00 0.00 H new ATOM 0 HB2 ARG B 42 4.533 -0.752 4.868 1.00 0.00 H new ATOM 0 HB3 ARG B 42 5.281 -2.327 4.692 1.00 0.00 H new ATOM 0 HG2 ARG B 42 6.037 -2.352 6.946 1.00 0.00 H new ATOM 0 HG3 ARG B 42 5.789 -0.629 7.143 1.00 0.00 H new ATOM 0 HD2 ARG B 42 4.006 -1.805 8.282 1.00 0.00 H new ATOM 0 HD3 ARG B 42 3.334 -0.960 6.901 1.00 0.00 H new ATOM 0 HE ARG B 42 4.032 -3.710 6.250 1.00 0.00 H new ATOM 0 HH11 ARG B 42 1.590 -1.585 7.678 1.00 0.00 H new ATOM 0 HH12 ARG B 42 0.277 -2.742 7.436 1.00 0.00 H new ATOM 0 HH21 ARG B 42 2.314 -5.198 5.985 1.00 0.00 H new ATOM 0 HH22 ARG B 42 0.682 -4.754 6.493 1.00 0.00 H new ATOM 1826 N LEU B 43 7.458 -1.368 2.434 1.00 0.00 N ATOM 1827 CA LEU B 43 7.504 -1.346 0.977 1.00 0.00 C ATOM 1828 C LEU B 43 6.707 -2.508 0.399 1.00 0.00 C ATOM 1829 O LEU B 43 6.751 -3.619 0.917 1.00 0.00 O ATOM 1830 CB LEU B 43 8.954 -1.403 0.469 1.00 0.00 C ATOM 1831 CG LEU B 43 9.827 -0.173 0.768 1.00 0.00 C ATOM 1832 CD1 LEU B 43 10.234 -0.123 2.235 1.00 0.00 C ATOM 1833 CD2 LEU B 43 11.060 -0.166 -0.127 1.00 0.00 C ATOM 0 H LEU B 43 8.133 -1.996 2.871 1.00 0.00 H new ATOM 0 HA LEU B 43 7.058 -0.409 0.644 1.00 0.00 H new ATOM 0 HB2 LEU B 43 9.435 -2.279 0.904 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.933 -1.554 -0.610 1.00 0.00 H new ATOM 0 HG LEU B 43 9.234 0.717 0.557 1.00 0.00 H new ATOM 0 HD11 LEU B 43 10.850 0.759 2.412 1.00 0.00 H new ATOM 0 HD12 LEU B 43 9.341 -0.073 2.859 1.00 0.00 H new ATOM 0 HD13 LEU B 43 10.802 -1.019 2.486 1.00 0.00 H new ATOM 0 HD21 LEU B 43 11.667 0.711 0.097 1.00 0.00 H new ATOM 0 HD22 LEU B 43 11.645 -1.068 0.052 1.00 0.00 H new ATOM 0 HD23 LEU B 43 10.751 -0.136 -1.172 1.00 0.00 H new ATOM 1845 N ILE B 44 5.961 -2.241 -0.659 1.00 0.00 N ATOM 1846 CA ILE B 44 5.191 -3.275 -1.331 1.00 0.00 C ATOM 1847 C ILE B 44 5.539 -3.320 -2.814 1.00 0.00 C ATOM 1848 O ILE B 44 5.460 -2.305 -3.514 1.00 0.00 O ATOM 1849 CB ILE B 44 3.670 -3.051 -1.172 1.00 0.00 C ATOM 1850 CG1 ILE B 44 3.281 -3.050 0.309 1.00 0.00 C ATOM 1851 CG2 ILE B 44 2.890 -4.121 -1.927 1.00 0.00 C ATOM 1852 CD1 ILE B 44 1.809 -2.791 0.549 1.00 0.00 C ATOM 0 H ILE B 44 5.872 -1.313 -1.073 1.00 0.00 H new ATOM 0 HA ILE B 44 5.451 -4.224 -0.862 1.00 0.00 H new ATOM 0 HB ILE B 44 3.419 -2.079 -1.596 1.00 0.00 H new ATOM 0 HG12 ILE B 44 3.548 -4.012 0.747 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.864 -2.290 0.829 1.00 0.00 H new ATOM 0 HG21 ILE B 44 1.821 -3.947 -1.804 1.00 0.00 H new ATOM 0 HG22 ILE B 44 3.145 -4.078 -2.986 1.00 0.00 H new ATOM 0 HG23 ILE B 44 3.146 -5.104 -1.532 1.00 0.00 H new ATOM 0 HD11 ILE B 44 1.607 -2.805 1.620 1.00 0.00 H new ATOM 0 HD12 ILE B 44 1.540 -1.816 0.142 1.00 0.00 H new ATOM 0 HD13 ILE B 44 1.219 -3.565 0.058 1.00 0.00 H new ATOM 1864 N PHE B 45 5.924 -4.496 -3.284 1.00 0.00 N ATOM 1865 CA PHE B 45 6.281 -4.687 -4.679 1.00 0.00 C ATOM 1866 C PHE B 45 5.519 -5.873 -5.259 1.00 0.00 C ATOM 1867 O PHE B 45 5.742 -7.017 -4.862 1.00 0.00 O ATOM 1868 CB PHE B 45 7.794 -4.899 -4.816 1.00 0.00 C ATOM 1869 CG PHE B 45 8.270 -5.018 -6.236 1.00 0.00 C ATOM 1870 CD1 PHE B 45 8.312 -3.906 -7.062 1.00 0.00 C ATOM 1871 CD2 PHE B 45 8.680 -6.242 -6.744 1.00 0.00 C ATOM 1872 CE1 PHE B 45 8.751 -4.012 -8.366 1.00 0.00 C ATOM 1873 CE2 PHE B 45 9.122 -6.353 -8.047 1.00 0.00 C ATOM 1874 CZ PHE B 45 9.157 -5.236 -8.859 1.00 0.00 C ATOM 0 H PHE B 45 5.997 -5.338 -2.714 1.00 0.00 H new ATOM 0 HA PHE B 45 6.007 -3.792 -5.238 1.00 0.00 H new ATOM 0 HB2 PHE B 45 8.311 -4.067 -4.339 1.00 0.00 H new ATOM 0 HB3 PHE B 45 8.074 -5.802 -4.273 1.00 0.00 H new ATOM 0 HD1 PHE B 45 7.998 -2.946 -6.681 1.00 0.00 H new ATOM 0 HD2 PHE B 45 8.653 -7.118 -6.113 1.00 0.00 H new ATOM 0 HE1 PHE B 45 8.777 -3.138 -9.000 1.00 0.00 H new ATOM 0 HE2 PHE B 45 9.440 -7.311 -8.431 1.00 0.00 H new ATOM 0 HZ PHE B 45 9.502 -5.320 -9.879 1.00 0.00 H new ATOM 1884 N ALA B 46 4.588 -5.577 -6.169 1.00 0.00 N ATOM 1885 CA ALA B 46 3.784 -6.596 -6.855 1.00 0.00 C ATOM 1886 C ALA B 46 2.906 -7.389 -5.883 1.00 0.00 C ATOM 1887 O ALA B 46 2.392 -8.453 -6.223 1.00 0.00 O ATOM 1888 CB ALA B 46 4.684 -7.532 -7.652 1.00 0.00 C ATOM 0 H ALA B 46 4.369 -4.622 -6.453 1.00 0.00 H new ATOM 0 HA ALA B 46 3.115 -6.077 -7.541 1.00 0.00 H new ATOM 0 HB1 ALA B 46 4.074 -8.282 -8.155 1.00 0.00 H new ATOM 0 HB2 ALA B 46 5.239 -6.958 -8.394 1.00 0.00 H new ATOM 0 HB3 ALA B 46 5.383 -8.026 -6.978 1.00 0.00 H new ATOM 1894 N GLY B 47 2.717 -6.856 -4.685 1.00 0.00 N ATOM 1895 CA GLY B 47 1.905 -7.535 -3.692 1.00 0.00 C ATOM 1896 C GLY B 47 2.750 -8.155 -2.601 1.00 0.00 C ATOM 1897 O GLY B 47 2.246 -8.519 -1.540 1.00 0.00 O ATOM 0 H GLY B 47 3.111 -5.965 -4.381 1.00 0.00 H new ATOM 0 HA2 GLY B 47 1.204 -6.827 -3.250 1.00 0.00 H new ATOM 0 HA3 GLY B 47 1.312 -8.310 -4.177 1.00 0.00 H new ATOM 1901 N LYS B 48 4.042 -8.272 -2.866 1.00 0.00 N ATOM 1902 CA LYS B 48 4.980 -8.809 -1.894 1.00 0.00 C ATOM 1903 C LYS B 48 5.420 -7.705 -0.937 1.00 0.00 C ATOM 1904 O LYS B 48 5.731 -6.593 -1.368 1.00 0.00 O ATOM 1905 CB LYS B 48 6.186 -9.419 -2.616 1.00 0.00 C ATOM 1906 CG LYS B 48 7.297 -9.889 -1.691 1.00 0.00 C ATOM 1907 CD LYS B 48 8.400 -10.587 -2.468 1.00 0.00 C ATOM 1908 CE LYS B 48 7.972 -11.968 -2.937 1.00 0.00 C ATOM 1909 NZ LYS B 48 7.738 -12.892 -1.796 1.00 0.00 N ATOM 0 H LYS B 48 4.466 -8.000 -3.753 1.00 0.00 H new ATOM 0 HA LYS B 48 4.494 -9.594 -1.315 1.00 0.00 H new ATOM 0 HB2 LYS B 48 5.847 -10.264 -3.215 1.00 0.00 H new ATOM 0 HB3 LYS B 48 6.593 -8.681 -3.307 1.00 0.00 H new ATOM 0 HG2 LYS B 48 7.711 -9.036 -1.153 1.00 0.00 H new ATOM 0 HG3 LYS B 48 6.888 -10.569 -0.944 1.00 0.00 H new ATOM 0 HD2 LYS B 48 8.678 -9.980 -3.330 1.00 0.00 H new ATOM 0 HD3 LYS B 48 9.287 -10.675 -1.841 1.00 0.00 H new ATOM 0 HE2 LYS B 48 7.061 -11.884 -3.529 1.00 0.00 H new ATOM 0 HE3 LYS B 48 8.739 -12.384 -3.590 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 7.750 -13.874 -2.137 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 8.487 -12.763 -1.086 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 6.814 -12.686 -1.366 1.00 0.00 H new ATOM 1923 N GLN B 49 5.428 -8.008 0.353 1.00 0.00 N ATOM 1924 CA GLN B 49 5.786 -7.019 1.359 1.00 0.00 C ATOM 1925 C GLN B 49 7.281 -7.074 1.655 1.00 0.00 C ATOM 1926 O GLN B 49 7.816 -8.123 2.011 1.00 0.00 O ATOM 1927 CB GLN B 49 4.997 -7.252 2.645 1.00 0.00 C ATOM 1928 CG GLN B 49 4.710 -5.972 3.413 1.00 0.00 C ATOM 1929 CD GLN B 49 4.036 -6.232 4.743 1.00 0.00 C ATOM 1930 OE1 GLN B 49 2.819 -6.380 4.813 1.00 0.00 O ATOM 1931 NE2 GLN B 49 4.808 -6.229 5.816 1.00 0.00 N ATOM 0 H GLN B 49 5.192 -8.927 0.727 1.00 0.00 H new ATOM 0 HA GLN B 49 5.539 -6.033 0.967 1.00 0.00 H new ATOM 0 HB2 GLN B 49 4.054 -7.741 2.401 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.554 -7.935 3.286 1.00 0.00 H new ATOM 0 HG2 GLN B 49 5.644 -5.436 3.581 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.075 -5.324 2.808 1.00 0.00 H new ATOM 0 HE21 GLN B 49 5.816 -6.103 5.719 1.00 0.00 H new ATOM 0 HE22 GLN B 49 4.396 -6.352 6.741 1.00 0.00 H new ATOM 1940 N LEU B 50 7.941 -5.940 1.503 1.00 0.00 N ATOM 1941 CA LEU B 50 9.376 -5.840 1.719 1.00 0.00 C ATOM 1942 C LEU B 50 9.671 -5.393 3.142 1.00 0.00 C ATOM 1943 O LEU B 50 9.400 -4.248 3.515 1.00 0.00 O ATOM 1944 CB LEU B 50 10.010 -4.854 0.728 1.00 0.00 C ATOM 1945 CG LEU B 50 10.153 -5.335 -0.723 1.00 0.00 C ATOM 1946 CD1 LEU B 50 8.800 -5.599 -1.364 1.00 0.00 C ATOM 1947 CD2 LEU B 50 10.925 -4.311 -1.533 1.00 0.00 C ATOM 0 H LEU B 50 7.500 -5.063 1.227 1.00 0.00 H new ATOM 0 HA LEU B 50 9.808 -6.828 1.558 1.00 0.00 H new ATOM 0 HB2 LEU B 50 9.414 -3.941 0.727 1.00 0.00 H new ATOM 0 HB3 LEU B 50 11.000 -4.588 1.098 1.00 0.00 H new ATOM 0 HG LEU B 50 10.701 -6.277 -0.711 1.00 0.00 H new ATOM 0 HD11 LEU B 50 8.943 -5.938 -2.390 1.00 0.00 H new ATOM 0 HD12 LEU B 50 8.273 -6.368 -0.798 1.00 0.00 H new ATOM 0 HD13 LEU B 50 8.212 -4.681 -1.364 1.00 0.00 H new ATOM 0 HD21 LEU B 50 11.023 -4.659 -2.561 1.00 0.00 H new ATOM 0 HD22 LEU B 50 10.392 -3.360 -1.521 1.00 0.00 H new ATOM 0 HD23 LEU B 50 11.916 -4.177 -1.100 1.00 0.00 H new ATOM 1959 N GLU B 51 10.220 -6.299 3.933 1.00 0.00 N ATOM 1960 CA GLU B 51 10.568 -5.993 5.307 1.00 0.00 C ATOM 1961 C GLU B 51 12.057 -5.694 5.428 1.00 0.00 C ATOM 1962 O GLU B 51 12.836 -5.957 4.513 1.00 0.00 O ATOM 1963 CB GLU B 51 10.184 -7.146 6.239 1.00 0.00 C ATOM 1964 CG GLU B 51 8.682 -7.367 6.360 1.00 0.00 C ATOM 1965 CD GLU B 51 7.948 -6.145 6.879 1.00 0.00 C ATOM 1966 OE1 GLU B 51 7.970 -5.899 8.109 1.00 0.00 O ATOM 1967 OE2 GLU B 51 7.352 -5.420 6.063 1.00 0.00 O ATOM 0 H GLU B 51 10.434 -7.254 3.645 1.00 0.00 H new ATOM 0 HA GLU B 51 10.007 -5.108 5.606 1.00 0.00 H new ATOM 0 HB2 GLU B 51 10.648 -8.063 5.877 1.00 0.00 H new ATOM 0 HB3 GLU B 51 10.594 -6.951 7.230 1.00 0.00 H new ATOM 0 HG2 GLU B 51 8.280 -7.640 5.384 1.00 0.00 H new ATOM 0 HG3 GLU B 51 8.496 -8.208 7.028 1.00 0.00 H new ATOM 1974 N ASP B 52 12.446 -5.168 6.577 1.00 0.00 N ATOM 1975 CA ASP B 52 13.825 -4.751 6.829 1.00 0.00 C ATOM 1976 C ASP B 52 14.733 -5.934 7.165 1.00 0.00 C ATOM 1977 O ASP B 52 15.813 -5.754 7.729 1.00 0.00 O ATOM 1978 CB ASP B 52 13.851 -3.747 7.981 1.00 0.00 C ATOM 1979 CG ASP B 52 13.041 -4.223 9.167 1.00 0.00 C ATOM 1980 OD1 ASP B 52 13.556 -5.031 9.971 1.00 0.00 O ATOM 1981 OD2 ASP B 52 11.870 -3.802 9.282 1.00 0.00 O ATOM 0 H ASP B 52 11.818 -5.016 7.366 1.00 0.00 H new ATOM 0 HA ASP B 52 14.203 -4.293 5.915 1.00 0.00 H new ATOM 0 HB2 ASP B 52 14.882 -3.578 8.291 1.00 0.00 H new ATOM 0 HB3 ASP B 52 13.460 -2.790 7.636 1.00 0.00 H new ATOM 1986 N GLY B 53 14.309 -7.134 6.797 1.00 0.00 N ATOM 1987 CA GLY B 53 15.076 -8.316 7.130 1.00 0.00 C ATOM 1988 C GLY B 53 15.736 -8.955 5.927 1.00 0.00 C ATOM 1989 O GLY B 53 16.422 -9.968 6.057 1.00 0.00 O ATOM 0 H GLY B 53 13.450 -7.310 6.275 1.00 0.00 H new ATOM 0 HA2 GLY B 53 15.842 -8.051 7.859 1.00 0.00 H new ATOM 0 HA3 GLY B 53 14.420 -9.045 7.607 1.00 0.00 H new ATOM 1993 N ARG B 54 15.540 -8.375 4.751 1.00 0.00 N ATOM 1994 CA ARG B 54 16.101 -8.940 3.531 1.00 0.00 C ATOM 1995 C ARG B 54 16.688 -7.851 2.640 1.00 0.00 C ATOM 1996 O ARG B 54 16.561 -6.659 2.933 1.00 0.00 O ATOM 1997 CB ARG B 54 15.037 -9.735 2.768 1.00 0.00 C ATOM 1998 CG ARG B 54 14.500 -10.929 3.540 1.00 0.00 C ATOM 1999 CD ARG B 54 13.535 -11.754 2.705 1.00 0.00 C ATOM 2000 NE ARG B 54 12.986 -12.873 3.466 1.00 0.00 N ATOM 2001 CZ ARG B 54 13.280 -14.150 3.230 1.00 0.00 C ATOM 2002 NH1 ARG B 54 14.140 -14.474 2.273 1.00 0.00 N ATOM 2003 NH2 ARG B 54 12.725 -15.110 3.958 1.00 0.00 N ATOM 0 H ARG B 54 15.001 -7.520 4.616 1.00 0.00 H new ATOM 0 HA ARG B 54 16.907 -9.617 3.815 1.00 0.00 H new ATOM 0 HB2 ARG B 54 14.209 -9.072 2.519 1.00 0.00 H new ATOM 0 HB3 ARG B 54 15.461 -10.083 1.826 1.00 0.00 H new ATOM 0 HG2 ARG B 54 15.331 -11.557 3.862 1.00 0.00 H new ATOM 0 HG3 ARG B 54 13.995 -10.582 4.441 1.00 0.00 H new ATOM 0 HD2 ARG B 54 12.722 -11.119 2.354 1.00 0.00 H new ATOM 0 HD3 ARG B 54 14.049 -12.132 1.821 1.00 0.00 H new ATOM 0 HE ARG B 54 12.338 -12.663 4.225 1.00 0.00 H new ATOM 0 HH11 ARG B 54 14.580 -13.743 1.714 1.00 0.00 H new ATOM 0 HH12 ARG B 54 14.361 -15.454 2.097 1.00 0.00 H new ATOM 0 HH21 ARG B 54 12.070 -14.871 4.702 1.00 0.00 H new ATOM 0 HH22 ARG B 54 12.953 -16.087 3.773 1.00 0.00 H new ATOM 2017 N THR B 55 17.331 -8.270 1.557 1.00 0.00 N ATOM 2018 CA THR B 55 17.968 -7.348 0.626 1.00 0.00 C ATOM 2019 C THR B 55 17.111 -7.168 -0.625 1.00 0.00 C ATOM 2020 O THR B 55 16.052 -7.787 -0.753 1.00 0.00 O ATOM 2021 CB THR B 55 19.361 -7.861 0.201 1.00 0.00 C ATOM 2022 OG1 THR B 55 19.238 -9.123 -0.471 1.00 0.00 O ATOM 2023 CG2 THR B 55 20.282 -8.012 1.404 1.00 0.00 C ATOM 0 H THR B 55 17.425 -9.253 1.301 1.00 0.00 H new ATOM 0 HA THR B 55 18.077 -6.393 1.140 1.00 0.00 H new ATOM 0 HB THR B 55 19.796 -7.127 -0.477 1.00 0.00 H new ATOM 0 HG1 THR B 55 18.877 -9.790 0.150 1.00 0.00 H new ATOM 0 HG21 THR B 55 21.255 -8.375 1.074 1.00 0.00 H new ATOM 0 HG22 THR B 55 20.402 -7.046 1.894 1.00 0.00 H new ATOM 0 HG23 THR B 55 19.849 -8.724 2.107 1.00 0.00 H new ATOM 2031 N LEU B 56 17.576 -6.334 -1.549 1.00 0.00 N ATOM 2032 CA LEU B 56 16.881 -6.145 -2.820 1.00 0.00 C ATOM 2033 C LEU B 56 16.920 -7.426 -3.646 1.00 0.00 C ATOM 2034 O LEU B 56 15.989 -7.721 -4.399 1.00 0.00 O ATOM 2035 CB LEU B 56 17.494 -4.997 -3.631 1.00 0.00 C ATOM 2036 CG LEU B 56 17.166 -3.580 -3.145 1.00 0.00 C ATOM 2037 CD1 LEU B 56 17.912 -3.248 -1.864 1.00 0.00 C ATOM 2038 CD2 LEU B 56 17.487 -2.568 -4.231 1.00 0.00 C ATOM 0 H LEU B 56 18.426 -5.780 -1.444 1.00 0.00 H new ATOM 0 HA LEU B 56 15.846 -5.891 -2.590 1.00 0.00 H new ATOM 0 HB2 LEU B 56 18.577 -5.118 -3.632 1.00 0.00 H new ATOM 0 HB3 LEU B 56 17.162 -5.091 -4.665 1.00 0.00 H new ATOM 0 HG LEU B 56 16.099 -3.534 -2.925 1.00 0.00 H new ATOM 0 HD11 LEU B 56 17.657 -2.237 -1.546 1.00 0.00 H new ATOM 0 HD12 LEU B 56 17.629 -3.955 -1.084 1.00 0.00 H new ATOM 0 HD13 LEU B 56 18.986 -3.313 -2.041 1.00 0.00 H new ATOM 0 HD21 LEU B 56 17.250 -1.565 -3.875 1.00 0.00 H new ATOM 0 HD22 LEU B 56 18.547 -2.624 -4.479 1.00 0.00 H new ATOM 0 HD23 LEU B 56 16.894 -2.787 -5.119 1.00 0.00 H new ATOM 2050 N SER B 57 17.995 -8.190 -3.485 1.00 0.00 N ATOM 2051 CA SER B 57 18.173 -9.427 -4.231 1.00 0.00 C ATOM 2052 C SER B 57 17.153 -10.475 -3.787 1.00 0.00 C ATOM 2053 O SER B 57 16.703 -11.294 -4.588 1.00 0.00 O ATOM 2054 CB SER B 57 19.599 -9.959 -4.045 1.00 0.00 C ATOM 2055 OG SER B 57 19.858 -11.047 -4.917 1.00 0.00 O ATOM 0 H SER B 57 18.757 -7.972 -2.843 1.00 0.00 H new ATOM 0 HA SER B 57 18.012 -9.218 -5.289 1.00 0.00 H new ATOM 0 HB2 SER B 57 20.316 -9.160 -4.234 1.00 0.00 H new ATOM 0 HB3 SER B 57 19.740 -10.276 -3.012 1.00 0.00 H new ATOM 0 HG SER B 57 20.774 -11.366 -4.779 1.00 0.00 H new ATOM 2061 N ASP B 58 16.772 -10.425 -2.511 1.00 0.00 N ATOM 2062 CA ASP B 58 15.798 -11.368 -1.960 1.00 0.00 C ATOM 2063 C ASP B 58 14.434 -11.186 -2.603 1.00 0.00 C ATOM 2064 O ASP B 58 13.714 -12.155 -2.845 1.00 0.00 O ATOM 2065 CB ASP B 58 15.654 -11.196 -0.445 1.00 0.00 C ATOM 2066 CG ASP B 58 16.863 -11.670 0.329 1.00 0.00 C ATOM 2067 OD1 ASP B 58 16.981 -12.886 0.568 1.00 0.00 O ATOM 2068 OD2 ASP B 58 17.693 -10.821 0.720 1.00 0.00 O ATOM 0 H ASP B 58 17.122 -9.742 -1.839 1.00 0.00 H new ATOM 0 HA ASP B 58 16.171 -12.369 -2.176 1.00 0.00 H new ATOM 0 HB2 ASP B 58 15.478 -10.144 -0.221 1.00 0.00 H new ATOM 0 HB3 ASP B 58 14.776 -11.746 -0.106 1.00 0.00 H new ATOM 2073 N TYR B 59 14.084 -9.942 -2.880 1.00 0.00 N ATOM 2074 CA TYR B 59 12.774 -9.626 -3.429 1.00 0.00 C ATOM 2075 C TYR B 59 12.823 -9.517 -4.951 1.00 0.00 C ATOM 2076 O TYR B 59 11.810 -9.223 -5.588 1.00 0.00 O ATOM 2077 CB TYR B 59 12.245 -8.329 -2.808 1.00 0.00 C ATOM 2078 CG TYR B 59 11.980 -8.437 -1.318 1.00 0.00 C ATOM 2079 CD1 TYR B 59 10.797 -8.989 -0.844 1.00 0.00 C ATOM 2080 CD2 TYR B 59 12.911 -7.991 -0.388 1.00 0.00 C ATOM 2081 CE1 TYR B 59 10.547 -9.091 0.512 1.00 0.00 C ATOM 2082 CE2 TYR B 59 12.668 -8.090 0.970 1.00 0.00 C ATOM 2083 CZ TYR B 59 11.485 -8.643 1.414 1.00 0.00 C ATOM 2084 OH TYR B 59 11.237 -8.741 2.767 1.00 0.00 O ATOM 0 H TYR B 59 14.688 -9.133 -2.734 1.00 0.00 H new ATOM 0 HA TYR B 59 12.092 -10.439 -3.180 1.00 0.00 H new ATOM 0 HB2 TYR B 59 12.966 -7.531 -2.984 1.00 0.00 H new ATOM 0 HB3 TYR B 59 11.323 -8.043 -3.313 1.00 0.00 H new ATOM 0 HD1 TYR B 59 10.059 -9.345 -1.547 1.00 0.00 H new ATOM 0 HD2 TYR B 59 13.840 -7.560 -0.731 1.00 0.00 H new ATOM 0 HE1 TYR B 59 9.620 -9.520 0.862 1.00 0.00 H new ATOM 0 HE2 TYR B 59 13.401 -7.736 1.680 1.00 0.00 H new ATOM 0 HH TYR B 59 12.000 -8.381 3.266 1.00 0.00 H new ATOM 2094 N ASN B 60 14.008 -9.763 -5.522 1.00 0.00 N ATOM 2095 CA ASN B 60 14.196 -9.756 -6.977 1.00 0.00 C ATOM 2096 C ASN B 60 13.794 -8.413 -7.581 1.00 0.00 C ATOM 2097 O ASN B 60 13.207 -8.353 -8.662 1.00 0.00 O ATOM 2098 CB ASN B 60 13.395 -10.894 -7.627 1.00 0.00 C ATOM 2099 CG ASN B 60 13.989 -12.264 -7.343 1.00 0.00 C ATOM 2100 OD1 ASN B 60 13.679 -12.896 -6.332 1.00 0.00 O ATOM 2101 ND2 ASN B 60 14.832 -12.742 -8.243 1.00 0.00 N ATOM 0 H ASN B 60 14.856 -9.971 -4.994 1.00 0.00 H new ATOM 0 HA ASN B 60 15.256 -9.912 -7.178 1.00 0.00 H new ATOM 0 HB2 ASN B 60 12.368 -10.865 -7.262 1.00 0.00 H new ATOM 0 HB3 ASN B 60 13.355 -10.736 -8.705 1.00 0.00 H new ATOM 0 HD21 ASN B 60 15.249 -13.663 -8.112 1.00 0.00 H new ATOM 0 HD22 ASN B 60 15.065 -12.189 -9.068 1.00 0.00 H new ATOM 2108 N ILE B 61 14.145 -7.339 -6.888 1.00 0.00 N ATOM 2109 CA ILE B 61 13.783 -5.994 -7.314 1.00 0.00 C ATOM 2110 C ILE B 61 14.546 -5.589 -8.573 1.00 0.00 C ATOM 2111 O ILE B 61 15.776 -5.637 -8.611 1.00 0.00 O ATOM 2112 CB ILE B 61 14.050 -4.969 -6.190 1.00 0.00 C ATOM 2113 CG1 ILE B 61 13.235 -5.335 -4.950 1.00 0.00 C ATOM 2114 CG2 ILE B 61 13.716 -3.555 -6.652 1.00 0.00 C ATOM 2115 CD1 ILE B 61 13.537 -4.472 -3.748 1.00 0.00 C ATOM 0 H ILE B 61 14.684 -7.374 -6.023 1.00 0.00 H new ATOM 0 HA ILE B 61 12.717 -6.000 -7.540 1.00 0.00 H new ATOM 0 HB ILE B 61 15.110 -4.997 -5.939 1.00 0.00 H new ATOM 0 HG12 ILE B 61 12.174 -5.254 -5.187 1.00 0.00 H new ATOM 0 HG13 ILE B 61 13.426 -6.377 -4.695 1.00 0.00 H new ATOM 0 HG21 ILE B 61 13.912 -2.852 -5.843 1.00 0.00 H new ATOM 0 HG22 ILE B 61 14.333 -3.298 -7.513 1.00 0.00 H new ATOM 0 HG23 ILE B 61 12.664 -3.502 -6.931 1.00 0.00 H new ATOM 0 HD11 ILE B 61 12.921 -4.791 -2.907 1.00 0.00 H new ATOM 0 HD12 ILE B 61 14.590 -4.571 -3.484 1.00 0.00 H new ATOM 0 HD13 ILE B 61 13.318 -3.431 -3.984 1.00 0.00 H new ATOM 2127 N GLN B 62 13.802 -5.205 -9.605 1.00 0.00 N ATOM 2128 CA GLN B 62 14.396 -4.775 -10.865 1.00 0.00 C ATOM 2129 C GLN B 62 14.799 -3.307 -10.798 1.00 0.00 C ATOM 2130 O GLN B 62 14.375 -2.577 -9.901 1.00 0.00 O ATOM 2131 CB GLN B 62 13.408 -4.969 -12.017 1.00 0.00 C ATOM 2132 CG GLN B 62 12.951 -6.404 -12.217 1.00 0.00 C ATOM 2133 CD GLN B 62 11.969 -6.538 -13.366 1.00 0.00 C ATOM 2134 OE1 GLN B 62 11.097 -7.405 -13.355 1.00 0.00 O ATOM 2135 NE2 GLN B 62 12.104 -5.683 -14.371 1.00 0.00 N ATOM 0 H GLN B 62 12.782 -5.183 -9.593 1.00 0.00 H new ATOM 0 HA GLN B 62 15.283 -5.384 -11.040 1.00 0.00 H new ATOM 0 HB2 GLN B 62 12.533 -4.344 -11.839 1.00 0.00 H new ATOM 0 HB3 GLN B 62 13.870 -4.616 -12.939 1.00 0.00 H new ATOM 0 HG2 GLN B 62 13.818 -7.037 -12.407 1.00 0.00 H new ATOM 0 HG3 GLN B 62 12.486 -6.767 -11.300 1.00 0.00 H new ATOM 0 HE21 GLN B 62 12.840 -4.977 -14.345 1.00 0.00 H new ATOM 0 HE22 GLN B 62 11.472 -5.731 -15.170 1.00 0.00 H new ATOM 2144 N LYS B 63 15.603 -2.875 -11.760 1.00 0.00 N ATOM 2145 CA LYS B 63 16.025 -1.484 -11.830 1.00 0.00 C ATOM 2146 C LYS B 63 14.885 -0.612 -12.330 1.00 0.00 C ATOM 2147 O LYS B 63 14.117 -1.030 -13.200 1.00 0.00 O ATOM 2148 CB LYS B 63 17.226 -1.319 -12.763 1.00 0.00 C ATOM 2149 CG LYS B 63 18.382 -2.250 -12.454 1.00 0.00 C ATOM 2150 CD LYS B 63 19.599 -1.913 -13.299 1.00 0.00 C ATOM 2151 CE LYS B 63 20.631 -3.031 -13.277 1.00 0.00 C ATOM 2152 NZ LYS B 63 20.124 -4.265 -13.936 1.00 0.00 N ATOM 0 H LYS B 63 15.975 -3.468 -12.502 1.00 0.00 H new ATOM 0 HA LYS B 63 16.313 -1.175 -10.825 1.00 0.00 H new ATOM 0 HB2 LYS B 63 16.901 -1.489 -13.790 1.00 0.00 H new ATOM 0 HB3 LYS B 63 17.578 -0.289 -12.706 1.00 0.00 H new ATOM 0 HG2 LYS B 63 18.638 -2.178 -11.397 1.00 0.00 H new ATOM 0 HG3 LYS B 63 18.082 -3.281 -12.639 1.00 0.00 H new ATOM 0 HD2 LYS B 63 19.287 -1.727 -14.327 1.00 0.00 H new ATOM 0 HD3 LYS B 63 20.053 -0.993 -12.932 1.00 0.00 H new ATOM 0 HE2 LYS B 63 21.539 -2.697 -13.780 1.00 0.00 H new ATOM 0 HE3 LYS B 63 20.902 -3.255 -12.245 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 20.927 -4.861 -14.221 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 19.521 -4.791 -13.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 19.569 -4.007 -14.777 1.00 0.00 H new ATOM 2166 N GLU B 64 14.783 0.589 -11.769 1.00 0.00 N ATOM 2167 CA GLU B 64 13.806 1.585 -12.203 1.00 0.00 C ATOM 2168 C GLU B 64 12.382 1.084 -12.001 1.00 0.00 C ATOM 2169 O GLU B 64 11.466 1.452 -12.736 1.00 0.00 O ATOM 2170 CB GLU B 64 14.051 1.959 -13.666 1.00 0.00 C ATOM 2171 CG GLU B 64 15.494 2.355 -13.948 1.00 0.00 C ATOM 2172 CD GLU B 64 15.698 2.835 -15.368 1.00 0.00 C ATOM 2173 OE1 GLU B 64 15.621 2.003 -16.298 1.00 0.00 O ATOM 2174 OE2 GLU B 64 15.941 4.041 -15.564 1.00 0.00 O ATOM 0 H GLU B 64 15.376 0.901 -11.000 1.00 0.00 H new ATOM 0 HA GLU B 64 13.930 2.477 -11.590 1.00 0.00 H new ATOM 0 HB2 GLU B 64 13.782 1.115 -14.301 1.00 0.00 H new ATOM 0 HB3 GLU B 64 13.394 2.785 -13.939 1.00 0.00 H new ATOM 0 HG2 GLU B 64 15.793 3.142 -13.256 1.00 0.00 H new ATOM 0 HG3 GLU B 64 16.145 1.501 -13.760 1.00 0.00 H new ATOM 2181 N SER B 65 12.208 0.258 -10.981 1.00 0.00 N ATOM 2182 CA SER B 65 10.906 -0.291 -10.645 1.00 0.00 C ATOM 2183 C SER B 65 10.134 0.668 -9.740 1.00 0.00 C ATOM 2184 O SER B 65 10.735 1.495 -9.050 1.00 0.00 O ATOM 2185 CB SER B 65 11.096 -1.648 -9.963 1.00 0.00 C ATOM 2186 OG SER B 65 12.060 -1.566 -8.926 1.00 0.00 O ATOM 0 H SER B 65 12.962 -0.049 -10.366 1.00 0.00 H new ATOM 0 HA SER B 65 10.324 -0.426 -11.556 1.00 0.00 H new ATOM 0 HB2 SER B 65 10.145 -1.990 -9.554 1.00 0.00 H new ATOM 0 HB3 SER B 65 11.411 -2.388 -10.699 1.00 0.00 H new ATOM 0 HG SER B 65 12.939 -1.821 -9.276 1.00 0.00 H new ATOM 2192 N THR B 66 8.809 0.570 -9.754 1.00 0.00 N ATOM 2193 CA THR B 66 7.980 1.417 -8.913 1.00 0.00 C ATOM 2194 C THR B 66 7.497 0.655 -7.679 1.00 0.00 C ATOM 2195 O THR B 66 6.592 -0.178 -7.756 1.00 0.00 O ATOM 2196 CB THR B 66 6.766 1.966 -9.690 1.00 0.00 C ATOM 2197 OG1 THR B 66 7.210 2.624 -10.886 1.00 0.00 O ATOM 2198 CG2 THR B 66 5.969 2.946 -8.838 1.00 0.00 C ATOM 0 H THR B 66 8.290 -0.086 -10.337 1.00 0.00 H new ATOM 0 HA THR B 66 8.597 2.257 -8.594 1.00 0.00 H new ATOM 0 HB THR B 66 6.121 1.127 -9.949 1.00 0.00 H new ATOM 0 HG1 THR B 66 6.435 2.969 -11.376 1.00 0.00 H new ATOM 0 HG21 THR B 66 5.119 3.318 -9.410 1.00 0.00 H new ATOM 0 HG22 THR B 66 5.610 2.440 -7.942 1.00 0.00 H new ATOM 0 HG23 THR B 66 6.607 3.782 -8.552 1.00 0.00 H new ATOM 2206 N LEU B 67 8.118 0.941 -6.546 1.00 0.00 N ATOM 2207 CA LEU B 67 7.746 0.313 -5.289 1.00 0.00 C ATOM 2208 C LEU B 67 6.746 1.193 -4.559 1.00 0.00 C ATOM 2209 O LEU B 67 6.824 2.413 -4.635 1.00 0.00 O ATOM 2210 CB LEU B 67 8.977 0.074 -4.400 1.00 0.00 C ATOM 2211 CG LEU B 67 9.982 -0.970 -4.907 1.00 0.00 C ATOM 2212 CD1 LEU B 67 10.783 -0.440 -6.088 1.00 0.00 C ATOM 2213 CD2 LEU B 67 10.914 -1.394 -3.785 1.00 0.00 C ATOM 0 H LEU B 67 8.886 1.608 -6.472 1.00 0.00 H new ATOM 0 HA LEU B 67 7.295 -0.655 -5.509 1.00 0.00 H new ATOM 0 HB2 LEU B 67 9.500 1.022 -4.276 1.00 0.00 H new ATOM 0 HB3 LEU B 67 8.633 -0.232 -3.412 1.00 0.00 H new ATOM 0 HG LEU B 67 9.419 -1.839 -5.247 1.00 0.00 H new ATOM 0 HD11 LEU B 67 11.485 -1.203 -6.423 1.00 0.00 H new ATOM 0 HD12 LEU B 67 10.105 -0.187 -6.903 1.00 0.00 H new ATOM 0 HD13 LEU B 67 11.333 0.451 -5.784 1.00 0.00 H new ATOM 0 HD21 LEU B 67 11.621 -2.134 -4.159 1.00 0.00 H new ATOM 0 HD22 LEU B 67 11.460 -0.525 -3.417 1.00 0.00 H new ATOM 0 HD23 LEU B 67 10.331 -1.827 -2.972 1.00 0.00 H new ATOM 2225 N HIS B 68 5.798 0.578 -3.876 1.00 0.00 N ATOM 2226 CA HIS B 68 4.802 1.328 -3.122 1.00 0.00 C ATOM 2227 C HIS B 68 5.193 1.405 -1.656 1.00 0.00 C ATOM 2228 O HIS B 68 5.440 0.382 -1.023 1.00 0.00 O ATOM 2229 CB HIS B 68 3.422 0.683 -3.264 1.00 0.00 C ATOM 2230 CG HIS B 68 2.825 0.837 -4.624 1.00 0.00 C ATOM 2231 ND1 HIS B 68 1.760 1.663 -4.884 1.00 0.00 N ATOM 2232 CD2 HIS B 68 3.149 0.262 -5.804 1.00 0.00 C ATOM 2233 CE1 HIS B 68 1.452 1.595 -6.164 1.00 0.00 C ATOM 2234 NE2 HIS B 68 2.281 0.752 -6.749 1.00 0.00 N ATOM 0 H HIS B 68 5.694 -0.435 -3.826 1.00 0.00 H new ATOM 0 HA HIS B 68 4.758 2.339 -3.527 1.00 0.00 H new ATOM 0 HB2 HIS B 68 3.501 -0.379 -3.030 1.00 0.00 H new ATOM 0 HB3 HIS B 68 2.748 1.123 -2.529 1.00 0.00 H new ATOM 0 HD1 HIS B 68 1.281 2.240 -4.193 1.00 0.00 H new ATOM 0 HD2 HIS B 68 3.943 -0.450 -5.972 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.656 2.138 -6.651 1.00 0.00 H new ATOM 2243 N LEU B 69 5.266 2.615 -1.126 1.00 0.00 N ATOM 2244 CA LEU B 69 5.610 2.807 0.272 1.00 0.00 C ATOM 2245 C LEU B 69 4.351 3.054 1.100 1.00 0.00 C ATOM 2246 O LEU B 69 3.703 4.098 0.979 1.00 0.00 O ATOM 2247 CB LEU B 69 6.588 3.976 0.436 1.00 0.00 C ATOM 2248 CG LEU B 69 7.126 4.180 1.854 1.00 0.00 C ATOM 2249 CD1 LEU B 69 7.915 2.962 2.308 1.00 0.00 C ATOM 2250 CD2 LEU B 69 7.993 5.429 1.922 1.00 0.00 C ATOM 0 H LEU B 69 5.092 3.477 -1.642 1.00 0.00 H new ATOM 0 HA LEU B 69 6.095 1.899 0.631 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.431 3.821 -0.237 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.091 4.892 0.118 1.00 0.00 H new ATOM 0 HG LEU B 69 6.278 4.311 2.526 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.289 3.127 3.318 1.00 0.00 H new ATOM 0 HD12 LEU B 69 7.268 2.085 2.299 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.755 2.800 1.632 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.367 5.558 2.938 1.00 0.00 H new ATOM 0 HD22 LEU B 69 8.834 5.326 1.236 1.00 0.00 H new ATOM 0 HD23 LEU B 69 7.400 6.299 1.640 1.00 0.00 H new ATOM 2262 N VAL B 70 4.007 2.081 1.923 1.00 0.00 N ATOM 2263 CA VAL B 70 2.834 2.165 2.776 1.00 0.00 C ATOM 2264 C VAL B 70 3.264 2.270 4.231 1.00 0.00 C ATOM 2265 O VAL B 70 4.173 1.571 4.667 1.00 0.00 O ATOM 2266 CB VAL B 70 1.923 0.931 2.598 1.00 0.00 C ATOM 2267 CG1 VAL B 70 0.643 1.079 3.402 1.00 0.00 C ATOM 2268 CG2 VAL B 70 1.607 0.706 1.128 1.00 0.00 C ATOM 0 H VAL B 70 4.531 1.211 2.020 1.00 0.00 H new ATOM 0 HA VAL B 70 2.270 3.053 2.489 1.00 0.00 H new ATOM 0 HB VAL B 70 2.459 0.059 2.973 1.00 0.00 H new ATOM 0 HG11 VAL B 70 0.019 0.197 3.259 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.887 1.183 4.459 1.00 0.00 H new ATOM 0 HG13 VAL B 70 0.102 1.964 3.066 1.00 0.00 H new ATOM 0 HG21 VAL B 70 0.964 -0.168 1.024 1.00 0.00 H new ATOM 0 HG22 VAL B 70 1.097 1.582 0.727 1.00 0.00 H new ATOM 0 HG23 VAL B 70 2.533 0.543 0.578 1.00 0.00 H new ATOM 2278 N LEU B 71 2.626 3.155 4.972 1.00 0.00 N ATOM 2279 CA LEU B 71 2.972 3.359 6.367 1.00 0.00 C ATOM 2280 C LEU B 71 2.257 2.350 7.262 1.00 0.00 C ATOM 2281 O LEU B 71 1.114 1.985 7.006 1.00 0.00 O ATOM 2282 CB LEU B 71 2.633 4.785 6.804 1.00 0.00 C ATOM 2283 CG LEU B 71 3.515 5.881 6.197 1.00 0.00 C ATOM 2284 CD1 LEU B 71 3.132 6.169 4.753 1.00 0.00 C ATOM 2285 CD2 LEU B 71 3.436 7.137 7.040 1.00 0.00 C ATOM 0 H LEU B 71 1.866 3.744 4.633 1.00 0.00 H new ATOM 0 HA LEU B 71 4.047 3.208 6.470 1.00 0.00 H new ATOM 0 HB2 LEU B 71 1.595 4.991 6.543 1.00 0.00 H new ATOM 0 HB3 LEU B 71 2.706 4.842 7.890 1.00 0.00 H new ATOM 0 HG LEU B 71 4.545 5.526 6.193 1.00 0.00 H new ATOM 0 HD11 LEU B 71 3.778 6.951 4.354 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.249 5.263 4.158 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.094 6.499 4.711 1.00 0.00 H new ATOM 0 HD21 LEU B 71 4.066 7.910 6.601 1.00 0.00 H new ATOM 0 HD22 LEU B 71 2.404 7.487 7.076 1.00 0.00 H new ATOM 0 HD23 LEU B 71 3.781 6.919 8.051 1.00 0.00 H new ATOM 2297 N ARG B 72 2.949 1.898 8.301 1.00 0.00 N ATOM 2298 CA ARG B 72 2.364 0.996 9.294 1.00 0.00 C ATOM 2299 C ARG B 72 1.577 1.804 10.328 1.00 0.00 C ATOM 2300 O ARG B 72 0.937 1.248 11.221 1.00 0.00 O ATOM 2301 CB ARG B 72 3.471 0.162 9.963 1.00 0.00 C ATOM 2302 CG ARG B 72 2.966 -0.847 10.990 1.00 0.00 C ATOM 2303 CD ARG B 72 4.079 -1.767 11.478 1.00 0.00 C ATOM 2304 NE ARG B 72 4.328 -2.877 10.550 1.00 0.00 N ATOM 2305 CZ ARG B 72 5.543 -3.345 10.245 1.00 0.00 C ATOM 2306 NH1 ARG B 72 6.626 -2.792 10.781 1.00 0.00 N ATOM 2307 NH2 ARG B 72 5.669 -4.375 9.411 1.00 0.00 N ATOM 0 H ARG B 72 3.923 2.142 8.481 1.00 0.00 H new ATOM 0 HA ARG B 72 1.675 0.310 8.802 1.00 0.00 H new ATOM 0 HB2 ARG B 72 4.025 -0.371 9.190 1.00 0.00 H new ATOM 0 HB3 ARG B 72 4.174 0.838 10.451 1.00 0.00 H new ATOM 0 HG2 ARG B 72 2.535 -0.316 11.839 1.00 0.00 H new ATOM 0 HG3 ARG B 72 2.168 -1.445 10.550 1.00 0.00 H new ATOM 0 HD2 ARG B 72 4.995 -1.190 11.606 1.00 0.00 H new ATOM 0 HD3 ARG B 72 3.815 -2.167 12.457 1.00 0.00 H new ATOM 0 HE ARG B 72 3.522 -3.320 10.109 1.00 0.00 H new ATOM 0 HH11 ARG B 72 6.532 -2.008 11.427 1.00 0.00 H new ATOM 0 HH12 ARG B 72 7.551 -3.151 10.546 1.00 0.00 H new ATOM 0 HH21 ARG B 72 4.839 -4.807 9.005 1.00 0.00 H new ATOM 0 HH22 ARG B 72 6.596 -4.732 9.178 1.00 0.00 H new ATOM 2321 N LEU B 73 1.629 3.125 10.167 1.00 0.00 N ATOM 2322 CA LEU B 73 0.916 4.063 11.025 1.00 0.00 C ATOM 2323 C LEU B 73 1.399 3.993 12.468 1.00 0.00 C ATOM 2324 O LEU B 73 0.842 3.265 13.291 1.00 0.00 O ATOM 2325 CB LEU B 73 -0.600 3.832 10.965 1.00 0.00 C ATOM 2326 CG LEU B 73 -1.253 4.089 9.607 1.00 0.00 C ATOM 2327 CD1 LEU B 73 -2.753 3.849 9.691 1.00 0.00 C ATOM 2328 CD2 LEU B 73 -0.963 5.507 9.133 1.00 0.00 C ATOM 0 H LEU B 73 2.172 3.576 9.431 1.00 0.00 H new ATOM 0 HA LEU B 73 1.132 5.062 10.645 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -0.805 2.802 11.258 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -1.077 4.474 11.705 1.00 0.00 H new ATOM 0 HG LEU B 73 -0.830 3.394 8.881 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -3.206 4.035 8.717 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -2.940 2.817 9.987 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -3.188 4.523 10.429 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -1.436 5.671 8.165 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -1.359 6.220 9.856 1.00 0.00 H new ATOM 0 HD23 LEU B 73 0.114 5.646 9.039 1.00 0.00 H new