USER MOD reduce.3.24.130724 H: found=0, std=0, add=1066, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1061 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 134 HIS : no HD1:sc= 0 X(o=1.2,f=1.2) USER MOD Set 1.2: A 137 THR OG1 : rot -48:sc= 1.23 USER MOD Set 2.1: A 112 MET CE :methyl -168:sc= -0.943 (180deg=-1.33!) USER MOD Set 2.2: A 135 MET CE :methyl -111:sc= -0.908 (180deg=-3.01!) USER MOD Set 3.1: A 85 THR OG1 : rot -141:sc= 0.971 USER MOD Set 3.2: A 98 GLN : amide:sc= -3.8! C(o=-2.8!,f=-7.4!) USER MOD Set 4.1: A 66 SER OG : rot 142:sc= 0.551 USER MOD Set 4.2: A 69 SER OG : rot -157:sc= 0.00631 USER MOD Set 5.1: A 47 THR OG1 : rot 126:sc= 1.23 USER MOD Set 5.2: A 61 GLN : amide:sc= -5.5! K(o=-4.3!,f=-2.9) USER MOD Set 6.1: A 29 LYS NZ :NH3+ 168:sc= 1.28 (180deg=0) USER MOD Set 6.2: A 43 TYR OH : rot -123:sc= 2.3 USER MOD Single : A 10 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 12 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 14 GLN : amide:sc= -2.7 X(o=-2.7,f=-2.4!) USER MOD Single : A 17 LYS NZ :NH3+ 168:sc= -0.0223 (180deg=-0.195) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.0844 X(o=-0.084,f=-0.25) USER MOD Single : A 30 HIS : no HD1:sc= -0.0766 X(o=-0.077,f=-0.077) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl 180:sc= -0.394 (180deg=-0.394) USER MOD Single : A 51 GLN : amide:sc= -1.6 K(o=-1.6,f=-0.51) USER MOD Single : A 52 LYS NZ :NH3+ -106:sc= -0.485 (180deg=-2.4!) USER MOD Single : A 53 LYS NZ :NH3+ -172:sc=-0.00194 (180deg=-0.0728) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0931) USER MOD Single : A 62 MET CE :methyl 163:sc= -1.62 (180deg=-2.85) USER MOD Single : A 70 LYS NZ :NH3+ -155:sc= 1.29 (180deg=0.425) USER MOD Single : A 72 ASN : amide:sc= -2.09! C(o=-2.1!,f=-8.1!) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 120:sc= -0.446! USER MOD Single : A 87 HIS : no HD1:sc= -0.0324 X(o=-0.032,f=-0.18) USER MOD Single : A 94 SER OG : rot 180:sc= 0.0134 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -0.454 X(o=-0.45,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=-0.087) USER MOD Single : A 113 GLN : amide:sc= -0.333 K(o=-0.33,f=-0.85) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= -0.124 K(o=-0.12,f=-4.1!) USER MOD Single : A 118 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0072) USER MOD Single : A 124 THR OG1 : rot 79:sc= 0.85 USER MOD Single : A 125 LYS NZ :NH3+ -138:sc= 1.3 (180deg=-0.548!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 TYR OH : rot -143:sc= -0.256 USER MOD Single : A 139 SER OG : rot -32:sc= 0.579 USER MOD ----------------------------------------------------------------- ATOM 97 N GLU A 7 36.239 -0.624 1.257 1.00 0.00 N ATOM 98 CA GLU A 7 35.301 -1.536 1.885 1.00 0.00 C ATOM 99 C GLU A 7 33.901 -1.374 1.304 1.00 0.00 C ATOM 100 O GLU A 7 33.566 -0.321 0.746 1.00 0.00 O ATOM 101 CB GLU A 7 35.204 -1.207 3.370 1.00 0.00 C ATOM 102 CG GLU A 7 36.478 -1.342 4.161 1.00 0.00 C ATOM 103 CD GLU A 7 36.257 -0.929 5.585 1.00 0.00 C ATOM 104 OE1 GLU A 7 35.659 -1.714 6.362 1.00 0.00 O ATOM 105 OE2 GLU A 7 36.646 0.199 5.958 1.00 0.00 O ATOM 0 HA GLU A 7 35.659 -2.551 1.714 1.00 0.00 H new ATOM 0 HB2 GLU A 7 34.843 -0.184 3.472 1.00 0.00 H new ATOM 0 HB3 GLU A 7 34.452 -1.857 3.817 1.00 0.00 H new ATOM 0 HG2 GLU A 7 36.828 -2.374 4.125 1.00 0.00 H new ATOM 0 HG3 GLU A 7 37.258 -0.725 3.714 1.00 0.00 H new ATOM 112 N PRO A 8 33.058 -2.402 1.414 1.00 0.00 N ATOM 113 CA PRO A 8 31.684 -2.279 1.038 1.00 0.00 C ATOM 114 C PRO A 8 30.893 -1.545 2.109 1.00 0.00 C ATOM 115 O PRO A 8 31.376 -1.321 3.241 1.00 0.00 O ATOM 116 CB PRO A 8 31.197 -3.702 0.925 1.00 0.00 C ATOM 117 CG PRO A 8 32.053 -4.468 1.863 1.00 0.00 C ATOM 118 CD PRO A 8 33.385 -3.768 1.880 1.00 0.00 C ATOM 0 HA PRO A 8 31.562 -1.713 0.114 1.00 0.00 H new ATOM 0 HB2 PRO A 8 30.144 -3.783 1.194 1.00 0.00 H new ATOM 0 HB3 PRO A 8 31.295 -4.074 -0.095 1.00 0.00 H new ATOM 0 HG2 PRO A 8 31.613 -4.493 2.860 1.00 0.00 H new ATOM 0 HG3 PRO A 8 32.161 -5.502 1.536 1.00 0.00 H new ATOM 0 HD2 PRO A 8 33.822 -3.759 2.879 1.00 0.00 H new ATOM 0 HD3 PRO A 8 34.104 -4.256 1.222 1.00 0.00 H new ATOM 126 N LEU A 9 29.689 -1.229 1.780 1.00 0.00 N ATOM 127 CA LEU A 9 28.854 -0.448 2.641 1.00 0.00 C ATOM 128 C LEU A 9 27.727 -1.316 3.121 1.00 0.00 C ATOM 129 O LEU A 9 26.973 -1.833 2.313 1.00 0.00 O ATOM 130 CB LEU A 9 28.286 0.753 1.853 1.00 0.00 C ATOM 131 CG LEU A 9 28.037 2.076 2.637 1.00 0.00 C ATOM 132 CD1 LEU A 9 26.950 1.922 3.693 1.00 0.00 C ATOM 133 CD2 LEU A 9 29.331 2.569 3.282 1.00 0.00 C ATOM 0 H LEU A 9 29.248 -1.504 0.902 1.00 0.00 H new ATOM 0 HA LEU A 9 29.428 -0.077 3.490 1.00 0.00 H new ATOM 0 HB2 LEU A 9 28.971 0.972 1.034 1.00 0.00 H new ATOM 0 HB3 LEU A 9 27.341 0.445 1.405 1.00 0.00 H new ATOM 0 HG LEU A 9 27.691 2.816 1.915 1.00 0.00 H new ATOM 0 HD11 LEU A 9 26.812 2.870 4.214 1.00 0.00 H new ATOM 0 HD12 LEU A 9 26.015 1.632 3.213 1.00 0.00 H new ATOM 0 HD13 LEU A 9 27.244 1.154 4.409 1.00 0.00 H new ATOM 0 HD21 LEU A 9 29.137 3.494 3.825 1.00 0.00 H new ATOM 0 HD22 LEU A 9 29.704 1.813 3.974 1.00 0.00 H new ATOM 0 HD23 LEU A 9 30.077 2.752 2.508 1.00 0.00 H new ATOM 145 N GLN A 10 27.654 -1.521 4.409 1.00 0.00 N ATOM 146 CA GLN A 10 26.568 -2.259 5.007 1.00 0.00 C ATOM 147 C GLN A 10 25.304 -1.423 5.032 1.00 0.00 C ATOM 148 O GLN A 10 25.145 -0.514 5.857 1.00 0.00 O ATOM 149 CB GLN A 10 26.925 -2.731 6.403 1.00 0.00 C ATOM 150 CG GLN A 10 27.826 -3.931 6.447 1.00 0.00 C ATOM 151 CD GLN A 10 28.167 -4.343 7.858 1.00 0.00 C ATOM 152 OE1 GLN A 10 28.269 -3.504 8.759 1.00 0.00 O ATOM 153 NE2 GLN A 10 28.300 -5.620 8.076 1.00 0.00 N ATOM 0 H GLN A 10 28.346 -1.181 5.077 1.00 0.00 H new ATOM 0 HA GLN A 10 26.387 -3.142 4.393 1.00 0.00 H new ATOM 0 HB2 GLN A 10 27.407 -1.912 6.937 1.00 0.00 H new ATOM 0 HB3 GLN A 10 26.005 -2.964 6.940 1.00 0.00 H new ATOM 0 HG2 GLN A 10 27.343 -4.763 5.935 1.00 0.00 H new ATOM 0 HG3 GLN A 10 28.745 -3.712 5.903 1.00 0.00 H new ATOM 0 HE21 GLN A 10 28.209 -6.281 7.305 1.00 0.00 H new ATOM 0 HE22 GLN A 10 28.496 -5.959 9.018 1.00 0.00 H new ATOM 162 N VAL A 11 24.444 -1.707 4.113 1.00 0.00 N ATOM 163 CA VAL A 11 23.204 -1.015 3.957 1.00 0.00 C ATOM 164 C VAL A 11 22.087 -1.896 4.467 1.00 0.00 C ATOM 165 O VAL A 11 22.078 -3.095 4.217 1.00 0.00 O ATOM 166 CB VAL A 11 22.919 -0.723 2.462 1.00 0.00 C ATOM 167 CG1 VAL A 11 21.701 0.158 2.290 1.00 0.00 C ATOM 168 CG2 VAL A 11 24.121 -0.128 1.769 1.00 0.00 C ATOM 0 H VAL A 11 24.586 -2.449 3.428 1.00 0.00 H new ATOM 0 HA VAL A 11 23.263 -0.077 4.510 1.00 0.00 H new ATOM 0 HB VAL A 11 22.706 -1.680 1.986 1.00 0.00 H new ATOM 0 HG11 VAL A 11 21.532 0.342 1.229 1.00 0.00 H new ATOM 0 HG12 VAL A 11 20.829 -0.339 2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 11 21.863 1.107 2.801 1.00 0.00 H new ATOM 0 HG21 VAL A 11 23.881 0.062 0.723 1.00 0.00 H new ATOM 0 HG22 VAL A 11 24.394 0.809 2.255 1.00 0.00 H new ATOM 0 HG23 VAL A 11 24.957 -0.825 1.828 1.00 0.00 H new ATOM 178 N HIS A 12 21.212 -1.342 5.222 1.00 0.00 N ATOM 179 CA HIS A 12 20.034 -2.037 5.639 1.00 0.00 C ATOM 180 C HIS A 12 18.871 -1.413 4.918 1.00 0.00 C ATOM 181 O HIS A 12 18.506 -0.268 5.174 1.00 0.00 O ATOM 182 CB HIS A 12 19.845 -1.979 7.161 1.00 0.00 C ATOM 183 CG HIS A 12 20.953 -2.633 7.945 1.00 0.00 C ATOM 184 ND1 HIS A 12 20.854 -3.871 8.542 1.00 0.00 N ATOM 185 CD2 HIS A 12 22.201 -2.186 8.227 1.00 0.00 C ATOM 186 CE1 HIS A 12 22.011 -4.133 9.154 1.00 0.00 C ATOM 187 NE2 HIS A 12 22.868 -3.139 8.990 1.00 0.00 N ATOM 0 H HIS A 12 21.286 -0.388 5.575 1.00 0.00 H new ATOM 0 HA HIS A 12 20.116 -3.095 5.390 1.00 0.00 H new ATOM 0 HB2 HIS A 12 19.765 -0.936 7.467 1.00 0.00 H new ATOM 0 HB3 HIS A 12 18.901 -2.459 7.417 1.00 0.00 H new ATOM 0 HD2 HIS A 12 22.613 -1.239 7.909 1.00 0.00 H new ATOM 0 HE1 HIS A 12 22.219 -5.036 9.709 1.00 0.00 H new ATOM 0 HE2 HIS A 12 23.821 -3.083 9.349 1.00 0.00 H new ATOM 195 N VAL A 13 18.341 -2.120 3.978 1.00 0.00 N ATOM 196 CA VAL A 13 17.279 -1.618 3.173 1.00 0.00 C ATOM 197 C VAL A 13 15.959 -2.077 3.699 1.00 0.00 C ATOM 198 O VAL A 13 15.798 -3.235 4.121 1.00 0.00 O ATOM 199 CB VAL A 13 17.428 -2.013 1.683 1.00 0.00 C ATOM 200 CG1 VAL A 13 18.708 -1.479 1.137 1.00 0.00 C ATOM 201 CG2 VAL A 13 17.393 -3.503 1.483 1.00 0.00 C ATOM 0 H VAL A 13 18.634 -3.069 3.745 1.00 0.00 H new ATOM 0 HA VAL A 13 17.329 -0.530 3.226 1.00 0.00 H new ATOM 0 HB VAL A 13 16.580 -1.580 1.152 1.00 0.00 H new ATOM 0 HG11 VAL A 13 18.803 -1.762 0.089 1.00 0.00 H new ATOM 0 HG12 VAL A 13 18.714 -0.392 1.221 1.00 0.00 H new ATOM 0 HG13 VAL A 13 19.544 -1.891 1.701 1.00 0.00 H new ATOM 0 HG21 VAL A 13 17.501 -3.730 0.422 1.00 0.00 H new ATOM 0 HG22 VAL A 13 18.210 -3.964 2.038 1.00 0.00 H new ATOM 0 HG23 VAL A 13 16.442 -3.896 1.843 1.00 0.00 H new ATOM 211 N GLN A 14 15.062 -1.171 3.769 1.00 0.00 N ATOM 212 CA GLN A 14 13.730 -1.468 4.127 1.00 0.00 C ATOM 213 C GLN A 14 12.976 -1.375 2.828 1.00 0.00 C ATOM 214 O GLN A 14 12.906 -0.302 2.216 1.00 0.00 O ATOM 215 CB GLN A 14 13.235 -0.472 5.194 1.00 0.00 C ATOM 216 CG GLN A 14 12.014 -0.930 5.999 1.00 0.00 C ATOM 217 CD GLN A 14 10.717 -0.919 5.232 1.00 0.00 C ATOM 218 OE1 GLN A 14 10.354 -1.889 4.583 1.00 0.00 O ATOM 219 NE2 GLN A 14 9.988 0.160 5.349 1.00 0.00 N ATOM 0 H GLN A 14 15.235 -0.184 3.576 1.00 0.00 H new ATOM 0 HA GLN A 14 13.600 -2.450 4.581 1.00 0.00 H new ATOM 0 HB2 GLN A 14 14.052 -0.271 5.887 1.00 0.00 H new ATOM 0 HB3 GLN A 14 12.994 0.471 4.703 1.00 0.00 H new ATOM 0 HG2 GLN A 14 12.195 -1.940 6.366 1.00 0.00 H new ATOM 0 HG3 GLN A 14 11.910 -0.287 6.873 1.00 0.00 H new ATOM 0 HE21 GLN A 14 10.328 0.948 5.900 1.00 0.00 H new ATOM 0 HE22 GLN A 14 9.079 0.214 4.889 1.00 0.00 H new ATOM 228 N LEU A 15 12.545 -2.498 2.355 1.00 0.00 N ATOM 229 CA LEU A 15 11.920 -2.589 1.086 1.00 0.00 C ATOM 230 C LEU A 15 10.441 -2.799 1.260 1.00 0.00 C ATOM 231 O LEU A 15 9.999 -3.865 1.682 1.00 0.00 O ATOM 232 CB LEU A 15 12.544 -3.734 0.284 1.00 0.00 C ATOM 233 CG LEU A 15 14.042 -3.636 0.013 1.00 0.00 C ATOM 234 CD1 LEU A 15 14.520 -4.845 -0.749 1.00 0.00 C ATOM 235 CD2 LEU A 15 14.402 -2.353 -0.729 1.00 0.00 C ATOM 0 H LEU A 15 12.620 -3.387 2.849 1.00 0.00 H new ATOM 0 HA LEU A 15 12.072 -1.660 0.536 1.00 0.00 H new ATOM 0 HB2 LEU A 15 12.353 -4.666 0.815 1.00 0.00 H new ATOM 0 HB3 LEU A 15 12.027 -3.801 -0.673 1.00 0.00 H new ATOM 0 HG LEU A 15 14.550 -3.606 0.977 1.00 0.00 H new ATOM 0 HD11 LEU A 15 15.591 -4.759 -0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 15 14.324 -5.744 -0.165 1.00 0.00 H new ATOM 0 HD13 LEU A 15 13.992 -4.908 -1.700 1.00 0.00 H new ATOM 0 HD21 LEU A 15 15.478 -2.322 -0.902 1.00 0.00 H new ATOM 0 HD22 LEU A 15 13.880 -2.327 -1.685 1.00 0.00 H new ATOM 0 HD23 LEU A 15 14.106 -1.491 -0.130 1.00 0.00 H new ATOM 247 N GLU A 16 9.691 -1.791 0.969 1.00 0.00 N ATOM 248 CA GLU A 16 8.265 -1.859 1.092 1.00 0.00 C ATOM 249 C GLU A 16 7.703 -2.337 -0.206 1.00 0.00 C ATOM 250 O GLU A 16 8.147 -1.923 -1.263 1.00 0.00 O ATOM 251 CB GLU A 16 7.672 -0.489 1.378 1.00 0.00 C ATOM 252 CG GLU A 16 8.165 0.179 2.633 1.00 0.00 C ATOM 253 CD GLU A 16 7.641 1.585 2.745 1.00 0.00 C ATOM 254 OE1 GLU A 16 8.101 2.461 1.995 1.00 0.00 O ATOM 255 OE2 GLU A 16 6.729 1.835 3.552 1.00 0.00 O ATOM 0 H GLU A 16 10.044 -0.893 0.638 1.00 0.00 H new ATOM 0 HA GLU A 16 8.020 -2.532 1.914 1.00 0.00 H new ATOM 0 HB2 GLU A 16 7.885 0.164 0.532 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.588 -0.587 1.441 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.851 -0.399 3.502 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.255 0.193 2.636 1.00 0.00 H new ATOM 262 N LYS A 17 6.773 -3.209 -0.148 1.00 0.00 N ATOM 263 CA LYS A 17 6.086 -3.638 -1.332 1.00 0.00 C ATOM 264 C LYS A 17 4.713 -3.052 -1.253 1.00 0.00 C ATOM 265 O LYS A 17 3.911 -3.523 -0.459 1.00 0.00 O ATOM 266 CB LYS A 17 5.999 -5.169 -1.392 1.00 0.00 C ATOM 267 CG LYS A 17 7.342 -5.890 -1.460 1.00 0.00 C ATOM 268 CD LYS A 17 8.070 -5.614 -2.770 1.00 0.00 C ATOM 269 CE LYS A 17 9.396 -6.348 -2.839 1.00 0.00 C ATOM 270 NZ LYS A 17 9.248 -7.820 -2.743 1.00 0.00 N ATOM 0 H LYS A 17 6.456 -3.654 0.713 1.00 0.00 H new ATOM 0 HA LYS A 17 6.615 -3.311 -2.227 1.00 0.00 H new ATOM 0 HB2 LYS A 17 5.459 -5.522 -0.514 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.408 -5.450 -2.264 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.966 -5.574 -0.624 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.184 -6.963 -1.352 1.00 0.00 H new ATOM 0 HD2 LYS A 17 7.441 -5.918 -3.607 1.00 0.00 H new ATOM 0 HD3 LYS A 17 8.241 -4.542 -2.873 1.00 0.00 H new ATOM 0 HE2 LYS A 17 9.895 -6.099 -3.776 1.00 0.00 H new ATOM 0 HE3 LYS A 17 10.040 -6.000 -2.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 10.147 -8.277 -2.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 8.990 -8.080 -1.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 8.502 -8.137 -3.395 1.00 0.00 H new ATOM 284 N VAL A 18 4.424 -1.995 -2.010 1.00 0.00 N ATOM 285 CA VAL A 18 3.163 -1.379 -1.848 1.00 0.00 C ATOM 286 C VAL A 18 2.160 -1.993 -2.785 1.00 0.00 C ATOM 287 O VAL A 18 2.232 -1.829 -3.996 1.00 0.00 O ATOM 288 CB VAL A 18 3.265 0.154 -1.988 1.00 0.00 C ATOM 289 CG1 VAL A 18 1.899 0.831 -2.060 1.00 0.00 C ATOM 290 CG2 VAL A 18 4.075 0.736 -0.834 1.00 0.00 C ATOM 0 H VAL A 18 5.038 -1.579 -2.710 1.00 0.00 H new ATOM 0 HA VAL A 18 2.806 -1.562 -0.834 1.00 0.00 H new ATOM 0 HB VAL A 18 3.772 0.353 -2.932 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.032 1.908 -2.158 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.351 0.453 -2.923 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.338 0.616 -1.151 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.140 1.818 -0.944 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.587 0.496 0.111 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.078 0.310 -0.842 1.00 0.00 H new ATOM 300 N TYR A 19 1.284 -2.763 -2.224 1.00 0.00 N ATOM 301 CA TYR A 19 0.242 -3.376 -2.974 1.00 0.00 C ATOM 302 C TYR A 19 -0.888 -2.388 -3.071 1.00 0.00 C ATOM 303 O TYR A 19 -0.967 -1.450 -2.254 1.00 0.00 O ATOM 304 CB TYR A 19 -0.246 -4.640 -2.271 1.00 0.00 C ATOM 305 CG TYR A 19 0.779 -5.750 -2.125 1.00 0.00 C ATOM 306 CD1 TYR A 19 1.772 -5.694 -1.163 1.00 0.00 C ATOM 307 CD2 TYR A 19 0.725 -6.871 -2.929 1.00 0.00 C ATOM 308 CE1 TYR A 19 2.677 -6.717 -1.010 1.00 0.00 C ATOM 309 CE2 TYR A 19 1.618 -7.908 -2.776 1.00 0.00 C ATOM 310 CZ TYR A 19 2.593 -7.824 -1.816 1.00 0.00 C ATOM 311 OH TYR A 19 3.479 -8.864 -1.640 1.00 0.00 O ATOM 0 H TYR A 19 1.273 -2.984 -1.228 1.00 0.00 H new ATOM 0 HA TYR A 19 0.605 -3.654 -3.963 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -0.602 -4.367 -1.278 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.102 -5.031 -2.820 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.837 -4.829 -0.519 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -0.034 -6.936 -3.695 1.00 0.00 H new ATOM 0 HE1 TYR A 19 3.450 -6.650 -0.259 1.00 0.00 H new ATOM 0 HE2 TYR A 19 1.551 -8.781 -3.408 1.00 0.00 H new ATOM 0 HH TYR A 19 3.285 -9.572 -2.289 1.00 0.00 H new ATOM 321 N LEU A 20 -1.757 -2.578 -4.040 1.00 0.00 N ATOM 322 CA LEU A 20 -2.912 -1.699 -4.219 1.00 0.00 C ATOM 323 C LEU A 20 -3.759 -1.708 -2.963 1.00 0.00 C ATOM 324 O LEU A 20 -4.157 -0.668 -2.463 1.00 0.00 O ATOM 325 CB LEU A 20 -3.789 -2.191 -5.359 1.00 0.00 C ATOM 326 CG LEU A 20 -3.146 -2.418 -6.710 1.00 0.00 C ATOM 327 CD1 LEU A 20 -4.193 -2.967 -7.659 1.00 0.00 C ATOM 328 CD2 LEU A 20 -2.548 -1.127 -7.254 1.00 0.00 C ATOM 0 H LEU A 20 -1.693 -3.333 -4.722 1.00 0.00 H new ATOM 0 HA LEU A 20 -2.540 -0.698 -4.436 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -4.246 -3.130 -5.046 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -4.597 -1.472 -5.492 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.331 -3.134 -6.608 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -3.744 -3.136 -8.638 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -4.579 -3.909 -7.269 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.010 -2.251 -7.753 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -2.092 -1.318 -8.226 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -3.334 -0.379 -7.362 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.789 -0.758 -6.564 1.00 0.00 H new ATOM 340 N ASP A 21 -3.947 -2.910 -2.454 1.00 0.00 N ATOM 341 CA ASP A 21 -4.806 -3.230 -1.306 1.00 0.00 C ATOM 342 C ASP A 21 -4.532 -2.409 -0.047 1.00 0.00 C ATOM 343 O ASP A 21 -5.455 -2.076 0.692 1.00 0.00 O ATOM 344 CB ASP A 21 -4.672 -4.712 -1.011 1.00 0.00 C ATOM 345 CG ASP A 21 -5.212 -5.120 0.329 1.00 0.00 C ATOM 346 OD1 ASP A 21 -6.430 -5.345 0.440 1.00 0.00 O ATOM 347 OD2 ASP A 21 -4.401 -5.285 1.260 1.00 0.00 O ATOM 0 H ASP A 21 -3.489 -3.735 -2.840 1.00 0.00 H new ATOM 0 HA ASP A 21 -5.825 -2.965 -1.589 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.191 -5.275 -1.787 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.619 -4.989 -1.067 1.00 0.00 H new ATOM 352 N GLY A 22 -3.296 -2.088 0.195 1.00 0.00 N ATOM 353 CA GLY A 22 -2.986 -1.352 1.387 1.00 0.00 C ATOM 354 C GLY A 22 -2.104 -2.131 2.324 1.00 0.00 C ATOM 355 O GLY A 22 -1.306 -1.545 3.057 1.00 0.00 O ATOM 0 H GLY A 22 -2.501 -2.317 -0.401 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.492 -0.419 1.117 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -3.911 -1.086 1.899 1.00 0.00 H new ATOM 359 N ASP A 23 -2.251 -3.441 2.329 1.00 0.00 N ATOM 360 CA ASP A 23 -1.384 -4.278 3.144 1.00 0.00 C ATOM 361 C ASP A 23 -0.096 -4.461 2.409 1.00 0.00 C ATOM 362 O ASP A 23 -0.053 -5.083 1.353 1.00 0.00 O ATOM 363 CB ASP A 23 -2.018 -5.640 3.473 1.00 0.00 C ATOM 364 CG ASP A 23 -1.089 -6.545 4.274 1.00 0.00 C ATOM 365 OD1 ASP A 23 -0.809 -6.243 5.454 1.00 0.00 O ATOM 366 OD2 ASP A 23 -0.620 -7.583 3.737 1.00 0.00 O ATOM 0 H ASP A 23 -2.952 -3.946 1.787 1.00 0.00 H new ATOM 0 HA ASP A 23 -1.217 -3.784 4.101 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -2.938 -5.481 4.036 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -2.295 -6.141 2.545 1.00 0.00 H new ATOM 371 N VAL A 24 0.939 -3.893 2.915 1.00 0.00 N ATOM 372 CA VAL A 24 2.181 -3.926 2.228 1.00 0.00 C ATOM 373 C VAL A 24 3.114 -4.903 2.891 1.00 0.00 C ATOM 374 O VAL A 24 2.895 -5.312 4.039 1.00 0.00 O ATOM 375 CB VAL A 24 2.836 -2.522 2.132 1.00 0.00 C ATOM 376 CG1 VAL A 24 1.854 -1.480 1.619 1.00 0.00 C ATOM 377 CG2 VAL A 24 3.456 -2.100 3.433 1.00 0.00 C ATOM 0 H VAL A 24 0.951 -3.397 3.806 1.00 0.00 H new ATOM 0 HA VAL A 24 1.983 -4.255 1.208 1.00 0.00 H new ATOM 0 HB VAL A 24 3.643 -2.598 1.403 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.348 -0.510 1.565 1.00 0.00 H new ATOM 0 HG12 VAL A 24 1.506 -1.766 0.626 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.003 -1.417 2.297 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.902 -1.112 3.320 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.689 -2.065 4.207 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.227 -2.816 3.718 1.00 0.00 H new ATOM 387 N SER A 25 4.112 -5.302 2.188 1.00 0.00 N ATOM 388 CA SER A 25 5.088 -6.175 2.742 1.00 0.00 C ATOM 389 C SER A 25 6.278 -5.334 3.120 1.00 0.00 C ATOM 390 O SER A 25 6.777 -4.559 2.300 1.00 0.00 O ATOM 391 CB SER A 25 5.471 -7.268 1.738 1.00 0.00 C ATOM 392 OG SER A 25 6.289 -8.280 2.324 1.00 0.00 O ATOM 0 H SER A 25 4.277 -5.036 1.217 1.00 0.00 H new ATOM 0 HA SER A 25 4.696 -6.685 3.622 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.565 -7.723 1.337 1.00 0.00 H new ATOM 0 HB3 SER A 25 6.000 -6.817 0.898 1.00 0.00 H new ATOM 0 HG SER A 25 6.507 -8.956 1.649 1.00 0.00 H new ATOM 398 N ILE A 26 6.670 -5.425 4.359 1.00 0.00 N ATOM 399 CA ILE A 26 7.804 -4.703 4.858 1.00 0.00 C ATOM 400 C ILE A 26 8.976 -5.648 4.897 1.00 0.00 C ATOM 401 O ILE A 26 8.955 -6.659 5.614 1.00 0.00 O ATOM 402 CB ILE A 26 7.517 -4.112 6.270 1.00 0.00 C ATOM 403 CG1 ILE A 26 6.350 -3.116 6.215 1.00 0.00 C ATOM 404 CG2 ILE A 26 8.746 -3.459 6.874 1.00 0.00 C ATOM 405 CD1 ILE A 26 6.534 -2.000 5.211 1.00 0.00 C ATOM 0 H ILE A 26 6.207 -6.008 5.057 1.00 0.00 H new ATOM 0 HA ILE A 26 8.025 -3.860 4.203 1.00 0.00 H new ATOM 0 HB ILE A 26 7.239 -4.944 6.917 1.00 0.00 H new ATOM 0 HG12 ILE A 26 5.435 -3.658 5.975 1.00 0.00 H new ATOM 0 HG13 ILE A 26 6.212 -2.680 7.205 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.500 -3.061 7.858 1.00 0.00 H new ATOM 0 HG22 ILE A 26 9.541 -4.199 6.970 1.00 0.00 H new ATOM 0 HG23 ILE A 26 9.082 -2.648 6.228 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.666 -1.342 5.236 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.429 -1.430 5.461 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.640 -2.423 4.212 1.00 0.00 H new ATOM 417 N GLU A 27 9.952 -5.370 4.112 1.00 0.00 N ATOM 418 CA GLU A 27 11.087 -6.225 4.002 1.00 0.00 C ATOM 419 C GLU A 27 12.328 -5.534 4.530 1.00 0.00 C ATOM 420 O GLU A 27 12.469 -4.330 4.421 1.00 0.00 O ATOM 421 CB GLU A 27 11.267 -6.634 2.546 1.00 0.00 C ATOM 422 CG GLU A 27 12.391 -7.598 2.309 1.00 0.00 C ATOM 423 CD GLU A 27 12.190 -8.853 3.102 1.00 0.00 C ATOM 424 OE1 GLU A 27 11.251 -9.623 2.788 1.00 0.00 O ATOM 425 OE2 GLU A 27 12.912 -9.056 4.093 1.00 0.00 O ATOM 0 H GLU A 27 9.991 -4.539 3.522 1.00 0.00 H new ATOM 0 HA GLU A 27 10.927 -7.119 4.604 1.00 0.00 H new ATOM 0 HB2 GLU A 27 10.339 -7.081 2.189 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.440 -5.739 1.948 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.452 -7.839 1.248 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.338 -7.135 2.586 1.00 0.00 H new ATOM 432 N HIS A 28 13.213 -6.301 5.098 1.00 0.00 N ATOM 433 CA HIS A 28 14.438 -5.784 5.650 1.00 0.00 C ATOM 434 C HIS A 28 15.583 -6.614 5.176 1.00 0.00 C ATOM 435 O HIS A 28 15.738 -7.765 5.582 1.00 0.00 O ATOM 436 CB HIS A 28 14.434 -5.776 7.181 1.00 0.00 C ATOM 437 CG HIS A 28 13.561 -4.737 7.833 1.00 0.00 C ATOM 438 ND1 HIS A 28 14.014 -3.847 8.786 1.00 0.00 N ATOM 439 CD2 HIS A 28 12.245 -4.501 7.706 1.00 0.00 C ATOM 440 CE1 HIS A 28 12.980 -3.117 9.203 1.00 0.00 C ATOM 441 NE2 HIS A 28 11.871 -3.474 8.580 1.00 0.00 N ATOM 0 H HIS A 28 13.107 -7.311 5.193 1.00 0.00 H new ATOM 0 HA HIS A 28 14.535 -4.752 5.311 1.00 0.00 H new ATOM 0 HB2 HIS A 28 14.117 -6.759 7.529 1.00 0.00 H new ATOM 0 HB3 HIS A 28 15.458 -5.631 7.527 1.00 0.00 H new ATOM 0 HD2 HIS A 28 11.579 -5.022 7.034 1.00 0.00 H new ATOM 0 HE1 HIS A 28 13.040 -2.339 9.949 1.00 0.00 H new ATOM 0 HE2 HIS A 28 10.938 -3.083 8.709 1.00 0.00 H new ATOM 449 N LYS A 29 16.359 -6.053 4.328 1.00 0.00 N ATOM 450 CA LYS A 29 17.517 -6.721 3.820 1.00 0.00 C ATOM 451 C LYS A 29 18.743 -6.006 4.261 1.00 0.00 C ATOM 452 O LYS A 29 18.707 -4.817 4.572 1.00 0.00 O ATOM 453 CB LYS A 29 17.570 -6.790 2.303 1.00 0.00 C ATOM 454 CG LYS A 29 16.490 -7.567 1.605 1.00 0.00 C ATOM 455 CD LYS A 29 17.022 -8.045 0.264 1.00 0.00 C ATOM 456 CE LYS A 29 17.469 -6.886 -0.630 1.00 0.00 C ATOM 457 NZ LYS A 29 17.974 -7.336 -1.946 1.00 0.00 N ATOM 0 H LYS A 29 16.217 -5.113 3.959 1.00 0.00 H new ATOM 0 HA LYS A 29 17.461 -7.737 4.210 1.00 0.00 H new ATOM 0 HB2 LYS A 29 17.552 -5.770 1.919 1.00 0.00 H new ATOM 0 HB3 LYS A 29 18.531 -7.220 2.019 1.00 0.00 H new ATOM 0 HG2 LYS A 29 16.182 -8.417 2.214 1.00 0.00 H new ATOM 0 HG3 LYS A 29 15.608 -6.942 1.461 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.863 -8.719 0.429 1.00 0.00 H new ATOM 0 HD3 LYS A 29 16.249 -8.618 -0.248 1.00 0.00 H new ATOM 0 HE2 LYS A 29 16.631 -6.206 -0.781 1.00 0.00 H new ATOM 0 HE3 LYS A 29 18.250 -6.321 -0.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 18.070 -6.517 -2.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 18.901 -7.791 -1.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 17.306 -8.017 -2.360 1.00 0.00 H new ATOM 471 N HIS A 30 19.798 -6.715 4.293 1.00 0.00 N ATOM 472 CA HIS A 30 21.084 -6.165 4.616 1.00 0.00 C ATOM 473 C HIS A 30 22.043 -6.448 3.473 1.00 0.00 C ATOM 474 O HIS A 30 22.337 -7.619 3.174 1.00 0.00 O ATOM 475 CB HIS A 30 21.618 -6.681 5.981 1.00 0.00 C ATOM 476 CG HIS A 30 21.867 -8.164 6.092 1.00 0.00 C ATOM 477 ND1 HIS A 30 23.124 -8.732 6.048 1.00 0.00 N ATOM 478 CD2 HIS A 30 21.001 -9.190 6.266 1.00 0.00 C ATOM 479 CE1 HIS A 30 22.993 -10.045 6.189 1.00 0.00 C ATOM 480 NE2 HIS A 30 21.715 -10.386 6.327 1.00 0.00 N ATOM 0 H HIS A 30 19.812 -7.715 4.094 1.00 0.00 H new ATOM 0 HA HIS A 30 20.989 -5.086 4.735 1.00 0.00 H new ATOM 0 HB2 HIS A 30 22.551 -6.162 6.200 1.00 0.00 H new ATOM 0 HB3 HIS A 30 20.905 -6.396 6.755 1.00 0.00 H new ATOM 0 HD2 HIS A 30 19.928 -9.097 6.345 1.00 0.00 H new ATOM 0 HE1 HIS A 30 23.816 -10.745 6.191 1.00 0.00 H new ATOM 0 HE2 HIS A 30 21.337 -11.325 6.451 1.00 0.00 H new ATOM 488 N GLU A 31 22.495 -5.433 2.798 1.00 0.00 N ATOM 489 CA GLU A 31 23.376 -5.658 1.717 1.00 0.00 C ATOM 490 C GLU A 31 24.586 -4.790 1.794 1.00 0.00 C ATOM 491 O GLU A 31 24.507 -3.619 2.128 1.00 0.00 O ATOM 492 CB GLU A 31 22.660 -5.525 0.389 1.00 0.00 C ATOM 493 CG GLU A 31 22.060 -4.184 0.084 1.00 0.00 C ATOM 494 CD GLU A 31 21.146 -4.297 -1.098 1.00 0.00 C ATOM 495 OE1 GLU A 31 21.636 -4.282 -2.245 1.00 0.00 O ATOM 496 OE2 GLU A 31 19.932 -4.470 -0.909 1.00 0.00 O ATOM 0 H GLU A 31 22.265 -4.456 2.982 1.00 0.00 H new ATOM 0 HA GLU A 31 23.729 -6.686 1.791 1.00 0.00 H new ATOM 0 HB2 GLU A 31 23.365 -5.772 -0.405 1.00 0.00 H new ATOM 0 HB3 GLU A 31 21.866 -6.270 0.353 1.00 0.00 H new ATOM 0 HG2 GLU A 31 21.508 -3.817 0.949 1.00 0.00 H new ATOM 0 HG3 GLU A 31 22.849 -3.460 -0.122 1.00 0.00 H new ATOM 503 N LYS A 32 25.701 -5.383 1.549 1.00 0.00 N ATOM 504 CA LYS A 32 26.924 -4.692 1.498 1.00 0.00 C ATOM 505 C LYS A 32 27.230 -4.376 0.078 1.00 0.00 C ATOM 506 O LYS A 32 27.335 -5.269 -0.762 1.00 0.00 O ATOM 507 CB LYS A 32 28.050 -5.489 2.097 1.00 0.00 C ATOM 508 CG LYS A 32 27.964 -5.697 3.592 1.00 0.00 C ATOM 509 CD LYS A 32 29.239 -6.332 4.140 1.00 0.00 C ATOM 510 CE LYS A 32 29.742 -7.453 3.252 1.00 0.00 C ATOM 511 NZ LYS A 32 30.948 -8.107 3.791 1.00 0.00 N ATOM 0 H LYS A 32 25.781 -6.385 1.376 1.00 0.00 H new ATOM 0 HA LYS A 32 26.829 -3.779 2.086 1.00 0.00 H new ATOM 0 HB2 LYS A 32 28.083 -6.464 1.611 1.00 0.00 H new ATOM 0 HB3 LYS A 32 28.991 -4.988 1.869 1.00 0.00 H new ATOM 0 HG2 LYS A 32 27.791 -4.740 4.085 1.00 0.00 H new ATOM 0 HG3 LYS A 32 27.110 -6.333 3.824 1.00 0.00 H new ATOM 0 HD2 LYS A 32 30.012 -5.570 4.234 1.00 0.00 H new ATOM 0 HD3 LYS A 32 29.050 -6.720 5.141 1.00 0.00 H new ATOM 0 HE2 LYS A 32 28.954 -8.196 3.130 1.00 0.00 H new ATOM 0 HE3 LYS A 32 29.961 -7.056 2.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 31.250 -8.865 3.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 31.711 -7.406 3.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 30.735 -8.512 4.725 1.00 0.00 H new ATOM 525 N VAL A 33 27.342 -3.140 -0.197 1.00 0.00 N ATOM 526 CA VAL A 33 27.583 -2.700 -1.526 1.00 0.00 C ATOM 527 C VAL A 33 28.843 -1.839 -1.632 1.00 0.00 C ATOM 528 O VAL A 33 29.063 -0.963 -0.823 1.00 0.00 O ATOM 529 CB VAL A 33 26.320 -2.037 -2.137 1.00 0.00 C ATOM 530 CG1 VAL A 33 25.591 -1.183 -1.125 1.00 0.00 C ATOM 531 CG2 VAL A 33 26.670 -1.231 -3.340 1.00 0.00 C ATOM 0 H VAL A 33 27.270 -2.391 0.492 1.00 0.00 H new ATOM 0 HA VAL A 33 27.790 -3.579 -2.137 1.00 0.00 H new ATOM 0 HB VAL A 33 25.649 -2.841 -2.440 1.00 0.00 H new ATOM 0 HG11 VAL A 33 24.713 -0.736 -1.591 1.00 0.00 H new ATOM 0 HG12 VAL A 33 25.280 -1.802 -0.283 1.00 0.00 H new ATOM 0 HG13 VAL A 33 26.254 -0.394 -0.770 1.00 0.00 H new ATOM 0 HG21 VAL A 33 25.767 -0.777 -3.749 1.00 0.00 H new ATOM 0 HG22 VAL A 33 27.375 -0.448 -3.061 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.124 -1.877 -4.091 1.00 0.00 H new ATOM 541 N PHE A 34 29.666 -2.132 -2.619 1.00 0.00 N ATOM 542 CA PHE A 34 30.956 -1.479 -2.809 1.00 0.00 C ATOM 543 C PHE A 34 30.840 -0.119 -3.495 1.00 0.00 C ATOM 544 O PHE A 34 31.738 0.716 -3.375 1.00 0.00 O ATOM 545 CB PHE A 34 31.905 -2.387 -3.594 1.00 0.00 C ATOM 546 CG PHE A 34 32.376 -3.630 -2.862 1.00 0.00 C ATOM 547 CD1 PHE A 34 31.487 -4.630 -2.490 1.00 0.00 C ATOM 548 CD2 PHE A 34 33.718 -3.798 -2.564 1.00 0.00 C ATOM 549 CE1 PHE A 34 31.925 -5.765 -1.839 1.00 0.00 C ATOM 550 CE2 PHE A 34 34.163 -4.933 -1.916 1.00 0.00 C ATOM 551 CZ PHE A 34 33.265 -5.919 -1.554 1.00 0.00 C ATOM 0 H PHE A 34 29.459 -2.839 -3.324 1.00 0.00 H new ATOM 0 HA PHE A 34 31.363 -1.298 -1.814 1.00 0.00 H new ATOM 0 HB2 PHE A 34 31.407 -2.695 -4.513 1.00 0.00 H new ATOM 0 HB3 PHE A 34 32.779 -1.805 -3.885 1.00 0.00 H new ATOM 0 HD1 PHE A 34 30.436 -4.518 -2.714 1.00 0.00 H new ATOM 0 HD2 PHE A 34 34.426 -3.031 -2.842 1.00 0.00 H new ATOM 0 HE1 PHE A 34 31.219 -6.531 -1.553 1.00 0.00 H new ATOM 0 HE2 PHE A 34 35.213 -5.050 -1.692 1.00 0.00 H new ATOM 0 HZ PHE A 34 33.612 -6.808 -1.049 1.00 0.00 H new ATOM 561 N SER A 35 29.766 0.103 -4.219 1.00 0.00 N ATOM 562 CA SER A 35 29.543 1.370 -4.852 1.00 0.00 C ATOM 563 C SER A 35 28.117 1.772 -4.643 1.00 0.00 C ATOM 564 O SER A 35 27.208 1.083 -5.096 1.00 0.00 O ATOM 565 CB SER A 35 29.859 1.308 -6.353 1.00 0.00 C ATOM 566 OG SER A 35 29.608 2.554 -6.990 1.00 0.00 O ATOM 0 H SER A 35 29.032 -0.587 -4.381 1.00 0.00 H new ATOM 0 HA SER A 35 30.209 2.108 -4.405 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.903 1.029 -6.495 1.00 0.00 H new ATOM 0 HB3 SER A 35 29.255 0.531 -6.821 1.00 0.00 H new ATOM 0 HG SER A 35 29.820 2.482 -7.944 1.00 0.00 H new ATOM 572 N MET A 36 27.904 2.887 -3.973 1.00 0.00 N ATOM 573 CA MET A 36 26.548 3.369 -3.717 1.00 0.00 C ATOM 574 C MET A 36 25.804 3.601 -4.998 1.00 0.00 C ATOM 575 O MET A 36 24.613 3.374 -5.074 1.00 0.00 O ATOM 576 CB MET A 36 26.544 4.628 -2.861 1.00 0.00 C ATOM 577 CG MET A 36 26.734 4.357 -1.384 1.00 0.00 C ATOM 578 SD MET A 36 25.238 4.656 -0.411 1.00 0.00 S ATOM 579 CE MET A 36 24.045 3.597 -1.228 1.00 0.00 C ATOM 0 H MET A 36 28.644 3.479 -3.595 1.00 0.00 H new ATOM 0 HA MET A 36 26.034 2.588 -3.157 1.00 0.00 H new ATOM 0 HB2 MET A 36 27.336 5.293 -3.205 1.00 0.00 H new ATOM 0 HB3 MET A 36 25.600 5.154 -3.007 1.00 0.00 H new ATOM 0 HG2 MET A 36 27.048 3.322 -1.248 1.00 0.00 H new ATOM 0 HG3 MET A 36 27.539 4.987 -1.005 1.00 0.00 H new ATOM 0 HE1 MET A 36 23.080 3.684 -0.730 1.00 0.00 H new ATOM 0 HE2 MET A 36 23.944 3.899 -2.270 1.00 0.00 H new ATOM 0 HE3 MET A 36 24.385 2.562 -1.182 1.00 0.00 H new ATOM 589 N ASP A 37 26.535 3.948 -6.024 1.00 0.00 N ATOM 590 CA ASP A 37 25.941 4.235 -7.320 1.00 0.00 C ATOM 591 C ASP A 37 25.398 2.963 -7.943 1.00 0.00 C ATOM 592 O ASP A 37 24.349 2.973 -8.599 1.00 0.00 O ATOM 593 CB ASP A 37 26.929 4.921 -8.256 1.00 0.00 C ATOM 594 CG ASP A 37 26.283 5.313 -9.565 1.00 0.00 C ATOM 595 OD1 ASP A 37 25.393 6.192 -9.561 1.00 0.00 O ATOM 596 OD2 ASP A 37 26.672 4.785 -10.625 1.00 0.00 O ATOM 0 H ASP A 37 27.550 4.042 -5.995 1.00 0.00 H new ATOM 0 HA ASP A 37 25.115 4.928 -7.162 1.00 0.00 H new ATOM 0 HB2 ASP A 37 27.333 5.809 -7.770 1.00 0.00 H new ATOM 0 HB3 ASP A 37 27.769 4.254 -8.451 1.00 0.00 H new ATOM 601 N ASP A 38 26.076 1.847 -7.670 1.00 0.00 N ATOM 602 CA ASP A 38 25.633 0.535 -8.153 1.00 0.00 C ATOM 603 C ASP A 38 24.340 0.187 -7.474 1.00 0.00 C ATOM 604 O ASP A 38 23.411 -0.317 -8.094 1.00 0.00 O ATOM 605 CB ASP A 38 26.656 -0.547 -7.831 1.00 0.00 C ATOM 606 CG ASP A 38 26.224 -1.925 -8.302 1.00 0.00 C ATOM 607 OD1 ASP A 38 26.194 -2.161 -9.526 1.00 0.00 O ATOM 608 OD2 ASP A 38 25.932 -2.801 -7.461 1.00 0.00 O ATOM 0 H ASP A 38 26.933 1.824 -7.118 1.00 0.00 H new ATOM 0 HA ASP A 38 25.511 0.587 -9.235 1.00 0.00 H new ATOM 0 HB2 ASP A 38 27.608 -0.291 -8.297 1.00 0.00 H new ATOM 0 HB3 ASP A 38 26.824 -0.572 -6.754 1.00 0.00 H new ATOM 613 N PHE A 39 24.285 0.508 -6.197 1.00 0.00 N ATOM 614 CA PHE A 39 23.124 0.299 -5.379 1.00 0.00 C ATOM 615 C PHE A 39 21.938 1.117 -5.921 1.00 0.00 C ATOM 616 O PHE A 39 20.832 0.594 -6.070 1.00 0.00 O ATOM 617 CB PHE A 39 23.455 0.718 -3.947 1.00 0.00 C ATOM 618 CG PHE A 39 22.347 0.553 -2.973 1.00 0.00 C ATOM 619 CD1 PHE A 39 21.434 1.556 -2.799 1.00 0.00 C ATOM 620 CD2 PHE A 39 22.229 -0.600 -2.221 1.00 0.00 C ATOM 621 CE1 PHE A 39 20.421 1.427 -1.907 1.00 0.00 C ATOM 622 CE2 PHE A 39 21.210 -0.736 -1.314 1.00 0.00 C ATOM 623 CZ PHE A 39 20.302 0.290 -1.163 1.00 0.00 C ATOM 0 H PHE A 39 25.067 0.930 -5.696 1.00 0.00 H new ATOM 0 HA PHE A 39 22.842 -0.754 -5.396 1.00 0.00 H new ATOM 0 HB2 PHE A 39 24.311 0.137 -3.603 1.00 0.00 H new ATOM 0 HB3 PHE A 39 23.761 1.764 -3.952 1.00 0.00 H new ATOM 0 HD1 PHE A 39 21.521 2.463 -3.380 1.00 0.00 H new ATOM 0 HD2 PHE A 39 22.944 -1.399 -2.348 1.00 0.00 H new ATOM 0 HE1 PHE A 39 19.706 2.227 -1.785 1.00 0.00 H new ATOM 0 HE2 PHE A 39 21.120 -1.637 -0.725 1.00 0.00 H new ATOM 0 HZ PHE A 39 19.494 0.193 -0.453 1.00 0.00 H new ATOM 633 N TRP A 40 22.186 2.390 -6.238 1.00 0.00 N ATOM 634 CA TRP A 40 21.140 3.269 -6.755 1.00 0.00 C ATOM 635 C TRP A 40 20.640 2.762 -8.088 1.00 0.00 C ATOM 636 O TRP A 40 19.463 2.777 -8.360 1.00 0.00 O ATOM 637 CB TRP A 40 21.614 4.734 -6.871 1.00 0.00 C ATOM 638 CG TRP A 40 22.086 5.323 -5.570 1.00 0.00 C ATOM 639 CD1 TRP A 40 23.258 5.991 -5.347 1.00 0.00 C ATOM 640 CD2 TRP A 40 21.415 5.271 -4.309 1.00 0.00 C ATOM 641 NE1 TRP A 40 23.370 6.326 -4.022 1.00 0.00 N ATOM 642 CE2 TRP A 40 22.242 5.904 -3.369 1.00 0.00 C ATOM 643 CE3 TRP A 40 20.195 4.745 -3.881 1.00 0.00 C ATOM 644 CZ2 TRP A 40 21.886 6.015 -2.037 1.00 0.00 C ATOM 645 CZ3 TRP A 40 19.849 4.865 -2.561 1.00 0.00 C ATOM 646 CH2 TRP A 40 20.689 5.488 -1.656 1.00 0.00 C ATOM 0 H TRP A 40 23.100 2.832 -6.145 1.00 0.00 H new ATOM 0 HA TRP A 40 20.318 3.255 -6.039 1.00 0.00 H new ATOM 0 HB2 TRP A 40 22.424 4.788 -7.599 1.00 0.00 H new ATOM 0 HB3 TRP A 40 20.796 5.341 -7.259 1.00 0.00 H new ATOM 0 HD1 TRP A 40 23.991 6.222 -6.106 1.00 0.00 H new ATOM 0 HE1 TRP A 40 24.160 6.808 -3.594 1.00 0.00 H new ATOM 0 HE3 TRP A 40 19.535 4.252 -4.579 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 22.534 6.502 -1.324 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 18.904 4.466 -2.221 1.00 0.00 H new ATOM 0 HH2 TRP A 40 20.388 5.558 -0.621 1.00 0.00 H new ATOM 657 N ALA A 41 21.541 2.265 -8.888 1.00 0.00 N ATOM 658 CA ALA A 41 21.183 1.712 -10.179 1.00 0.00 C ATOM 659 C ALA A 41 20.447 0.380 -10.013 1.00 0.00 C ATOM 660 O ALA A 41 19.614 0.014 -10.836 1.00 0.00 O ATOM 661 CB ALA A 41 22.415 1.556 -11.054 1.00 0.00 C ATOM 0 H ALA A 41 22.537 2.228 -8.673 1.00 0.00 H new ATOM 0 HA ALA A 41 20.505 2.406 -10.676 1.00 0.00 H new ATOM 0 HB1 ALA A 41 22.126 1.139 -12.019 1.00 0.00 H new ATOM 0 HB2 ALA A 41 22.880 2.530 -11.204 1.00 0.00 H new ATOM 0 HB3 ALA A 41 23.124 0.886 -10.568 1.00 0.00 H new ATOM 667 N ALA A 42 20.744 -0.321 -8.936 1.00 0.00 N ATOM 668 CA ALA A 42 20.108 -1.591 -8.650 1.00 0.00 C ATOM 669 C ALA A 42 18.659 -1.409 -8.203 1.00 0.00 C ATOM 670 O ALA A 42 17.801 -2.232 -8.521 1.00 0.00 O ATOM 671 CB ALA A 42 20.891 -2.361 -7.601 1.00 0.00 C ATOM 0 H ALA A 42 21.429 -0.028 -8.239 1.00 0.00 H new ATOM 0 HA ALA A 42 20.101 -2.167 -9.576 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.395 -3.311 -7.402 1.00 0.00 H new ATOM 0 HB2 ALA A 42 21.901 -2.548 -7.965 1.00 0.00 H new ATOM 0 HB3 ALA A 42 20.939 -1.777 -6.682 1.00 0.00 H new ATOM 677 N TYR A 43 18.384 -0.350 -7.459 1.00 0.00 N ATOM 678 CA TYR A 43 17.035 -0.103 -6.960 1.00 0.00 C ATOM 679 C TYR A 43 16.423 1.136 -7.574 1.00 0.00 C ATOM 680 O TYR A 43 15.447 1.658 -7.058 1.00 0.00 O ATOM 681 CB TYR A 43 17.052 -0.002 -5.434 1.00 0.00 C ATOM 682 CG TYR A 43 17.458 -1.293 -4.768 1.00 0.00 C ATOM 683 CD1 TYR A 43 16.511 -2.252 -4.469 1.00 0.00 C ATOM 684 CD2 TYR A 43 18.784 -1.563 -4.464 1.00 0.00 C ATOM 685 CE1 TYR A 43 16.862 -3.447 -3.891 1.00 0.00 C ATOM 686 CE2 TYR A 43 19.145 -2.755 -3.879 1.00 0.00 C ATOM 687 CZ TYR A 43 18.177 -3.695 -3.598 1.00 0.00 C ATOM 688 OH TYR A 43 18.531 -4.891 -3.027 1.00 0.00 O ATOM 0 H TYR A 43 19.072 0.352 -7.186 1.00 0.00 H new ATOM 0 HA TYR A 43 16.410 -0.946 -7.254 1.00 0.00 H new ATOM 0 HB2 TYR A 43 17.740 0.788 -5.134 1.00 0.00 H new ATOM 0 HB3 TYR A 43 16.062 0.287 -5.082 1.00 0.00 H new ATOM 0 HD1 TYR A 43 15.473 -2.058 -4.694 1.00 0.00 H new ATOM 0 HD2 TYR A 43 19.543 -0.828 -4.689 1.00 0.00 H new ATOM 0 HE1 TYR A 43 16.107 -4.186 -3.669 1.00 0.00 H new ATOM 0 HE2 TYR A 43 20.180 -2.953 -3.642 1.00 0.00 H new ATOM 0 HH TYR A 43 18.995 -4.724 -2.180 1.00 0.00 H new ATOM 698 N ALA A 44 16.985 1.577 -8.694 1.00 0.00 N ATOM 699 CA ALA A 44 16.485 2.739 -9.450 1.00 0.00 C ATOM 700 C ALA A 44 14.965 2.699 -9.707 1.00 0.00 C ATOM 701 O ALA A 44 14.312 3.742 -9.720 1.00 0.00 O ATOM 702 CB ALA A 44 17.228 2.866 -10.773 1.00 0.00 C ATOM 0 H ALA A 44 17.807 1.141 -9.113 1.00 0.00 H new ATOM 0 HA ALA A 44 16.674 3.612 -8.826 1.00 0.00 H new ATOM 0 HB1 ALA A 44 16.849 3.728 -11.322 1.00 0.00 H new ATOM 0 HB2 ALA A 44 18.293 2.997 -10.581 1.00 0.00 H new ATOM 0 HB3 ALA A 44 17.075 1.963 -11.365 1.00 0.00 H new ATOM 708 N GLY A 45 14.414 1.508 -9.889 1.00 0.00 N ATOM 709 CA GLY A 45 12.993 1.373 -10.165 1.00 0.00 C ATOM 710 C GLY A 45 12.110 1.583 -8.938 1.00 0.00 C ATOM 711 O GLY A 45 10.933 1.889 -9.063 1.00 0.00 O ATOM 0 H GLY A 45 14.926 0.627 -9.851 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.711 2.093 -10.933 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.803 0.380 -10.573 1.00 0.00 H new ATOM 715 N TRP A 46 12.662 1.363 -7.775 1.00 0.00 N ATOM 716 CA TRP A 46 11.967 1.556 -6.524 1.00 0.00 C ATOM 717 C TRP A 46 11.847 3.057 -6.223 1.00 0.00 C ATOM 718 O TRP A 46 12.617 3.869 -6.749 1.00 0.00 O ATOM 719 CB TRP A 46 12.774 0.905 -5.402 1.00 0.00 C ATOM 720 CG TRP A 46 13.039 -0.550 -5.549 1.00 0.00 C ATOM 721 CD1 TRP A 46 13.759 -1.170 -6.524 1.00 0.00 C ATOM 722 CD2 TRP A 46 12.627 -1.564 -4.661 1.00 0.00 C ATOM 723 NE1 TRP A 46 13.755 -2.507 -6.323 1.00 0.00 N ATOM 724 CE2 TRP A 46 13.077 -2.781 -5.182 1.00 0.00 C ATOM 725 CE3 TRP A 46 11.898 -1.565 -3.483 1.00 0.00 C ATOM 726 CZ2 TRP A 46 12.821 -3.987 -4.569 1.00 0.00 C ATOM 727 CZ3 TRP A 46 11.644 -2.760 -2.874 1.00 0.00 C ATOM 728 CH2 TRP A 46 12.106 -3.957 -3.422 1.00 0.00 C ATOM 0 H TRP A 46 13.623 1.039 -7.665 1.00 0.00 H new ATOM 0 HA TRP A 46 10.974 1.111 -6.592 1.00 0.00 H new ATOM 0 HB2 TRP A 46 13.730 1.422 -5.322 1.00 0.00 H new ATOM 0 HB3 TRP A 46 12.246 1.065 -4.462 1.00 0.00 H new ATOM 0 HD1 TRP A 46 14.260 -0.668 -7.338 1.00 0.00 H new ATOM 0 HE1 TRP A 46 14.192 -3.198 -6.932 1.00 0.00 H new ATOM 0 HE3 TRP A 46 11.538 -0.641 -3.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 13.176 -4.917 -4.987 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 11.077 -2.779 -1.955 1.00 0.00 H new ATOM 0 HH2 TRP A 46 11.886 -4.885 -2.916 1.00 0.00 H new ATOM 739 N THR A 47 10.912 3.416 -5.385 1.00 0.00 N ATOM 740 CA THR A 47 10.745 4.760 -4.978 1.00 0.00 C ATOM 741 C THR A 47 11.575 4.984 -3.708 1.00 0.00 C ATOM 742 O THR A 47 11.353 4.309 -2.690 1.00 0.00 O ATOM 743 CB THR A 47 9.255 5.018 -4.693 1.00 0.00 C ATOM 744 OG1 THR A 47 8.464 4.714 -5.866 1.00 0.00 O ATOM 745 CG2 THR A 47 9.009 6.445 -4.264 1.00 0.00 C ATOM 0 H THR A 47 10.244 2.767 -4.969 1.00 0.00 H new ATOM 0 HA THR A 47 11.077 5.445 -5.758 1.00 0.00 H new ATOM 0 HB THR A 47 8.957 4.365 -3.873 1.00 0.00 H new ATOM 0 HG1 THR A 47 7.762 4.072 -5.630 1.00 0.00 H new ATOM 0 HG21 THR A 47 7.946 6.589 -4.072 1.00 0.00 H new ATOM 0 HG22 THR A 47 9.574 6.654 -3.355 1.00 0.00 H new ATOM 0 HG23 THR A 47 9.330 7.123 -5.055 1.00 0.00 H new ATOM 753 N LEU A 48 12.545 5.870 -3.783 1.00 0.00 N ATOM 754 CA LEU A 48 13.401 6.164 -2.656 1.00 0.00 C ATOM 755 C LEU A 48 12.654 7.089 -1.722 1.00 0.00 C ATOM 756 O LEU A 48 12.320 8.223 -2.085 1.00 0.00 O ATOM 757 CB LEU A 48 14.750 6.770 -3.169 1.00 0.00 C ATOM 758 CG LEU A 48 15.903 7.088 -2.161 1.00 0.00 C ATOM 759 CD1 LEU A 48 15.667 8.347 -1.346 1.00 0.00 C ATOM 760 CD2 LEU A 48 16.163 5.922 -1.234 1.00 0.00 C ATOM 0 H LEU A 48 12.761 6.405 -4.624 1.00 0.00 H new ATOM 0 HA LEU A 48 13.656 5.261 -2.100 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.151 6.082 -3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 48 14.511 7.697 -3.689 1.00 0.00 H new ATOM 0 HG LEU A 48 16.784 7.265 -2.779 1.00 0.00 H new ATOM 0 HD11 LEU A 48 16.506 8.505 -0.669 1.00 0.00 H new ATOM 0 HD12 LEU A 48 15.575 9.202 -2.016 1.00 0.00 H new ATOM 0 HD13 LEU A 48 14.750 8.239 -0.767 1.00 0.00 H new ATOM 0 HD21 LEU A 48 16.970 6.176 -0.547 1.00 0.00 H new ATOM 0 HD22 LEU A 48 15.259 5.700 -0.666 1.00 0.00 H new ATOM 0 HD23 LEU A 48 16.448 5.048 -1.820 1.00 0.00 H new ATOM 772 N VAL A 49 12.346 6.594 -0.550 1.00 0.00 N ATOM 773 CA VAL A 49 11.616 7.371 0.413 1.00 0.00 C ATOM 774 C VAL A 49 12.583 8.111 1.304 1.00 0.00 C ATOM 775 O VAL A 49 12.484 9.323 1.462 1.00 0.00 O ATOM 776 CB VAL A 49 10.608 6.511 1.227 1.00 0.00 C ATOM 777 CG1 VAL A 49 9.886 7.341 2.277 1.00 0.00 C ATOM 778 CG2 VAL A 49 9.600 5.902 0.282 1.00 0.00 C ATOM 0 H VAL A 49 12.591 5.653 -0.241 1.00 0.00 H new ATOM 0 HA VAL A 49 11.010 8.101 -0.124 1.00 0.00 H new ATOM 0 HB VAL A 49 11.164 5.728 1.743 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.190 6.707 2.826 1.00 0.00 H new ATOM 0 HG12 VAL A 49 10.614 7.765 2.969 1.00 0.00 H new ATOM 0 HG13 VAL A 49 9.336 8.146 1.790 1.00 0.00 H new ATOM 0 HG21 VAL A 49 8.890 5.298 0.847 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.066 6.695 -0.241 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.115 5.273 -0.444 1.00 0.00 H new ATOM 788 N GLU A 50 13.556 7.407 1.832 1.00 0.00 N ATOM 789 CA GLU A 50 14.557 8.044 2.640 1.00 0.00 C ATOM 790 C GLU A 50 15.809 7.221 2.623 1.00 0.00 C ATOM 791 O GLU A 50 15.785 6.044 2.266 1.00 0.00 O ATOM 792 CB GLU A 50 14.090 8.240 4.090 1.00 0.00 C ATOM 793 CG GLU A 50 13.865 6.960 4.839 1.00 0.00 C ATOM 794 CD GLU A 50 13.529 7.183 6.279 1.00 0.00 C ATOM 795 OE1 GLU A 50 14.435 7.474 7.068 1.00 0.00 O ATOM 796 OE2 GLU A 50 12.345 7.063 6.664 1.00 0.00 O ATOM 0 H GLU A 50 13.672 6.400 1.715 1.00 0.00 H new ATOM 0 HA GLU A 50 14.746 9.031 2.218 1.00 0.00 H new ATOM 0 HB2 GLU A 50 14.833 8.834 4.622 1.00 0.00 H new ATOM 0 HB3 GLU A 50 13.164 8.815 4.088 1.00 0.00 H new ATOM 0 HG2 GLU A 50 13.057 6.404 4.364 1.00 0.00 H new ATOM 0 HG3 GLU A 50 14.760 6.342 4.771 1.00 0.00 H new ATOM 803 N GLN A 51 16.883 7.842 2.944 1.00 0.00 N ATOM 804 CA GLN A 51 18.137 7.199 3.097 1.00 0.00 C ATOM 805 C GLN A 51 18.943 7.876 4.171 1.00 0.00 C ATOM 806 O GLN A 51 18.950 9.114 4.291 1.00 0.00 O ATOM 807 CB GLN A 51 18.897 7.187 1.802 1.00 0.00 C ATOM 808 CG GLN A 51 19.065 8.543 1.160 1.00 0.00 C ATOM 809 CD GLN A 51 19.948 8.456 -0.026 1.00 0.00 C ATOM 810 OE1 GLN A 51 21.146 8.666 0.057 1.00 0.00 O ATOM 811 NE2 GLN A 51 19.386 8.063 -1.117 1.00 0.00 N ATOM 0 H GLN A 51 16.916 8.847 3.114 1.00 0.00 H new ATOM 0 HA GLN A 51 17.955 6.166 3.392 1.00 0.00 H new ATOM 0 HB2 GLN A 51 19.883 6.758 1.979 1.00 0.00 H new ATOM 0 HB3 GLN A 51 18.384 6.529 1.101 1.00 0.00 H new ATOM 0 HG2 GLN A 51 18.091 8.935 0.866 1.00 0.00 H new ATOM 0 HG3 GLN A 51 19.486 9.243 1.882 1.00 0.00 H new ATOM 0 HE21 GLN A 51 18.380 7.899 -1.142 1.00 0.00 H new ATOM 0 HE22 GLN A 51 19.948 7.916 -1.956 1.00 0.00 H new ATOM 820 N LYS A 52 19.583 7.081 4.945 1.00 0.00 N ATOM 821 CA LYS A 52 20.427 7.529 5.995 1.00 0.00 C ATOM 822 C LYS A 52 21.705 6.714 5.984 1.00 0.00 C ATOM 823 O LYS A 52 21.848 5.796 5.164 1.00 0.00 O ATOM 824 CB LYS A 52 19.688 7.456 7.337 1.00 0.00 C ATOM 825 CG LYS A 52 18.970 6.154 7.582 1.00 0.00 C ATOM 826 CD LYS A 52 18.045 6.157 8.817 1.00 0.00 C ATOM 827 CE LYS A 52 18.772 6.306 10.153 1.00 0.00 C ATOM 828 NZ LYS A 52 19.271 7.678 10.412 1.00 0.00 N ATOM 0 H LYS A 52 19.534 6.065 4.865 1.00 0.00 H new ATOM 0 HA LYS A 52 20.698 8.574 5.846 1.00 0.00 H new ATOM 0 HB2 LYS A 52 20.405 7.619 8.142 1.00 0.00 H new ATOM 0 HB3 LYS A 52 18.965 8.270 7.385 1.00 0.00 H new ATOM 0 HG2 LYS A 52 18.378 5.909 6.701 1.00 0.00 H new ATOM 0 HG3 LYS A 52 19.710 5.362 7.699 1.00 0.00 H new ATOM 0 HD2 LYS A 52 17.327 6.971 8.716 1.00 0.00 H new ATOM 0 HD3 LYS A 52 17.474 5.228 8.830 1.00 0.00 H new ATOM 0 HE2 LYS A 52 18.096 6.017 10.958 1.00 0.00 H new ATOM 0 HE3 LYS A 52 19.613 5.613 10.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 20.304 7.701 10.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 18.829 8.340 9.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 19.031 7.957 11.385 1.00 0.00 H new ATOM 842 N LYS A 53 22.614 7.032 6.865 1.00 0.00 N ATOM 843 CA LYS A 53 23.906 6.395 6.909 1.00 0.00 C ATOM 844 C LYS A 53 23.795 4.920 7.310 1.00 0.00 C ATOM 845 O LYS A 53 23.698 4.590 8.490 1.00 0.00 O ATOM 846 CB LYS A 53 24.842 7.137 7.878 1.00 0.00 C ATOM 847 CG LYS A 53 26.273 6.632 7.869 1.00 0.00 C ATOM 848 CD LYS A 53 26.993 6.984 6.576 1.00 0.00 C ATOM 849 CE LYS A 53 28.357 6.316 6.496 1.00 0.00 C ATOM 850 NZ LYS A 53 29.226 6.622 7.660 1.00 0.00 N ATOM 0 H LYS A 53 22.479 7.747 7.580 1.00 0.00 H new ATOM 0 HA LYS A 53 24.326 6.439 5.904 1.00 0.00 H new ATOM 0 HB2 LYS A 53 24.841 8.197 7.626 1.00 0.00 H new ATOM 0 HB3 LYS A 53 24.444 7.049 8.889 1.00 0.00 H new ATOM 0 HG2 LYS A 53 26.814 7.060 8.713 1.00 0.00 H new ATOM 0 HG3 LYS A 53 26.277 5.550 8.003 1.00 0.00 H new ATOM 0 HD2 LYS A 53 26.386 6.676 5.725 1.00 0.00 H new ATOM 0 HD3 LYS A 53 27.112 8.065 6.508 1.00 0.00 H new ATOM 0 HE2 LYS A 53 28.222 5.237 6.425 1.00 0.00 H new ATOM 0 HE3 LYS A 53 28.858 6.636 5.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 30.183 6.253 7.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 29.272 7.652 7.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 28.833 6.176 8.513 1.00 0.00 H new ATOM 864 N GLY A 54 23.746 4.059 6.324 1.00 0.00 N ATOM 865 CA GLY A 54 23.751 2.644 6.578 1.00 0.00 C ATOM 866 C GLY A 54 22.387 2.011 6.470 1.00 0.00 C ATOM 867 O GLY A 54 22.258 0.806 6.611 1.00 0.00 O ATOM 0 H GLY A 54 23.702 4.316 5.338 1.00 0.00 H new ATOM 0 HA2 GLY A 54 24.426 2.158 5.873 1.00 0.00 H new ATOM 0 HA3 GLY A 54 24.149 2.463 7.576 1.00 0.00 H new ATOM 871 N TYR A 55 21.363 2.802 6.231 1.00 0.00 N ATOM 872 CA TYR A 55 20.046 2.294 6.094 1.00 0.00 C ATOM 873 C TYR A 55 19.327 3.082 5.008 1.00 0.00 C ATOM 874 O TYR A 55 19.377 4.303 4.994 1.00 0.00 O ATOM 875 CB TYR A 55 19.345 2.385 7.467 1.00 0.00 C ATOM 876 CG TYR A 55 17.852 2.213 7.457 1.00 0.00 C ATOM 877 CD1 TYR A 55 17.069 3.276 7.122 1.00 0.00 C ATOM 878 CD2 TYR A 55 17.240 1.022 7.800 1.00 0.00 C ATOM 879 CE1 TYR A 55 15.710 3.202 7.114 1.00 0.00 C ATOM 880 CE2 TYR A 55 15.862 0.914 7.796 1.00 0.00 C ATOM 881 CZ TYR A 55 15.097 2.013 7.451 1.00 0.00 C ATOM 882 OH TYR A 55 13.724 1.920 7.446 1.00 0.00 O ATOM 0 H TYR A 55 21.437 3.814 6.129 1.00 0.00 H new ATOM 0 HA TYR A 55 20.043 1.247 5.789 1.00 0.00 H new ATOM 0 HB2 TYR A 55 19.774 1.627 8.123 1.00 0.00 H new ATOM 0 HB3 TYR A 55 19.576 3.355 7.907 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.542 4.209 6.854 1.00 0.00 H new ATOM 0 HD2 TYR A 55 17.843 0.169 8.073 1.00 0.00 H new ATOM 0 HE1 TYR A 55 15.118 4.065 6.847 1.00 0.00 H new ATOM 0 HE2 TYR A 55 15.387 -0.020 8.060 1.00 0.00 H new ATOM 0 HH TYR A 55 13.457 1.014 7.706 1.00 0.00 H new ATOM 892 N VAL A 56 18.686 2.395 4.107 1.00 0.00 N ATOM 893 CA VAL A 56 17.971 3.030 3.021 1.00 0.00 C ATOM 894 C VAL A 56 16.547 2.472 2.965 1.00 0.00 C ATOM 895 O VAL A 56 16.330 1.289 3.217 1.00 0.00 O ATOM 896 CB VAL A 56 18.705 2.827 1.646 1.00 0.00 C ATOM 897 CG1 VAL A 56 17.894 3.388 0.504 1.00 0.00 C ATOM 898 CG2 VAL A 56 20.072 3.500 1.652 1.00 0.00 C ATOM 0 H VAL A 56 18.640 1.376 4.099 1.00 0.00 H new ATOM 0 HA VAL A 56 17.936 4.104 3.206 1.00 0.00 H new ATOM 0 HB VAL A 56 18.827 1.753 1.507 1.00 0.00 H new ATOM 0 HG11 VAL A 56 18.429 3.232 -0.433 1.00 0.00 H new ATOM 0 HG12 VAL A 56 16.929 2.882 0.460 1.00 0.00 H new ATOM 0 HG13 VAL A 56 17.737 4.455 0.659 1.00 0.00 H new ATOM 0 HG21 VAL A 56 20.558 3.344 0.689 1.00 0.00 H new ATOM 0 HG22 VAL A 56 19.951 4.569 1.829 1.00 0.00 H new ATOM 0 HG23 VAL A 56 20.686 3.069 2.443 1.00 0.00 H new ATOM 908 N LEU A 57 15.596 3.314 2.677 1.00 0.00 N ATOM 909 CA LEU A 57 14.223 2.926 2.590 1.00 0.00 C ATOM 910 C LEU A 57 13.681 3.157 1.177 1.00 0.00 C ATOM 911 O LEU A 57 13.553 4.311 0.704 1.00 0.00 O ATOM 912 CB LEU A 57 13.413 3.644 3.695 1.00 0.00 C ATOM 913 CG LEU A 57 11.891 3.773 3.535 1.00 0.00 C ATOM 914 CD1 LEU A 57 11.212 2.486 3.203 1.00 0.00 C ATOM 915 CD2 LEU A 57 11.252 4.399 4.762 1.00 0.00 C ATOM 0 H LEU A 57 15.759 4.304 2.494 1.00 0.00 H new ATOM 0 HA LEU A 57 14.123 1.855 2.768 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.603 3.123 4.634 1.00 0.00 H new ATOM 0 HB3 LEU A 57 13.820 4.650 3.801 1.00 0.00 H new ATOM 0 HG LEU A 57 11.748 4.435 2.681 1.00 0.00 H new ATOM 0 HD11 LEU A 57 10.140 2.655 3.105 1.00 0.00 H new ATOM 0 HD12 LEU A 57 11.605 2.099 2.263 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.394 1.763 3.998 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.175 4.474 4.613 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.455 3.778 5.635 1.00 0.00 H new ATOM 0 HD23 LEU A 57 11.667 5.394 4.921 1.00 0.00 H new ATOM 927 N PHE A 58 13.401 2.047 0.520 1.00 0.00 N ATOM 928 CA PHE A 58 12.850 2.003 -0.827 1.00 0.00 C ATOM 929 C PHE A 58 11.518 1.293 -0.831 1.00 0.00 C ATOM 930 O PHE A 58 11.326 0.307 -0.134 1.00 0.00 O ATOM 931 CB PHE A 58 13.770 1.244 -1.796 1.00 0.00 C ATOM 932 CG PHE A 58 14.804 2.046 -2.523 1.00 0.00 C ATOM 933 CD1 PHE A 58 14.434 2.839 -3.587 1.00 0.00 C ATOM 934 CD2 PHE A 58 16.131 1.971 -2.190 1.00 0.00 C ATOM 935 CE1 PHE A 58 15.365 3.545 -4.309 1.00 0.00 C ATOM 936 CE2 PHE A 58 17.070 2.683 -2.907 1.00 0.00 C ATOM 937 CZ PHE A 58 16.685 3.470 -3.968 1.00 0.00 C ATOM 0 H PHE A 58 13.555 1.121 0.919 1.00 0.00 H new ATOM 0 HA PHE A 58 12.745 3.039 -1.151 1.00 0.00 H new ATOM 0 HB2 PHE A 58 14.281 0.462 -1.235 1.00 0.00 H new ATOM 0 HB3 PHE A 58 13.144 0.747 -2.537 1.00 0.00 H new ATOM 0 HD1 PHE A 58 13.391 2.907 -3.859 1.00 0.00 H new ATOM 0 HD2 PHE A 58 16.443 1.352 -1.362 1.00 0.00 H new ATOM 0 HE1 PHE A 58 15.054 4.157 -5.143 1.00 0.00 H new ATOM 0 HE2 PHE A 58 18.113 2.622 -2.634 1.00 0.00 H new ATOM 0 HZ PHE A 58 17.423 4.025 -4.528 1.00 0.00 H new ATOM 947 N ARG A 59 10.615 1.776 -1.619 1.00 0.00 N ATOM 948 CA ARG A 59 9.360 1.116 -1.776 1.00 0.00 C ATOM 949 C ARG A 59 9.125 0.771 -3.220 1.00 0.00 C ATOM 950 O ARG A 59 9.371 1.573 -4.120 1.00 0.00 O ATOM 951 CB ARG A 59 8.199 1.934 -1.218 1.00 0.00 C ATOM 952 CG ARG A 59 8.054 3.309 -1.812 1.00 0.00 C ATOM 953 CD ARG A 59 6.857 4.034 -1.247 1.00 0.00 C ATOM 954 NE ARG A 59 6.828 3.977 0.220 1.00 0.00 N ATOM 955 CZ ARG A 59 5.951 4.591 1.025 1.00 0.00 C ATOM 956 NH1 ARG A 59 5.080 5.473 0.549 1.00 0.00 N ATOM 957 NH2 ARG A 59 5.962 4.314 2.312 1.00 0.00 N ATOM 0 H ARG A 59 10.723 2.630 -2.167 1.00 0.00 H new ATOM 0 HA ARG A 59 9.405 0.195 -1.195 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.273 1.383 -1.382 1.00 0.00 H new ATOM 0 HB3 ARG A 59 8.326 2.031 -0.140 1.00 0.00 H new ATOM 0 HG2 ARG A 59 8.957 3.888 -1.616 1.00 0.00 H new ATOM 0 HG3 ARG A 59 7.955 3.230 -2.895 1.00 0.00 H new ATOM 0 HD2 ARG A 59 6.877 5.075 -1.570 1.00 0.00 H new ATOM 0 HD3 ARG A 59 5.943 3.593 -1.646 1.00 0.00 H new ATOM 0 HE ARG A 59 7.548 3.413 0.671 1.00 0.00 H new ATOM 0 HH11 ARG A 59 5.070 5.694 -0.447 1.00 0.00 H new ATOM 0 HH12 ARG A 59 4.420 5.929 1.179 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.632 3.640 2.683 1.00 0.00 H new ATOM 0 HH22 ARG A 59 5.301 4.773 2.938 1.00 0.00 H new ATOM 971 N LYS A 60 8.698 -0.411 -3.432 1.00 0.00 N ATOM 972 CA LYS A 60 8.349 -0.903 -4.723 1.00 0.00 C ATOM 973 C LYS A 60 6.915 -1.319 -4.674 1.00 0.00 C ATOM 974 O LYS A 60 6.532 -2.179 -3.898 1.00 0.00 O ATOM 975 CB LYS A 60 9.219 -2.092 -5.097 1.00 0.00 C ATOM 976 CG LYS A 60 8.847 -2.790 -6.384 1.00 0.00 C ATOM 977 CD LYS A 60 9.248 -1.998 -7.611 1.00 0.00 C ATOM 978 CE LYS A 60 10.747 -1.979 -7.799 1.00 0.00 C ATOM 979 NZ LYS A 60 11.089 -1.538 -9.162 1.00 0.00 N ATOM 0 H LYS A 60 8.573 -1.098 -2.688 1.00 0.00 H new ATOM 0 HA LYS A 60 8.504 -0.128 -5.474 1.00 0.00 H new ATOM 0 HB2 LYS A 60 10.253 -1.754 -5.173 1.00 0.00 H new ATOM 0 HB3 LYS A 60 9.180 -2.819 -4.285 1.00 0.00 H new ATOM 0 HG2 LYS A 60 9.327 -3.768 -6.414 1.00 0.00 H new ATOM 0 HG3 LYS A 60 7.771 -2.962 -6.402 1.00 0.00 H new ATOM 0 HD2 LYS A 60 8.776 -2.430 -8.493 1.00 0.00 H new ATOM 0 HD3 LYS A 60 8.880 -0.976 -7.521 1.00 0.00 H new ATOM 0 HE2 LYS A 60 11.203 -1.310 -7.069 1.00 0.00 H new ATOM 0 HE3 LYS A 60 11.155 -2.974 -7.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 12.120 -1.433 -9.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 10.757 -2.245 -9.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 10.631 -0.625 -9.357 1.00 0.00 H new ATOM 993 N GLN A 61 6.137 -0.696 -5.448 1.00 0.00 N ATOM 994 CA GLN A 61 4.751 -0.974 -5.499 1.00 0.00 C ATOM 995 C GLN A 61 4.466 -1.867 -6.669 1.00 0.00 C ATOM 996 O GLN A 61 5.218 -1.866 -7.653 1.00 0.00 O ATOM 997 CB GLN A 61 3.908 0.312 -5.533 1.00 0.00 C ATOM 998 CG GLN A 61 4.647 1.569 -5.930 1.00 0.00 C ATOM 999 CD GLN A 61 5.660 2.129 -4.912 1.00 0.00 C ATOM 1000 OE1 GLN A 61 6.691 2.685 -5.281 1.00 0.00 O ATOM 1001 NE2 GLN A 61 5.340 2.066 -3.660 1.00 0.00 N ATOM 0 H GLN A 61 6.440 0.041 -6.084 1.00 0.00 H new ATOM 0 HA GLN A 61 4.463 -1.495 -4.586 1.00 0.00 H new ATOM 0 HB2 GLN A 61 3.081 0.164 -6.227 1.00 0.00 H new ATOM 0 HB3 GLN A 61 3.472 0.465 -4.546 1.00 0.00 H new ATOM 0 HG2 GLN A 61 5.176 1.372 -6.863 1.00 0.00 H new ATOM 0 HG3 GLN A 61 3.910 2.345 -6.139 1.00 0.00 H new ATOM 0 HE21 GLN A 61 4.479 1.599 -3.377 1.00 0.00 H new ATOM 0 HE22 GLN A 61 5.949 2.483 -2.956 1.00 0.00 H new ATOM 1010 N MET A 62 3.425 -2.628 -6.568 1.00 0.00 N ATOM 1011 CA MET A 62 3.107 -3.588 -7.578 1.00 0.00 C ATOM 1012 C MET A 62 1.629 -3.558 -7.898 1.00 0.00 C ATOM 1013 O MET A 62 0.845 -2.949 -7.169 1.00 0.00 O ATOM 1014 CB MET A 62 3.604 -4.980 -7.174 1.00 0.00 C ATOM 1015 CG MET A 62 3.036 -5.513 -5.869 1.00 0.00 C ATOM 1016 SD MET A 62 3.828 -7.054 -5.356 1.00 0.00 S ATOM 1017 CE MET A 62 5.534 -6.516 -5.134 1.00 0.00 C ATOM 0 H MET A 62 2.771 -2.603 -5.785 1.00 0.00 H new ATOM 0 HA MET A 62 3.629 -3.325 -8.498 1.00 0.00 H new ATOM 0 HB2 MET A 62 3.360 -5.682 -7.972 1.00 0.00 H new ATOM 0 HB3 MET A 62 4.691 -4.952 -7.095 1.00 0.00 H new ATOM 0 HG2 MET A 62 3.163 -4.764 -5.087 1.00 0.00 H new ATOM 0 HG3 MET A 62 1.964 -5.678 -5.982 1.00 0.00 H new ATOM 0 HE1 MET A 62 6.074 -7.254 -4.542 1.00 0.00 H new ATOM 0 HE2 MET A 62 6.012 -6.412 -6.108 1.00 0.00 H new ATOM 0 HE3 MET A 62 5.549 -5.556 -4.618 1.00 0.00 H new ATOM 1027 N ASP A 63 1.262 -4.230 -8.962 1.00 0.00 N ATOM 1028 CA ASP A 63 -0.086 -4.152 -9.522 1.00 0.00 C ATOM 1029 C ASP A 63 -1.052 -5.169 -8.904 1.00 0.00 C ATOM 1030 O ASP A 63 -2.271 -5.032 -9.009 1.00 0.00 O ATOM 1031 CB ASP A 63 0.000 -4.330 -11.043 1.00 0.00 C ATOM 1032 CG ASP A 63 -1.333 -4.257 -11.736 1.00 0.00 C ATOM 1033 OD1 ASP A 63 -1.866 -3.147 -11.940 1.00 0.00 O ATOM 1034 OD2 ASP A 63 -1.869 -5.304 -12.121 1.00 0.00 O ATOM 0 H ASP A 63 1.886 -4.853 -9.474 1.00 0.00 H new ATOM 0 HA ASP A 63 -0.496 -3.171 -9.280 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.656 -3.562 -11.453 1.00 0.00 H new ATOM 0 HB3 ASP A 63 0.461 -5.293 -11.262 1.00 0.00 H new ATOM 1039 N ASP A 64 -0.521 -6.171 -8.273 1.00 0.00 N ATOM 1040 CA ASP A 64 -1.352 -7.188 -7.636 1.00 0.00 C ATOM 1041 C ASP A 64 -1.637 -6.796 -6.183 1.00 0.00 C ATOM 1042 O ASP A 64 -0.974 -5.898 -5.634 1.00 0.00 O ATOM 1043 CB ASP A 64 -0.670 -8.566 -7.736 1.00 0.00 C ATOM 1044 CG ASP A 64 -1.464 -9.708 -7.132 1.00 0.00 C ATOM 1045 OD1 ASP A 64 -2.702 -9.801 -7.349 1.00 0.00 O ATOM 1046 OD2 ASP A 64 -0.856 -10.580 -6.479 1.00 0.00 O ATOM 0 H ASP A 64 0.483 -6.321 -8.176 1.00 0.00 H new ATOM 0 HA ASP A 64 -2.309 -7.256 -8.154 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -0.481 -8.788 -8.786 1.00 0.00 H new ATOM 0 HB3 ASP A 64 0.300 -8.514 -7.241 1.00 0.00 H new ATOM 1051 N ILE A 65 -2.625 -7.413 -5.569 1.00 0.00 N ATOM 1052 CA ILE A 65 -2.944 -7.094 -4.199 1.00 0.00 C ATOM 1053 C ILE A 65 -2.310 -8.094 -3.259 1.00 0.00 C ATOM 1054 O ILE A 65 -1.762 -9.106 -3.692 1.00 0.00 O ATOM 1055 CB ILE A 65 -4.463 -6.984 -3.905 1.00 0.00 C ATOM 1056 CG1 ILE A 65 -5.184 -8.309 -4.158 1.00 0.00 C ATOM 1057 CG2 ILE A 65 -5.085 -5.842 -4.693 1.00 0.00 C ATOM 1058 CD1 ILE A 65 -6.664 -8.290 -3.817 1.00 0.00 C ATOM 0 H ILE A 65 -3.213 -8.130 -5.993 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.529 -6.100 -4.029 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.583 -6.758 -2.845 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.068 -8.577 -5.208 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.698 -9.091 -3.574 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.151 -5.784 -4.471 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -4.605 -4.904 -4.414 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -4.946 -6.018 -5.760 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.098 -9.268 -4.026 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.791 -8.055 -2.760 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -7.167 -7.534 -4.420 1.00 0.00 H new ATOM 1070 N SER A 66 -2.391 -7.800 -1.997 1.00 0.00 N ATOM 1071 CA SER A 66 -1.781 -8.574 -0.953 1.00 0.00 C ATOM 1072 C SER A 66 -2.379 -9.992 -0.905 1.00 0.00 C ATOM 1073 O SER A 66 -3.595 -10.157 -1.005 1.00 0.00 O ATOM 1074 CB SER A 66 -2.063 -7.851 0.321 1.00 0.00 C ATOM 1075 OG SER A 66 -2.226 -6.458 0.047 1.00 0.00 O ATOM 0 H SER A 66 -2.901 -6.987 -1.651 1.00 0.00 H new ATOM 0 HA SER A 66 -0.710 -8.684 -1.122 1.00 0.00 H new ATOM 0 HB2 SER A 66 -2.964 -8.250 0.787 1.00 0.00 H new ATOM 0 HB3 SER A 66 -1.246 -8.001 1.027 1.00 0.00 H new ATOM 0 HG SER A 66 -2.940 -6.095 0.611 1.00 0.00 H new ATOM 1081 N PRO A 67 -1.534 -11.015 -0.736 1.00 0.00 N ATOM 1082 CA PRO A 67 -1.953 -12.421 -0.755 1.00 0.00 C ATOM 1083 C PRO A 67 -3.005 -12.764 0.309 1.00 0.00 C ATOM 1084 O PRO A 67 -4.023 -13.399 0.009 1.00 0.00 O ATOM 1085 CB PRO A 67 -0.660 -13.202 -0.501 1.00 0.00 C ATOM 1086 CG PRO A 67 0.314 -12.209 0.031 1.00 0.00 C ATOM 1087 CD PRO A 67 -0.088 -10.875 -0.517 1.00 0.00 C ATOM 0 HA PRO A 67 -2.435 -12.665 -1.701 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -0.824 -14.010 0.212 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -0.291 -13.658 -1.420 1.00 0.00 H new ATOM 0 HG2 PRO A 67 0.301 -12.200 1.121 1.00 0.00 H new ATOM 0 HG3 PRO A 67 1.330 -12.462 -0.273 1.00 0.00 H new ATOM 0 HD2 PRO A 67 0.136 -10.070 0.183 1.00 0.00 H new ATOM 0 HD3 PRO A 67 0.438 -10.647 -1.444 1.00 0.00 H new ATOM 1095 N LEU A 68 -2.787 -12.321 1.527 1.00 0.00 N ATOM 1096 CA LEU A 68 -3.698 -12.613 2.611 1.00 0.00 C ATOM 1097 C LEU A 68 -4.952 -11.757 2.438 1.00 0.00 C ATOM 1098 O LEU A 68 -6.056 -12.165 2.769 1.00 0.00 O ATOM 1099 CB LEU A 68 -2.999 -12.365 3.968 1.00 0.00 C ATOM 1100 CG LEU A 68 -3.483 -13.186 5.191 1.00 0.00 C ATOM 1101 CD1 LEU A 68 -4.893 -12.818 5.624 1.00 0.00 C ATOM 1102 CD2 LEU A 68 -3.402 -14.670 4.872 1.00 0.00 C ATOM 0 H LEU A 68 -1.982 -11.754 1.793 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.995 -13.662 2.595 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -1.934 -12.557 3.836 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -3.105 -11.308 4.211 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.825 -12.946 6.026 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -5.179 -13.424 6.484 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.926 -11.763 5.896 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -5.586 -13.003 4.803 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -3.742 -15.246 5.732 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -4.035 -14.893 4.013 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.371 -14.937 4.642 1.00 0.00 H new ATOM 1114 N SER A 69 -4.788 -10.605 1.845 1.00 0.00 N ATOM 1115 CA SER A 69 -5.908 -9.749 1.567 1.00 0.00 C ATOM 1116 C SER A 69 -6.841 -10.373 0.529 1.00 0.00 C ATOM 1117 O SER A 69 -7.991 -10.013 0.463 1.00 0.00 O ATOM 1118 CB SER A 69 -5.456 -8.383 1.132 1.00 0.00 C ATOM 1119 OG SER A 69 -4.614 -7.797 2.113 1.00 0.00 O ATOM 0 H SER A 69 -3.885 -10.237 1.544 1.00 0.00 H new ATOM 0 HA SER A 69 -6.470 -9.635 2.494 1.00 0.00 H new ATOM 0 HB2 SER A 69 -4.923 -8.456 0.184 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.323 -7.745 0.962 1.00 0.00 H new ATOM 0 HG SER A 69 -4.630 -6.822 2.017 1.00 0.00 H new ATOM 1125 N LYS A 70 -6.320 -11.280 -0.291 1.00 0.00 N ATOM 1126 CA LYS A 70 -7.139 -12.016 -1.252 1.00 0.00 C ATOM 1127 C LYS A 70 -8.037 -13.020 -0.548 1.00 0.00 C ATOM 1128 O LYS A 70 -9.164 -13.247 -0.974 1.00 0.00 O ATOM 1129 CB LYS A 70 -6.252 -12.760 -2.224 1.00 0.00 C ATOM 1130 CG LYS A 70 -5.294 -11.866 -2.926 1.00 0.00 C ATOM 1131 CD LYS A 70 -4.393 -12.624 -3.840 1.00 0.00 C ATOM 1132 CE LYS A 70 -3.414 -11.680 -4.454 1.00 0.00 C ATOM 1133 NZ LYS A 70 -2.668 -12.289 -5.557 1.00 0.00 N ATOM 0 H LYS A 70 -5.330 -11.525 -0.310 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.758 -11.293 -1.784 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -5.698 -13.530 -1.687 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.874 -13.269 -2.960 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -5.846 -11.120 -3.497 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.696 -11.327 -2.191 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.868 -13.404 -3.289 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.976 -13.119 -4.617 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -3.942 -10.799 -4.819 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -2.715 -11.339 -3.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -1.757 -11.801 -5.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -2.499 -13.294 -5.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -3.218 -12.206 -6.436 1.00 0.00 H new ATOM 1147 N VAL A 71 -7.539 -13.606 0.543 1.00 0.00 N ATOM 1148 CA VAL A 71 -8.307 -14.625 1.278 1.00 0.00 C ATOM 1149 C VAL A 71 -9.404 -13.910 2.067 1.00 0.00 C ATOM 1150 O VAL A 71 -10.457 -14.458 2.378 1.00 0.00 O ATOM 1151 CB VAL A 71 -7.392 -15.486 2.239 1.00 0.00 C ATOM 1152 CG1 VAL A 71 -6.071 -15.845 1.578 1.00 0.00 C ATOM 1153 CG2 VAL A 71 -7.166 -14.841 3.601 1.00 0.00 C ATOM 0 H VAL A 71 -6.621 -13.399 0.936 1.00 0.00 H new ATOM 0 HA VAL A 71 -8.743 -15.326 0.566 1.00 0.00 H new ATOM 0 HB VAL A 71 -7.944 -16.407 2.426 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -5.468 -16.436 2.267 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.262 -16.424 0.674 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.534 -14.933 1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -6.530 -15.486 4.208 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.682 -13.873 3.470 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -8.124 -14.702 4.101 1.00 0.00 H new ATOM 1163 N ASN A 72 -9.099 -12.682 2.382 1.00 0.00 N ATOM 1164 CA ASN A 72 -9.988 -11.768 3.045 1.00 0.00 C ATOM 1165 C ASN A 72 -10.983 -11.190 2.011 1.00 0.00 C ATOM 1166 O ASN A 72 -12.131 -11.603 1.953 1.00 0.00 O ATOM 1167 CB ASN A 72 -9.116 -10.685 3.695 1.00 0.00 C ATOM 1168 CG ASN A 72 -9.851 -9.506 4.278 1.00 0.00 C ATOM 1169 OD1 ASN A 72 -10.981 -9.600 4.736 1.00 0.00 O ATOM 1170 ND2 ASN A 72 -9.183 -8.382 4.290 1.00 0.00 N ATOM 0 H ASN A 72 -8.187 -12.274 2.176 1.00 0.00 H new ATOM 0 HA ASN A 72 -10.583 -12.253 3.818 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -8.527 -11.148 4.487 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -8.413 -10.316 2.948 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -9.603 -7.543 4.691 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -8.242 -8.344 3.898 1.00 0.00 H new ATOM 1177 N GLY A 73 -10.495 -10.317 1.154 1.00 0.00 N ATOM 1178 CA GLY A 73 -11.293 -9.729 0.103 1.00 0.00 C ATOM 1179 C GLY A 73 -12.321 -8.721 0.582 1.00 0.00 C ATOM 1180 O GLY A 73 -13.327 -8.528 -0.067 1.00 0.00 O ATOM 0 H GLY A 73 -9.527 -9.995 1.169 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -10.629 -9.241 -0.610 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -11.807 -10.526 -0.434 1.00 0.00 H new ATOM 1184 N TYR A 74 -12.008 -7.994 1.633 1.00 0.00 N ATOM 1185 CA TYR A 74 -12.941 -7.104 2.262 1.00 0.00 C ATOM 1186 C TYR A 74 -12.443 -5.707 2.183 1.00 0.00 C ATOM 1187 O TYR A 74 -11.233 -5.450 2.257 1.00 0.00 O ATOM 1188 CB TYR A 74 -13.198 -7.475 3.737 1.00 0.00 C ATOM 1189 CG TYR A 74 -14.236 -8.558 3.967 1.00 0.00 C ATOM 1190 CD1 TYR A 74 -14.034 -9.856 3.552 1.00 0.00 C ATOM 1191 CD2 TYR A 74 -15.430 -8.260 4.600 1.00 0.00 C ATOM 1192 CE1 TYR A 74 -14.986 -10.827 3.759 1.00 0.00 C ATOM 1193 CE2 TYR A 74 -16.389 -9.221 4.815 1.00 0.00 C ATOM 1194 CZ TYR A 74 -16.164 -10.505 4.390 1.00 0.00 C ATOM 1195 OH TYR A 74 -17.124 -11.475 4.594 1.00 0.00 O ATOM 0 H TYR A 74 -11.088 -8.009 2.074 1.00 0.00 H new ATOM 0 HA TYR A 74 -13.886 -7.196 1.726 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -12.257 -7.798 4.182 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -13.511 -6.577 4.270 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -13.111 -10.116 3.055 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -15.613 -7.249 4.933 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -14.809 -11.839 3.427 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -17.312 -8.967 5.315 1.00 0.00 H new ATOM 0 HH TYR A 74 -17.894 -11.081 5.054 1.00 0.00 H new ATOM 1205 N ILE A 75 -13.348 -4.842 1.956 1.00 0.00 N ATOM 1206 CA ILE A 75 -13.132 -3.420 1.935 1.00 0.00 C ATOM 1207 C ILE A 75 -14.152 -2.811 2.837 1.00 0.00 C ATOM 1208 O ILE A 75 -15.304 -3.249 2.820 1.00 0.00 O ATOM 1209 CB ILE A 75 -13.282 -2.889 0.501 1.00 0.00 C ATOM 1210 CG1 ILE A 75 -12.016 -3.138 -0.274 1.00 0.00 C ATOM 1211 CG2 ILE A 75 -13.686 -1.402 0.435 1.00 0.00 C ATOM 1212 CD1 ILE A 75 -12.119 -2.770 -1.725 1.00 0.00 C ATOM 0 H ILE A 75 -14.317 -5.101 1.768 1.00 0.00 H new ATOM 0 HA ILE A 75 -12.127 -3.167 2.274 1.00 0.00 H new ATOM 0 HB ILE A 75 -14.105 -3.440 0.045 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -11.204 -2.570 0.180 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -11.751 -4.192 -0.193 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -13.774 -1.095 -0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -14.644 -1.263 0.936 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -12.926 -0.796 0.929 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -11.170 -2.976 -2.221 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -12.909 -3.357 -2.194 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -12.353 -1.709 -1.816 1.00 0.00 H new ATOM 1224 N GLY A 76 -13.756 -1.849 3.624 1.00 0.00 N ATOM 1225 CA GLY A 76 -14.671 -1.287 4.540 1.00 0.00 C ATOM 1226 C GLY A 76 -14.595 0.195 4.640 1.00 0.00 C ATOM 1227 O GLY A 76 -13.497 0.812 4.646 1.00 0.00 O ATOM 0 H GLY A 76 -12.817 -1.452 3.640 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -15.682 -1.570 4.247 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -14.493 -1.717 5.526 1.00 0.00 H new ATOM 1231 N VAL A 77 -15.719 0.796 4.721 1.00 0.00 N ATOM 1232 CA VAL A 77 -15.719 2.183 4.896 1.00 0.00 C ATOM 1233 C VAL A 77 -16.133 2.545 6.260 1.00 0.00 C ATOM 1234 O VAL A 77 -16.936 1.860 6.906 1.00 0.00 O ATOM 1235 CB VAL A 77 -16.526 2.996 3.863 1.00 0.00 C ATOM 1236 CG1 VAL A 77 -16.062 2.740 2.454 1.00 0.00 C ATOM 1237 CG2 VAL A 77 -18.003 2.807 4.030 1.00 0.00 C ATOM 0 H VAL A 77 -16.636 0.352 4.669 1.00 0.00 H new ATOM 0 HA VAL A 77 -14.680 2.466 4.725 1.00 0.00 H new ATOM 0 HB VAL A 77 -16.329 4.049 4.061 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -16.658 3.333 1.761 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -15.012 3.019 2.360 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -16.179 1.682 2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -18.532 3.398 3.282 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -18.252 1.753 3.903 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -18.301 3.132 5.027 1.00 0.00 H new ATOM 1247 N SER A 78 -15.568 3.586 6.714 1.00 0.00 N ATOM 1248 CA SER A 78 -15.961 4.148 7.951 1.00 0.00 C ATOM 1249 C SER A 78 -17.045 5.168 7.607 1.00 0.00 C ATOM 1250 O SER A 78 -17.218 5.459 6.416 1.00 0.00 O ATOM 1251 CB SER A 78 -14.750 4.771 8.606 1.00 0.00 C ATOM 1252 OG SER A 78 -13.678 3.832 8.615 1.00 0.00 O ATOM 0 H SER A 78 -14.813 4.083 6.241 1.00 0.00 H new ATOM 0 HA SER A 78 -16.355 3.421 8.661 1.00 0.00 H new ATOM 0 HB2 SER A 78 -14.454 5.671 8.067 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.990 5.074 9.625 1.00 0.00 H new ATOM 0 HG SER A 78 -12.892 4.237 9.038 1.00 0.00 H new ATOM 1258 N ASP A 79 -17.729 5.717 8.605 1.00 0.00 N ATOM 1259 CA ASP A 79 -18.901 6.632 8.413 1.00 0.00 C ATOM 1260 C ASP A 79 -18.674 7.737 7.365 1.00 0.00 C ATOM 1261 O ASP A 79 -19.569 8.059 6.583 1.00 0.00 O ATOM 1262 CB ASP A 79 -19.309 7.256 9.747 1.00 0.00 C ATOM 1263 CG ASP A 79 -20.465 8.224 9.615 1.00 0.00 C ATOM 1264 OD1 ASP A 79 -21.629 7.773 9.565 1.00 0.00 O ATOM 1265 OD2 ASP A 79 -20.233 9.444 9.580 1.00 0.00 O ATOM 0 H ASP A 79 -17.502 5.552 9.586 1.00 0.00 H new ATOM 0 HA ASP A 79 -19.704 6.006 8.024 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -19.583 6.464 10.444 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -18.453 7.777 10.176 1.00 0.00 H new ATOM 1270 N ASN A 80 -17.460 8.233 7.296 1.00 0.00 N ATOM 1271 CA ASN A 80 -17.097 9.320 6.373 1.00 0.00 C ATOM 1272 C ASN A 80 -16.717 8.789 5.012 1.00 0.00 C ATOM 1273 O ASN A 80 -16.109 9.493 4.222 1.00 0.00 O ATOM 1274 CB ASN A 80 -15.932 10.158 6.921 1.00 0.00 C ATOM 1275 CG ASN A 80 -16.334 11.118 8.009 1.00 0.00 C ATOM 1276 OD1 ASN A 80 -16.688 12.263 7.739 1.00 0.00 O ATOM 1277 ND2 ASN A 80 -16.279 10.681 9.230 1.00 0.00 N ATOM 0 H ASN A 80 -16.685 7.904 7.872 1.00 0.00 H new ATOM 0 HA ASN A 80 -17.981 9.951 6.278 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -15.164 9.487 7.306 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -15.483 10.719 6.101 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -16.535 11.295 10.003 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -15.980 9.724 9.416 1.00 0.00 H new ATOM 1284 N GLY A 81 -17.070 7.544 4.750 1.00 0.00 N ATOM 1285 CA GLY A 81 -16.770 6.915 3.503 1.00 0.00 C ATOM 1286 C GLY A 81 -15.314 6.694 3.372 1.00 0.00 C ATOM 1287 O GLY A 81 -14.736 6.949 2.335 1.00 0.00 O ATOM 0 H GLY A 81 -17.574 6.949 5.407 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -17.296 5.963 3.433 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -17.125 7.536 2.681 1.00 0.00 H new ATOM 1291 N VAL A 82 -14.712 6.279 4.455 1.00 0.00 N ATOM 1292 CA VAL A 82 -13.299 6.005 4.465 1.00 0.00 C ATOM 1293 C VAL A 82 -13.068 4.693 3.745 1.00 0.00 C ATOM 1294 O VAL A 82 -13.464 3.669 4.224 1.00 0.00 O ATOM 1295 CB VAL A 82 -12.735 5.950 5.899 1.00 0.00 C ATOM 1296 CG1 VAL A 82 -11.225 5.781 5.875 1.00 0.00 C ATOM 1297 CG2 VAL A 82 -13.113 7.209 6.657 1.00 0.00 C ATOM 0 H VAL A 82 -15.181 6.122 5.347 1.00 0.00 H new ATOM 0 HA VAL A 82 -12.773 6.813 3.957 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.167 5.089 6.409 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.847 5.744 6.897 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.971 4.854 5.361 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -10.773 6.623 5.351 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.710 7.160 7.668 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.703 8.079 6.145 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -14.199 7.294 6.703 1.00 0.00 H new ATOM 1307 N ILE A 83 -12.338 4.772 2.678 1.00 0.00 N ATOM 1308 CA ILE A 83 -12.125 3.730 1.632 1.00 0.00 C ATOM 1309 C ILE A 83 -11.081 2.679 2.060 1.00 0.00 C ATOM 1310 O ILE A 83 -10.297 2.171 1.275 1.00 0.00 O ATOM 1311 CB ILE A 83 -11.785 4.413 0.247 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -12.871 5.440 -0.089 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.676 3.401 -0.902 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -14.273 4.868 -0.021 1.00 0.00 C ATOM 0 H ILE A 83 -11.818 5.623 2.466 1.00 0.00 H new ATOM 0 HA ILE A 83 -13.054 3.174 1.505 1.00 0.00 H new ATOM 0 HB ILE A 83 -10.812 4.893 0.352 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -12.794 6.280 0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.694 5.833 -1.090 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.441 3.926 -1.828 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -10.886 2.683 -0.681 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -12.624 2.874 -1.014 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -14.996 5.645 -0.269 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.366 4.046 -0.731 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -14.468 4.500 0.987 1.00 0.00 H new ATOM 1326 N SER A 84 -11.082 2.362 3.292 1.00 0.00 N ATOM 1327 CA SER A 84 -9.983 1.617 3.840 1.00 0.00 C ATOM 1328 C SER A 84 -10.241 0.106 3.777 1.00 0.00 C ATOM 1329 O SER A 84 -11.372 -0.354 3.770 1.00 0.00 O ATOM 1330 CB SER A 84 -9.787 2.084 5.277 1.00 0.00 C ATOM 1331 OG SER A 84 -11.050 2.166 5.953 1.00 0.00 O ATOM 0 H SER A 84 -11.821 2.598 3.954 1.00 0.00 H new ATOM 0 HA SER A 84 -9.080 1.796 3.256 1.00 0.00 H new ATOM 0 HB2 SER A 84 -9.129 1.393 5.804 1.00 0.00 H new ATOM 0 HB3 SER A 84 -9.299 3.058 5.286 1.00 0.00 H new ATOM 0 HG SER A 84 -11.049 1.559 6.722 1.00 0.00 H new ATOM 1337 N THR A 85 -9.210 -0.665 3.658 1.00 0.00 N ATOM 1338 CA THR A 85 -9.402 -2.070 3.636 1.00 0.00 C ATOM 1339 C THR A 85 -9.324 -2.607 5.047 1.00 0.00 C ATOM 1340 O THR A 85 -8.591 -2.059 5.904 1.00 0.00 O ATOM 1341 CB THR A 85 -8.418 -2.803 2.681 1.00 0.00 C ATOM 1342 OG1 THR A 85 -7.075 -2.489 2.992 1.00 0.00 O ATOM 1343 CG2 THR A 85 -8.693 -2.430 1.240 1.00 0.00 C ATOM 0 H THR A 85 -8.244 -0.349 3.576 1.00 0.00 H new ATOM 0 HA THR A 85 -10.394 -2.269 3.231 1.00 0.00 H new ATOM 0 HB THR A 85 -8.572 -3.874 2.815 1.00 0.00 H new ATOM 0 HG1 THR A 85 -6.562 -2.391 2.163 1.00 0.00 H new ATOM 0 HG21 THR A 85 -7.993 -2.954 0.589 1.00 0.00 H new ATOM 0 HG22 THR A 85 -9.713 -2.713 0.979 1.00 0.00 H new ATOM 0 HG23 THR A 85 -8.571 -1.354 1.113 1.00 0.00 H new ATOM 1351 N PHE A 86 -10.122 -3.603 5.319 1.00 0.00 N ATOM 1352 CA PHE A 86 -10.161 -4.232 6.611 1.00 0.00 C ATOM 1353 C PHE A 86 -10.157 -5.713 6.405 1.00 0.00 C ATOM 1354 O PHE A 86 -10.343 -6.174 5.279 1.00 0.00 O ATOM 1355 CB PHE A 86 -11.444 -3.904 7.378 1.00 0.00 C ATOM 1356 CG PHE A 86 -11.589 -2.528 7.937 1.00 0.00 C ATOM 1357 CD1 PHE A 86 -11.801 -1.448 7.118 1.00 0.00 C ATOM 1358 CD2 PHE A 86 -11.569 -2.336 9.301 1.00 0.00 C ATOM 1359 CE1 PHE A 86 -11.983 -0.188 7.648 1.00 0.00 C ATOM 1360 CE2 PHE A 86 -11.762 -1.084 9.844 1.00 0.00 C ATOM 1361 CZ PHE A 86 -11.969 -0.006 9.014 1.00 0.00 C ATOM 0 H PHE A 86 -10.771 -4.005 4.642 1.00 0.00 H new ATOM 0 HA PHE A 86 -9.303 -3.873 7.179 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -12.288 -4.085 6.712 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -11.531 -4.611 8.203 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -11.826 -1.586 6.047 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -11.400 -3.179 9.955 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -12.137 0.656 6.992 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -11.751 -0.950 10.916 1.00 0.00 H new ATOM 0 HZ PHE A 86 -12.120 0.979 9.431 1.00 0.00 H new ATOM 1371 N HIS A 87 -9.985 -6.451 7.467 1.00 0.00 N ATOM 1372 CA HIS A 87 -10.080 -7.886 7.416 1.00 0.00 C ATOM 1373 C HIS A 87 -11.388 -8.279 8.078 1.00 0.00 C ATOM 1374 O HIS A 87 -11.559 -8.073 9.282 1.00 0.00 O ATOM 1375 CB HIS A 87 -8.878 -8.553 8.124 1.00 0.00 C ATOM 1376 CG HIS A 87 -8.837 -10.060 7.986 1.00 0.00 C ATOM 1377 ND1 HIS A 87 -7.980 -10.732 7.139 1.00 0.00 N ATOM 1378 CD2 HIS A 87 -9.565 -11.021 8.615 1.00 0.00 C ATOM 1379 CE1 HIS A 87 -8.206 -12.042 7.271 1.00 0.00 C ATOM 1380 NE2 HIS A 87 -9.164 -12.274 8.160 1.00 0.00 N ATOM 0 H HIS A 87 -9.775 -6.076 8.392 1.00 0.00 H new ATOM 0 HA HIS A 87 -10.059 -8.228 6.381 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -7.955 -8.137 7.720 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -8.906 -8.297 9.183 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -10.334 -10.840 9.352 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -7.679 -12.811 6.726 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -9.530 -13.181 8.449 1.00 0.00 H new ATOM 1388 N GLY A 88 -12.303 -8.800 7.304 1.00 0.00 N ATOM 1389 CA GLY A 88 -13.599 -9.158 7.833 1.00 0.00 C ATOM 1390 C GLY A 88 -14.523 -7.956 7.887 1.00 0.00 C ATOM 1391 O GLY A 88 -14.236 -6.932 7.248 1.00 0.00 O ATOM 0 H GLY A 88 -12.179 -8.987 6.309 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -14.045 -9.935 7.213 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -13.483 -9.576 8.833 1.00 0.00 H new ATOM 1395 N ARG A 89 -15.637 -8.090 8.614 1.00 0.00 N ATOM 1396 CA ARG A 89 -16.614 -7.003 8.786 1.00 0.00 C ATOM 1397 C ARG A 89 -15.937 -5.753 9.354 1.00 0.00 C ATOM 1398 O ARG A 89 -15.412 -5.769 10.488 1.00 0.00 O ATOM 1399 CB ARG A 89 -17.753 -7.423 9.721 1.00 0.00 C ATOM 1400 CG ARG A 89 -18.589 -8.590 9.231 1.00 0.00 C ATOM 1401 CD ARG A 89 -19.476 -8.221 8.051 1.00 0.00 C ATOM 1402 NE ARG A 89 -20.164 -9.397 7.513 1.00 0.00 N ATOM 1403 CZ ARG A 89 -20.361 -9.643 6.214 1.00 0.00 C ATOM 1404 NH1 ARG A 89 -19.884 -8.816 5.290 1.00 0.00 N ATOM 1405 NH2 ARG A 89 -21.017 -10.726 5.840 1.00 0.00 N ATOM 0 H ARG A 89 -15.889 -8.951 9.099 1.00 0.00 H new ATOM 0 HA ARG A 89 -17.027 -6.780 7.802 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -17.329 -7.682 10.691 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -18.409 -6.566 9.877 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -17.930 -9.409 8.943 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -19.211 -8.955 10.048 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -20.211 -7.479 8.364 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -18.872 -7.761 7.269 1.00 0.00 H new ATOM 0 HE ARG A 89 -20.520 -10.081 8.181 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -19.362 -7.985 5.570 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -20.039 -9.012 4.301 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -21.373 -11.374 6.542 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -21.168 -10.914 4.849 1.00 0.00 H new ATOM 1419 N PRO A 90 -15.922 -4.674 8.576 1.00 0.00 N ATOM 1420 CA PRO A 90 -15.300 -3.435 8.962 1.00 0.00 C ATOM 1421 C PRO A 90 -16.125 -2.658 9.964 1.00 0.00 C ATOM 1422 O PRO A 90 -16.986 -1.849 9.619 1.00 0.00 O ATOM 1423 CB PRO A 90 -15.164 -2.666 7.660 1.00 0.00 C ATOM 1424 CG PRO A 90 -16.232 -3.207 6.777 1.00 0.00 C ATOM 1425 CD PRO A 90 -16.510 -4.599 7.237 1.00 0.00 C ATOM 0 HA PRO A 90 -14.346 -3.606 9.460 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -15.289 -1.595 7.820 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.178 -2.809 7.219 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -17.131 -2.593 6.838 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -15.912 -3.201 5.735 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -17.581 -4.801 7.263 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.064 -5.334 6.567 1.00 0.00 H new ATOM 1433 N GLU A 91 -15.932 -2.977 11.188 1.00 0.00 N ATOM 1434 CA GLU A 91 -16.581 -2.287 12.247 1.00 0.00 C ATOM 1435 C GLU A 91 -15.598 -1.242 12.782 1.00 0.00 C ATOM 1436 O GLU A 91 -14.387 -1.386 12.585 1.00 0.00 O ATOM 1437 CB GLU A 91 -16.993 -3.293 13.332 1.00 0.00 C ATOM 1438 CG GLU A 91 -15.832 -4.023 13.945 1.00 0.00 C ATOM 1439 CD GLU A 91 -16.242 -5.047 14.945 1.00 0.00 C ATOM 1440 OE1 GLU A 91 -16.425 -4.701 16.119 1.00 0.00 O ATOM 1441 OE2 GLU A 91 -16.370 -6.222 14.581 1.00 0.00 O ATOM 0 H GLU A 91 -15.315 -3.730 11.491 1.00 0.00 H new ATOM 0 HA GLU A 91 -17.488 -1.787 11.908 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -17.536 -2.767 14.117 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -17.681 -4.019 12.900 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -15.258 -4.506 13.155 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -15.170 -3.302 14.424 1.00 0.00 H new ATOM 1448 N PRO A 92 -16.070 -0.199 13.478 1.00 0.00 N ATOM 1449 CA PRO A 92 -15.193 0.851 14.005 1.00 0.00 C ATOM 1450 C PRO A 92 -14.317 0.330 15.148 1.00 0.00 C ATOM 1451 O PRO A 92 -13.367 0.977 15.571 1.00 0.00 O ATOM 1452 CB PRO A 92 -16.149 1.935 14.504 1.00 0.00 C ATOM 1453 CG PRO A 92 -17.479 1.275 14.659 1.00 0.00 C ATOM 1454 CD PRO A 92 -17.479 0.034 13.804 1.00 0.00 C ATOM 0 HA PRO A 92 -14.501 1.220 13.248 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -15.807 2.350 15.452 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -16.204 2.762 13.796 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -17.659 1.020 15.703 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -18.278 1.950 14.353 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -17.906 -0.814 14.339 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -18.075 0.175 12.902 1.00 0.00 H new ATOM 1462 N ALA A 93 -14.651 -0.849 15.628 1.00 0.00 N ATOM 1463 CA ALA A 93 -13.898 -1.502 16.669 1.00 0.00 C ATOM 1464 C ALA A 93 -12.905 -2.499 16.059 1.00 0.00 C ATOM 1465 O ALA A 93 -12.278 -3.289 16.772 1.00 0.00 O ATOM 1466 CB ALA A 93 -14.844 -2.190 17.641 1.00 0.00 C ATOM 0 H ALA A 93 -15.458 -1.382 15.303 1.00 0.00 H new ATOM 0 HA ALA A 93 -13.327 -0.756 17.222 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -14.267 -2.681 18.424 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -15.507 -1.450 18.089 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -15.437 -2.933 17.107 1.00 0.00 H new ATOM 1472 N SER A 94 -12.791 -2.484 14.746 1.00 0.00 N ATOM 1473 CA SER A 94 -11.826 -3.316 14.051 1.00 0.00 C ATOM 1474 C SER A 94 -10.629 -2.440 13.657 1.00 0.00 C ATOM 1475 O SER A 94 -10.614 -1.233 13.951 1.00 0.00 O ATOM 1476 CB SER A 94 -12.473 -3.983 12.812 1.00 0.00 C ATOM 1477 OG SER A 94 -11.585 -4.871 12.150 1.00 0.00 O ATOM 0 H SER A 94 -13.360 -1.900 14.133 1.00 0.00 H new ATOM 0 HA SER A 94 -11.485 -4.120 14.703 1.00 0.00 H new ATOM 0 HB2 SER A 94 -13.365 -4.528 13.121 1.00 0.00 H new ATOM 0 HB3 SER A 94 -12.797 -3.211 12.115 1.00 0.00 H new ATOM 0 HG SER A 94 -12.037 -5.269 11.377 1.00 0.00 H new ATOM 1483 N GLU A 95 -9.648 -3.018 13.017 1.00 0.00 N ATOM 1484 CA GLU A 95 -8.461 -2.298 12.640 1.00 0.00 C ATOM 1485 C GLU A 95 -8.428 -2.057 11.150 1.00 0.00 C ATOM 1486 O GLU A 95 -8.481 -3.008 10.359 1.00 0.00 O ATOM 1487 CB GLU A 95 -7.205 -3.058 13.021 1.00 0.00 C ATOM 1488 CG GLU A 95 -6.999 -3.270 14.495 1.00 0.00 C ATOM 1489 CD GLU A 95 -5.730 -4.021 14.755 1.00 0.00 C ATOM 1490 OE1 GLU A 95 -5.766 -5.269 14.774 1.00 0.00 O ATOM 1491 OE2 GLU A 95 -4.661 -3.383 14.925 1.00 0.00 O ATOM 0 H GLU A 95 -9.649 -4.000 12.742 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.489 -1.348 13.174 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.228 -4.032 12.531 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.343 -2.522 12.625 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -6.967 -2.307 15.004 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.844 -3.821 14.909 1.00 0.00 H new ATOM 1498 N PRO A 96 -8.374 -0.799 10.735 1.00 0.00 N ATOM 1499 CA PRO A 96 -8.188 -0.469 9.349 1.00 0.00 C ATOM 1500 C PRO A 96 -6.738 -0.707 8.973 1.00 0.00 C ATOM 1501 O PRO A 96 -5.822 -0.365 9.729 1.00 0.00 O ATOM 1502 CB PRO A 96 -8.538 1.011 9.259 1.00 0.00 C ATOM 1503 CG PRO A 96 -8.351 1.545 10.638 1.00 0.00 C ATOM 1504 CD PRO A 96 -8.505 0.395 11.589 1.00 0.00 C ATOM 0 HA PRO A 96 -8.800 -1.069 8.675 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -7.892 1.525 8.547 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -9.564 1.152 8.918 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -7.366 2.001 10.743 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -9.086 2.321 10.852 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -7.741 0.415 12.366 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.472 0.421 12.092 1.00 0.00 H new ATOM 1512 N ILE A 97 -6.529 -1.301 7.844 1.00 0.00 N ATOM 1513 CA ILE A 97 -5.194 -1.661 7.411 1.00 0.00 C ATOM 1514 C ILE A 97 -4.401 -0.406 6.997 1.00 0.00 C ATOM 1515 O ILE A 97 -3.205 -0.298 7.256 1.00 0.00 O ATOM 1516 CB ILE A 97 -5.286 -2.685 6.257 1.00 0.00 C ATOM 1517 CG1 ILE A 97 -6.102 -3.902 6.731 1.00 0.00 C ATOM 1518 CG2 ILE A 97 -3.892 -3.117 5.797 1.00 0.00 C ATOM 1519 CD1 ILE A 97 -6.543 -4.822 5.622 1.00 0.00 C ATOM 0 H ILE A 97 -7.268 -1.555 7.188 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.655 -2.123 8.238 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.784 -2.222 5.405 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -5.504 -4.471 7.443 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.983 -3.548 7.266 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.984 -3.838 4.984 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.338 -2.246 5.448 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.360 -3.576 6.630 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.111 -5.652 6.042 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.170 -4.272 4.920 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.668 -5.209 5.100 1.00 0.00 H new ATOM 1531 N GLN A 98 -5.090 0.532 6.401 1.00 0.00 N ATOM 1532 CA GLN A 98 -4.518 1.799 5.962 1.00 0.00 C ATOM 1533 C GLN A 98 -5.671 2.740 5.739 1.00 0.00 C ATOM 1534 O GLN A 98 -6.756 2.495 6.290 1.00 0.00 O ATOM 1535 CB GLN A 98 -3.681 1.624 4.659 1.00 0.00 C ATOM 1536 CG GLN A 98 -4.440 1.406 3.335 1.00 0.00 C ATOM 1537 CD GLN A 98 -5.630 0.497 3.455 1.00 0.00 C ATOM 1538 OE1 GLN A 98 -6.776 0.937 3.517 1.00 0.00 O ATOM 1539 NE2 GLN A 98 -5.356 -0.680 3.752 1.00 0.00 N ATOM 0 H GLN A 98 -6.086 0.444 6.198 1.00 0.00 H new ATOM 0 HA GLN A 98 -3.834 2.191 6.714 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -3.055 2.509 4.543 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -3.011 0.776 4.804 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -4.771 2.372 2.955 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -3.752 0.992 2.598 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -4.393 -1.011 3.689 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -6.094 -1.314 4.059 1.00 0.00 H new ATOM 1548 N SER A 99 -5.473 3.791 4.993 1.00 0.00 N ATOM 1549 CA SER A 99 -6.571 4.595 4.602 1.00 0.00 C ATOM 1550 C SER A 99 -6.320 5.173 3.201 1.00 0.00 C ATOM 1551 O SER A 99 -5.173 5.453 2.824 1.00 0.00 O ATOM 1552 CB SER A 99 -6.865 5.690 5.636 1.00 0.00 C ATOM 1553 OG SER A 99 -8.008 6.449 5.287 1.00 0.00 O ATOM 0 H SER A 99 -4.563 4.100 4.651 1.00 0.00 H new ATOM 0 HA SER A 99 -7.464 3.971 4.557 1.00 0.00 H new ATOM 0 HB2 SER A 99 -7.016 5.235 6.615 1.00 0.00 H new ATOM 0 HB3 SER A 99 -6.002 6.351 5.721 1.00 0.00 H new ATOM 0 HG SER A 99 -8.166 7.135 5.969 1.00 0.00 H new ATOM 1559 N PHE A 100 -7.375 5.297 2.417 1.00 0.00 N ATOM 1560 CA PHE A 100 -7.261 5.877 1.105 1.00 0.00 C ATOM 1561 C PHE A 100 -7.902 7.256 1.041 1.00 0.00 C ATOM 1562 O PHE A 100 -7.193 8.267 1.029 1.00 0.00 O ATOM 1563 CB PHE A 100 -7.799 4.948 0.011 1.00 0.00 C ATOM 1564 CG PHE A 100 -6.974 3.707 -0.173 1.00 0.00 C ATOM 1565 CD1 PHE A 100 -5.758 3.769 -0.827 1.00 0.00 C ATOM 1566 CD2 PHE A 100 -7.409 2.486 0.305 1.00 0.00 C ATOM 1567 CE1 PHE A 100 -4.993 2.639 -0.998 1.00 0.00 C ATOM 1568 CE2 PHE A 100 -6.648 1.350 0.135 1.00 0.00 C ATOM 1569 CZ PHE A 100 -5.438 1.428 -0.516 1.00 0.00 C ATOM 0 H PHE A 100 -8.318 5.002 2.672 1.00 0.00 H new ATOM 0 HA PHE A 100 -6.196 6.006 0.910 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -8.822 4.663 0.257 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.838 5.493 -0.932 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -5.405 4.716 -1.208 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.357 2.421 0.818 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -4.044 2.701 -1.510 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -7.000 0.401 0.512 1.00 0.00 H new ATOM 0 HZ PHE A 100 -4.838 0.540 -0.649 1.00 0.00 H new ATOM 1579 N PHE A 101 -9.218 7.321 1.051 1.00 0.00 N ATOM 1580 CA PHE A 101 -9.895 8.596 0.926 1.00 0.00 C ATOM 1581 C PHE A 101 -11.256 8.516 1.635 1.00 0.00 C ATOM 1582 O PHE A 101 -11.579 7.469 2.201 1.00 0.00 O ATOM 1583 CB PHE A 101 -10.035 8.956 -0.580 1.00 0.00 C ATOM 1584 CG PHE A 101 -10.426 10.382 -0.858 1.00 0.00 C ATOM 1585 CD1 PHE A 101 -9.583 11.418 -0.502 1.00 0.00 C ATOM 1586 CD2 PHE A 101 -11.626 10.684 -1.476 1.00 0.00 C ATOM 1587 CE1 PHE A 101 -9.932 12.727 -0.751 1.00 0.00 C ATOM 1588 CE2 PHE A 101 -11.974 11.994 -1.726 1.00 0.00 C ATOM 1589 CZ PHE A 101 -11.129 13.014 -1.364 1.00 0.00 C ATOM 0 H PHE A 101 -9.835 6.514 1.143 1.00 0.00 H new ATOM 0 HA PHE A 101 -9.319 9.389 1.403 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -9.087 8.751 -1.077 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.778 8.297 -1.028 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -8.640 11.199 -0.023 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -12.295 9.887 -1.765 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -9.266 13.528 -0.465 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -12.914 12.219 -2.208 1.00 0.00 H new ATOM 0 HZ PHE A 101 -11.404 14.040 -1.560 1.00 0.00 H new ATOM 1599 N GLN A 102 -12.012 9.608 1.617 1.00 0.00 N ATOM 1600 CA GLN A 102 -13.319 9.716 2.256 1.00 0.00 C ATOM 1601 C GLN A 102 -14.365 10.230 1.279 1.00 0.00 C ATOM 1602 O GLN A 102 -14.126 11.204 0.557 1.00 0.00 O ATOM 1603 CB GLN A 102 -13.240 10.654 3.448 1.00 0.00 C ATOM 1604 CG GLN A 102 -12.632 10.036 4.681 1.00 0.00 C ATOM 1605 CD GLN A 102 -12.309 11.041 5.771 1.00 0.00 C ATOM 1606 OE1 GLN A 102 -11.369 10.844 6.548 1.00 0.00 O ATOM 1607 NE2 GLN A 102 -13.051 12.123 5.838 1.00 0.00 N ATOM 0 H GLN A 102 -11.725 10.466 1.145 1.00 0.00 H new ATOM 0 HA GLN A 102 -13.613 8.721 2.590 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -12.655 11.530 3.168 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -14.244 11.004 3.688 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -13.319 9.290 5.079 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -11.719 9.511 4.401 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -13.820 12.255 5.181 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -12.858 12.831 6.547 1.00 0.00 H new ATOM 1616 N ILE A 103 -15.499 9.581 1.254 1.00 0.00 N ATOM 1617 CA ILE A 103 -16.611 9.958 0.383 1.00 0.00 C ATOM 1618 C ILE A 103 -17.908 9.913 1.203 1.00 0.00 C ATOM 1619 O ILE A 103 -17.999 9.205 2.200 1.00 0.00 O ATOM 1620 CB ILE A 103 -16.755 9.004 -0.865 1.00 0.00 C ATOM 1621 CG1 ILE A 103 -17.153 7.601 -0.407 1.00 0.00 C ATOM 1622 CG2 ILE A 103 -15.457 8.970 -1.673 1.00 0.00 C ATOM 1623 CD1 ILE A 103 -17.479 6.668 -1.528 1.00 0.00 C ATOM 0 H ILE A 103 -15.691 8.767 1.838 1.00 0.00 H new ATOM 0 HA ILE A 103 -16.414 10.960 0.002 1.00 0.00 H new ATOM 0 HB ILE A 103 -17.540 9.391 -1.515 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -16.339 7.177 0.181 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -18.017 7.676 0.253 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -15.579 8.306 -2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -15.220 9.975 -2.024 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -14.646 8.605 -1.043 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -17.752 5.694 -1.123 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -18.314 7.068 -2.103 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -16.610 6.561 -2.177 1.00 0.00 H new ATOM 1635 N ASP A 104 -18.874 10.655 0.814 1.00 0.00 N ATOM 1636 CA ASP A 104 -20.124 10.686 1.523 1.00 0.00 C ATOM 1637 C ASP A 104 -21.019 9.556 1.149 1.00 0.00 C ATOM 1638 O ASP A 104 -21.498 9.451 -0.004 1.00 0.00 O ATOM 1639 CB ASP A 104 -20.858 12.006 1.371 1.00 0.00 C ATOM 1640 CG ASP A 104 -20.606 12.949 2.539 1.00 0.00 C ATOM 1641 OD1 ASP A 104 -20.074 12.505 3.595 1.00 0.00 O ATOM 1642 OD2 ASP A 104 -20.981 14.141 2.446 1.00 0.00 O ATOM 0 H ASP A 104 -18.835 11.264 -0.004 1.00 0.00 H new ATOM 0 HA ASP A 104 -19.857 10.575 2.574 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -20.545 12.488 0.445 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -21.928 11.816 1.286 1.00 0.00 H new ATOM 1647 N LEU A 105 -21.304 8.723 2.116 1.00 0.00 N ATOM 1648 CA LEU A 105 -22.163 7.607 1.883 1.00 0.00 C ATOM 1649 C LEU A 105 -23.565 8.075 1.600 1.00 0.00 C ATOM 1650 O LEU A 105 -24.293 7.454 0.834 1.00 0.00 O ATOM 1651 CB LEU A 105 -22.150 6.613 3.017 1.00 0.00 C ATOM 1652 CG LEU A 105 -20.829 5.927 3.324 1.00 0.00 C ATOM 1653 CD1 LEU A 105 -21.105 4.719 4.171 1.00 0.00 C ATOM 1654 CD2 LEU A 105 -20.068 5.542 2.051 1.00 0.00 C ATOM 0 H LEU A 105 -20.951 8.802 3.070 1.00 0.00 H new ATOM 0 HA LEU A 105 -21.776 7.085 1.008 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -22.482 7.126 3.920 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -22.889 5.842 2.799 1.00 0.00 H new ATOM 0 HG LEU A 105 -20.188 6.624 3.864 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -20.167 4.214 4.401 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -21.588 5.027 5.098 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -21.761 4.037 3.630 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -19.131 5.055 2.321 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -20.675 4.858 1.457 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -19.856 6.439 1.468 1.00 0.00 H new ATOM 1666 N GLU A 106 -23.912 9.207 2.175 1.00 0.00 N ATOM 1667 CA GLU A 106 -25.191 9.833 1.938 1.00 0.00 C ATOM 1668 C GLU A 106 -25.310 10.321 0.491 1.00 0.00 C ATOM 1669 O GLU A 106 -26.400 10.603 0.021 1.00 0.00 O ATOM 1670 CB GLU A 106 -25.421 10.990 2.911 1.00 0.00 C ATOM 1671 CG GLU A 106 -24.289 12.002 2.946 1.00 0.00 C ATOM 1672 CD GLU A 106 -24.631 13.243 3.729 1.00 0.00 C ATOM 1673 OE1 GLU A 106 -24.812 13.162 4.964 1.00 0.00 O ATOM 1674 OE2 GLU A 106 -24.709 14.335 3.125 1.00 0.00 O ATOM 0 H GLU A 106 -23.312 9.719 2.822 1.00 0.00 H new ATOM 0 HA GLU A 106 -25.962 9.081 2.107 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -26.344 11.502 2.639 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -25.564 10.586 3.913 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -23.406 11.536 3.383 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -24.029 12.283 1.925 1.00 0.00 H new ATOM 1681 N ARG A 107 -24.183 10.422 -0.209 1.00 0.00 N ATOM 1682 CA ARG A 107 -24.207 10.837 -1.591 1.00 0.00 C ATOM 1683 C ARG A 107 -24.210 9.593 -2.515 1.00 0.00 C ATOM 1684 O ARG A 107 -24.545 9.683 -3.695 1.00 0.00 O ATOM 1685 CB ARG A 107 -23.052 11.831 -1.903 1.00 0.00 C ATOM 1686 CG ARG A 107 -21.927 11.292 -2.774 1.00 0.00 C ATOM 1687 CD ARG A 107 -20.843 12.333 -3.032 1.00 0.00 C ATOM 1688 NE ARG A 107 -21.391 13.616 -3.493 1.00 0.00 N ATOM 1689 CZ ARG A 107 -20.738 14.554 -4.201 1.00 0.00 C ATOM 1690 NH1 ARG A 107 -19.506 14.336 -4.653 1.00 0.00 N ATOM 1691 NH2 ARG A 107 -21.335 15.714 -4.448 1.00 0.00 N ATOM 0 H ARG A 107 -23.254 10.222 0.162 1.00 0.00 H new ATOM 0 HA ARG A 107 -25.128 11.386 -1.787 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -23.476 12.708 -2.392 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -22.624 12.168 -0.959 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.483 10.421 -2.292 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -22.337 10.955 -3.726 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -20.273 12.493 -2.117 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -20.147 11.950 -3.778 1.00 0.00 H new ATOM 0 HE ARG A 107 -22.362 13.814 -3.252 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -19.043 13.447 -4.464 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -19.024 15.058 -5.189 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -22.279 15.886 -4.102 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -20.850 16.433 -4.984 1.00 0.00 H new ATOM 1705 N LEU A 108 -23.817 8.432 -1.956 1.00 0.00 N ATOM 1706 CA LEU A 108 -23.901 7.126 -2.674 1.00 0.00 C ATOM 1707 C LEU A 108 -25.315 6.807 -3.131 1.00 0.00 C ATOM 1708 O LEU A 108 -26.298 7.359 -2.610 1.00 0.00 O ATOM 1709 CB LEU A 108 -23.377 5.953 -1.818 1.00 0.00 C ATOM 1710 CG LEU A 108 -21.911 5.551 -1.984 1.00 0.00 C ATOM 1711 CD1 LEU A 108 -21.604 5.025 -3.329 1.00 0.00 C ATOM 1712 CD2 LEU A 108 -20.988 6.628 -1.581 1.00 0.00 C ATOM 0 H LEU A 108 -23.438 8.362 -1.012 1.00 0.00 H new ATOM 0 HA LEU A 108 -23.263 7.239 -3.551 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -23.539 6.204 -0.770 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -23.991 5.079 -2.035 1.00 0.00 H new ATOM 0 HG LEU A 108 -21.749 4.722 -1.295 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -20.549 4.758 -3.383 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.212 4.141 -3.522 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -21.824 5.787 -4.077 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -19.959 6.295 -1.717 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -21.168 7.510 -2.195 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -21.154 6.876 -0.533 1.00 0.00 H new ATOM 1724 N GLU A 109 -25.407 5.895 -4.091 1.00 0.00 N ATOM 1725 CA GLU A 109 -26.681 5.489 -4.661 1.00 0.00 C ATOM 1726 C GLU A 109 -27.545 4.802 -3.590 1.00 0.00 C ATOM 1727 O GLU A 109 -28.506 5.395 -3.099 1.00 0.00 O ATOM 1728 CB GLU A 109 -26.458 4.560 -5.848 1.00 0.00 C ATOM 1729 CG GLU A 109 -25.425 5.051 -6.850 1.00 0.00 C ATOM 1730 CD GLU A 109 -25.677 6.445 -7.357 1.00 0.00 C ATOM 1731 OE1 GLU A 109 -26.723 6.693 -7.981 1.00 0.00 O ATOM 1732 OE2 GLU A 109 -24.809 7.316 -7.151 1.00 0.00 O ATOM 0 H GLU A 109 -24.601 5.418 -4.494 1.00 0.00 H new ATOM 0 HA GLU A 109 -27.207 6.376 -5.014 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -26.148 3.584 -5.475 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -27.407 4.418 -6.365 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -24.439 5.017 -6.386 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -25.402 4.366 -7.698 1.00 0.00 H new ATOM 1739 N SER A 110 -27.189 3.571 -3.219 1.00 0.00 N ATOM 1740 CA SER A 110 -27.875 2.888 -2.140 1.00 0.00 C ATOM 1741 C SER A 110 -27.044 1.693 -1.614 1.00 0.00 C ATOM 1742 O SER A 110 -26.295 1.832 -0.648 1.00 0.00 O ATOM 1743 CB SER A 110 -29.295 2.443 -2.557 1.00 0.00 C ATOM 1744 OG SER A 110 -30.061 2.037 -1.437 1.00 0.00 O ATOM 0 H SER A 110 -26.435 3.037 -3.650 1.00 0.00 H new ATOM 0 HA SER A 110 -27.986 3.601 -1.323 1.00 0.00 H new ATOM 0 HB2 SER A 110 -29.800 3.264 -3.066 1.00 0.00 H new ATOM 0 HB3 SER A 110 -29.225 1.621 -3.269 1.00 0.00 H new ATOM 0 HG SER A 110 -30.954 1.763 -1.733 1.00 0.00 H new ATOM 1750 N HIS A 111 -27.101 0.551 -2.306 1.00 0.00 N ATOM 1751 CA HIS A 111 -26.439 -0.680 -1.823 1.00 0.00 C ATOM 1752 C HIS A 111 -24.926 -0.596 -1.870 1.00 0.00 C ATOM 1753 O HIS A 111 -24.251 -1.301 -1.138 1.00 0.00 O ATOM 1754 CB HIS A 111 -26.946 -1.959 -2.534 1.00 0.00 C ATOM 1755 CG HIS A 111 -26.693 -2.010 -4.023 1.00 0.00 C ATOM 1756 ND1 HIS A 111 -25.491 -2.387 -4.594 1.00 0.00 N ATOM 1757 CD2 HIS A 111 -27.518 -1.721 -5.060 1.00 0.00 C ATOM 1758 CE1 HIS A 111 -25.619 -2.312 -5.914 1.00 0.00 C ATOM 1759 NE2 HIS A 111 -26.832 -1.913 -6.257 1.00 0.00 N ATOM 0 H HIS A 111 -27.592 0.446 -3.194 1.00 0.00 H new ATOM 0 HA HIS A 111 -26.725 -0.760 -0.774 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -26.472 -2.825 -2.071 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -28.018 -2.051 -2.360 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -28.544 -1.394 -4.972 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -24.833 -2.547 -6.617 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -27.191 -1.775 -7.202 1.00 0.00 H new ATOM 1767 N MET A 112 -24.420 0.259 -2.727 1.00 0.00 N ATOM 1768 CA MET A 112 -22.988 0.504 -2.860 1.00 0.00 C ATOM 1769 C MET A 112 -22.327 0.767 -1.520 1.00 0.00 C ATOM 1770 O MET A 112 -21.422 0.036 -1.111 1.00 0.00 O ATOM 1771 CB MET A 112 -22.758 1.670 -3.797 1.00 0.00 C ATOM 1772 CG MET A 112 -22.837 1.311 -5.260 1.00 0.00 C ATOM 1773 SD MET A 112 -21.403 0.372 -5.803 1.00 0.00 S ATOM 1774 CE MET A 112 -20.119 1.590 -5.530 1.00 0.00 C ATOM 0 H MET A 112 -24.991 0.815 -3.363 1.00 0.00 H new ATOM 0 HA MET A 112 -22.531 -0.396 -3.272 1.00 0.00 H new ATOM 0 HB2 MET A 112 -23.495 2.444 -3.584 1.00 0.00 H new ATOM 0 HB3 MET A 112 -21.777 2.099 -3.592 1.00 0.00 H new ATOM 0 HG2 MET A 112 -23.741 0.730 -5.442 1.00 0.00 H new ATOM 0 HG3 MET A 112 -22.919 2.222 -5.853 1.00 0.00 H new ATOM 0 HE1 MET A 112 -19.197 1.260 -6.008 1.00 0.00 H new ATOM 0 HE2 MET A 112 -20.427 2.545 -5.956 1.00 0.00 H new ATOM 0 HE3 MET A 112 -19.951 1.708 -4.460 1.00 0.00 H new ATOM 1784 N GLN A 113 -22.829 1.762 -0.810 1.00 0.00 N ATOM 1785 CA GLN A 113 -22.265 2.134 0.468 1.00 0.00 C ATOM 1786 C GLN A 113 -22.531 1.055 1.503 1.00 0.00 C ATOM 1787 O GLN A 113 -21.702 0.793 2.352 1.00 0.00 O ATOM 1788 CB GLN A 113 -22.800 3.483 0.959 1.00 0.00 C ATOM 1789 CG GLN A 113 -24.283 3.539 1.031 1.00 0.00 C ATOM 1790 CD GLN A 113 -24.813 4.092 2.331 1.00 0.00 C ATOM 1791 OE1 GLN A 113 -25.005 3.356 3.290 1.00 0.00 O ATOM 1792 NE2 GLN A 113 -25.122 5.342 2.358 1.00 0.00 N ATOM 0 H GLN A 113 -23.628 2.326 -1.101 1.00 0.00 H new ATOM 0 HA GLN A 113 -21.189 2.237 0.329 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -22.388 3.691 1.946 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -22.446 4.270 0.293 1.00 0.00 H new ATOM 0 HG2 GLN A 113 -24.654 4.152 0.209 1.00 0.00 H new ATOM 0 HG3 GLN A 113 -24.682 2.535 0.885 1.00 0.00 H new ATOM 0 HE21 GLN A 113 -24.949 5.928 1.541 1.00 0.00 H new ATOM 0 HE22 GLN A 113 -25.540 5.746 3.196 1.00 0.00 H new ATOM 1801 N LYS A 114 -23.670 0.398 1.380 1.00 0.00 N ATOM 1802 CA LYS A 114 -24.060 -0.640 2.316 1.00 0.00 C ATOM 1803 C LYS A 114 -23.166 -1.863 2.198 1.00 0.00 C ATOM 1804 O LYS A 114 -22.913 -2.564 3.188 1.00 0.00 O ATOM 1805 CB LYS A 114 -25.518 -1.026 2.150 1.00 0.00 C ATOM 1806 CG LYS A 114 -26.486 0.121 2.356 1.00 0.00 C ATOM 1807 CD LYS A 114 -27.898 -0.393 2.394 1.00 0.00 C ATOM 1808 CE LYS A 114 -28.916 0.724 2.533 1.00 0.00 C ATOM 1809 NZ LYS A 114 -30.288 0.188 2.646 1.00 0.00 N ATOM 0 H LYS A 114 -24.346 0.567 0.635 1.00 0.00 H new ATOM 0 HA LYS A 114 -23.935 -0.226 3.317 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -25.663 -1.436 1.150 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -25.756 -1.820 2.858 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -26.255 0.639 3.287 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -26.377 0.848 1.551 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -28.102 -0.955 1.483 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -28.007 -1.086 3.228 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -28.684 1.323 3.413 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -28.852 1.387 1.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -30.962 0.975 2.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -30.516 -0.364 1.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -30.353 -0.425 3.484 1.00 0.00 H new ATOM 1823 N ASN A 115 -22.680 -2.119 1.007 1.00 0.00 N ATOM 1824 CA ASN A 115 -21.761 -3.218 0.800 1.00 0.00 C ATOM 1825 C ASN A 115 -20.414 -2.866 1.352 1.00 0.00 C ATOM 1826 O ASN A 115 -19.683 -3.722 1.824 1.00 0.00 O ATOM 1827 CB ASN A 115 -21.678 -3.660 -0.671 1.00 0.00 C ATOM 1828 CG ASN A 115 -22.941 -4.362 -1.133 1.00 0.00 C ATOM 1829 OD1 ASN A 115 -23.661 -4.956 -0.331 1.00 0.00 O ATOM 1830 ND2 ASN A 115 -23.208 -4.335 -2.407 1.00 0.00 N ATOM 0 H ASN A 115 -22.903 -1.585 0.167 1.00 0.00 H new ATOM 0 HA ASN A 115 -22.149 -4.080 1.342 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -21.498 -2.788 -1.300 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -20.826 -4.327 -0.800 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -24.034 -4.815 -2.765 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -22.592 -3.834 -3.047 1.00 0.00 H new ATOM 1837 N LEU A 116 -20.113 -1.590 1.341 1.00 0.00 N ATOM 1838 CA LEU A 116 -18.879 -1.089 1.917 1.00 0.00 C ATOM 1839 C LEU A 116 -18.968 -1.134 3.454 1.00 0.00 C ATOM 1840 O LEU A 116 -17.962 -1.303 4.133 1.00 0.00 O ATOM 1841 CB LEU A 116 -18.630 0.340 1.457 1.00 0.00 C ATOM 1842 CG LEU A 116 -18.621 0.580 -0.053 1.00 0.00 C ATOM 1843 CD1 LEU A 116 -18.539 2.063 -0.353 1.00 0.00 C ATOM 1844 CD2 LEU A 116 -17.469 -0.157 -0.713 1.00 0.00 C ATOM 0 H LEU A 116 -20.710 -0.869 0.936 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.052 -1.716 1.585 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -19.395 0.979 1.899 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -17.671 0.666 1.860 1.00 0.00 H new ATOM 0 HG LEU A 116 -19.553 0.191 -0.463 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -18.534 2.216 -1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -19.401 2.570 0.081 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -17.624 2.471 0.076 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -17.485 0.030 -1.787 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.525 0.196 -0.297 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.569 -1.227 -0.530 1.00 0.00 H new ATOM 1856 N LEU A 117 -20.192 -0.950 3.979 1.00 0.00 N ATOM 1857 CA LEU A 117 -20.469 -1.027 5.420 1.00 0.00 C ATOM 1858 C LEU A 117 -20.129 -2.391 5.975 1.00 0.00 C ATOM 1859 O LEU A 117 -19.425 -2.504 6.962 1.00 0.00 O ATOM 1860 CB LEU A 117 -21.953 -0.753 5.721 1.00 0.00 C ATOM 1861 CG LEU A 117 -22.508 0.594 5.299 1.00 0.00 C ATOM 1862 CD1 LEU A 117 -23.974 0.714 5.681 1.00 0.00 C ATOM 1863 CD2 LEU A 117 -21.704 1.708 5.911 1.00 0.00 C ATOM 0 H LEU A 117 -21.016 -0.744 3.414 1.00 0.00 H new ATOM 0 HA LEU A 117 -19.846 -0.267 5.892 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -22.545 -1.529 5.236 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -22.105 -0.860 6.795 1.00 0.00 H new ATOM 0 HG LEU A 117 -22.434 0.673 4.214 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -24.353 1.687 5.369 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -24.544 -0.072 5.187 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -24.078 0.613 6.761 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -22.115 2.668 5.598 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -21.745 1.632 6.998 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -20.668 1.633 5.581 1.00 0.00 H new ATOM 1875 N LYS A 118 -20.649 -3.435 5.356 1.00 0.00 N ATOM 1876 CA LYS A 118 -20.374 -4.762 5.851 1.00 0.00 C ATOM 1877 C LYS A 118 -19.127 -5.383 5.267 1.00 0.00 C ATOM 1878 O LYS A 118 -18.659 -6.411 5.750 1.00 0.00 O ATOM 1879 CB LYS A 118 -21.588 -5.704 5.803 1.00 0.00 C ATOM 1880 CG LYS A 118 -22.325 -5.819 4.488 1.00 0.00 C ATOM 1881 CD LYS A 118 -21.468 -6.338 3.348 1.00 0.00 C ATOM 1882 CE LYS A 118 -22.273 -6.654 2.095 1.00 0.00 C ATOM 1883 NZ LYS A 118 -23.069 -7.893 2.226 1.00 0.00 N ATOM 0 H LYS A 118 -21.248 -3.390 4.532 1.00 0.00 H new ATOM 0 HA LYS A 118 -20.159 -4.617 6.910 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -21.253 -6.701 6.090 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -22.300 -5.376 6.561 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -23.180 -6.482 4.618 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -22.720 -4.840 4.217 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -20.706 -5.597 3.107 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -20.945 -7.237 3.674 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -22.940 -5.820 1.877 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -21.595 -6.751 1.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -23.544 -8.098 1.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -22.441 -8.684 2.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -23.783 -7.770 2.972 1.00 0.00 H new ATOM 1897 N GLY A 119 -18.602 -4.800 4.225 1.00 0.00 N ATOM 1898 CA GLY A 119 -17.405 -5.309 3.674 1.00 0.00 C ATOM 1899 C GLY A 119 -17.677 -6.225 2.530 1.00 0.00 C ATOM 1900 O GLY A 119 -18.502 -7.144 2.636 1.00 0.00 O ATOM 0 H GLY A 119 -18.988 -3.982 3.754 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -16.777 -4.483 3.339 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -16.847 -5.842 4.444 1.00 0.00 H new ATOM 1904 N ILE A 120 -17.021 -5.958 1.441 1.00 0.00 N ATOM 1905 CA ILE A 120 -17.147 -6.746 0.227 1.00 0.00 C ATOM 1906 C ILE A 120 -16.764 -8.202 0.547 1.00 0.00 C ATOM 1907 O ILE A 120 -15.767 -8.435 1.189 1.00 0.00 O ATOM 1908 CB ILE A 120 -16.231 -6.160 -0.897 1.00 0.00 C ATOM 1909 CG1 ILE A 120 -16.420 -4.629 -0.992 1.00 0.00 C ATOM 1910 CG2 ILE A 120 -16.529 -6.802 -2.251 1.00 0.00 C ATOM 1911 CD1 ILE A 120 -17.867 -4.193 -1.111 1.00 0.00 C ATOM 0 H ILE A 120 -16.370 -5.177 1.358 1.00 0.00 H new ATOM 0 HA ILE A 120 -18.175 -6.714 -0.135 1.00 0.00 H new ATOM 0 HB ILE A 120 -15.197 -6.384 -0.635 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -15.982 -4.164 -0.109 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -15.867 -4.258 -1.855 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -15.875 -6.372 -3.009 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -16.356 -7.877 -2.190 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -17.569 -6.616 -2.521 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -17.916 -3.106 -1.173 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -18.305 -4.627 -2.010 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -18.422 -4.532 -0.236 1.00 0.00 H new ATOM 1923 N PRO A 121 -17.576 -9.185 0.130 1.00 0.00 N ATOM 1924 CA PRO A 121 -17.374 -10.599 0.501 1.00 0.00 C ATOM 1925 C PRO A 121 -16.211 -11.286 -0.212 1.00 0.00 C ATOM 1926 O PRO A 121 -15.865 -12.429 0.115 1.00 0.00 O ATOM 1927 CB PRO A 121 -18.691 -11.259 0.087 1.00 0.00 C ATOM 1928 CG PRO A 121 -19.188 -10.422 -1.040 1.00 0.00 C ATOM 1929 CD PRO A 121 -18.776 -9.013 -0.721 1.00 0.00 C ATOM 0 HA PRO A 121 -17.122 -10.681 1.558 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -18.537 -12.292 -0.224 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -19.403 -11.277 0.912 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -18.760 -10.749 -1.987 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -20.271 -10.500 -1.136 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -18.549 -8.447 -1.625 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -19.565 -8.473 -0.197 1.00 0.00 H new ATOM 1937 N PHE A 122 -15.595 -10.600 -1.136 1.00 0.00 N ATOM 1938 CA PHE A 122 -14.555 -11.192 -1.973 1.00 0.00 C ATOM 1939 C PHE A 122 -13.974 -10.114 -2.839 1.00 0.00 C ATOM 1940 O PHE A 122 -14.707 -9.243 -3.301 1.00 0.00 O ATOM 1941 CB PHE A 122 -15.145 -12.316 -2.865 1.00 0.00 C ATOM 1942 CG PHE A 122 -14.129 -13.054 -3.697 1.00 0.00 C ATOM 1943 CD1 PHE A 122 -13.449 -14.138 -3.173 1.00 0.00 C ATOM 1944 CD2 PHE A 122 -13.858 -12.666 -4.997 1.00 0.00 C ATOM 1945 CE1 PHE A 122 -12.517 -14.819 -3.929 1.00 0.00 C ATOM 1946 CE2 PHE A 122 -12.930 -13.339 -5.754 1.00 0.00 C ATOM 1947 CZ PHE A 122 -12.257 -14.419 -5.222 1.00 0.00 C ATOM 0 H PHE A 122 -15.789 -9.619 -1.339 1.00 0.00 H new ATOM 0 HA PHE A 122 -13.783 -11.629 -1.339 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -15.664 -13.033 -2.228 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -15.892 -11.881 -3.529 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -13.650 -14.455 -2.160 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -14.383 -11.823 -5.422 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -11.992 -15.664 -3.508 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -12.727 -13.022 -6.766 1.00 0.00 H new ATOM 0 HZ PHE A 122 -11.528 -14.950 -5.817 1.00 0.00 H new ATOM 1957 N ARG A 123 -12.682 -10.141 -3.050 1.00 0.00 N ATOM 1958 CA ARG A 123 -12.038 -9.135 -3.843 1.00 0.00 C ATOM 1959 C ARG A 123 -10.746 -9.628 -4.477 1.00 0.00 C ATOM 1960 O ARG A 123 -9.932 -10.271 -3.828 1.00 0.00 O ATOM 1961 CB ARG A 123 -11.807 -7.891 -3.002 1.00 0.00 C ATOM 1962 CG ARG A 123 -10.895 -6.881 -3.619 1.00 0.00 C ATOM 1963 CD ARG A 123 -10.784 -5.669 -2.757 1.00 0.00 C ATOM 1964 NE ARG A 123 -10.458 -5.972 -1.347 1.00 0.00 N ATOM 1965 CZ ARG A 123 -9.250 -5.801 -0.785 1.00 0.00 C ATOM 1966 NH1 ARG A 123 -8.180 -5.643 -1.532 1.00 0.00 N ATOM 1967 NH2 ARG A 123 -9.102 -5.815 0.528 1.00 0.00 N ATOM 0 H ARG A 123 -12.056 -10.855 -2.679 1.00 0.00 H new ATOM 0 HA ARG A 123 -12.701 -8.886 -4.672 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -12.769 -7.419 -2.804 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -11.395 -8.192 -2.038 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -9.908 -7.319 -3.767 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -11.270 -6.599 -4.603 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -10.016 -5.012 -3.165 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -11.725 -5.120 -2.794 1.00 0.00 H new ATOM 0 HE ARG A 123 -11.206 -6.338 -0.757 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -8.262 -5.649 -2.549 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -7.267 -5.514 -1.095 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -9.912 -5.957 1.131 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -8.178 -5.684 0.938 1.00 0.00 H new ATOM 1981 N THR A 124 -10.587 -9.308 -5.735 1.00 0.00 N ATOM 1982 CA THR A 124 -9.398 -9.587 -6.485 1.00 0.00 C ATOM 1983 C THR A 124 -8.769 -8.203 -6.836 1.00 0.00 C ATOM 1984 O THR A 124 -9.409 -7.163 -6.577 1.00 0.00 O ATOM 1985 CB THR A 124 -9.791 -10.371 -7.759 1.00 0.00 C ATOM 1986 OG1 THR A 124 -10.733 -11.402 -7.403 1.00 0.00 O ATOM 1987 CG2 THR A 124 -8.580 -11.010 -8.415 1.00 0.00 C ATOM 0 H THR A 124 -11.306 -8.831 -6.279 1.00 0.00 H new ATOM 0 HA THR A 124 -8.681 -10.193 -5.931 1.00 0.00 H new ATOM 0 HB THR A 124 -10.233 -9.672 -8.469 1.00 0.00 H new ATOM 0 HG1 THR A 124 -11.625 -11.009 -7.301 1.00 0.00 H new ATOM 0 HG21 THR A 124 -8.893 -11.553 -9.307 1.00 0.00 H new ATOM 0 HG22 THR A 124 -7.866 -10.235 -8.694 1.00 0.00 H new ATOM 0 HG23 THR A 124 -8.110 -11.702 -7.716 1.00 0.00 H new ATOM 1995 N LYS A 125 -7.567 -8.164 -7.418 1.00 0.00 N ATOM 1996 CA LYS A 125 -6.858 -6.901 -7.643 1.00 0.00 C ATOM 1997 C LYS A 125 -7.605 -5.942 -8.558 1.00 0.00 C ATOM 1998 O LYS A 125 -7.641 -4.743 -8.296 1.00 0.00 O ATOM 1999 CB LYS A 125 -5.407 -7.113 -8.152 1.00 0.00 C ATOM 2000 CG LYS A 125 -5.281 -7.788 -9.528 1.00 0.00 C ATOM 2001 CD LYS A 125 -4.463 -6.937 -10.510 1.00 0.00 C ATOM 2002 CE LYS A 125 -5.119 -5.581 -10.747 1.00 0.00 C ATOM 2003 NZ LYS A 125 -4.436 -4.765 -11.750 1.00 0.00 N ATOM 0 H LYS A 125 -7.065 -8.991 -7.741 1.00 0.00 H new ATOM 0 HA LYS A 125 -6.807 -6.434 -6.659 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -4.910 -6.144 -8.195 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -4.868 -7.715 -7.420 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -4.809 -8.763 -9.412 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -6.275 -7.962 -9.939 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -3.456 -6.793 -10.118 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -4.364 -7.466 -11.458 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -6.152 -5.736 -11.060 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -5.150 -5.033 -9.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -4.391 -3.779 -11.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -3.472 -5.127 -11.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -4.959 -4.808 -12.648 1.00 0.00 H new ATOM 2017 N ALA A 126 -8.237 -6.464 -9.594 1.00 0.00 N ATOM 2018 CA ALA A 126 -8.859 -5.606 -10.573 1.00 0.00 C ATOM 2019 C ALA A 126 -10.161 -5.102 -10.045 1.00 0.00 C ATOM 2020 O ALA A 126 -10.580 -3.998 -10.336 1.00 0.00 O ATOM 2021 CB ALA A 126 -9.041 -6.342 -11.871 1.00 0.00 C ATOM 0 H ALA A 126 -8.330 -7.464 -9.774 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.214 -4.749 -10.767 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -9.511 -5.683 -12.600 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -8.069 -6.664 -12.246 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -9.674 -7.214 -11.709 1.00 0.00 H new ATOM 2027 N GLU A 127 -10.751 -5.897 -9.194 1.00 0.00 N ATOM 2028 CA GLU A 127 -12.013 -5.564 -8.587 1.00 0.00 C ATOM 2029 C GLU A 127 -11.792 -4.475 -7.547 1.00 0.00 C ATOM 2030 O GLU A 127 -12.652 -3.635 -7.318 1.00 0.00 O ATOM 2031 CB GLU A 127 -12.605 -6.803 -7.959 1.00 0.00 C ATOM 2032 CG GLU A 127 -12.463 -8.013 -8.854 1.00 0.00 C ATOM 2033 CD GLU A 127 -13.187 -9.208 -8.337 1.00 0.00 C ATOM 2034 OE1 GLU A 127 -12.909 -9.625 -7.198 1.00 0.00 O ATOM 2035 OE2 GLU A 127 -14.028 -9.767 -9.069 1.00 0.00 O ATOM 0 H GLU A 127 -10.370 -6.796 -8.901 1.00 0.00 H new ATOM 0 HA GLU A 127 -12.710 -5.192 -9.337 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -12.113 -6.997 -7.006 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -13.660 -6.632 -7.744 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -12.839 -7.769 -9.848 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -11.406 -8.255 -8.964 1.00 0.00 H new ATOM 2042 N PHE A 128 -10.601 -4.488 -6.947 1.00 0.00 N ATOM 2043 CA PHE A 128 -10.194 -3.489 -5.996 1.00 0.00 C ATOM 2044 C PHE A 128 -10.094 -2.136 -6.673 1.00 0.00 C ATOM 2045 O PHE A 128 -10.679 -1.164 -6.223 1.00 0.00 O ATOM 2046 CB PHE A 128 -8.835 -3.867 -5.372 1.00 0.00 C ATOM 2047 CG PHE A 128 -8.243 -2.773 -4.512 1.00 0.00 C ATOM 2048 CD1 PHE A 128 -7.440 -1.804 -5.085 1.00 0.00 C ATOM 2049 CD2 PHE A 128 -8.506 -2.700 -3.160 1.00 0.00 C ATOM 2050 CE1 PHE A 128 -6.918 -0.781 -4.329 1.00 0.00 C ATOM 2051 CE2 PHE A 128 -7.981 -1.684 -2.392 1.00 0.00 C ATOM 2052 CZ PHE A 128 -7.189 -0.722 -2.977 1.00 0.00 C ATOM 0 H PHE A 128 -9.896 -5.205 -7.119 1.00 0.00 H new ATOM 0 HA PHE A 128 -10.941 -3.436 -5.204 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -8.958 -4.766 -4.769 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -8.133 -4.112 -6.169 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -7.220 -1.851 -6.141 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -9.132 -3.449 -2.697 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -6.298 -0.027 -4.791 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -8.190 -1.642 -1.333 1.00 0.00 H new ATOM 0 HZ PHE A 128 -6.780 0.078 -2.378 1.00 0.00 H new ATOM 2062 N GLU A 129 -9.351 -2.074 -7.750 1.00 0.00 N ATOM 2063 CA GLU A 129 -9.193 -0.822 -8.444 1.00 0.00 C ATOM 2064 C GLU A 129 -10.505 -0.372 -9.082 1.00 0.00 C ATOM 2065 O GLU A 129 -10.737 0.808 -9.233 1.00 0.00 O ATOM 2066 CB GLU A 129 -8.017 -0.856 -9.428 1.00 0.00 C ATOM 2067 CG GLU A 129 -7.998 -2.060 -10.337 1.00 0.00 C ATOM 2068 CD GLU A 129 -6.919 -1.991 -11.378 1.00 0.00 C ATOM 2069 OE1 GLU A 129 -7.134 -1.365 -12.430 1.00 0.00 O ATOM 2070 OE2 GLU A 129 -5.830 -2.553 -11.183 1.00 0.00 O ATOM 0 H GLU A 129 -8.853 -2.864 -8.160 1.00 0.00 H new ATOM 0 HA GLU A 129 -8.935 -0.061 -7.707 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -8.045 0.045 -10.040 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.085 -0.828 -8.863 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -7.860 -2.959 -9.737 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -8.966 -2.152 -10.830 1.00 0.00 H new ATOM 2077 N ASP A 130 -11.381 -1.333 -9.367 1.00 0.00 N ATOM 2078 CA ASP A 130 -12.721 -1.074 -9.927 1.00 0.00 C ATOM 2079 C ASP A 130 -13.581 -0.369 -8.896 1.00 0.00 C ATOM 2080 O ASP A 130 -14.234 0.630 -9.180 1.00 0.00 O ATOM 2081 CB ASP A 130 -13.383 -2.396 -10.308 1.00 0.00 C ATOM 2082 CG ASP A 130 -14.799 -2.263 -10.852 1.00 0.00 C ATOM 2083 OD1 ASP A 130 -15.757 -2.263 -10.053 1.00 0.00 O ATOM 2084 OD2 ASP A 130 -14.990 -2.236 -12.080 1.00 0.00 O ATOM 0 H ASP A 130 -11.187 -2.323 -9.218 1.00 0.00 H new ATOM 0 HA ASP A 130 -12.620 -0.445 -10.811 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -12.766 -2.894 -11.056 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -13.404 -3.043 -9.431 1.00 0.00 H new ATOM 2089 N VAL A 131 -13.577 -0.887 -7.697 1.00 0.00 N ATOM 2090 CA VAL A 131 -14.332 -0.269 -6.631 1.00 0.00 C ATOM 2091 C VAL A 131 -13.693 1.070 -6.215 1.00 0.00 C ATOM 2092 O VAL A 131 -14.391 2.053 -6.015 1.00 0.00 O ATOM 2093 CB VAL A 131 -14.578 -1.230 -5.413 1.00 0.00 C ATOM 2094 CG1 VAL A 131 -13.299 -1.763 -4.846 1.00 0.00 C ATOM 2095 CG2 VAL A 131 -15.396 -0.558 -4.327 1.00 0.00 C ATOM 0 H VAL A 131 -13.065 -1.728 -7.431 1.00 0.00 H new ATOM 0 HA VAL A 131 -15.326 -0.052 -7.023 1.00 0.00 H new ATOM 0 HB VAL A 131 -15.148 -2.075 -5.799 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -13.520 -2.422 -4.006 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -12.765 -2.321 -5.615 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -12.680 -0.934 -4.503 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.546 -1.254 -3.501 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -14.867 0.325 -3.967 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -16.364 -0.261 -4.731 1.00 0.00 H new ATOM 2105 N ILE A 132 -12.370 1.120 -6.169 1.00 0.00 N ATOM 2106 CA ILE A 132 -11.651 2.337 -5.812 1.00 0.00 C ATOM 2107 C ILE A 132 -11.857 3.461 -6.846 1.00 0.00 C ATOM 2108 O ILE A 132 -12.066 4.632 -6.475 1.00 0.00 O ATOM 2109 CB ILE A 132 -10.128 2.053 -5.514 1.00 0.00 C ATOM 2110 CG1 ILE A 132 -9.892 1.757 -4.013 1.00 0.00 C ATOM 2111 CG2 ILE A 132 -9.213 3.173 -5.994 1.00 0.00 C ATOM 2112 CD1 ILE A 132 -10.678 0.592 -3.449 1.00 0.00 C ATOM 0 H ILE A 132 -11.766 0.324 -6.376 1.00 0.00 H new ATOM 0 HA ILE A 132 -12.084 2.703 -4.881 1.00 0.00 H new ATOM 0 HB ILE A 132 -9.867 1.163 -6.087 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -8.830 1.564 -3.861 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -10.139 2.651 -3.441 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -8.178 2.922 -5.762 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -9.324 3.297 -7.071 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.482 4.103 -5.493 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -10.440 0.470 -2.392 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -11.745 0.785 -3.561 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -10.416 -0.319 -3.987 1.00 0.00 H new ATOM 2124 N GLU A 133 -11.858 3.112 -8.129 1.00 0.00 N ATOM 2125 CA GLU A 133 -12.084 4.100 -9.176 1.00 0.00 C ATOM 2126 C GLU A 133 -13.530 4.584 -9.125 1.00 0.00 C ATOM 2127 O GLU A 133 -13.835 5.694 -9.533 1.00 0.00 O ATOM 2128 CB GLU A 133 -11.758 3.547 -10.579 1.00 0.00 C ATOM 2129 CG GLU A 133 -12.676 2.431 -11.023 1.00 0.00 C ATOM 2130 CD GLU A 133 -12.470 1.995 -12.440 1.00 0.00 C ATOM 2131 OE1 GLU A 133 -11.473 1.311 -12.746 1.00 0.00 O ATOM 2132 OE2 GLU A 133 -13.305 2.349 -13.297 1.00 0.00 O ATOM 0 H GLU A 133 -11.706 2.161 -8.466 1.00 0.00 H new ATOM 0 HA GLU A 133 -11.408 4.936 -8.993 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -11.814 4.361 -11.302 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -10.730 3.184 -10.587 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -12.531 1.573 -10.366 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -13.709 2.755 -10.901 1.00 0.00 H new ATOM 2139 N HIS A 134 -14.398 3.752 -8.601 1.00 0.00 N ATOM 2140 CA HIS A 134 -15.787 4.087 -8.479 1.00 0.00 C ATOM 2141 C HIS A 134 -15.983 4.959 -7.232 1.00 0.00 C ATOM 2142 O HIS A 134 -16.803 5.844 -7.222 1.00 0.00 O ATOM 2143 CB HIS A 134 -16.630 2.815 -8.390 1.00 0.00 C ATOM 2144 CG HIS A 134 -17.987 2.943 -9.003 1.00 0.00 C ATOM 2145 ND1 HIS A 134 -18.571 1.960 -9.762 1.00 0.00 N ATOM 2146 CD2 HIS A 134 -18.874 3.965 -8.973 1.00 0.00 C ATOM 2147 CE1 HIS A 134 -19.753 2.391 -10.165 1.00 0.00 C ATOM 2148 NE2 HIS A 134 -19.995 3.614 -9.713 1.00 0.00 N ATOM 0 H HIS A 134 -14.157 2.826 -8.249 1.00 0.00 H new ATOM 0 HA HIS A 134 -16.111 4.644 -9.358 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -16.096 2.002 -8.881 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -16.740 2.537 -7.342 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -18.732 4.903 -8.456 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -20.433 1.822 -10.782 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -20.829 4.178 -9.875 1.00 0.00 H new ATOM 2156 N MET A 135 -15.197 4.714 -6.200 1.00 0.00 N ATOM 2157 CA MET A 135 -15.246 5.516 -4.967 1.00 0.00 C ATOM 2158 C MET A 135 -14.847 6.944 -5.261 1.00 0.00 C ATOM 2159 O MET A 135 -15.466 7.895 -4.770 1.00 0.00 O ATOM 2160 CB MET A 135 -14.324 4.949 -3.881 1.00 0.00 C ATOM 2161 CG MET A 135 -14.613 3.520 -3.392 1.00 0.00 C ATOM 2162 SD MET A 135 -16.201 3.285 -2.548 1.00 0.00 S ATOM 2163 CE MET A 135 -17.371 3.194 -3.896 1.00 0.00 C ATOM 0 H MET A 135 -14.508 3.962 -6.181 1.00 0.00 H new ATOM 0 HA MET A 135 -16.271 5.482 -4.597 1.00 0.00 H new ATOM 0 HB2 MET A 135 -13.301 4.977 -4.257 1.00 0.00 H new ATOM 0 HB3 MET A 135 -14.366 5.616 -3.020 1.00 0.00 H new ATOM 0 HG2 MET A 135 -14.575 2.848 -4.249 1.00 0.00 H new ATOM 0 HG3 MET A 135 -13.814 3.219 -2.714 1.00 0.00 H new ATOM 0 HE1 MET A 135 -18.003 4.082 -3.890 1.00 0.00 H new ATOM 0 HE2 MET A 135 -16.832 3.139 -4.842 1.00 0.00 H new ATOM 0 HE3 MET A 135 -17.992 2.306 -3.780 1.00 0.00 H new ATOM 2173 N LYS A 136 -13.842 7.100 -6.099 1.00 0.00 N ATOM 2174 CA LYS A 136 -13.371 8.414 -6.462 1.00 0.00 C ATOM 2175 C LYS A 136 -14.364 9.193 -7.322 1.00 0.00 C ATOM 2176 O LYS A 136 -14.229 10.393 -7.475 1.00 0.00 O ATOM 2177 CB LYS A 136 -11.965 8.424 -7.030 1.00 0.00 C ATOM 2178 CG LYS A 136 -11.773 7.597 -8.257 1.00 0.00 C ATOM 2179 CD LYS A 136 -10.333 7.645 -8.734 1.00 0.00 C ATOM 2180 CE LYS A 136 -9.359 7.145 -7.660 1.00 0.00 C ATOM 2181 NZ LYS A 136 -7.947 7.207 -8.095 1.00 0.00 N ATOM 0 H LYS A 136 -13.338 6.331 -6.540 1.00 0.00 H new ATOM 0 HA LYS A 136 -13.303 8.956 -5.519 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -11.689 9.454 -7.258 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -11.277 8.072 -6.262 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -12.056 6.565 -8.050 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -12.432 7.956 -9.047 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -10.227 7.036 -9.632 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -10.076 8.668 -9.010 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -9.483 7.742 -6.757 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -9.609 6.117 -7.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -7.333 6.858 -7.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -7.818 6.616 -8.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -7.696 8.191 -8.319 1.00 0.00 H new ATOM 2195 N THR A 137 -15.332 8.496 -7.933 1.00 0.00 N ATOM 2196 CA THR A 137 -16.374 9.184 -8.690 1.00 0.00 C ATOM 2197 C THR A 137 -17.219 10.023 -7.729 1.00 0.00 C ATOM 2198 O THR A 137 -17.762 11.057 -8.108 1.00 0.00 O ATOM 2199 CB THR A 137 -17.313 8.209 -9.471 1.00 0.00 C ATOM 2200 OG1 THR A 137 -18.222 7.536 -8.595 1.00 0.00 O ATOM 2201 CG2 THR A 137 -16.509 7.173 -10.174 1.00 0.00 C ATOM 0 H THR A 137 -15.411 7.479 -7.917 1.00 0.00 H new ATOM 0 HA THR A 137 -15.872 9.809 -9.429 1.00 0.00 H new ATOM 0 HB THR A 137 -17.876 8.813 -10.183 1.00 0.00 H new ATOM 0 HG1 THR A 137 -17.730 7.174 -7.828 1.00 0.00 H new ATOM 0 HG21 THR A 137 -17.175 6.500 -10.714 1.00 0.00 H new ATOM 0 HG22 THR A 137 -15.831 7.655 -10.878 1.00 0.00 H new ATOM 0 HG23 THR A 137 -15.932 6.604 -9.445 1.00 0.00 H new ATOM 2209 N TYR A 138 -17.280 9.577 -6.466 1.00 0.00 N ATOM 2210 CA TYR A 138 -18.018 10.252 -5.457 1.00 0.00 C ATOM 2211 C TYR A 138 -17.142 11.328 -4.920 1.00 0.00 C ATOM 2212 O TYR A 138 -17.438 12.502 -5.089 1.00 0.00 O ATOM 2213 CB TYR A 138 -18.493 9.246 -4.371 1.00 0.00 C ATOM 2214 CG TYR A 138 -19.522 8.285 -4.927 1.00 0.00 C ATOM 2215 CD1 TYR A 138 -19.155 7.162 -5.653 1.00 0.00 C ATOM 2216 CD2 TYR A 138 -20.857 8.562 -4.800 1.00 0.00 C ATOM 2217 CE1 TYR A 138 -20.103 6.356 -6.244 1.00 0.00 C ATOM 2218 CE2 TYR A 138 -21.816 7.762 -5.370 1.00 0.00 C ATOM 2219 CZ TYR A 138 -21.436 6.668 -6.105 1.00 0.00 C ATOM 2220 OH TYR A 138 -22.395 5.869 -6.675 1.00 0.00 O ATOM 0 H TYR A 138 -16.808 8.733 -6.142 1.00 0.00 H new ATOM 0 HA TYR A 138 -18.927 10.704 -5.853 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -17.638 8.687 -3.990 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -18.918 9.791 -3.528 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -18.109 6.915 -5.757 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -21.163 9.432 -4.237 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -19.803 5.487 -6.811 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -22.863 7.993 -5.241 1.00 0.00 H new ATOM 0 HH TYR A 138 -23.128 6.426 -7.010 1.00 0.00 H new ATOM 2230 N SER A 139 -16.046 10.902 -4.290 1.00 0.00 N ATOM 2231 CA SER A 139 -14.948 11.761 -3.813 1.00 0.00 C ATOM 2232 C SER A 139 -15.412 12.977 -2.977 1.00 0.00 C ATOM 2233 O SER A 139 -14.636 13.919 -2.745 1.00 0.00 O ATOM 2234 CB SER A 139 -14.120 12.204 -5.019 1.00 0.00 C ATOM 2235 OG SER A 139 -12.926 12.877 -4.651 1.00 0.00 O ATOM 0 H SER A 139 -15.888 9.915 -4.088 1.00 0.00 H new ATOM 0 HA SER A 139 -14.343 11.169 -3.126 1.00 0.00 H new ATOM 0 HB2 SER A 139 -13.868 11.331 -5.621 1.00 0.00 H new ATOM 0 HB3 SER A 139 -14.723 12.861 -5.646 1.00 0.00 H new ATOM 0 HG SER A 139 -13.073 13.371 -3.817 1.00 0.00 H new ATOM 2241 N GLY A 140 -16.610 12.939 -2.501 1.00 0.00 N ATOM 2242 CA GLY A 140 -17.125 14.017 -1.767 1.00 0.00 C ATOM 2243 C GLY A 140 -18.016 13.459 -0.779 1.00 0.00 C ATOM 2244 O GLY A 140 -18.575 12.398 -1.078 1.00 0.00 O ATOM 2245 OXT GLY A 140 -18.134 14.012 0.315 1.00 0.00 O ATOM 0 H GLY A 140 -17.251 12.154 -2.616 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -16.322 14.579 -1.290 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -17.656 14.710 -2.419 1.00 0.00 H new