USER MOD reduce.3.24.130724 H: found=0, std=0, add=672, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 675 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 30 THR OG1 : rot 135:sc= 1.24 USER MOD Set 1.2: A 91 SER OG : rot -27:sc= 0.938 USER MOD Set 2.1: A 53 LYS NZ :NH3+ 162:sc= 1.82 (180deg=0.695) USER MOD Set 2.2: A 54 SER OG : rot -90:sc= 1.52 USER MOD Set 2.3: A 69 TYR OH : rot -129:sc= 1 USER MOD Set 3.1: A 39 SER OG : rot 90:sc= 1.13 USER MOD Set 3.2: A 65 THR OG1 : rot 54:sc= 2.4 USER MOD Set 4.1: A 32 LYS NZ :NH3+ -140:sc= 1.26 (180deg=-0.0159) USER MOD Set 4.2: A 36 GLN : amide:sc= 1.13 K(o=2.4,f=-8.1!) USER MOD Set 5.1: A 24 THR OG1 : rot 165:sc= 1.16 USER MOD Set 5.2: A 33 SER OG : rot 64:sc= 1.93 USER MOD Single : A 9 SER OG : rot 23:sc= 0.0219 USER MOD Single : A 11 ASN : amide:sc= -0.11 K(o=-0.11,f=-1.8) USER MOD Single : A 12 GLN : amide:sc= -0.628 K(o=-0.63,f=-4.4!) USER MOD Single : A 13 LYS NZ :NH3+ -168:sc= 1.04 (180deg=0.512) USER MOD Single : A 19 LYS NZ :NH3+ -171:sc= 1.37 (180deg=0.98) USER MOD Single : A 20 SER OG : rot -92:sc= 1.03 USER MOD Single : A 22 LYS NZ :NH3+ -146:sc= 2.37 (180deg=0.964) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot -153:sc= 1.79 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 168:sc= 1.32 USER MOD Single : A 38 LYS NZ :NH3+ -149:sc= 1.36! (180deg=0.0453) USER MOD Single : A 40 LYS NZ :NH3+ -111:sc= 1.05 (180deg=-0.787) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 THR OG1 : rot 94:sc= 1.33 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 128:sc= 1.66 USER MOD Single : A 61 MET CE :methyl -166:sc= -0.0179 (180deg=-0.243) USER MOD Single : A 63 SER OG : rot -132:sc= 1.32 USER MOD Single : A 64 LYS NZ :NH3+ 171:sc= 2.28 (180deg=2.08) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0056 USER MOD Single : A 98 SER OG : rot -106:sc= 1.06 USER MOD ----------------------------------------------------------------- ATOM 108 N SER A 9 8.326 5.963 -26.937 1.00 0.00 N ATOM 109 CA SER A 9 7.178 5.089 -27.186 1.00 0.00 C ATOM 110 C SER A 9 6.224 5.138 -25.993 1.00 0.00 C ATOM 111 O SER A 9 5.139 5.695 -26.124 1.00 0.00 O ATOM 112 CB SER A 9 7.568 3.634 -27.492 1.00 0.00 C ATOM 113 OG SER A 9 8.424 3.541 -28.607 1.00 0.00 O ATOM 0 HA SER A 9 6.685 5.467 -28.082 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.058 3.199 -26.621 1.00 0.00 H new ATOM 0 HB3 SER A 9 6.667 3.048 -27.676 1.00 0.00 H new ATOM 0 HG SER A 9 8.883 4.397 -28.739 1.00 0.00 H new ATOM 119 N ILE A 10 6.600 4.550 -24.844 1.00 0.00 N ATOM 120 CA ILE A 10 5.676 4.248 -23.739 1.00 0.00 C ATOM 121 C ILE A 10 4.917 5.482 -23.251 1.00 0.00 C ATOM 122 O ILE A 10 3.694 5.448 -23.255 1.00 0.00 O ATOM 123 CB ILE A 10 6.349 3.425 -22.605 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.357 2.910 -21.530 1.00 0.00 C ATOM 125 CG2 ILE A 10 7.562 4.091 -21.941 1.00 0.00 C ATOM 126 CD1 ILE A 10 4.952 3.892 -20.419 1.00 0.00 C ATOM 0 H ILE A 10 7.562 4.269 -24.655 1.00 0.00 H new ATOM 0 HA ILE A 10 4.907 3.590 -24.145 1.00 0.00 H new ATOM 0 HB ILE A 10 6.735 2.562 -23.147 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.450 2.581 -22.037 1.00 0.00 H new ATOM 0 HG13 ILE A 10 5.796 2.030 -21.060 1.00 0.00 H new ATOM 0 HG21 ILE A 10 7.957 3.436 -21.165 1.00 0.00 H new ATOM 0 HG22 ILE A 10 8.333 4.272 -22.690 1.00 0.00 H new ATOM 0 HG23 ILE A 10 7.259 5.039 -21.496 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.256 3.403 -19.737 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.839 4.205 -19.869 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.473 4.765 -20.862 1.00 0.00 H new ATOM 138 N ASN A 11 5.596 6.560 -22.844 1.00 0.00 N ATOM 139 CA ASN A 11 4.959 7.685 -22.152 1.00 0.00 C ATOM 140 C ASN A 11 3.907 8.359 -23.057 1.00 0.00 C ATOM 141 O ASN A 11 2.718 8.423 -22.733 1.00 0.00 O ATOM 142 CB ASN A 11 6.078 8.637 -21.683 1.00 0.00 C ATOM 143 CG ASN A 11 5.694 9.545 -20.524 1.00 0.00 C ATOM 144 OD1 ASN A 11 4.550 9.649 -20.109 1.00 0.00 O ATOM 145 ND2 ASN A 11 6.674 10.200 -19.939 1.00 0.00 N ATOM 0 H ASN A 11 6.599 6.677 -22.985 1.00 0.00 H new ATOM 0 HA ASN A 11 4.404 7.352 -21.275 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.943 8.043 -21.390 1.00 0.00 H new ATOM 0 HB3 ASN A 11 6.387 9.256 -22.525 1.00 0.00 H new ATOM 0 HD21 ASN A 11 6.480 10.798 -19.136 1.00 0.00 H new ATOM 0 HD22 ASN A 11 7.628 10.110 -20.289 1.00 0.00 H new ATOM 152 N GLN A 12 4.354 8.767 -24.248 1.00 0.00 N ATOM 153 CA GLN A 12 3.540 9.290 -25.343 1.00 0.00 C ATOM 154 C GLN A 12 2.404 8.330 -25.722 1.00 0.00 C ATOM 155 O GLN A 12 1.236 8.725 -25.695 1.00 0.00 O ATOM 156 CB GLN A 12 4.490 9.619 -26.509 1.00 0.00 C ATOM 157 CG GLN A 12 3.847 9.761 -27.903 1.00 0.00 C ATOM 158 CD GLN A 12 3.776 8.454 -28.703 1.00 0.00 C ATOM 159 OE1 GLN A 12 2.731 8.056 -29.200 1.00 0.00 O ATOM 160 NE2 GLN A 12 4.872 7.735 -28.869 1.00 0.00 N ATOM 0 H GLN A 12 5.346 8.739 -24.484 1.00 0.00 H new ATOM 0 HA GLN A 12 3.026 10.202 -25.041 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.007 10.550 -26.275 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.249 8.838 -26.561 1.00 0.00 H new ATOM 0 HG2 GLN A 12 2.838 10.157 -27.786 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.412 10.495 -28.478 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.754 8.048 -28.463 1.00 0.00 H new ATOM 0 HE22 GLN A 12 4.836 6.867 -29.403 1.00 0.00 H new ATOM 169 N LYS A 13 2.725 7.080 -26.085 1.00 0.00 N ATOM 170 CA LYS A 13 1.733 6.152 -26.624 1.00 0.00 C ATOM 171 C LYS A 13 0.714 5.728 -25.567 1.00 0.00 C ATOM 172 O LYS A 13 -0.440 5.500 -25.915 1.00 0.00 O ATOM 173 CB LYS A 13 2.422 4.949 -27.295 1.00 0.00 C ATOM 174 CG LYS A 13 1.478 4.062 -28.127 1.00 0.00 C ATOM 175 CD LYS A 13 0.747 4.775 -29.276 1.00 0.00 C ATOM 176 CE LYS A 13 1.686 5.318 -30.358 1.00 0.00 C ATOM 177 NZ LYS A 13 2.095 4.248 -31.294 1.00 0.00 N ATOM 0 H LYS A 13 3.666 6.693 -26.013 1.00 0.00 H new ATOM 0 HA LYS A 13 1.166 6.674 -27.395 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.220 5.316 -27.941 1.00 0.00 H new ATOM 0 HB3 LYS A 13 2.891 4.337 -26.524 1.00 0.00 H new ATOM 0 HG2 LYS A 13 2.055 3.236 -28.543 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.734 3.627 -27.460 1.00 0.00 H new ATOM 0 HD2 LYS A 13 0.042 4.080 -29.734 1.00 0.00 H new ATOM 0 HD3 LYS A 13 0.162 5.599 -28.867 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.188 6.116 -30.909 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.569 5.755 -29.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.879 4.587 -31.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 2.404 3.414 -30.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 1.290 3.990 -31.899 1.00 0.00 H new ATOM 191 N LEU A 14 1.099 5.670 -24.287 1.00 0.00 N ATOM 192 CA LEU A 14 0.191 5.359 -23.187 1.00 0.00 C ATOM 193 C LEU A 14 -0.826 6.486 -22.990 1.00 0.00 C ATOM 194 O LEU A 14 -2.013 6.198 -22.863 1.00 0.00 O ATOM 195 CB LEU A 14 0.999 5.033 -21.923 1.00 0.00 C ATOM 196 CG LEU A 14 0.134 4.392 -20.822 1.00 0.00 C ATOM 197 CD1 LEU A 14 0.949 3.346 -20.067 1.00 0.00 C ATOM 198 CD2 LEU A 14 -0.376 5.437 -19.836 1.00 0.00 C ATOM 0 H LEU A 14 2.059 5.840 -23.987 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.393 4.470 -23.426 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.814 4.357 -22.181 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.452 5.947 -21.539 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.724 3.923 -21.303 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.332 2.896 -19.289 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.280 2.573 -20.760 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.818 3.821 -19.611 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.983 4.951 -19.072 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.471 5.936 -19.364 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.981 6.173 -20.366 1.00 0.00 H new ATOM 210 N ALA A 15 -0.402 7.760 -23.031 1.00 0.00 N ATOM 211 CA ALA A 15 -1.348 8.879 -23.046 1.00 0.00 C ATOM 212 C ALA A 15 -2.254 8.854 -24.286 1.00 0.00 C ATOM 213 O ALA A 15 -3.471 9.008 -24.169 1.00 0.00 O ATOM 214 CB ALA A 15 -0.598 10.206 -22.965 1.00 0.00 C ATOM 0 H ALA A 15 0.580 8.035 -23.054 1.00 0.00 H new ATOM 0 HA ALA A 15 -1.991 8.774 -22.172 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.312 11.029 -22.977 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -0.019 10.241 -22.042 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.074 10.297 -23.818 1.00 0.00 H new ATOM 220 N LEU A 16 -1.665 8.622 -25.470 1.00 0.00 N ATOM 221 CA LEU A 16 -2.394 8.485 -26.730 1.00 0.00 C ATOM 222 C LEU A 16 -3.429 7.352 -26.657 1.00 0.00 C ATOM 223 O LEU A 16 -4.537 7.531 -27.144 1.00 0.00 O ATOM 224 CB LEU A 16 -1.376 8.323 -27.873 1.00 0.00 C ATOM 225 CG LEU A 16 -1.937 8.558 -29.290 1.00 0.00 C ATOM 226 CD1 LEU A 16 -0.788 8.938 -30.229 1.00 0.00 C ATOM 227 CD2 LEU A 16 -2.604 7.316 -29.890 1.00 0.00 C ATOM 0 H LEU A 16 -0.655 8.524 -25.575 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.977 9.384 -26.930 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.553 9.017 -27.706 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.959 7.317 -27.827 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.685 9.346 -29.196 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.179 9.105 -31.233 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.310 9.849 -29.869 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.057 8.130 -30.254 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.977 7.549 -30.887 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.876 6.507 -29.955 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -3.434 7.006 -29.255 1.00 0.00 H new ATOM 239 N VAL A 17 -3.119 6.229 -25.999 1.00 0.00 N ATOM 240 CA VAL A 17 -4.073 5.178 -25.629 1.00 0.00 C ATOM 241 C VAL A 17 -5.153 5.675 -24.663 1.00 0.00 C ATOM 242 O VAL A 17 -6.341 5.543 -24.958 1.00 0.00 O ATOM 243 CB VAL A 17 -3.307 3.943 -25.110 1.00 0.00 C ATOM 244 CG1 VAL A 17 -4.090 3.028 -24.160 1.00 0.00 C ATOM 245 CG2 VAL A 17 -2.858 3.142 -26.336 1.00 0.00 C ATOM 0 H VAL A 17 -2.166 6.020 -25.700 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.624 4.878 -26.520 1.00 0.00 H new ATOM 0 HB VAL A 17 -2.477 4.314 -24.508 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.459 2.193 -23.857 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.393 3.593 -23.278 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.975 2.647 -24.669 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.310 2.257 -26.012 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.732 2.837 -26.912 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.211 3.761 -26.958 1.00 0.00 H new ATOM 255 N ILE A 18 -4.763 6.254 -23.524 1.00 0.00 N ATOM 256 CA ILE A 18 -5.655 6.779 -22.475 1.00 0.00 C ATOM 257 C ILE A 18 -6.669 7.823 -22.990 1.00 0.00 C ATOM 258 O ILE A 18 -7.741 7.957 -22.403 1.00 0.00 O ATOM 259 CB ILE A 18 -4.791 7.221 -21.271 1.00 0.00 C ATOM 260 CG1 ILE A 18 -4.374 5.939 -20.506 1.00 0.00 C ATOM 261 CG2 ILE A 18 -5.539 8.198 -20.362 1.00 0.00 C ATOM 262 CD1 ILE A 18 -3.669 6.172 -19.168 1.00 0.00 C ATOM 0 H ILE A 18 -3.777 6.377 -23.294 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.318 5.987 -22.126 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.909 7.758 -21.621 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -5.265 5.337 -20.328 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.716 5.352 -21.147 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.897 8.484 -19.529 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.813 9.087 -20.930 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.441 7.720 -19.978 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.420 5.212 -18.716 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.755 6.743 -19.333 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.328 6.727 -18.501 1.00 0.00 H new ATOM 274 N LYS A 19 -6.411 8.456 -24.143 1.00 0.00 N ATOM 275 CA LYS A 19 -7.367 9.273 -24.907 1.00 0.00 C ATOM 276 C LYS A 19 -8.734 8.597 -25.118 1.00 0.00 C ATOM 277 O LYS A 19 -9.745 9.292 -25.070 1.00 0.00 O ATOM 278 CB LYS A 19 -6.711 9.594 -26.253 1.00 0.00 C ATOM 279 CG LYS A 19 -7.519 10.469 -27.221 1.00 0.00 C ATOM 280 CD LYS A 19 -6.679 10.900 -28.439 1.00 0.00 C ATOM 281 CE LYS A 19 -5.876 9.773 -29.114 1.00 0.00 C ATOM 282 NZ LYS A 19 -6.734 8.686 -29.634 1.00 0.00 N ATOM 0 H LYS A 19 -5.494 8.412 -24.588 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.586 10.175 -24.336 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.760 10.090 -26.059 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.483 8.653 -26.754 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.397 9.920 -27.561 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -7.880 11.354 -26.697 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -7.344 11.344 -29.180 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.986 11.680 -28.124 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -5.291 10.191 -29.934 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -5.168 9.358 -28.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -6.139 7.889 -29.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -7.383 8.368 -28.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -7.285 9.036 -30.444 1.00 0.00 H new ATOM 296 N SER A 20 -8.785 7.274 -25.343 1.00 0.00 N ATOM 297 CA SER A 20 -10.060 6.533 -25.430 1.00 0.00 C ATOM 298 C SER A 20 -10.036 5.063 -24.966 1.00 0.00 C ATOM 299 O SER A 20 -11.093 4.430 -24.906 1.00 0.00 O ATOM 300 CB SER A 20 -10.662 6.665 -26.836 1.00 0.00 C ATOM 301 OG SER A 20 -9.960 5.911 -27.796 1.00 0.00 O ATOM 0 H SER A 20 -7.957 6.692 -25.469 1.00 0.00 H new ATOM 0 HA SER A 20 -10.703 7.017 -24.695 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.702 6.341 -26.814 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.661 7.714 -27.131 1.00 0.00 H new ATOM 0 HG SER A 20 -9.273 6.471 -28.214 1.00 0.00 H new ATOM 307 N GLY A 21 -8.883 4.528 -24.543 1.00 0.00 N ATOM 308 CA GLY A 21 -8.726 3.179 -23.992 1.00 0.00 C ATOM 309 C GLY A 21 -9.178 3.060 -22.528 1.00 0.00 C ATOM 310 O GLY A 21 -9.925 3.901 -22.018 1.00 0.00 O ATOM 0 H GLY A 21 -8.003 5.043 -24.577 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -9.299 2.478 -24.599 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -7.679 2.884 -24.066 1.00 0.00 H new ATOM 314 N LYS A 22 -8.806 1.956 -21.862 1.00 0.00 N ATOM 315 CA LYS A 22 -9.212 1.648 -20.481 1.00 0.00 C ATOM 316 C LYS A 22 -8.013 1.287 -19.605 1.00 0.00 C ATOM 317 O LYS A 22 -7.312 0.302 -19.859 1.00 0.00 O ATOM 318 CB LYS A 22 -10.302 0.558 -20.441 1.00 0.00 C ATOM 319 CG LYS A 22 -11.686 1.084 -20.868 1.00 0.00 C ATOM 320 CD LYS A 22 -11.980 1.028 -22.379 1.00 0.00 C ATOM 321 CE LYS A 22 -13.061 2.049 -22.759 1.00 0.00 C ATOM 322 NZ LYS A 22 -12.524 3.432 -22.839 1.00 0.00 N ATOM 0 H LYS A 22 -8.206 1.241 -22.273 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.649 2.555 -20.062 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -10.012 -0.264 -21.096 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -10.368 0.153 -19.431 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -12.451 0.509 -20.345 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.781 2.118 -20.535 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -11.068 1.231 -22.940 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -12.307 0.025 -22.654 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -13.496 1.774 -23.720 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -13.865 2.015 -22.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.252 4.106 -22.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.688 3.516 -22.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -12.255 3.644 -23.821 1.00 0.00 H new ATOM 336 N TYR A 23 -7.795 2.119 -18.583 1.00 0.00 N ATOM 337 CA TYR A 23 -6.652 2.120 -17.674 1.00 0.00 C ATOM 338 C TYR A 23 -7.070 2.184 -16.192 1.00 0.00 C ATOM 339 O TYR A 23 -8.247 2.335 -15.872 1.00 0.00 O ATOM 340 CB TYR A 23 -5.784 3.335 -18.036 1.00 0.00 C ATOM 341 CG TYR A 23 -6.447 4.672 -17.740 1.00 0.00 C ATOM 342 CD1 TYR A 23 -7.381 5.219 -18.645 1.00 0.00 C ATOM 343 CD2 TYR A 23 -6.141 5.356 -16.548 1.00 0.00 C ATOM 344 CE1 TYR A 23 -8.016 6.438 -18.350 1.00 0.00 C ATOM 345 CE2 TYR A 23 -6.767 6.582 -16.252 1.00 0.00 C ATOM 346 CZ TYR A 23 -7.709 7.124 -17.156 1.00 0.00 C ATOM 347 OH TYR A 23 -8.314 8.311 -16.888 1.00 0.00 O ATOM 0 H TYR A 23 -8.459 2.859 -18.356 1.00 0.00 H new ATOM 0 HA TYR A 23 -6.103 1.186 -17.790 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -4.845 3.276 -17.486 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -5.536 3.290 -19.096 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -7.608 4.701 -19.565 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -5.423 4.938 -15.858 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.740 6.850 -19.038 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -6.529 7.106 -15.338 1.00 0.00 H new ATOM 0 HH TYR A 23 -7.995 8.654 -16.027 1.00 0.00 H new ATOM 357 N THR A 24 -6.086 2.100 -15.291 1.00 0.00 N ATOM 358 CA THR A 24 -6.235 2.221 -13.830 1.00 0.00 C ATOM 359 C THR A 24 -4.984 2.875 -13.212 1.00 0.00 C ATOM 360 O THR A 24 -3.892 2.738 -13.772 1.00 0.00 O ATOM 361 CB THR A 24 -6.531 0.821 -13.263 1.00 0.00 C ATOM 362 OG1 THR A 24 -6.861 0.850 -11.900 1.00 0.00 O ATOM 363 CG2 THR A 24 -5.386 -0.172 -13.455 1.00 0.00 C ATOM 0 H THR A 24 -5.118 1.938 -15.569 1.00 0.00 H new ATOM 0 HA THR A 24 -7.067 2.876 -13.573 1.00 0.00 H new ATOM 0 HB THR A 24 -7.389 0.481 -13.843 1.00 0.00 H new ATOM 0 HG1 THR A 24 -7.274 -0.001 -11.645 1.00 0.00 H new ATOM 0 HG21 THR A 24 -5.666 -1.136 -13.031 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.181 -0.289 -14.519 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.493 0.200 -12.952 1.00 0.00 H new ATOM 371 N LEU A 25 -5.130 3.598 -12.086 1.00 0.00 N ATOM 372 CA LEU A 25 -4.087 4.433 -11.453 1.00 0.00 C ATOM 373 C LEU A 25 -4.045 4.266 -9.925 1.00 0.00 C ATOM 374 O LEU A 25 -5.067 4.435 -9.255 1.00 0.00 O ATOM 375 CB LEU A 25 -4.332 5.933 -11.737 1.00 0.00 C ATOM 376 CG LEU A 25 -4.231 6.411 -13.194 1.00 0.00 C ATOM 377 CD1 LEU A 25 -4.497 7.917 -13.262 1.00 0.00 C ATOM 378 CD2 LEU A 25 -2.846 6.176 -13.784 1.00 0.00 C ATOM 0 H LEU A 25 -6.010 3.619 -11.571 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.143 4.098 -11.884 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.327 6.186 -11.370 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.619 6.507 -11.146 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.967 5.841 -13.762 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.425 8.253 -14.296 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.496 8.128 -12.881 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.760 8.444 -12.657 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.825 6.530 -14.815 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.104 6.719 -13.198 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.617 5.111 -13.762 1.00 0.00 H new ATOM 390 N GLY A 26 -2.856 4.015 -9.369 1.00 0.00 N ATOM 391 CA GLY A 26 -2.617 3.898 -7.924 1.00 0.00 C ATOM 392 C GLY A 26 -2.704 2.450 -7.429 1.00 0.00 C ATOM 393 O GLY A 26 -3.436 1.642 -7.993 1.00 0.00 O ATOM 0 H GLY A 26 -2.010 3.884 -9.924 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.632 4.300 -7.688 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.346 4.506 -7.388 1.00 0.00 H new ATOM 397 N TYR A 27 -1.959 2.120 -6.363 1.00 0.00 N ATOM 398 CA TYR A 27 -1.675 0.735 -5.957 1.00 0.00 C ATOM 399 C TYR A 27 -2.942 -0.105 -5.748 1.00 0.00 C ATOM 400 O TYR A 27 -3.130 -1.115 -6.423 1.00 0.00 O ATOM 401 CB TYR A 27 -0.769 0.715 -4.717 1.00 0.00 C ATOM 402 CG TYR A 27 -0.176 -0.653 -4.429 1.00 0.00 C ATOM 403 CD1 TYR A 27 1.045 -1.016 -5.032 1.00 0.00 C ATOM 404 CD2 TYR A 27 -0.839 -1.572 -3.585 1.00 0.00 C ATOM 405 CE1 TYR A 27 1.591 -2.282 -4.799 1.00 0.00 C ATOM 406 CE2 TYR A 27 -0.284 -2.848 -3.344 1.00 0.00 C ATOM 407 CZ TYR A 27 0.933 -3.203 -3.967 1.00 0.00 C ATOM 408 OH TYR A 27 1.545 -4.394 -3.747 1.00 0.00 O ATOM 0 H TYR A 27 -1.532 2.816 -5.751 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.144 0.263 -6.784 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.040 1.432 -4.855 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -1.343 1.044 -3.851 1.00 0.00 H new ATOM 0 HD1 TYR A 27 1.559 -0.316 -5.674 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -1.775 -1.297 -3.122 1.00 0.00 H new ATOM 0 HE1 TYR A 27 2.527 -2.554 -5.263 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -0.785 -3.546 -2.690 1.00 0.00 H new ATOM 0 HH TYR A 27 0.871 -5.076 -3.547 1.00 0.00 H new ATOM 418 N LYS A 28 -3.833 0.324 -4.843 1.00 0.00 N ATOM 419 CA LYS A 28 -5.107 -0.353 -4.560 1.00 0.00 C ATOM 420 C LYS A 28 -5.962 -0.517 -5.823 1.00 0.00 C ATOM 421 O LYS A 28 -6.524 -1.589 -6.044 1.00 0.00 O ATOM 422 CB LYS A 28 -5.843 0.413 -3.447 1.00 0.00 C ATOM 423 CG LYS A 28 -7.090 -0.328 -2.940 1.00 0.00 C ATOM 424 CD LYS A 28 -7.725 0.419 -1.759 1.00 0.00 C ATOM 425 CE LYS A 28 -8.950 -0.343 -1.242 1.00 0.00 C ATOM 426 NZ LYS A 28 -9.572 0.345 -0.085 1.00 0.00 N ATOM 0 H LYS A 28 -3.687 1.162 -4.280 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.906 -1.366 -4.212 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.160 0.579 -2.614 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.135 1.395 -3.820 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.815 -0.424 -3.748 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.819 -1.338 -2.634 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -6.995 0.533 -0.958 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.017 1.422 -2.070 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.682 -0.443 -2.043 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.656 -1.352 -0.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.398 -0.198 0.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -8.880 0.418 0.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -9.875 1.298 -0.370 1.00 0.00 H new ATOM 440 N SER A 29 -6.013 0.521 -6.666 1.00 0.00 N ATOM 441 CA SER A 29 -6.709 0.540 -7.952 1.00 0.00 C ATOM 442 C SER A 29 -6.196 -0.555 -8.878 1.00 0.00 C ATOM 443 O SER A 29 -6.993 -1.380 -9.332 1.00 0.00 O ATOM 444 CB SER A 29 -6.514 1.880 -8.667 1.00 0.00 C ATOM 445 OG SER A 29 -6.519 2.975 -7.779 1.00 0.00 O ATOM 0 H SER A 29 -5.550 1.406 -6.459 1.00 0.00 H new ATOM 0 HA SER A 29 -7.764 0.379 -7.732 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.570 1.863 -9.211 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.305 2.012 -9.405 1.00 0.00 H new ATOM 0 HG SER A 29 -6.201 3.776 -8.245 1.00 0.00 H new ATOM 451 N THR A 30 -4.883 -0.573 -9.164 1.00 0.00 N ATOM 452 CA THR A 30 -4.286 -1.627 -9.986 1.00 0.00 C ATOM 453 C THR A 30 -4.490 -2.993 -9.332 1.00 0.00 C ATOM 454 O THR A 30 -5.131 -3.819 -9.964 1.00 0.00 O ATOM 455 CB THR A 30 -2.853 -1.318 -10.453 1.00 0.00 C ATOM 456 OG1 THR A 30 -2.398 -2.385 -11.245 1.00 0.00 O ATOM 457 CG2 THR A 30 -1.835 -1.102 -9.344 1.00 0.00 C ATOM 0 H THR A 30 -4.221 0.130 -8.837 1.00 0.00 H new ATOM 0 HA THR A 30 -4.825 -1.664 -10.933 1.00 0.00 H new ATOM 0 HB THR A 30 -2.924 -0.374 -10.994 1.00 0.00 H new ATOM 0 HG1 THR A 30 -1.957 -2.033 -12.046 1.00 0.00 H new ATOM 0 HG21 THR A 30 -0.859 -0.891 -9.782 1.00 0.00 H new ATOM 0 HG22 THR A 30 -2.144 -0.260 -8.725 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.771 -2.000 -8.729 1.00 0.00 H new ATOM 465 N VAL A 31 -4.137 -3.224 -8.058 1.00 0.00 N ATOM 466 CA VAL A 31 -4.379 -4.518 -7.383 1.00 0.00 C ATOM 467 C VAL A 31 -5.821 -5.019 -7.567 1.00 0.00 C ATOM 468 O VAL A 31 -6.014 -6.148 -8.020 1.00 0.00 O ATOM 469 CB VAL A 31 -3.976 -4.474 -5.896 1.00 0.00 C ATOM 470 CG1 VAL A 31 -4.370 -5.770 -5.175 1.00 0.00 C ATOM 471 CG2 VAL A 31 -2.457 -4.310 -5.761 1.00 0.00 C ATOM 0 H VAL A 31 -3.680 -2.529 -7.468 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.733 -5.246 -7.873 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.497 -3.628 -5.447 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.073 -5.709 -4.128 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.449 -5.908 -5.238 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.868 -6.615 -5.646 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.187 -4.280 -4.705 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.956 -5.151 -6.240 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.147 -3.382 -6.241 1.00 0.00 H new ATOM 481 N LYS A 32 -6.833 -4.181 -7.288 1.00 0.00 N ATOM 482 CA LYS A 32 -8.244 -4.487 -7.571 1.00 0.00 C ATOM 483 C LYS A 32 -8.459 -4.853 -9.047 1.00 0.00 C ATOM 484 O LYS A 32 -9.022 -5.902 -9.351 1.00 0.00 O ATOM 485 CB LYS A 32 -9.105 -3.285 -7.141 1.00 0.00 C ATOM 486 CG LYS A 32 -10.611 -3.533 -7.308 1.00 0.00 C ATOM 487 CD LYS A 32 -11.406 -2.248 -7.030 1.00 0.00 C ATOM 488 CE LYS A 32 -12.927 -2.454 -7.078 1.00 0.00 C ATOM 489 NZ LYS A 32 -13.389 -2.978 -8.384 1.00 0.00 N ATOM 0 H LYS A 32 -6.694 -3.267 -6.857 1.00 0.00 H new ATOM 0 HA LYS A 32 -8.548 -5.364 -6.999 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.895 -3.050 -6.098 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.819 -2.412 -7.728 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.817 -3.883 -8.320 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.933 -4.321 -6.627 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -11.129 -1.863 -6.049 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -11.125 -1.490 -7.761 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -13.222 -3.145 -6.288 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -13.425 -1.506 -6.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -14.279 -2.510 -8.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -12.667 -2.789 -9.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -13.546 -4.003 -8.311 1.00 0.00 H new ATOM 503 N SER A 33 -8.003 -3.989 -9.955 1.00 0.00 N ATOM 504 CA SER A 33 -8.152 -4.117 -11.410 1.00 0.00 C ATOM 505 C SER A 33 -7.537 -5.416 -11.947 1.00 0.00 C ATOM 506 O SER A 33 -8.221 -6.172 -12.629 1.00 0.00 O ATOM 507 CB SER A 33 -7.525 -2.916 -12.135 1.00 0.00 C ATOM 508 OG SER A 33 -7.961 -1.670 -11.614 1.00 0.00 O ATOM 0 H SER A 33 -7.498 -3.144 -9.688 1.00 0.00 H new ATOM 0 HA SER A 33 -9.223 -4.143 -11.609 1.00 0.00 H new ATOM 0 HB2 SER A 33 -6.439 -2.977 -12.058 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.772 -2.968 -13.195 1.00 0.00 H new ATOM 0 HG SER A 33 -7.670 -1.585 -10.682 1.00 0.00 H new ATOM 514 N LEU A 34 -6.265 -5.695 -11.622 1.00 0.00 N ATOM 515 CA LEU A 34 -5.520 -6.878 -12.062 1.00 0.00 C ATOM 516 C LEU A 34 -6.150 -8.178 -11.548 1.00 0.00 C ATOM 517 O LEU A 34 -6.102 -9.191 -12.248 1.00 0.00 O ATOM 518 CB LEU A 34 -4.057 -6.818 -11.575 1.00 0.00 C ATOM 519 CG LEU A 34 -3.242 -5.560 -11.929 1.00 0.00 C ATOM 520 CD1 LEU A 34 -1.861 -5.629 -11.281 1.00 0.00 C ATOM 521 CD2 LEU A 34 -3.109 -5.319 -13.418 1.00 0.00 C ATOM 0 H LEU A 34 -5.711 -5.081 -11.025 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.553 -6.876 -13.151 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -4.059 -6.924 -10.490 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.532 -7.684 -11.979 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.800 -4.712 -11.532 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.293 -4.735 -11.538 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.970 -5.691 -10.198 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.333 -6.511 -11.644 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.523 -4.416 -13.590 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.609 -6.170 -13.881 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.099 -5.197 -13.857 1.00 0.00 H new ATOM 533 N ARG A 35 -6.722 -8.158 -10.334 1.00 0.00 N ATOM 534 CA ARG A 35 -7.416 -9.305 -9.733 1.00 0.00 C ATOM 535 C ARG A 35 -8.830 -9.515 -10.289 1.00 0.00 C ATOM 536 O ARG A 35 -9.292 -10.652 -10.294 1.00 0.00 O ATOM 537 CB ARG A 35 -7.460 -9.141 -8.202 1.00 0.00 C ATOM 538 CG ARG A 35 -6.067 -9.277 -7.558 1.00 0.00 C ATOM 539 CD ARG A 35 -6.080 -8.895 -6.071 1.00 0.00 C ATOM 540 NE ARG A 35 -6.768 -9.906 -5.244 1.00 0.00 N ATOM 541 CZ ARG A 35 -6.346 -10.479 -4.121 1.00 0.00 C ATOM 542 NH1 ARG A 35 -5.178 -10.240 -3.567 1.00 0.00 N ATOM 543 NH2 ARG A 35 -7.123 -11.343 -3.512 1.00 0.00 N ATOM 0 H ARG A 35 -6.715 -7.333 -9.735 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.848 -10.197 -9.997 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -7.878 -8.165 -7.955 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -8.128 -9.890 -7.778 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -5.717 -10.304 -7.665 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -5.359 -8.641 -8.089 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -5.055 -8.776 -5.719 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -6.573 -7.931 -5.949 1.00 0.00 H new ATOM 0 HE ARG A 35 -7.685 -10.203 -5.577 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -4.533 -9.579 -4.001 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -4.917 -10.715 -2.703 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -8.039 -11.568 -3.901 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -6.811 -11.790 -2.650 1.00 0.00 H new ATOM 557 N GLN A 36 -9.523 -8.455 -10.733 1.00 0.00 N ATOM 558 CA GLN A 36 -10.919 -8.526 -11.192 1.00 0.00 C ATOM 559 C GLN A 36 -11.132 -8.438 -12.715 1.00 0.00 C ATOM 560 O GLN A 36 -12.229 -8.765 -13.166 1.00 0.00 O ATOM 561 CB GLN A 36 -11.769 -7.470 -10.467 1.00 0.00 C ATOM 562 CG GLN A 36 -11.862 -7.732 -8.956 1.00 0.00 C ATOM 563 CD GLN A 36 -12.930 -6.860 -8.299 1.00 0.00 C ATOM 564 OE1 GLN A 36 -12.909 -5.637 -8.371 1.00 0.00 O ATOM 565 NE2 GLN A 36 -13.903 -7.454 -7.635 1.00 0.00 N ATOM 0 H GLN A 36 -9.127 -7.516 -10.784 1.00 0.00 H new ATOM 0 HA GLN A 36 -11.246 -9.533 -10.931 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.339 -6.483 -10.636 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -12.772 -7.459 -10.894 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.092 -8.783 -8.782 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -10.895 -7.536 -8.492 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -13.929 -8.472 -7.570 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -14.630 -6.896 -7.187 1.00 0.00 H new ATOM 574 N GLY A 37 -10.142 -8.020 -13.516 1.00 0.00 N ATOM 575 CA GLY A 37 -10.315 -7.825 -14.959 1.00 0.00 C ATOM 576 C GLY A 37 -9.073 -8.123 -15.802 1.00 0.00 C ATOM 577 O GLY A 37 -7.962 -8.287 -15.295 1.00 0.00 O ATOM 0 H GLY A 37 -9.202 -7.809 -13.181 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -11.131 -8.462 -15.302 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.619 -6.794 -15.138 1.00 0.00 H new ATOM 581 N LYS A 38 -9.276 -8.182 -17.125 1.00 0.00 N ATOM 582 CA LYS A 38 -8.238 -8.462 -18.124 1.00 0.00 C ATOM 583 C LYS A 38 -7.336 -7.243 -18.325 1.00 0.00 C ATOM 584 O LYS A 38 -7.520 -6.470 -19.265 1.00 0.00 O ATOM 585 CB LYS A 38 -8.893 -8.968 -19.427 1.00 0.00 C ATOM 586 CG LYS A 38 -7.940 -9.710 -20.388 1.00 0.00 C ATOM 587 CD LYS A 38 -7.034 -8.878 -21.319 1.00 0.00 C ATOM 588 CE LYS A 38 -7.817 -8.059 -22.354 1.00 0.00 C ATOM 589 NZ LYS A 38 -8.014 -6.656 -21.933 1.00 0.00 N ATOM 0 H LYS A 38 -10.195 -8.032 -17.541 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.584 -9.258 -17.768 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -9.716 -9.635 -19.168 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.326 -8.117 -19.953 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -7.296 -10.351 -19.786 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -8.546 -10.365 -21.014 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.427 -8.203 -20.716 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -6.347 -9.546 -21.839 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -7.286 -8.078 -23.305 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -8.788 -8.525 -22.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -8.911 -6.300 -22.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -8.041 -6.606 -20.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -7.228 -6.074 -22.287 1.00 0.00 H new ATOM 603 N SER A 39 -6.339 -7.077 -17.456 1.00 0.00 N ATOM 604 CA SER A 39 -5.164 -6.266 -17.768 1.00 0.00 C ATOM 605 C SER A 39 -4.298 -6.929 -18.848 1.00 0.00 C ATOM 606 O SER A 39 -4.392 -8.134 -19.080 1.00 0.00 O ATOM 607 CB SER A 39 -4.354 -6.011 -16.500 1.00 0.00 C ATOM 608 OG SER A 39 -3.907 -7.220 -15.930 1.00 0.00 O ATOM 0 H SER A 39 -6.323 -7.496 -16.526 1.00 0.00 H new ATOM 0 HA SER A 39 -5.503 -5.310 -18.166 1.00 0.00 H new ATOM 0 HB2 SER A 39 -3.498 -5.377 -16.733 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.965 -5.469 -15.778 1.00 0.00 H new ATOM 0 HG SER A 39 -3.028 -7.450 -16.298 1.00 0.00 H new ATOM 614 N LYS A 40 -3.426 -6.137 -19.483 1.00 0.00 N ATOM 615 CA LYS A 40 -2.373 -6.623 -20.381 1.00 0.00 C ATOM 616 C LYS A 40 -1.015 -5.947 -20.164 1.00 0.00 C ATOM 617 O LYS A 40 0.014 -6.548 -20.479 1.00 0.00 O ATOM 618 CB LYS A 40 -2.908 -6.451 -21.803 1.00 0.00 C ATOM 619 CG LYS A 40 -1.935 -6.775 -22.947 1.00 0.00 C ATOM 620 CD LYS A 40 -1.281 -8.168 -22.980 1.00 0.00 C ATOM 621 CE LYS A 40 -0.459 -8.323 -24.275 1.00 0.00 C ATOM 622 NZ LYS A 40 0.603 -7.294 -24.406 1.00 0.00 N ATOM 0 H LYS A 40 -3.433 -5.122 -19.385 1.00 0.00 H new ATOM 0 HA LYS A 40 -2.158 -7.671 -20.172 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -3.788 -7.084 -21.915 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.240 -5.419 -21.920 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -2.470 -6.637 -23.887 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -1.136 -6.034 -22.923 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -0.637 -8.299 -22.111 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.047 -8.942 -22.929 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -0.004 -9.313 -24.295 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -1.127 -8.261 -25.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 0.363 -6.644 -25.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 0.680 -6.759 -23.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 1.511 -7.757 -24.611 1.00 0.00 H new ATOM 636 N LEU A 41 -0.980 -4.743 -19.580 1.00 0.00 N ATOM 637 CA LEU A 41 0.273 -4.031 -19.307 1.00 0.00 C ATOM 638 C LEU A 41 0.178 -3.273 -17.972 1.00 0.00 C ATOM 639 O LEU A 41 -0.747 -2.482 -17.802 1.00 0.00 O ATOM 640 CB LEU A 41 0.539 -3.160 -20.554 1.00 0.00 C ATOM 641 CG LEU A 41 1.688 -2.139 -20.525 1.00 0.00 C ATOM 642 CD1 LEU A 41 1.302 -0.878 -19.756 1.00 0.00 C ATOM 643 CD2 LEU A 41 3.013 -2.714 -20.016 1.00 0.00 C ATOM 0 H LEU A 41 -1.815 -4.238 -19.285 1.00 0.00 H new ATOM 0 HA LEU A 41 1.130 -4.689 -19.162 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.720 -3.833 -21.392 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.379 -2.615 -20.775 1.00 0.00 H new ATOM 0 HG LEU A 41 1.860 -1.867 -21.566 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.139 -0.180 -19.757 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.440 -0.411 -20.232 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.051 -1.141 -18.729 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.775 -1.935 -20.025 1.00 0.00 H new ATOM 0 HD22 LEU A 41 2.883 -3.083 -18.999 1.00 0.00 H new ATOM 0 HD23 LEU A 41 3.326 -3.534 -20.662 1.00 0.00 H new ATOM 655 N ILE A 42 1.117 -3.492 -17.035 1.00 0.00 N ATOM 656 CA ILE A 42 1.311 -2.640 -15.851 1.00 0.00 C ATOM 657 C ILE A 42 2.581 -1.793 -15.977 1.00 0.00 C ATOM 658 O ILE A 42 3.624 -2.279 -16.422 1.00 0.00 O ATOM 659 CB ILE A 42 1.270 -3.410 -14.506 1.00 0.00 C ATOM 660 CG1 ILE A 42 2.507 -4.264 -14.146 1.00 0.00 C ATOM 661 CG2 ILE A 42 0.022 -4.294 -14.390 1.00 0.00 C ATOM 662 CD1 ILE A 42 2.470 -4.714 -12.682 1.00 0.00 C ATOM 0 H ILE A 42 1.769 -4.275 -17.080 1.00 0.00 H new ATOM 0 HA ILE A 42 0.451 -1.970 -15.826 1.00 0.00 H new ATOM 0 HB ILE A 42 1.253 -2.594 -13.784 1.00 0.00 H new ATOM 0 HG12 ILE A 42 2.549 -5.138 -14.796 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.414 -3.688 -14.328 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.033 -4.815 -13.433 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -0.871 -3.673 -14.454 1.00 0.00 H new ATOM 0 HG23 ILE A 42 0.016 -5.023 -15.200 1.00 0.00 H new ATOM 0 HD11 ILE A 42 3.354 -5.312 -12.463 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.454 -3.839 -12.033 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.575 -5.312 -12.508 1.00 0.00 H new ATOM 674 N ILE A 43 2.502 -0.537 -15.525 1.00 0.00 N ATOM 675 CA ILE A 43 3.651 0.351 -15.350 1.00 0.00 C ATOM 676 C ILE A 43 3.878 0.558 -13.859 1.00 0.00 C ATOM 677 O ILE A 43 2.935 0.853 -13.122 1.00 0.00 O ATOM 678 CB ILE A 43 3.451 1.736 -16.002 1.00 0.00 C ATOM 679 CG1 ILE A 43 2.922 1.716 -17.449 1.00 0.00 C ATOM 680 CG2 ILE A 43 4.767 2.534 -15.936 1.00 0.00 C ATOM 681 CD1 ILE A 43 3.837 0.998 -18.446 1.00 0.00 C ATOM 0 H ILE A 43 1.617 -0.102 -15.266 1.00 0.00 H new ATOM 0 HA ILE A 43 4.503 -0.123 -15.837 1.00 0.00 H new ATOM 0 HB ILE A 43 2.665 2.217 -15.420 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.944 1.234 -17.459 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.775 2.743 -17.784 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.623 3.511 -16.397 1.00 0.00 H new ATOM 0 HG22 ILE A 43 5.062 2.664 -14.895 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.548 1.992 -16.470 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.389 1.031 -19.439 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.808 1.492 -18.469 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.965 -0.040 -18.140 1.00 0.00 H new ATOM 693 N ILE A 44 5.139 0.479 -13.433 1.00 0.00 N ATOM 694 CA ILE A 44 5.550 0.831 -12.076 1.00 0.00 C ATOM 695 C ILE A 44 6.570 1.977 -12.193 1.00 0.00 C ATOM 696 O ILE A 44 7.783 1.762 -12.200 1.00 0.00 O ATOM 697 CB ILE A 44 5.997 -0.429 -11.283 1.00 0.00 C ATOM 698 CG1 ILE A 44 4.904 -1.537 -11.243 1.00 0.00 C ATOM 699 CG2 ILE A 44 6.364 -0.038 -9.844 1.00 0.00 C ATOM 700 CD1 ILE A 44 5.460 -2.949 -11.045 1.00 0.00 C ATOM 0 H ILE A 44 5.908 0.167 -14.025 1.00 0.00 H new ATOM 0 HA ILE A 44 4.728 1.208 -11.468 1.00 0.00 H new ATOM 0 HB ILE A 44 6.863 -0.837 -11.805 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.205 -1.316 -10.436 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.336 -1.508 -12.173 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.676 -0.926 -9.294 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.180 0.685 -9.860 1.00 0.00 H new ATOM 0 HG23 ILE A 44 5.497 0.405 -9.355 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.638 -3.665 -11.028 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.136 -3.192 -11.865 1.00 0.00 H new ATOM 0 HD13 ILE A 44 6.003 -2.997 -10.101 1.00 0.00 H new ATOM 712 N ALA A 45 6.059 3.214 -12.316 1.00 0.00 N ATOM 713 CA ALA A 45 6.813 4.467 -12.206 1.00 0.00 C ATOM 714 C ALA A 45 6.684 5.048 -10.786 1.00 0.00 C ATOM 715 O ALA A 45 6.372 6.218 -10.570 1.00 0.00 O ATOM 716 CB ALA A 45 6.413 5.456 -13.312 1.00 0.00 C ATOM 0 H ALA A 45 5.068 3.371 -12.502 1.00 0.00 H new ATOM 0 HA ALA A 45 7.872 4.262 -12.363 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.989 6.375 -13.204 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.616 5.013 -14.287 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.350 5.682 -13.231 1.00 0.00 H new ATOM 722 N ALA A 46 6.936 4.193 -9.796 1.00 0.00 N ATOM 723 CA ALA A 46 7.027 4.527 -8.383 1.00 0.00 C ATOM 724 C ALA A 46 8.213 3.752 -7.804 1.00 0.00 C ATOM 725 O ALA A 46 8.460 2.619 -8.224 1.00 0.00 O ATOM 726 CB ALA A 46 5.705 4.152 -7.705 1.00 0.00 C ATOM 0 H ALA A 46 7.089 3.200 -9.971 1.00 0.00 H new ATOM 0 HA ALA A 46 7.190 5.592 -8.220 1.00 0.00 H new ATOM 0 HB1 ALA A 46 5.758 4.397 -6.644 1.00 0.00 H new ATOM 0 HB2 ALA A 46 4.889 4.709 -8.166 1.00 0.00 H new ATOM 0 HB3 ALA A 46 5.526 3.083 -7.822 1.00 0.00 H new ATOM 732 N ASN A 47 8.946 4.335 -6.853 1.00 0.00 N ATOM 733 CA ASN A 47 10.163 3.747 -6.295 1.00 0.00 C ATOM 734 C ASN A 47 9.799 2.630 -5.307 1.00 0.00 C ATOM 735 O ASN A 47 9.606 2.854 -4.113 1.00 0.00 O ATOM 736 CB ASN A 47 11.074 4.867 -5.771 1.00 0.00 C ATOM 737 CG ASN A 47 11.521 5.730 -6.946 1.00 0.00 C ATOM 738 OD1 ASN A 47 10.931 6.762 -7.248 1.00 0.00 O ATOM 739 ND2 ASN A 47 12.497 5.266 -7.702 1.00 0.00 N ATOM 0 H ASN A 47 8.707 5.239 -6.445 1.00 0.00 H new ATOM 0 HA ASN A 47 10.761 3.240 -7.052 1.00 0.00 H new ATOM 0 HB2 ASN A 47 10.542 5.474 -5.038 1.00 0.00 H new ATOM 0 HB3 ASN A 47 11.940 4.442 -5.264 1.00 0.00 H new ATOM 0 HD21 ASN A 47 12.769 5.767 -8.548 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.980 4.407 -7.440 1.00 0.00 H new ATOM 746 N THR A 48 9.595 1.440 -5.876 1.00 0.00 N ATOM 747 CA THR A 48 8.727 0.382 -5.346 1.00 0.00 C ATOM 748 C THR A 48 9.555 -0.766 -4.745 1.00 0.00 C ATOM 749 O THR A 48 10.253 -1.451 -5.495 1.00 0.00 O ATOM 750 CB THR A 48 7.796 -0.113 -6.466 1.00 0.00 C ATOM 751 OG1 THR A 48 7.028 0.958 -6.951 1.00 0.00 O ATOM 752 CG2 THR A 48 6.761 -1.134 -6.019 1.00 0.00 C ATOM 0 H THR A 48 10.046 1.175 -6.752 1.00 0.00 H new ATOM 0 HA THR A 48 8.119 0.785 -4.536 1.00 0.00 H new ATOM 0 HB THR A 48 8.469 -0.560 -7.198 1.00 0.00 H new ATOM 0 HG1 THR A 48 7.471 1.351 -7.732 1.00 0.00 H new ATOM 0 HG21 THR A 48 6.148 -1.428 -6.871 1.00 0.00 H new ATOM 0 HG22 THR A 48 7.266 -2.012 -5.616 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.126 -0.695 -5.249 1.00 0.00 H new ATOM 760 N PRO A 49 9.508 -1.007 -3.416 1.00 0.00 N ATOM 761 CA PRO A 49 10.325 -2.034 -2.767 1.00 0.00 C ATOM 762 C PRO A 49 9.879 -3.462 -3.123 1.00 0.00 C ATOM 763 O PRO A 49 8.746 -3.691 -3.552 1.00 0.00 O ATOM 764 CB PRO A 49 10.210 -1.748 -1.265 1.00 0.00 C ATOM 765 CG PRO A 49 8.835 -1.099 -1.133 1.00 0.00 C ATOM 766 CD PRO A 49 8.702 -0.302 -2.429 1.00 0.00 C ATOM 0 HA PRO A 49 11.359 -1.989 -3.108 1.00 0.00 H new ATOM 0 HB2 PRO A 49 10.281 -2.662 -0.675 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.003 -1.084 -0.921 1.00 0.00 H new ATOM 0 HG2 PRO A 49 8.045 -1.844 -1.035 1.00 0.00 H new ATOM 0 HG3 PRO A 49 8.776 -0.455 -0.256 1.00 0.00 H new ATOM 0 HD2 PRO A 49 7.661 -0.242 -2.746 1.00 0.00 H new ATOM 0 HD3 PRO A 49 9.054 0.721 -2.296 1.00 0.00 H new ATOM 774 N VAL A 50 10.778 -4.431 -2.901 1.00 0.00 N ATOM 775 CA VAL A 50 10.727 -5.808 -3.427 1.00 0.00 C ATOM 776 C VAL A 50 9.365 -6.484 -3.238 1.00 0.00 C ATOM 777 O VAL A 50 8.740 -6.876 -4.218 1.00 0.00 O ATOM 778 CB VAL A 50 11.867 -6.676 -2.850 1.00 0.00 C ATOM 779 CG1 VAL A 50 11.862 -8.088 -3.457 1.00 0.00 C ATOM 780 CG2 VAL A 50 13.245 -6.054 -3.127 1.00 0.00 C ATOM 0 H VAL A 50 11.602 -4.271 -2.322 1.00 0.00 H new ATOM 0 HA VAL A 50 10.874 -5.720 -4.504 1.00 0.00 H new ATOM 0 HB VAL A 50 11.691 -6.730 -1.776 1.00 0.00 H new ATOM 0 HG11 VAL A 50 12.677 -8.671 -3.028 1.00 0.00 H new ATOM 0 HG12 VAL A 50 10.912 -8.575 -3.237 1.00 0.00 H new ATOM 0 HG13 VAL A 50 11.993 -8.020 -4.537 1.00 0.00 H new ATOM 0 HG21 VAL A 50 14.023 -6.691 -2.707 1.00 0.00 H new ATOM 0 HG22 VAL A 50 13.393 -5.962 -4.203 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.298 -5.067 -2.668 1.00 0.00 H new ATOM 790 N LEU A 51 8.881 -6.615 -1.997 1.00 0.00 N ATOM 791 CA LEU A 51 7.608 -7.291 -1.716 1.00 0.00 C ATOM 792 C LEU A 51 6.414 -6.601 -2.398 1.00 0.00 C ATOM 793 O LEU A 51 5.496 -7.272 -2.862 1.00 0.00 O ATOM 794 CB LEU A 51 7.383 -7.378 -0.196 1.00 0.00 C ATOM 795 CG LEU A 51 8.467 -8.150 0.584 1.00 0.00 C ATOM 796 CD1 LEU A 51 8.151 -8.100 2.082 1.00 0.00 C ATOM 797 CD2 LEU A 51 8.568 -9.618 0.154 1.00 0.00 C ATOM 0 H LEU A 51 9.355 -6.259 -1.167 1.00 0.00 H new ATOM 0 HA LEU A 51 7.673 -8.296 -2.132 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.321 -6.366 0.205 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.419 -7.853 -0.014 1.00 0.00 H new ATOM 0 HG LEU A 51 9.421 -7.670 0.367 1.00 0.00 H new ATOM 0 HD11 LEU A 51 8.917 -8.645 2.634 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.133 -7.062 2.416 1.00 0.00 H new ATOM 0 HD13 LEU A 51 7.178 -8.557 2.264 1.00 0.00 H new ATOM 0 HD21 LEU A 51 9.346 -10.114 0.734 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.613 -10.114 0.327 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.817 -9.670 -0.906 1.00 0.00 H new ATOM 809 N ARG A 52 6.441 -5.265 -2.487 1.00 0.00 N ATOM 810 CA ARG A 52 5.391 -4.440 -3.093 1.00 0.00 C ATOM 811 C ARG A 52 5.407 -4.588 -4.620 1.00 0.00 C ATOM 812 O ARG A 52 4.379 -4.909 -5.227 1.00 0.00 O ATOM 813 CB ARG A 52 5.592 -2.987 -2.607 1.00 0.00 C ATOM 814 CG ARG A 52 4.327 -2.122 -2.589 1.00 0.00 C ATOM 815 CD ARG A 52 3.435 -2.320 -1.350 1.00 0.00 C ATOM 816 NE ARG A 52 2.776 -3.640 -1.309 1.00 0.00 N ATOM 817 CZ ARG A 52 2.666 -4.497 -0.300 1.00 0.00 C ATOM 818 NH1 ARG A 52 3.220 -4.270 0.868 1.00 0.00 N ATOM 819 NH2 ARG A 52 1.987 -5.611 -0.437 1.00 0.00 N ATOM 0 H ARG A 52 7.219 -4.712 -2.128 1.00 0.00 H new ATOM 0 HA ARG A 52 4.398 -4.766 -2.783 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.009 -3.012 -1.600 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.332 -2.506 -3.247 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.619 -1.073 -2.647 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.741 -2.340 -3.482 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.040 -2.196 -0.452 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.673 -1.541 -1.331 1.00 0.00 H new ATOM 0 HE ARG A 52 2.342 -3.938 -2.183 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.754 -3.415 1.022 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.116 -4.949 1.622 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.536 -5.827 -1.326 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.910 -6.261 0.345 1.00 0.00 H new ATOM 833 N LYS A 53 6.595 -4.429 -5.233 1.00 0.00 N ATOM 834 CA LYS A 53 6.762 -4.611 -6.679 1.00 0.00 C ATOM 835 C LYS A 53 6.331 -6.025 -7.048 1.00 0.00 C ATOM 836 O LYS A 53 5.524 -6.193 -7.958 1.00 0.00 O ATOM 837 CB LYS A 53 8.179 -4.260 -7.201 1.00 0.00 C ATOM 838 CG LYS A 53 9.238 -5.376 -7.164 1.00 0.00 C ATOM 839 CD LYS A 53 10.522 -5.069 -7.947 1.00 0.00 C ATOM 840 CE LYS A 53 11.455 -6.292 -8.054 1.00 0.00 C ATOM 841 NZ LYS A 53 10.780 -7.527 -8.541 1.00 0.00 N ATOM 0 H LYS A 53 7.453 -4.174 -4.744 1.00 0.00 H new ATOM 0 HA LYS A 53 6.118 -3.892 -7.185 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.084 -3.918 -8.232 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.555 -3.418 -6.619 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.501 -5.574 -6.125 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.797 -6.290 -7.561 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.260 -4.727 -8.948 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.054 -4.252 -7.460 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.278 -6.051 -8.727 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.891 -6.490 -7.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.495 -8.204 -8.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.235 -7.954 -7.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 10.138 -7.286 -9.323 1.00 0.00 H new ATOM 855 N SER A 54 6.828 -7.026 -6.309 1.00 0.00 N ATOM 856 CA SER A 54 6.633 -8.419 -6.673 1.00 0.00 C ATOM 857 C SER A 54 5.228 -8.933 -6.362 1.00 0.00 C ATOM 858 O SER A 54 4.813 -9.896 -6.992 1.00 0.00 O ATOM 859 CB SER A 54 7.760 -9.321 -6.165 1.00 0.00 C ATOM 860 OG SER A 54 8.942 -9.036 -6.907 1.00 0.00 O ATOM 0 H SER A 54 7.368 -6.887 -5.455 1.00 0.00 H new ATOM 0 HA SER A 54 6.700 -8.465 -7.760 1.00 0.00 H new ATOM 0 HB2 SER A 54 7.931 -9.150 -5.102 1.00 0.00 H new ATOM 0 HB3 SER A 54 7.486 -10.370 -6.279 1.00 0.00 H new ATOM 0 HG SER A 54 8.978 -9.612 -7.699 1.00 0.00 H new ATOM 866 N GLU A 55 4.438 -8.256 -5.515 1.00 0.00 N ATOM 867 CA GLU A 55 2.985 -8.456 -5.481 1.00 0.00 C ATOM 868 C GLU A 55 2.324 -7.972 -6.790 1.00 0.00 C ATOM 869 O GLU A 55 1.537 -8.714 -7.378 1.00 0.00 O ATOM 870 CB GLU A 55 2.377 -7.732 -4.266 1.00 0.00 C ATOM 871 CG GLU A 55 0.991 -8.289 -3.894 1.00 0.00 C ATOM 872 CD GLU A 55 0.090 -7.322 -3.101 1.00 0.00 C ATOM 873 OE1 GLU A 55 0.578 -6.268 -2.617 1.00 0.00 O ATOM 874 OE2 GLU A 55 -1.123 -7.628 -3.013 1.00 0.00 O ATOM 0 H GLU A 55 4.782 -7.567 -4.846 1.00 0.00 H new ATOM 0 HA GLU A 55 2.791 -9.524 -5.386 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.048 -7.831 -3.413 1.00 0.00 H new ATOM 0 HB3 GLU A 55 2.293 -6.667 -4.484 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.474 -8.575 -4.810 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.127 -9.198 -3.308 1.00 0.00 H new ATOM 881 N LEU A 56 2.656 -6.764 -7.290 1.00 0.00 N ATOM 882 CA LEU A 56 2.126 -6.309 -8.599 1.00 0.00 C ATOM 883 C LEU A 56 2.539 -7.227 -9.751 1.00 0.00 C ATOM 884 O LEU A 56 1.734 -7.585 -10.605 1.00 0.00 O ATOM 885 CB LEU A 56 2.521 -4.858 -8.911 1.00 0.00 C ATOM 886 CG LEU A 56 1.922 -3.807 -7.964 1.00 0.00 C ATOM 887 CD1 LEU A 56 1.594 -2.556 -8.768 1.00 0.00 C ATOM 888 CD2 LEU A 56 0.617 -4.224 -7.290 1.00 0.00 C ATOM 0 H LEU A 56 3.272 -6.098 -6.824 1.00 0.00 H new ATOM 0 HA LEU A 56 1.041 -6.356 -8.508 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.608 -4.778 -8.879 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.214 -4.624 -9.930 1.00 0.00 H new ATOM 0 HG LEU A 56 2.673 -3.657 -7.188 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.168 -1.801 -8.108 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.505 -2.167 -9.224 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.875 -2.803 -9.549 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.270 -3.420 -6.641 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.137 -4.427 -8.051 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.785 -5.123 -6.696 1.00 0.00 H new ATOM 900 N GLU A 57 3.804 -7.626 -9.717 1.00 0.00 N ATOM 901 CA GLU A 57 4.458 -8.597 -10.602 1.00 0.00 C ATOM 902 C GLU A 57 3.731 -9.957 -10.556 1.00 0.00 C ATOM 903 O GLU A 57 3.493 -10.559 -11.601 1.00 0.00 O ATOM 904 CB GLU A 57 5.912 -8.698 -10.118 1.00 0.00 C ATOM 905 CG GLU A 57 7.067 -9.099 -11.034 1.00 0.00 C ATOM 906 CD GLU A 57 8.367 -8.745 -10.281 1.00 0.00 C ATOM 907 OE1 GLU A 57 8.657 -9.376 -9.235 1.00 0.00 O ATOM 908 OE2 GLU A 57 9.025 -7.729 -10.625 1.00 0.00 O ATOM 0 H GLU A 57 4.452 -7.256 -9.021 1.00 0.00 H new ATOM 0 HA GLU A 57 4.425 -8.283 -11.645 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.169 -7.723 -9.705 1.00 0.00 H new ATOM 0 HB3 GLU A 57 5.914 -9.406 -9.289 1.00 0.00 H new ATOM 0 HG2 GLU A 57 7.029 -10.164 -11.263 1.00 0.00 H new ATOM 0 HG3 GLU A 57 7.012 -8.567 -11.984 1.00 0.00 H new ATOM 915 N TYR A 58 3.316 -10.415 -9.364 1.00 0.00 N ATOM 916 CA TYR A 58 2.487 -11.607 -9.164 1.00 0.00 C ATOM 917 C TYR A 58 1.110 -11.466 -9.822 1.00 0.00 C ATOM 918 O TYR A 58 0.696 -12.362 -10.556 1.00 0.00 O ATOM 919 CB TYR A 58 2.343 -11.917 -7.666 1.00 0.00 C ATOM 920 CG TYR A 58 1.910 -13.333 -7.363 1.00 0.00 C ATOM 921 CD1 TYR A 58 2.895 -14.328 -7.224 1.00 0.00 C ATOM 922 CD2 TYR A 58 0.551 -13.654 -7.180 1.00 0.00 C ATOM 923 CE1 TYR A 58 2.525 -15.653 -6.930 1.00 0.00 C ATOM 924 CE2 TYR A 58 0.177 -14.974 -6.861 1.00 0.00 C ATOM 925 CZ TYR A 58 1.164 -15.977 -6.748 1.00 0.00 C ATOM 926 OH TYR A 58 0.812 -17.259 -6.456 1.00 0.00 O ATOM 0 H TYR A 58 3.557 -9.950 -8.489 1.00 0.00 H new ATOM 0 HA TYR A 58 2.993 -12.442 -9.649 1.00 0.00 H new ATOM 0 HB2 TYR A 58 3.297 -11.728 -7.174 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.619 -11.227 -7.232 1.00 0.00 H new ATOM 0 HD1 TYR A 58 3.938 -14.074 -7.343 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -0.204 -12.889 -7.284 1.00 0.00 H new ATOM 0 HE1 TYR A 58 3.281 -16.420 -6.844 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -0.863 -15.218 -6.703 1.00 0.00 H new ATOM 0 HH TYR A 58 -0.162 -17.317 -6.360 1.00 0.00 H new ATOM 936 N TYR A 59 0.394 -10.354 -9.603 1.00 0.00 N ATOM 937 CA TYR A 59 -0.886 -10.140 -10.291 1.00 0.00 C ATOM 938 C TYR A 59 -0.713 -10.050 -11.812 1.00 0.00 C ATOM 939 O TYR A 59 -1.480 -10.679 -12.536 1.00 0.00 O ATOM 940 CB TYR A 59 -1.633 -8.921 -9.746 1.00 0.00 C ATOM 941 CG TYR A 59 -1.913 -8.958 -8.260 1.00 0.00 C ATOM 942 CD1 TYR A 59 -2.585 -10.057 -7.688 1.00 0.00 C ATOM 943 CD2 TYR A 59 -1.506 -7.882 -7.452 1.00 0.00 C ATOM 944 CE1 TYR A 59 -2.829 -10.089 -6.303 1.00 0.00 C ATOM 945 CE2 TYR A 59 -1.756 -7.908 -6.073 1.00 0.00 C ATOM 946 CZ TYR A 59 -2.417 -9.010 -5.492 1.00 0.00 C ATOM 947 OH TYR A 59 -2.710 -9.007 -4.162 1.00 0.00 O ATOM 0 H TYR A 59 0.671 -9.604 -8.969 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.499 -11.017 -10.084 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -1.051 -8.027 -9.969 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -2.580 -8.826 -10.277 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -2.913 -10.875 -8.313 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -1.001 -7.036 -7.894 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -3.331 -10.937 -5.861 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -1.441 -7.081 -5.453 1.00 0.00 H new ATOM 0 HH TYR A 59 -1.890 -8.855 -3.647 1.00 0.00 H new ATOM 957 N ALA A 60 0.323 -9.350 -12.293 1.00 0.00 N ATOM 958 CA ALA A 60 0.694 -9.327 -13.705 1.00 0.00 C ATOM 959 C ALA A 60 0.948 -10.743 -14.269 1.00 0.00 C ATOM 960 O ALA A 60 0.460 -11.086 -15.347 1.00 0.00 O ATOM 961 CB ALA A 60 1.908 -8.416 -13.890 1.00 0.00 C ATOM 0 H ALA A 60 0.930 -8.780 -11.703 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.143 -8.927 -14.277 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.190 -8.395 -14.943 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.659 -7.407 -13.560 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.741 -8.796 -13.299 1.00 0.00 H new ATOM 967 N MET A 61 1.683 -11.584 -13.523 1.00 0.00 N ATOM 968 CA MET A 61 1.893 -13.002 -13.823 1.00 0.00 C ATOM 969 C MET A 61 0.576 -13.795 -13.863 1.00 0.00 C ATOM 970 O MET A 61 0.413 -14.619 -14.763 1.00 0.00 O ATOM 971 CB MET A 61 2.915 -13.579 -12.823 1.00 0.00 C ATOM 972 CG MET A 61 3.174 -15.090 -12.935 1.00 0.00 C ATOM 973 SD MET A 61 1.912 -16.213 -12.248 1.00 0.00 S ATOM 974 CE MET A 61 1.968 -15.786 -10.484 1.00 0.00 C ATOM 0 H MET A 61 2.159 -11.284 -12.672 1.00 0.00 H new ATOM 0 HA MET A 61 2.303 -13.097 -14.829 1.00 0.00 H new ATOM 0 HB2 MET A 61 3.862 -13.055 -12.956 1.00 0.00 H new ATOM 0 HB3 MET A 61 2.570 -13.362 -11.812 1.00 0.00 H new ATOM 0 HG2 MET A 61 3.301 -15.332 -13.990 1.00 0.00 H new ATOM 0 HG3 MET A 61 4.121 -15.306 -12.442 1.00 0.00 H new ATOM 0 HE1 MET A 61 1.443 -16.548 -9.908 1.00 0.00 H new ATOM 0 HE2 MET A 61 3.006 -15.733 -10.155 1.00 0.00 H new ATOM 0 HE3 MET A 61 1.489 -14.820 -10.328 1.00 0.00 H new ATOM 984 N LEU A 62 -0.363 -13.561 -12.936 1.00 0.00 N ATOM 985 CA LEU A 62 -1.685 -14.198 -12.919 1.00 0.00 C ATOM 986 C LEU A 62 -2.533 -13.801 -14.142 1.00 0.00 C ATOM 987 O LEU A 62 -2.712 -14.617 -15.055 1.00 0.00 O ATOM 988 CB LEU A 62 -2.430 -13.882 -11.605 1.00 0.00 C ATOM 989 CG LEU A 62 -1.887 -14.571 -10.340 1.00 0.00 C ATOM 990 CD1 LEU A 62 -2.635 -14.005 -9.130 1.00 0.00 C ATOM 991 CD2 LEU A 62 -2.094 -16.086 -10.360 1.00 0.00 C ATOM 0 H LEU A 62 -0.221 -12.911 -12.163 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.526 -15.275 -12.974 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -2.405 -12.804 -11.447 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.476 -14.162 -11.727 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.815 -14.381 -10.291 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.267 -14.479 -8.220 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.470 -12.929 -9.071 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.702 -14.203 -9.236 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.693 -16.520 -9.444 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.159 -16.307 -10.430 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -1.578 -16.512 -11.220 1.00 0.00 H new ATOM 1003 N SER A 63 -3.072 -12.578 -14.165 1.00 0.00 N ATOM 1004 CA SER A 63 -3.896 -12.045 -15.254 1.00 0.00 C ATOM 1005 C SER A 63 -2.992 -11.571 -16.395 1.00 0.00 C ATOM 1006 O SER A 63 -2.715 -10.385 -16.546 1.00 0.00 O ATOM 1007 CB SER A 63 -4.863 -10.968 -14.725 1.00 0.00 C ATOM 1008 OG SER A 63 -4.277 -10.130 -13.751 1.00 0.00 O ATOM 0 H SER A 63 -2.943 -11.912 -13.403 1.00 0.00 H new ATOM 0 HA SER A 63 -4.533 -12.827 -15.667 1.00 0.00 H new ATOM 0 HB2 SER A 63 -5.210 -10.358 -15.559 1.00 0.00 H new ATOM 0 HB3 SER A 63 -5.740 -11.454 -14.298 1.00 0.00 H new ATOM 0 HG SER A 63 -4.881 -10.048 -12.984 1.00 0.00 H new ATOM 1014 N LYS A 64 -2.532 -12.539 -17.202 1.00 0.00 N ATOM 1015 CA LYS A 64 -1.321 -12.539 -18.044 1.00 0.00 C ATOM 1016 C LYS A 64 -1.001 -11.180 -18.692 1.00 0.00 C ATOM 1017 O LYS A 64 -1.522 -10.822 -19.747 1.00 0.00 O ATOM 1018 CB LYS A 64 -1.447 -13.648 -19.112 1.00 0.00 C ATOM 1019 CG LYS A 64 -1.599 -15.072 -18.544 1.00 0.00 C ATOM 1020 CD LYS A 64 -0.283 -15.643 -17.994 1.00 0.00 C ATOM 1021 CE LYS A 64 -0.528 -16.927 -17.194 1.00 0.00 C ATOM 1022 NZ LYS A 64 -1.019 -16.631 -15.829 1.00 0.00 N ATOM 0 H LYS A 64 -3.040 -13.419 -17.292 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.476 -12.740 -17.385 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -2.308 -13.429 -19.744 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -0.566 -13.619 -19.753 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -2.345 -15.062 -17.749 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.976 -15.731 -19.326 1.00 0.00 H new ATOM 0 HD2 LYS A 64 0.400 -15.850 -18.818 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.201 -14.902 -17.358 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -1.255 -17.549 -17.716 1.00 0.00 H new ATOM 0 HE3 LYS A 64 0.397 -17.501 -17.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.318 -17.514 -15.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -0.257 -16.192 -15.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -1.827 -15.978 -15.885 1.00 0.00 H new ATOM 1036 N THR A 65 -0.121 -10.433 -18.022 1.00 0.00 N ATOM 1037 CA THR A 65 0.171 -9.013 -18.237 1.00 0.00 C ATOM 1038 C THR A 65 1.683 -8.766 -18.209 1.00 0.00 C ATOM 1039 O THR A 65 2.395 -9.360 -17.398 1.00 0.00 O ATOM 1040 CB THR A 65 -0.523 -8.227 -17.111 1.00 0.00 C ATOM 1041 OG1 THR A 65 -1.909 -8.174 -17.325 1.00 0.00 O ATOM 1042 CG2 THR A 65 -0.045 -6.800 -16.901 1.00 0.00 C ATOM 0 H THR A 65 0.442 -10.827 -17.268 1.00 0.00 H new ATOM 0 HA THR A 65 -0.195 -8.690 -19.212 1.00 0.00 H new ATOM 0 HB THR A 65 -0.256 -8.787 -16.215 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.256 -9.082 -17.449 1.00 0.00 H new ATOM 0 HG21 THR A 65 -0.604 -6.346 -16.083 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.017 -6.804 -16.656 1.00 0.00 H new ATOM 0 HG23 THR A 65 -0.204 -6.225 -17.813 1.00 0.00 H new ATOM 1050 N LYS A 66 2.182 -7.856 -19.057 1.00 0.00 N ATOM 1051 CA LYS A 66 3.582 -7.406 -19.011 1.00 0.00 C ATOM 1052 C LYS A 66 3.785 -6.362 -17.904 1.00 0.00 C ATOM 1053 O LYS A 66 2.933 -5.505 -17.683 1.00 0.00 O ATOM 1054 CB LYS A 66 3.982 -6.860 -20.393 1.00 0.00 C ATOM 1055 CG LYS A 66 5.441 -6.368 -20.510 1.00 0.00 C ATOM 1056 CD LYS A 66 6.527 -7.406 -20.160 1.00 0.00 C ATOM 1057 CE LYS A 66 6.422 -8.735 -20.923 1.00 0.00 C ATOM 1058 NZ LYS A 66 6.771 -8.589 -22.352 1.00 0.00 N ATOM 0 H LYS A 66 1.630 -7.412 -19.791 1.00 0.00 H new ATOM 0 HA LYS A 66 4.229 -8.249 -18.770 1.00 0.00 H new ATOM 0 HB2 LYS A 66 3.819 -7.641 -21.135 1.00 0.00 H new ATOM 0 HB3 LYS A 66 3.316 -6.035 -20.646 1.00 0.00 H new ATOM 0 HG2 LYS A 66 5.608 -6.024 -21.531 1.00 0.00 H new ATOM 0 HG3 LYS A 66 5.567 -5.504 -19.858 1.00 0.00 H new ATOM 0 HD2 LYS A 66 7.505 -6.967 -20.357 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.480 -7.613 -19.091 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.083 -9.469 -20.463 1.00 0.00 H new ATOM 0 HE3 LYS A 66 5.407 -9.122 -20.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.686 -9.511 -22.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 6.124 -7.908 -22.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.749 -8.245 -22.437 1.00 0.00 H new ATOM 1072 N VAL A 67 4.946 -6.414 -17.246 1.00 0.00 N ATOM 1073 CA VAL A 67 5.417 -5.438 -16.257 1.00 0.00 C ATOM 1074 C VAL A 67 6.457 -4.519 -16.900 1.00 0.00 C ATOM 1075 O VAL A 67 7.399 -5.005 -17.526 1.00 0.00 O ATOM 1076 CB VAL A 67 6.048 -6.157 -15.044 1.00 0.00 C ATOM 1077 CG1 VAL A 67 6.418 -5.161 -13.938 1.00 0.00 C ATOM 1078 CG2 VAL A 67 5.105 -7.201 -14.435 1.00 0.00 C ATOM 0 H VAL A 67 5.614 -7.171 -17.394 1.00 0.00 H new ATOM 0 HA VAL A 67 4.566 -4.850 -15.914 1.00 0.00 H new ATOM 0 HB VAL A 67 6.941 -6.652 -15.424 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.860 -5.697 -13.098 1.00 0.00 H new ATOM 0 HG12 VAL A 67 7.136 -4.438 -14.325 1.00 0.00 H new ATOM 0 HG13 VAL A 67 5.522 -4.639 -13.604 1.00 0.00 H new ATOM 0 HG21 VAL A 67 5.592 -7.680 -13.586 1.00 0.00 H new ATOM 0 HG22 VAL A 67 4.189 -6.713 -14.100 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.862 -7.953 -15.185 1.00 0.00 H new ATOM 1088 N TYR A 68 6.314 -3.204 -16.706 1.00 0.00 N ATOM 1089 CA TYR A 68 7.281 -2.198 -17.144 1.00 0.00 C ATOM 1090 C TYR A 68 7.698 -1.271 -15.987 1.00 0.00 C ATOM 1091 O TYR A 68 6.928 -0.424 -15.525 1.00 0.00 O ATOM 1092 CB TYR A 68 6.715 -1.437 -18.346 1.00 0.00 C ATOM 1093 CG TYR A 68 7.730 -0.527 -19.008 1.00 0.00 C ATOM 1094 CD1 TYR A 68 8.622 -1.044 -19.967 1.00 0.00 C ATOM 1095 CD2 TYR A 68 7.811 0.826 -18.633 1.00 0.00 C ATOM 1096 CE1 TYR A 68 9.605 -0.213 -20.538 1.00 0.00 C ATOM 1097 CE2 TYR A 68 8.792 1.660 -19.199 1.00 0.00 C ATOM 1098 CZ TYR A 68 9.704 1.140 -20.141 1.00 0.00 C ATOM 1099 OH TYR A 68 10.673 1.951 -20.646 1.00 0.00 O ATOM 0 H TYR A 68 5.506 -2.803 -16.230 1.00 0.00 H new ATOM 0 HA TYR A 68 8.197 -2.694 -17.464 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.345 -2.153 -19.080 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.861 -0.843 -18.022 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.552 -2.080 -20.265 1.00 0.00 H new ATOM 0 HD2 TYR A 68 7.118 1.226 -17.908 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.283 -0.609 -21.279 1.00 0.00 H new ATOM 0 HE2 TYR A 68 8.847 2.700 -18.912 1.00 0.00 H new ATOM 0 HH TYR A 68 10.584 2.847 -20.259 1.00 0.00 H new ATOM 1109 N TYR A 69 8.929 -1.454 -15.504 1.00 0.00 N ATOM 1110 CA TYR A 69 9.545 -0.642 -14.453 1.00 0.00 C ATOM 1111 C TYR A 69 10.078 0.681 -15.015 1.00 0.00 C ATOM 1112 O TYR A 69 10.950 0.694 -15.881 1.00 0.00 O ATOM 1113 CB TYR A 69 10.657 -1.450 -13.772 1.00 0.00 C ATOM 1114 CG TYR A 69 10.098 -2.546 -12.888 1.00 0.00 C ATOM 1115 CD1 TYR A 69 9.440 -2.177 -11.702 1.00 0.00 C ATOM 1116 CD2 TYR A 69 10.168 -3.906 -13.262 1.00 0.00 C ATOM 1117 CE1 TYR A 69 8.821 -3.155 -10.910 1.00 0.00 C ATOM 1118 CE2 TYR A 69 9.563 -4.893 -12.457 1.00 0.00 C ATOM 1119 CZ TYR A 69 8.869 -4.515 -11.286 1.00 0.00 C ATOM 1120 OH TYR A 69 8.246 -5.441 -10.510 1.00 0.00 O ATOM 0 H TYR A 69 9.543 -2.194 -15.844 1.00 0.00 H new ATOM 0 HA TYR A 69 8.789 -0.389 -13.710 1.00 0.00 H new ATOM 0 HB2 TYR A 69 11.303 -1.890 -14.531 1.00 0.00 H new ATOM 0 HB3 TYR A 69 11.277 -0.782 -13.174 1.00 0.00 H new ATOM 0 HD1 TYR A 69 9.411 -1.140 -11.401 1.00 0.00 H new ATOM 0 HD2 TYR A 69 10.686 -4.191 -14.166 1.00 0.00 H new ATOM 0 HE1 TYR A 69 8.304 -2.866 -10.007 1.00 0.00 H new ATOM 0 HE2 TYR A 69 9.630 -5.935 -12.735 1.00 0.00 H new ATOM 0 HH TYR A 69 8.868 -6.171 -10.308 1.00 0.00 H new ATOM 1130 N PHE A 70 9.548 1.800 -14.506 1.00 0.00 N ATOM 1131 CA PHE A 70 9.793 3.156 -15.008 1.00 0.00 C ATOM 1132 C PHE A 70 9.990 4.147 -13.842 1.00 0.00 C ATOM 1133 O PHE A 70 9.612 5.312 -13.917 1.00 0.00 O ATOM 1134 CB PHE A 70 8.611 3.494 -15.932 1.00 0.00 C ATOM 1135 CG PHE A 70 8.652 4.754 -16.790 1.00 0.00 C ATOM 1136 CD1 PHE A 70 9.758 5.630 -16.830 1.00 0.00 C ATOM 1137 CD2 PHE A 70 7.525 5.039 -17.579 1.00 0.00 C ATOM 1138 CE1 PHE A 70 9.711 6.793 -17.619 1.00 0.00 C ATOM 1139 CE2 PHE A 70 7.484 6.192 -18.385 1.00 0.00 C ATOM 1140 CZ PHE A 70 8.574 7.075 -18.395 1.00 0.00 C ATOM 0 H PHE A 70 8.915 1.785 -13.706 1.00 0.00 H new ATOM 0 HA PHE A 70 10.719 3.228 -15.578 1.00 0.00 H new ATOM 0 HB2 PHE A 70 8.473 2.648 -16.605 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.719 3.555 -15.309 1.00 0.00 H new ATOM 0 HD1 PHE A 70 10.643 5.406 -16.253 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.681 4.366 -17.567 1.00 0.00 H new ATOM 0 HE1 PHE A 70 10.551 7.471 -17.629 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.616 6.396 -18.994 1.00 0.00 H new ATOM 0 HZ PHE A 70 8.539 7.970 -18.998 1.00 0.00 H new ATOM 1224 N LEU A 77 6.313 9.515 -16.325 1.00 0.00 N ATOM 1225 CA LEU A 77 4.970 9.049 -16.680 1.00 0.00 C ATOM 1226 C LEU A 77 3.846 10.019 -16.263 1.00 0.00 C ATOM 1227 O LEU A 77 2.758 9.986 -16.839 1.00 0.00 O ATOM 1228 CB LEU A 77 4.778 7.673 -16.024 1.00 0.00 C ATOM 1229 CG LEU A 77 3.538 6.890 -16.498 1.00 0.00 C ATOM 1230 CD1 LEU A 77 3.675 6.385 -17.938 1.00 0.00 C ATOM 1231 CD2 LEU A 77 3.361 5.701 -15.564 1.00 0.00 C ATOM 0 HA LEU A 77 4.897 8.990 -17.766 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.665 7.069 -16.216 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.712 7.808 -14.944 1.00 0.00 H new ATOM 0 HG LEU A 77 2.677 7.558 -16.477 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.774 5.841 -18.220 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.812 7.233 -18.609 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.537 5.722 -18.011 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.489 5.123 -15.872 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.248 5.070 -15.607 1.00 0.00 H new ATOM 0 HD23 LEU A 77 3.218 6.058 -14.544 1.00 0.00 H new ATOM 1243 N GLY A 78 4.102 10.940 -15.324 1.00 0.00 N ATOM 1244 CA GLY A 78 3.199 12.055 -15.030 1.00 0.00 C ATOM 1245 C GLY A 78 2.856 12.883 -16.276 1.00 0.00 C ATOM 1246 O GLY A 78 1.723 13.368 -16.395 1.00 0.00 O ATOM 0 H GLY A 78 4.943 10.931 -14.747 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.279 11.667 -14.592 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.659 12.703 -14.284 1.00 0.00 H new ATOM 1250 N THR A 79 3.790 12.959 -17.234 1.00 0.00 N ATOM 1251 CA THR A 79 3.603 13.551 -18.567 1.00 0.00 C ATOM 1252 C THR A 79 2.364 12.980 -19.252 1.00 0.00 C ATOM 1253 O THR A 79 1.572 13.752 -19.794 1.00 0.00 O ATOM 1254 CB THR A 79 4.837 13.338 -19.463 1.00 0.00 C ATOM 1255 OG1 THR A 79 6.020 13.646 -18.764 1.00 0.00 O ATOM 1256 CG2 THR A 79 4.806 14.220 -20.712 1.00 0.00 C ATOM 0 H THR A 79 4.733 12.596 -17.097 1.00 0.00 H new ATOM 0 HA THR A 79 3.466 14.623 -18.422 1.00 0.00 H new ATOM 0 HB THR A 79 4.816 12.289 -19.757 1.00 0.00 H new ATOM 0 HG1 THR A 79 6.793 13.503 -19.350 1.00 0.00 H new ATOM 0 HG21 THR A 79 5.697 14.033 -21.311 1.00 0.00 H new ATOM 0 HG22 THR A 79 3.918 13.987 -21.300 1.00 0.00 H new ATOM 0 HG23 THR A 79 4.781 15.269 -20.416 1.00 0.00 H new ATOM 1264 N ALA A 80 2.127 11.667 -19.134 1.00 0.00 N ATOM 1265 CA ALA A 80 0.870 11.027 -19.486 1.00 0.00 C ATOM 1266 C ALA A 80 -0.220 11.297 -18.433 1.00 0.00 C ATOM 1267 O ALA A 80 -1.171 12.028 -18.717 1.00 0.00 O ATOM 1268 CB ALA A 80 1.117 9.526 -19.708 1.00 0.00 C ATOM 0 H ALA A 80 2.826 11.012 -18.782 1.00 0.00 H new ATOM 0 HA ALA A 80 0.493 11.456 -20.415 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.179 9.038 -19.973 1.00 0.00 H new ATOM 0 HB2 ALA A 80 1.836 9.391 -20.516 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.511 9.083 -18.793 1.00 0.00 H new ATOM 1274 N VAL A 81 -0.097 10.740 -17.220 1.00 0.00 N ATOM 1275 CA VAL A 81 -1.278 10.439 -16.383 1.00 0.00 C ATOM 1276 C VAL A 81 -1.470 11.289 -15.121 1.00 0.00 C ATOM 1277 O VAL A 81 -2.574 11.294 -14.586 1.00 0.00 O ATOM 1278 CB VAL A 81 -1.300 8.948 -15.989 1.00 0.00 C ATOM 1279 CG1 VAL A 81 -1.221 8.027 -17.209 1.00 0.00 C ATOM 1280 CG2 VAL A 81 -0.168 8.585 -15.023 1.00 0.00 C ATOM 0 H VAL A 81 0.796 10.489 -16.796 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.113 10.704 -17.032 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.256 8.796 -15.488 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.240 6.987 -16.882 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.072 8.217 -17.864 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -0.295 8.220 -17.751 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.227 7.525 -14.776 1.00 0.00 H new ATOM 0 HG22 VAL A 81 0.793 8.795 -15.493 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -0.264 9.176 -14.112 1.00 0.00 H new ATOM 1405 N VAL A 89 2.166 4.387 -10.552 1.00 0.00 N ATOM 1406 CA VAL A 89 1.767 2.991 -10.723 1.00 0.00 C ATOM 1407 C VAL A 89 0.437 2.928 -11.483 1.00 0.00 C ATOM 1408 O VAL A 89 -0.580 3.475 -11.049 1.00 0.00 O ATOM 1409 CB VAL A 89 1.810 2.240 -9.381 1.00 0.00 C ATOM 1410 CG1 VAL A 89 0.633 2.512 -8.440 1.00 0.00 C ATOM 1411 CG2 VAL A 89 1.917 0.738 -9.627 1.00 0.00 C ATOM 0 HA VAL A 89 2.482 2.454 -11.346 1.00 0.00 H new ATOM 0 HB VAL A 89 2.693 2.627 -8.872 1.00 0.00 H new ATOM 0 HG11 VAL A 89 0.759 1.935 -7.524 1.00 0.00 H new ATOM 0 HG12 VAL A 89 0.598 3.574 -8.198 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.297 2.220 -8.927 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.947 0.214 -8.672 1.00 0.00 H new ATOM 0 HG22 VAL A 89 1.053 0.401 -10.199 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.828 0.525 -10.186 1.00 0.00 H new ATOM 1421 N VAL A 90 0.487 2.330 -12.676 1.00 0.00 N ATOM 1422 CA VAL A 90 -0.559 2.393 -13.707 1.00 0.00 C ATOM 1423 C VAL A 90 -0.796 0.992 -14.255 1.00 0.00 C ATOM 1424 O VAL A 90 0.082 0.124 -14.200 1.00 0.00 O ATOM 1425 CB VAL A 90 -0.142 3.342 -14.861 1.00 0.00 C ATOM 1426 CG1 VAL A 90 -1.241 3.584 -15.912 1.00 0.00 C ATOM 1427 CG2 VAL A 90 0.358 4.690 -14.331 1.00 0.00 C ATOM 0 H VAL A 90 1.287 1.766 -12.964 1.00 0.00 H new ATOM 0 HA VAL A 90 -1.474 2.782 -13.261 1.00 0.00 H new ATOM 0 HB VAL A 90 0.669 2.816 -15.365 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.866 4.258 -16.682 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -1.524 2.635 -16.367 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.112 4.030 -15.432 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.641 5.328 -15.168 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.434 5.173 -13.759 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.224 4.530 -13.688 1.00 0.00 H new ATOM 1437 N SER A 91 -1.966 0.728 -14.830 1.00 0.00 N ATOM 1438 CA SER A 91 -2.130 -0.438 -15.695 1.00 0.00 C ATOM 1439 C SER A 91 -3.137 -0.168 -16.808 1.00 0.00 C ATOM 1440 O SER A 91 -4.014 0.682 -16.661 1.00 0.00 O ATOM 1441 CB SER A 91 -2.516 -1.657 -14.855 1.00 0.00 C ATOM 1442 OG SER A 91 -1.692 -1.760 -13.704 1.00 0.00 O ATOM 0 H SER A 91 -2.805 1.297 -14.716 1.00 0.00 H new ATOM 0 HA SER A 91 -1.179 -0.650 -16.184 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.561 -1.580 -14.554 1.00 0.00 H new ATOM 0 HB3 SER A 91 -2.423 -2.562 -15.456 1.00 0.00 H new ATOM 0 HG SER A 91 -0.826 -1.338 -13.883 1.00 0.00 H new ATOM 1448 N ILE A 92 -3.001 -0.905 -17.913 1.00 0.00 N ATOM 1449 CA ILE A 92 -3.816 -0.821 -19.122 1.00 0.00 C ATOM 1450 C ILE A 92 -4.477 -2.180 -19.368 1.00 0.00 C ATOM 1451 O ILE A 92 -3.824 -3.238 -19.371 1.00 0.00 O ATOM 1452 CB ILE A 92 -2.990 -0.363 -20.347 1.00 0.00 C ATOM 1453 CG1 ILE A 92 -2.116 0.888 -20.096 1.00 0.00 C ATOM 1454 CG2 ILE A 92 -3.923 -0.116 -21.549 1.00 0.00 C ATOM 1455 CD1 ILE A 92 -2.891 2.170 -19.776 1.00 0.00 C ATOM 0 H ILE A 92 -2.275 -1.618 -17.990 1.00 0.00 H new ATOM 0 HA ILE A 92 -4.586 -0.064 -18.976 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.296 -1.177 -20.558 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.436 0.677 -19.270 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.501 1.065 -20.978 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.333 0.206 -22.407 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.450 -1.038 -21.796 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -4.647 0.658 -21.295 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.190 2.989 -19.617 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -3.550 2.414 -20.609 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -3.485 2.021 -18.875 1.00 0.00 H new ATOM 1467 N LEU A 93 -5.796 -2.110 -19.566 1.00 0.00 N ATOM 1468 CA LEU A 93 -6.696 -3.228 -19.794 1.00 0.00 C ATOM 1469 C LEU A 93 -7.024 -3.324 -21.282 1.00 0.00 C ATOM 1470 O LEU A 93 -6.632 -4.294 -21.935 1.00 0.00 O ATOM 1471 CB LEU A 93 -7.961 -3.081 -18.919 1.00 0.00 C ATOM 1472 CG LEU A 93 -7.708 -3.065 -17.394 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -7.424 -1.663 -16.831 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -8.943 -3.604 -16.668 1.00 0.00 C ATOM 0 H LEU A 93 -6.286 -1.216 -19.570 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.214 -4.161 -19.501 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.470 -2.158 -19.196 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.640 -3.901 -19.150 1.00 0.00 H new ATOM 0 HG LEU A 93 -6.825 -3.683 -17.230 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.256 -1.730 -15.756 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.537 -1.251 -17.312 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -8.277 -1.013 -17.025 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -8.766 -3.593 -15.592 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.804 -2.977 -16.900 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.139 -4.626 -16.993 1.00 0.00 H new ATOM 1486 N GLU A 94 -7.689 -2.296 -21.817 1.00 0.00 N ATOM 1487 CA GLU A 94 -8.135 -2.235 -23.208 1.00 0.00 C ATOM 1488 C GLU A 94 -7.441 -1.068 -23.918 1.00 0.00 C ATOM 1489 O GLU A 94 -7.828 0.093 -23.742 1.00 0.00 O ATOM 1490 CB GLU A 94 -9.674 -2.132 -23.328 1.00 0.00 C ATOM 1491 CG GLU A 94 -10.507 -2.989 -22.359 1.00 0.00 C ATOM 1492 CD GLU A 94 -10.064 -4.451 -22.286 1.00 0.00 C ATOM 1493 OE1 GLU A 94 -9.646 -5.026 -23.317 1.00 0.00 O ATOM 1494 OE2 GLU A 94 -10.047 -5.013 -21.170 1.00 0.00 O ATOM 0 H GLU A 94 -7.937 -1.465 -21.281 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.854 -3.169 -23.695 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.956 -1.089 -23.186 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.954 -2.402 -24.346 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.450 -2.552 -21.362 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.553 -2.951 -22.664 1.00 0.00 H new ATOM 1501 N ALA A 95 -6.428 -1.352 -24.745 1.00 0.00 N ATOM 1502 CA ALA A 95 -5.885 -0.375 -25.693 1.00 0.00 C ATOM 1503 C ALA A 95 -6.851 -0.147 -26.875 1.00 0.00 C ATOM 1504 O ALA A 95 -6.483 -0.296 -28.038 1.00 0.00 O ATOM 1505 CB ALA A 95 -4.478 -0.777 -26.145 1.00 0.00 C ATOM 0 H ALA A 95 -5.965 -2.260 -24.775 1.00 0.00 H new ATOM 0 HA ALA A 95 -5.790 0.584 -25.185 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.096 -0.037 -26.848 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.818 -0.829 -25.279 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.517 -1.752 -26.630 1.00 0.00 H new ATOM 1511 N GLY A 96 -8.098 0.236 -26.575 1.00 0.00 N ATOM 1512 CA GLY A 96 -9.170 0.504 -27.541 1.00 0.00 C ATOM 1513 C GLY A 96 -8.985 1.812 -28.317 1.00 0.00 C ATOM 1514 O GLY A 96 -9.957 2.525 -28.538 1.00 0.00 O ATOM 0 H GLY A 96 -8.400 0.373 -25.611 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -9.225 -0.323 -28.248 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -10.123 0.536 -27.013 1.00 0.00 H new ATOM 1518 N ASP A 97 -7.741 2.136 -28.679 1.00 0.00 N ATOM 1519 CA ASP A 97 -7.325 3.387 -29.305 1.00 0.00 C ATOM 1520 C ASP A 97 -6.169 3.105 -30.287 1.00 0.00 C ATOM 1521 O ASP A 97 -6.432 2.737 -31.430 1.00 0.00 O ATOM 1522 CB ASP A 97 -6.985 4.391 -28.188 1.00 0.00 C ATOM 1523 CG ASP A 97 -6.904 5.833 -28.686 1.00 0.00 C ATOM 1524 OD1 ASP A 97 -6.064 6.131 -29.565 1.00 0.00 O ATOM 1525 OD2 ASP A 97 -7.721 6.669 -28.217 1.00 0.00 O ATOM 0 H ASP A 97 -6.959 1.498 -28.534 1.00 0.00 H new ATOM 0 HA ASP A 97 -8.117 3.836 -29.904 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -7.741 4.325 -27.405 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -6.032 4.114 -27.736 1.00 0.00 H new ATOM 1530 N SER A 98 -4.905 3.234 -29.851 1.00 0.00 N ATOM 1531 CA SER A 98 -3.713 2.822 -30.601 1.00 0.00 C ATOM 1532 C SER A 98 -3.009 1.594 -29.991 1.00 0.00 C ATOM 1533 O SER A 98 -3.336 1.095 -28.920 1.00 0.00 O ATOM 1534 CB SER A 98 -2.780 4.028 -30.792 1.00 0.00 C ATOM 1535 OG SER A 98 -1.962 3.926 -31.953 1.00 0.00 O ATOM 0 H SER A 98 -4.681 3.639 -28.942 1.00 0.00 H new ATOM 0 HA SER A 98 -4.030 2.483 -31.587 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.379 4.936 -30.856 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.142 4.128 -29.914 1.00 0.00 H new ATOM 0 HG SER A 98 -1.042 3.716 -31.688 1.00 0.00 H new ATOM 1541 N ASP A 99 -1.966 1.168 -30.685 1.00 0.00 N ATOM 1542 CA ASP A 99 -1.136 -0.034 -30.636 1.00 0.00 C ATOM 1543 C ASP A 99 -0.452 -0.485 -29.328 1.00 0.00 C ATOM 1544 O ASP A 99 0.149 -1.559 -29.388 1.00 0.00 O ATOM 1545 CB ASP A 99 -0.035 0.218 -31.690 1.00 0.00 C ATOM 1546 CG ASP A 99 0.663 1.573 -31.482 1.00 0.00 C ATOM 1547 OD1 ASP A 99 0.062 2.615 -31.859 1.00 0.00 O ATOM 1548 OD2 ASP A 99 1.771 1.628 -30.903 1.00 0.00 O ATOM 0 H ASP A 99 -1.620 1.769 -31.433 1.00 0.00 H new ATOM 0 HA ASP A 99 -1.834 -0.857 -30.792 1.00 0.00 H new ATOM 0 HB2 ASP A 99 0.704 -0.582 -31.641 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -0.474 0.186 -32.687 1.00 0.00 H new ATOM 1553 N ILE A 100 -0.470 0.241 -28.193 1.00 0.00 N ATOM 1554 CA ILE A 100 0.603 0.098 -27.174 1.00 0.00 C ATOM 1555 C ILE A 100 0.944 -1.353 -26.788 1.00 0.00 C ATOM 1556 O ILE A 100 2.070 -1.788 -27.018 1.00 0.00 O ATOM 1557 CB ILE A 100 0.430 1.006 -25.929 1.00 0.00 C ATOM 1558 CG1 ILE A 100 1.815 1.161 -25.260 1.00 0.00 C ATOM 1559 CG2 ILE A 100 -0.574 0.497 -24.877 1.00 0.00 C ATOM 1560 CD1 ILE A 100 1.883 2.246 -24.189 1.00 0.00 C ATOM 0 H ILE A 100 -1.195 0.919 -27.956 1.00 0.00 H new ATOM 0 HA ILE A 100 1.480 0.472 -27.702 1.00 0.00 H new ATOM 0 HB ILE A 100 0.019 1.949 -26.290 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.097 0.208 -24.812 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.554 1.382 -26.030 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -0.621 1.203 -24.048 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -1.561 0.404 -25.331 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -0.251 -0.476 -24.507 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.890 2.285 -23.774 1.00 0.00 H new ATOM 0 HD12 ILE A 100 1.636 3.211 -24.632 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.172 2.019 -23.395 1.00 0.00 H new ATOM 1572 N LEU A 101 -0.023 -2.120 -26.274 1.00 0.00 N ATOM 1573 CA LEU A 101 0.109 -3.528 -25.878 1.00 0.00 C ATOM 1574 C LEU A 101 0.418 -4.541 -27.003 1.00 0.00 C ATOM 1575 O LEU A 101 0.620 -5.722 -26.705 1.00 0.00 O ATOM 1576 CB LEU A 101 -1.012 -3.978 -24.915 1.00 0.00 C ATOM 1577 CG LEU A 101 -2.400 -3.312 -25.008 1.00 0.00 C ATOM 1578 CD1 LEU A 101 -3.583 -4.255 -25.228 1.00 0.00 C ATOM 1579 CD2 LEU A 101 -2.606 -2.588 -23.675 1.00 0.00 C ATOM 0 H LEU A 101 -0.964 -1.760 -26.115 1.00 0.00 H new ATOM 0 HA LEU A 101 1.040 -3.546 -25.312 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.153 -5.050 -25.055 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.647 -3.834 -23.898 1.00 0.00 H new ATOM 0 HG LEU A 101 -2.391 -2.669 -25.888 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.505 -3.676 -25.277 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -3.446 -4.799 -26.163 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.643 -4.963 -24.401 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.577 -2.093 -23.676 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -2.568 -3.310 -22.859 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.820 -1.845 -23.539 1.00 0.00 H new