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 133:sc= 1.16 USER MOD Set 1.2: A 91 SER OG : rot -25:sc= 0.96 USER MOD Set 2.1: A 53 LYS NZ :NH3+ 140:sc= 1.6 (180deg=0.375) USER MOD Set 2.2: A 69 TYR OH : rot 167:sc= 1.45 USER MOD Set 3.1: A 39 SER OG : rot 61:sc= 1.08 USER MOD Set 3.2: A 63 SER OG : rot -51:sc= 2.19 USER MOD Set 3.3: A 65 THR OG1 : rot 138:sc= 2.1 USER MOD Set 4.1: A 24 THR OG1 : rot 150:sc= 0.00559 USER MOD Set 4.2: A 32 LYS NZ :NH3+ 128:sc= 2.48 (180deg=0) USER MOD Set 4.3: A 33 SER OG : rot 100:sc= 2.11 USER MOD Set 4.4: A 36 GLN : amide:sc= 1.09 K(o=5.7,f=-6!) USER MOD Set 5.1: A 19 LYS NZ :NH3+ 154:sc= 3 (180deg=0.351!) USER MOD Set 5.2: A 20 SER OG : rot 119:sc= 2.1 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.242 X(o=-0.24,f=-0.37) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 1.28 (180deg=1.28) USER MOD Single : A 22 LYS NZ :NH3+ -146:sc= 2.33 (180deg=0.848) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 28:sc= 1.06 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 164:sc= 1.34 USER MOD Single : A 38 LYS NZ :NH3+ 166:sc= 2.08 (180deg=1.52) USER MOD Single : A 40 LYS NZ :NH3+ -143:sc= 2.08 (180deg=-1.06!) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 THR OG1 : rot 89:sc= 1.25 USER MOD Single : A 54 SER OG : rot -38:sc= 1.17 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 178:sc= 2.14 USER MOD Single : A 61 MET CE :methyl 167:sc= 0 (180deg=-0.163) USER MOD Single : A 64 LYS NZ :NH3+ 168:sc= 1.65 (180deg=1.01) USER MOD Single : A 66 LYS NZ :NH3+ 174:sc= 1.35 (180deg=0.919!) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 170:sc= -0.804 USER MOD ----------------------------------------------------------------- ATOM 108 N SER A 9 8.555 7.406 -25.668 1.00 0.00 N ATOM 109 CA SER A 9 7.635 6.715 -26.562 1.00 0.00 C ATOM 110 C SER A 9 6.561 5.975 -25.787 1.00 0.00 C ATOM 111 O SER A 9 5.387 6.149 -26.102 1.00 0.00 O ATOM 112 CB SER A 9 8.392 5.738 -27.452 1.00 0.00 C ATOM 113 OG SER A 9 9.094 6.464 -28.441 1.00 0.00 O ATOM 0 HA SER A 9 7.151 7.469 -27.183 1.00 0.00 H new ATOM 0 HB2 SER A 9 9.086 5.146 -26.856 1.00 0.00 H new ATOM 0 HB3 SER A 9 7.698 5.040 -27.920 1.00 0.00 H new ATOM 0 HG SER A 9 9.585 5.841 -29.017 1.00 0.00 H new ATOM 119 N ILE A 10 6.937 5.200 -24.761 1.00 0.00 N ATOM 120 CA ILE A 10 5.965 4.614 -23.829 1.00 0.00 C ATOM 121 C ILE A 10 5.106 5.722 -23.202 1.00 0.00 C ATOM 122 O ILE A 10 3.885 5.606 -23.241 1.00 0.00 O ATOM 123 CB ILE A 10 6.638 3.646 -22.826 1.00 0.00 C ATOM 124 CG1 ILE A 10 5.665 2.942 -21.850 1.00 0.00 C ATOM 125 CG2 ILE A 10 7.828 4.260 -22.078 1.00 0.00 C ATOM 126 CD1 ILE A 10 5.168 3.747 -20.641 1.00 0.00 C ATOM 0 H ILE A 10 7.908 4.964 -24.555 1.00 0.00 H new ATOM 0 HA ILE A 10 5.271 3.974 -24.374 1.00 0.00 H new ATOM 0 HB ILE A 10 7.033 2.862 -23.472 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.794 2.618 -22.419 1.00 0.00 H new ATOM 0 HG13 ILE A 10 6.155 2.043 -21.477 1.00 0.00 H new ATOM 0 HG21 ILE A 10 8.247 3.522 -21.394 1.00 0.00 H new ATOM 0 HG22 ILE A 10 8.590 4.565 -22.795 1.00 0.00 H new ATOM 0 HG23 ILE A 10 7.493 5.130 -21.513 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.495 3.130 -20.045 1.00 0.00 H new ATOM 0 HD12 ILE A 10 6.019 4.050 -20.031 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.637 4.633 -20.988 1.00 0.00 H new ATOM 138 N ASN A 11 5.705 6.814 -22.703 1.00 0.00 N ATOM 139 CA ASN A 11 4.982 7.964 -22.148 1.00 0.00 C ATOM 140 C ASN A 11 3.941 8.533 -23.139 1.00 0.00 C ATOM 141 O ASN A 11 2.744 8.546 -22.840 1.00 0.00 O ATOM 142 CB ASN A 11 6.024 9.003 -21.699 1.00 0.00 C ATOM 143 CG ASN A 11 5.414 10.167 -20.941 1.00 0.00 C ATOM 144 OD1 ASN A 11 4.826 11.068 -21.514 1.00 0.00 O ATOM 145 ND2 ASN A 11 5.540 10.170 -19.630 1.00 0.00 N ATOM 0 H ASN A 11 6.719 6.923 -22.674 1.00 0.00 H new ATOM 0 HA ASN A 11 4.393 7.656 -21.285 1.00 0.00 H new ATOM 0 HB2 ASN A 11 6.766 8.515 -21.068 1.00 0.00 H new ATOM 0 HB3 ASN A 11 6.550 9.383 -22.575 1.00 0.00 H new ATOM 0 HD21 ASN A 11 5.143 10.933 -19.081 1.00 0.00 H new ATOM 0 HD22 ASN A 11 6.035 9.410 -19.163 1.00 0.00 H new ATOM 152 N GLN A 12 4.393 8.937 -24.333 1.00 0.00 N ATOM 153 CA GLN A 12 3.570 9.432 -25.437 1.00 0.00 C ATOM 154 C GLN A 12 2.450 8.447 -25.801 1.00 0.00 C ATOM 155 O GLN A 12 1.271 8.805 -25.763 1.00 0.00 O ATOM 156 CB GLN A 12 4.501 9.704 -26.635 1.00 0.00 C ATOM 157 CG GLN A 12 3.787 10.176 -27.909 1.00 0.00 C ATOM 158 CD GLN A 12 4.773 10.282 -29.068 1.00 0.00 C ATOM 159 OE1 GLN A 12 5.106 9.303 -29.720 1.00 0.00 O ATOM 160 NE2 GLN A 12 5.283 11.462 -29.361 1.00 0.00 N ATOM 0 H GLN A 12 5.387 8.926 -24.563 1.00 0.00 H new ATOM 0 HA GLN A 12 3.069 10.353 -25.139 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.233 10.458 -26.345 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.054 8.793 -26.862 1.00 0.00 H new ATOM 0 HG2 GLN A 12 2.990 9.478 -28.165 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.319 11.144 -27.733 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.010 12.284 -28.822 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.950 11.553 -30.127 1.00 0.00 H new ATOM 169 N LYS A 13 2.820 7.210 -26.165 1.00 0.00 N ATOM 170 CA LYS A 13 1.904 6.166 -26.626 1.00 0.00 C ATOM 171 C LYS A 13 0.873 5.810 -25.554 1.00 0.00 C ATOM 172 O LYS A 13 -0.290 5.603 -25.892 1.00 0.00 O ATOM 173 CB LYS A 13 2.721 4.950 -27.097 1.00 0.00 C ATOM 174 CG LYS A 13 1.893 3.955 -27.924 1.00 0.00 C ATOM 175 CD LYS A 13 2.782 2.818 -28.449 1.00 0.00 C ATOM 176 CE LYS A 13 2.012 1.971 -29.464 1.00 0.00 C ATOM 177 NZ LYS A 13 2.828 0.849 -29.966 1.00 0.00 N ATOM 0 H LYS A 13 3.793 6.904 -26.145 1.00 0.00 H new ATOM 0 HA LYS A 13 1.327 6.536 -27.474 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.565 5.295 -27.693 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.133 4.437 -26.228 1.00 0.00 H new ATOM 0 HG2 LYS A 13 1.091 3.544 -27.311 1.00 0.00 H new ATOM 0 HG3 LYS A 13 1.422 4.472 -28.760 1.00 0.00 H new ATOM 0 HD2 LYS A 13 3.677 3.231 -28.914 1.00 0.00 H new ATOM 0 HD3 LYS A 13 3.113 2.193 -27.620 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.105 1.583 -29.001 1.00 0.00 H new ATOM 0 HE3 LYS A 13 1.701 2.598 -30.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 2.274 0.297 -30.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 3.682 1.221 -30.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 3.104 0.238 -29.171 1.00 0.00 H new ATOM 191 N LEU A 14 1.262 5.790 -24.272 1.00 0.00 N ATOM 192 CA LEU A 14 0.348 5.517 -23.168 1.00 0.00 C ATOM 193 C LEU A 14 -0.679 6.640 -22.976 1.00 0.00 C ATOM 194 O LEU A 14 -1.850 6.327 -22.788 1.00 0.00 O ATOM 195 CB LEU A 14 1.139 5.218 -21.887 1.00 0.00 C ATOM 196 CG LEU A 14 0.250 4.582 -20.800 1.00 0.00 C ATOM 197 CD1 LEU A 14 1.040 3.519 -20.043 1.00 0.00 C ATOM 198 CD2 LEU A 14 -0.259 5.615 -19.796 1.00 0.00 C ATOM 0 H LEU A 14 2.223 5.964 -23.977 1.00 0.00 H new ATOM 0 HA LEU A 14 -0.231 4.628 -23.417 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.966 4.547 -22.119 1.00 0.00 H new ATOM 0 HB3 LEU A 14 1.575 6.141 -21.505 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.609 4.140 -21.306 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.407 3.073 -19.276 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.368 2.746 -20.738 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.910 3.978 -19.574 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.881 5.121 -19.049 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.588 6.093 -19.304 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -0.848 6.369 -20.317 1.00 0.00 H new ATOM 210 N ALA A 15 -0.290 7.920 -23.061 1.00 0.00 N ATOM 211 CA ALA A 15 -1.263 9.019 -23.033 1.00 0.00 C ATOM 212 C ALA A 15 -2.205 8.984 -24.249 1.00 0.00 C ATOM 213 O ALA A 15 -3.425 9.093 -24.103 1.00 0.00 O ATOM 214 CB ALA A 15 -0.538 10.359 -22.949 1.00 0.00 C ATOM 0 H ALA A 15 0.682 8.217 -23.149 1.00 0.00 H new ATOM 0 HA ALA A 15 -1.882 8.893 -22.145 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.269 11.167 -22.929 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.064 10.391 -22.041 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.110 10.477 -23.818 1.00 0.00 H new ATOM 220 N LEU A 16 -1.637 8.778 -25.446 1.00 0.00 N ATOM 221 CA LEU A 16 -2.360 8.568 -26.703 1.00 0.00 C ATOM 222 C LEU A 16 -3.380 7.419 -26.595 1.00 0.00 C ATOM 223 O LEU A 16 -4.520 7.583 -27.033 1.00 0.00 O ATOM 224 CB LEU A 16 -1.303 8.404 -27.813 1.00 0.00 C ATOM 225 CG LEU A 16 -1.794 7.849 -29.164 1.00 0.00 C ATOM 226 CD1 LEU A 16 -1.013 8.484 -30.317 1.00 0.00 C ATOM 227 CD2 LEU A 16 -1.565 6.336 -29.236 1.00 0.00 C ATOM 0 H LEU A 16 -0.624 8.753 -25.567 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.985 9.425 -26.954 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.845 9.377 -27.992 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.518 7.746 -27.440 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.856 8.080 -29.247 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.372 8.082 -31.264 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -1.158 9.564 -30.303 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.048 8.259 -30.205 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.917 5.960 -30.197 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.501 6.124 -29.131 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -2.114 5.846 -28.431 1.00 0.00 H new ATOM 239 N VAL A 17 -3.012 6.304 -25.950 1.00 0.00 N ATOM 240 CA VAL A 17 -3.929 5.247 -25.505 1.00 0.00 C ATOM 241 C VAL A 17 -4.968 5.790 -24.523 1.00 0.00 C ATOM 242 O VAL A 17 -6.151 5.754 -24.846 1.00 0.00 O ATOM 243 CB VAL A 17 -3.135 4.040 -24.958 1.00 0.00 C ATOM 244 CG1 VAL A 17 -3.937 3.126 -24.023 1.00 0.00 C ATOM 245 CG2 VAL A 17 -2.632 3.215 -26.146 1.00 0.00 C ATOM 0 H VAL A 17 -2.039 6.107 -25.717 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.497 4.884 -26.362 1.00 0.00 H new ATOM 0 HB VAL A 17 -2.320 4.447 -24.359 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.304 2.305 -23.686 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.280 3.698 -23.161 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.798 2.724 -24.557 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.068 2.357 -25.780 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.482 2.867 -26.733 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.988 3.833 -26.771 1.00 0.00 H new ATOM 255 N ILE A 18 -4.567 6.294 -23.350 1.00 0.00 N ATOM 256 CA ILE A 18 -5.450 6.778 -22.273 1.00 0.00 C ATOM 257 C ILE A 18 -6.530 7.760 -22.754 1.00 0.00 C ATOM 258 O ILE A 18 -7.651 7.707 -22.247 1.00 0.00 O ATOM 259 CB ILE A 18 -4.591 7.289 -21.090 1.00 0.00 C ATOM 260 CG1 ILE A 18 -4.131 6.056 -20.270 1.00 0.00 C ATOM 261 CG2 ILE A 18 -5.377 8.280 -20.227 1.00 0.00 C ATOM 262 CD1 ILE A 18 -3.520 6.370 -18.904 1.00 0.00 C ATOM 0 H ILE A 18 -3.579 6.381 -23.112 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.041 5.938 -21.907 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.720 7.829 -21.461 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -4.987 5.398 -20.124 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.399 5.502 -20.858 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.750 8.623 -19.404 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.677 9.134 -20.835 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -6.265 7.790 -19.827 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -3.232 5.441 -18.412 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -2.640 6.999 -19.035 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.252 6.894 -18.290 1.00 0.00 H new ATOM 274 N LYS A 19 -6.245 8.580 -23.775 1.00 0.00 N ATOM 275 CA LYS A 19 -7.217 9.442 -24.463 1.00 0.00 C ATOM 276 C LYS A 19 -8.502 8.718 -24.919 1.00 0.00 C ATOM 277 O LYS A 19 -9.547 9.359 -24.982 1.00 0.00 O ATOM 278 CB LYS A 19 -6.460 10.162 -25.597 1.00 0.00 C ATOM 279 CG LYS A 19 -7.281 11.084 -26.516 1.00 0.00 C ATOM 280 CD LYS A 19 -8.000 10.425 -27.711 1.00 0.00 C ATOM 281 CE LYS A 19 -7.074 9.822 -28.780 1.00 0.00 C ATOM 282 NZ LYS A 19 -6.683 8.423 -28.499 1.00 0.00 N ATOM 0 H LYS A 19 -5.303 8.665 -24.157 1.00 0.00 H new ATOM 0 HA LYS A 19 -7.615 10.175 -23.762 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.663 10.755 -25.148 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -5.982 9.405 -26.218 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.031 11.589 -25.907 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -6.615 11.854 -26.905 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -8.653 9.638 -27.333 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -8.640 11.169 -28.185 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -7.573 9.864 -29.748 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -6.175 10.434 -28.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -6.457 7.940 -29.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -5.848 8.414 -27.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -7.469 7.931 -28.029 1.00 0.00 H new ATOM 296 N SER A 20 -8.455 7.410 -25.219 1.00 0.00 N ATOM 297 CA SER A 20 -9.634 6.615 -25.631 1.00 0.00 C ATOM 298 C SER A 20 -9.666 5.148 -25.151 1.00 0.00 C ATOM 299 O SER A 20 -10.691 4.476 -25.296 1.00 0.00 O ATOM 300 CB SER A 20 -9.823 6.713 -27.154 1.00 0.00 C ATOM 301 OG SER A 20 -8.612 6.521 -27.862 1.00 0.00 O ATOM 0 H SER A 20 -7.593 6.866 -25.184 1.00 0.00 H new ATOM 0 HA SER A 20 -10.479 7.067 -25.112 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.551 5.968 -27.476 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.236 7.690 -27.404 1.00 0.00 H new ATOM 0 HG SER A 20 -8.697 5.742 -28.450 1.00 0.00 H new ATOM 307 N GLY A 21 -8.596 4.649 -24.526 1.00 0.00 N ATOM 308 CA GLY A 21 -8.465 3.321 -23.926 1.00 0.00 C ATOM 309 C GLY A 21 -9.093 3.202 -22.537 1.00 0.00 C ATOM 310 O GLY A 21 -9.940 4.007 -22.143 1.00 0.00 O ATOM 0 H GLY A 21 -7.743 5.199 -24.419 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -8.927 2.588 -24.587 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -7.407 3.067 -23.858 1.00 0.00 H new ATOM 314 N LYS A 22 -8.746 2.121 -21.828 1.00 0.00 N ATOM 315 CA LYS A 22 -9.290 1.786 -20.506 1.00 0.00 C ATOM 316 C LYS A 22 -8.155 1.433 -19.546 1.00 0.00 C ATOM 317 O LYS A 22 -7.455 0.441 -19.759 1.00 0.00 O ATOM 318 CB LYS A 22 -10.341 0.663 -20.620 1.00 0.00 C ATOM 319 CG LYS A 22 -11.665 1.152 -21.245 1.00 0.00 C ATOM 320 CD LYS A 22 -11.749 1.041 -22.780 1.00 0.00 C ATOM 321 CE LYS A 22 -12.807 2.005 -23.340 1.00 0.00 C ATOM 322 NZ LYS A 22 -12.325 3.411 -23.387 1.00 0.00 N ATOM 0 H LYS A 22 -8.065 1.440 -22.164 1.00 0.00 H new ATOM 0 HA LYS A 22 -9.803 2.655 -20.095 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -9.936 -0.149 -21.224 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -10.540 0.254 -19.629 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -12.486 0.581 -20.810 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -11.818 2.194 -20.964 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.777 1.266 -23.219 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -11.997 0.018 -23.062 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -13.089 1.687 -24.344 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -13.705 1.952 -22.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -13.119 4.057 -23.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.589 3.550 -22.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.929 3.611 -24.328 1.00 0.00 H new ATOM 336 N TYR A 23 -7.955 2.276 -18.527 1.00 0.00 N ATOM 337 CA TYR A 23 -6.815 2.248 -17.608 1.00 0.00 C ATOM 338 C TYR A 23 -7.217 2.321 -16.121 1.00 0.00 C ATOM 339 O TYR A 23 -8.383 2.522 -15.784 1.00 0.00 O ATOM 340 CB TYR A 23 -5.895 3.420 -17.981 1.00 0.00 C ATOM 341 CG TYR A 23 -6.497 4.783 -17.694 1.00 0.00 C ATOM 342 CD1 TYR A 23 -7.368 5.390 -18.620 1.00 0.00 C ATOM 343 CD2 TYR A 23 -6.209 5.426 -16.475 1.00 0.00 C ATOM 344 CE1 TYR A 23 -7.964 6.628 -18.324 1.00 0.00 C ATOM 345 CE2 TYR A 23 -6.810 6.661 -16.173 1.00 0.00 C ATOM 346 CZ TYR A 23 -7.685 7.269 -17.095 1.00 0.00 C ATOM 347 OH TYR A 23 -8.244 8.473 -16.801 1.00 0.00 O ATOM 0 H TYR A 23 -8.611 3.027 -18.312 1.00 0.00 H new ATOM 0 HA TYR A 23 -6.307 1.290 -17.716 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -4.958 3.324 -17.433 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -5.652 3.356 -19.042 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -7.578 4.902 -19.560 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -5.527 4.971 -15.772 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -8.634 7.089 -19.034 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -6.600 7.145 -15.231 1.00 0.00 H new ATOM 0 HH TYR A 23 -7.944 8.766 -15.915 1.00 0.00 H new ATOM 357 N THR A 24 -6.227 2.182 -15.229 1.00 0.00 N ATOM 358 CA THR A 24 -6.331 2.334 -13.769 1.00 0.00 C ATOM 359 C THR A 24 -5.036 2.932 -13.178 1.00 0.00 C ATOM 360 O THR A 24 -3.975 2.806 -13.795 1.00 0.00 O ATOM 361 CB THR A 24 -6.694 0.975 -13.145 1.00 0.00 C ATOM 362 OG1 THR A 24 -6.865 1.119 -11.760 1.00 0.00 O ATOM 363 CG2 THR A 24 -5.658 -0.125 -13.386 1.00 0.00 C ATOM 0 H THR A 24 -5.279 1.947 -15.522 1.00 0.00 H new ATOM 0 HA THR A 24 -7.125 3.041 -13.529 1.00 0.00 H new ATOM 0 HB THR A 24 -7.615 0.664 -13.639 1.00 0.00 H new ATOM 0 HG1 THR A 24 -7.520 0.463 -11.441 1.00 0.00 H new ATOM 0 HG21 THR A 24 -5.991 -1.049 -12.913 1.00 0.00 H new ATOM 0 HG22 THR A 24 -5.542 -0.287 -14.458 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.701 0.176 -12.959 1.00 0.00 H new ATOM 371 N LEU A 25 -5.120 3.596 -12.009 1.00 0.00 N ATOM 372 CA LEU A 25 -4.064 4.442 -11.417 1.00 0.00 C ATOM 373 C LEU A 25 -3.947 4.294 -9.889 1.00 0.00 C ATOM 374 O LEU A 25 -4.927 4.504 -9.168 1.00 0.00 O ATOM 375 CB LEU A 25 -4.346 5.933 -11.707 1.00 0.00 C ATOM 376 CG LEU A 25 -4.409 6.354 -13.180 1.00 0.00 C ATOM 377 CD1 LEU A 25 -4.750 7.842 -13.278 1.00 0.00 C ATOM 378 CD2 LEU A 25 -3.074 6.144 -13.884 1.00 0.00 C ATOM 0 H LEU A 25 -5.958 3.557 -11.428 1.00 0.00 H new ATOM 0 HA LEU A 25 -3.133 4.106 -11.875 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -5.294 6.196 -11.238 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.573 6.526 -11.218 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.172 5.739 -13.657 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.794 8.137 -14.326 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.717 8.025 -12.809 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -3.983 8.425 -12.769 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.159 6.454 -14.926 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.305 6.738 -13.390 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.802 5.089 -13.840 1.00 0.00 H new ATOM 390 N GLY A 26 -2.739 4.010 -9.390 1.00 0.00 N ATOM 391 CA GLY A 26 -2.443 3.872 -7.957 1.00 0.00 C ATOM 392 C GLY A 26 -2.607 2.432 -7.453 1.00 0.00 C ATOM 393 O GLY A 26 -3.421 1.677 -7.986 1.00 0.00 O ATOM 0 H GLY A 26 -1.921 3.866 -9.983 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.422 4.205 -7.768 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.103 4.528 -7.389 1.00 0.00 H new ATOM 397 N TYR A 27 -1.842 2.058 -6.414 1.00 0.00 N ATOM 398 CA TYR A 27 -1.614 0.662 -5.998 1.00 0.00 C ATOM 399 C TYR A 27 -2.917 -0.138 -5.840 1.00 0.00 C ATOM 400 O TYR A 27 -3.110 -1.135 -6.531 1.00 0.00 O ATOM 401 CB TYR A 27 -0.738 0.609 -4.732 1.00 0.00 C ATOM 402 CG TYR A 27 -0.219 -0.789 -4.425 1.00 0.00 C ATOM 403 CD1 TYR A 27 -0.992 -1.683 -3.650 1.00 0.00 C ATOM 404 CD2 TYR A 27 1.014 -1.218 -4.962 1.00 0.00 C ATOM 405 CE1 TYR A 27 -0.573 -3.017 -3.467 1.00 0.00 C ATOM 406 CE2 TYR A 27 1.433 -2.542 -4.769 1.00 0.00 C ATOM 407 CZ TYR A 27 0.623 -3.460 -4.073 1.00 0.00 C ATOM 408 OH TYR A 27 1.024 -4.757 -4.025 1.00 0.00 O ATOM 0 H TYR A 27 -1.353 2.733 -5.826 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.070 0.170 -6.804 1.00 0.00 H new ATOM 0 HB2 TYR A 27 0.108 1.286 -4.854 1.00 0.00 H new ATOM 0 HB3 TYR A 27 -1.316 0.971 -3.882 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -1.910 -1.342 -3.195 1.00 0.00 H new ATOM 0 HD2 TYR A 27 1.632 -0.529 -5.519 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -1.163 -3.695 -2.868 1.00 0.00 H new ATOM 0 HE2 TYR A 27 2.388 -2.862 -5.159 1.00 0.00 H new ATOM 0 HH TYR A 27 0.240 -5.339 -3.947 1.00 0.00 H new ATOM 418 N LYS A 28 -3.837 0.307 -4.972 1.00 0.00 N ATOM 419 CA LYS A 28 -5.133 -0.353 -4.744 1.00 0.00 C ATOM 420 C LYS A 28 -5.944 -0.510 -6.041 1.00 0.00 C ATOM 421 O LYS A 28 -6.487 -1.582 -6.296 1.00 0.00 O ATOM 422 CB LYS A 28 -5.908 0.421 -3.663 1.00 0.00 C ATOM 423 CG LYS A 28 -7.196 -0.299 -3.230 1.00 0.00 C ATOM 424 CD LYS A 28 -7.892 0.460 -2.091 1.00 0.00 C ATOM 425 CE LYS A 28 -9.169 -0.274 -1.667 1.00 0.00 C ATOM 426 NZ LYS A 28 -9.863 0.429 -0.561 1.00 0.00 N ATOM 0 H LYS A 28 -3.702 1.143 -4.403 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.953 -1.368 -4.390 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.266 0.564 -2.794 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.159 1.412 -4.041 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.872 -0.386 -4.081 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.959 -1.312 -2.906 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.217 0.552 -1.240 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.136 1.472 -2.415 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.840 -0.360 -2.522 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.919 -1.288 -1.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.722 -0.096 -0.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -9.231 0.489 0.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -10.123 1.388 -0.868 1.00 0.00 H new ATOM 440 N SER A 29 -5.999 0.543 -6.860 1.00 0.00 N ATOM 441 CA SER A 29 -6.728 0.626 -8.127 1.00 0.00 C ATOM 442 C SER A 29 -6.248 -0.403 -9.150 1.00 0.00 C ATOM 443 O SER A 29 -7.067 -1.110 -9.759 1.00 0.00 O ATOM 444 CB SER A 29 -6.510 2.008 -8.748 1.00 0.00 C ATOM 445 OG SER A 29 -6.478 3.045 -7.791 1.00 0.00 O ATOM 0 H SER A 29 -5.507 1.410 -6.644 1.00 0.00 H new ATOM 0 HA SER A 29 -7.776 0.436 -7.897 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.573 2.006 -9.305 1.00 0.00 H new ATOM 0 HB3 SER A 29 -7.306 2.208 -9.465 1.00 0.00 H new ATOM 0 HG SER A 29 -6.083 3.847 -8.191 1.00 0.00 H new ATOM 451 N THR A 30 -4.923 -0.463 -9.362 1.00 0.00 N ATOM 452 CA THR A 30 -4.307 -1.526 -10.155 1.00 0.00 C ATOM 453 C THR A 30 -4.597 -2.864 -9.493 1.00 0.00 C ATOM 454 O THR A 30 -5.362 -3.614 -10.083 1.00 0.00 O ATOM 455 CB THR A 30 -2.847 -1.258 -10.543 1.00 0.00 C ATOM 456 OG1 THR A 30 -2.393 -2.336 -11.316 1.00 0.00 O ATOM 457 CG2 THR A 30 -1.874 -1.070 -9.391 1.00 0.00 C ATOM 0 H THR A 30 -4.260 0.218 -8.991 1.00 0.00 H new ATOM 0 HA THR A 30 -4.769 -1.556 -11.142 1.00 0.00 H new ATOM 0 HB THR A 30 -2.862 -0.307 -11.076 1.00 0.00 H new ATOM 0 HG1 THR A 30 -1.935 -1.997 -12.113 1.00 0.00 H new ATOM 0 HG21 THR A 30 -0.874 -0.887 -9.785 1.00 0.00 H new ATOM 0 HG22 THR A 30 -2.187 -0.219 -8.786 1.00 0.00 H new ATOM 0 HG23 THR A 30 -1.862 -1.969 -8.774 1.00 0.00 H new ATOM 465 N VAL A 31 -4.157 -3.142 -8.259 1.00 0.00 N ATOM 466 CA VAL A 31 -4.335 -4.450 -7.600 1.00 0.00 C ATOM 467 C VAL A 31 -5.769 -4.990 -7.686 1.00 0.00 C ATOM 468 O VAL A 31 -5.942 -6.143 -8.077 1.00 0.00 O ATOM 469 CB VAL A 31 -3.810 -4.421 -6.153 1.00 0.00 C ATOM 470 CG1 VAL A 31 -4.162 -5.703 -5.382 1.00 0.00 C ATOM 471 CG2 VAL A 31 -2.284 -4.279 -6.186 1.00 0.00 C ATOM 0 H VAL A 31 -3.663 -2.462 -7.682 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.728 -5.161 -8.161 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.281 -3.580 -5.644 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.771 -5.636 -4.367 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.245 -5.821 -5.347 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -3.720 -6.563 -5.885 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.898 -4.257 -5.167 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.851 -5.125 -6.720 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.016 -3.353 -6.695 1.00 0.00 H new ATOM 481 N LYS A 32 -6.791 -4.168 -7.407 1.00 0.00 N ATOM 482 CA LYS A 32 -8.207 -4.490 -7.652 1.00 0.00 C ATOM 483 C LYS A 32 -8.424 -4.965 -9.093 1.00 0.00 C ATOM 484 O LYS A 32 -8.933 -6.058 -9.326 1.00 0.00 O ATOM 485 CB LYS A 32 -9.059 -3.256 -7.282 1.00 0.00 C ATOM 486 CG LYS A 32 -10.589 -3.431 -7.359 1.00 0.00 C ATOM 487 CD LYS A 32 -11.215 -3.382 -8.764 1.00 0.00 C ATOM 488 CE LYS A 32 -11.054 -2.022 -9.460 1.00 0.00 C ATOM 489 NZ LYS A 32 -11.122 -2.153 -10.935 1.00 0.00 N ATOM 0 H LYS A 32 -6.656 -3.244 -6.997 1.00 0.00 H new ATOM 0 HA LYS A 32 -8.523 -5.323 -7.023 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.800 -2.954 -6.267 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -8.775 -2.435 -7.941 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -10.847 -4.387 -6.904 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.052 -2.654 -6.751 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -10.759 -4.154 -9.383 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -12.276 -3.619 -8.689 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.835 -1.343 -9.118 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.099 -1.578 -9.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.824 -1.484 -11.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.190 -1.944 -11.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -11.400 -3.123 -11.185 1.00 0.00 H new ATOM 503 N SER A 33 -8.049 -4.132 -10.065 1.00 0.00 N ATOM 504 CA SER A 33 -8.213 -4.381 -11.502 1.00 0.00 C ATOM 505 C SER A 33 -7.394 -5.574 -12.024 1.00 0.00 C ATOM 506 O SER A 33 -7.842 -6.256 -12.943 1.00 0.00 O ATOM 507 CB SER A 33 -7.824 -3.124 -12.285 1.00 0.00 C ATOM 508 OG SER A 33 -8.431 -1.970 -11.721 1.00 0.00 O ATOM 0 H SER A 33 -7.607 -3.234 -9.869 1.00 0.00 H new ATOM 0 HA SER A 33 -9.263 -4.632 -11.652 1.00 0.00 H new ATOM 0 HB2 SER A 33 -6.740 -3.009 -12.281 1.00 0.00 H new ATOM 0 HB3 SER A 33 -8.130 -3.229 -13.326 1.00 0.00 H new ATOM 0 HG SER A 33 -7.780 -1.499 -11.160 1.00 0.00 H new ATOM 514 N LEU A 34 -6.222 -5.854 -11.438 1.00 0.00 N ATOM 515 CA LEU A 34 -5.419 -7.041 -11.743 1.00 0.00 C ATOM 516 C LEU A 34 -6.050 -8.300 -11.128 1.00 0.00 C ATOM 517 O LEU A 34 -6.097 -9.338 -11.779 1.00 0.00 O ATOM 518 CB LEU A 34 -3.966 -6.887 -11.258 1.00 0.00 C ATOM 519 CG LEU A 34 -3.230 -5.588 -11.627 1.00 0.00 C ATOM 520 CD1 LEU A 34 -1.796 -5.602 -11.111 1.00 0.00 C ATOM 521 CD2 LEU A 34 -3.250 -5.262 -13.112 1.00 0.00 C ATOM 0 H LEU A 34 -5.801 -5.253 -10.729 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.402 -7.148 -12.828 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.962 -6.979 -10.172 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.389 -7.724 -11.651 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.788 -4.793 -11.132 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -1.301 -4.671 -11.387 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.801 -5.703 -10.026 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.259 -6.443 -11.551 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -2.710 -4.332 -13.288 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.773 -6.069 -13.668 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.282 -5.151 -13.446 1.00 0.00 H new ATOM 533 N ARG A 35 -6.598 -8.213 -9.906 1.00 0.00 N ATOM 534 CA ARG A 35 -7.387 -9.288 -9.280 1.00 0.00 C ATOM 535 C ARG A 35 -8.701 -9.575 -10.025 1.00 0.00 C ATOM 536 O ARG A 35 -9.171 -10.707 -9.982 1.00 0.00 O ATOM 537 CB ARG A 35 -7.623 -8.963 -7.794 1.00 0.00 C ATOM 538 CG ARG A 35 -6.345 -9.158 -6.956 1.00 0.00 C ATOM 539 CD ARG A 35 -6.457 -8.439 -5.607 1.00 0.00 C ATOM 540 NE ARG A 35 -5.315 -8.736 -4.718 1.00 0.00 N ATOM 541 CZ ARG A 35 -5.274 -9.577 -3.692 1.00 0.00 C ATOM 542 NH1 ARG A 35 -6.297 -10.336 -3.366 1.00 0.00 N ATOM 543 NH2 ARG A 35 -4.187 -9.677 -2.966 1.00 0.00 N ATOM 0 H ARG A 35 -6.505 -7.385 -9.317 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.810 -10.210 -9.348 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -7.968 -7.933 -7.697 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -8.415 -9.602 -7.403 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -6.172 -10.222 -6.792 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -5.484 -8.776 -7.505 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -6.514 -7.363 -5.774 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -7.384 -8.735 -5.116 1.00 0.00 H new ATOM 0 HE ARG A 35 -4.451 -8.232 -4.917 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -7.159 -10.290 -3.909 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -6.228 -10.971 -2.570 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -3.371 -9.108 -3.189 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -4.158 -10.324 -2.178 1.00 0.00 H new ATOM 557 N GLN A 36 -9.243 -8.610 -10.781 1.00 0.00 N ATOM 558 CA GLN A 36 -10.283 -8.843 -11.800 1.00 0.00 C ATOM 559 C GLN A 36 -9.763 -9.552 -13.077 1.00 0.00 C ATOM 560 O GLN A 36 -10.549 -9.820 -13.984 1.00 0.00 O ATOM 561 CB GLN A 36 -10.986 -7.521 -12.172 1.00 0.00 C ATOM 562 CG GLN A 36 -11.859 -6.953 -11.043 1.00 0.00 C ATOM 563 CD GLN A 36 -12.620 -5.714 -11.509 1.00 0.00 C ATOM 564 OE1 GLN A 36 -12.084 -4.615 -11.594 1.00 0.00 O ATOM 565 NE2 GLN A 36 -13.895 -5.841 -11.824 1.00 0.00 N ATOM 0 H GLN A 36 -8.969 -7.631 -10.703 1.00 0.00 H new ATOM 0 HA GLN A 36 -10.999 -9.526 -11.343 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -10.232 -6.782 -12.445 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -11.606 -7.684 -13.053 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.565 -7.713 -10.707 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -11.233 -6.699 -10.187 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -14.349 -6.752 -11.756 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -14.427 -5.028 -12.135 1.00 0.00 H new ATOM 574 N GLY A 37 -8.462 -9.855 -13.187 1.00 0.00 N ATOM 575 CA GLY A 37 -7.844 -10.716 -14.206 1.00 0.00 C ATOM 576 C GLY A 37 -7.717 -10.116 -15.612 1.00 0.00 C ATOM 577 O GLY A 37 -6.762 -10.422 -16.324 1.00 0.00 O ATOM 0 H GLY A 37 -7.774 -9.485 -12.531 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.848 -10.995 -13.861 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.426 -11.635 -14.277 1.00 0.00 H new ATOM 581 N LYS A 38 -8.675 -9.272 -16.018 1.00 0.00 N ATOM 582 CA LYS A 38 -8.865 -8.767 -17.386 1.00 0.00 C ATOM 583 C LYS A 38 -7.990 -7.550 -17.767 1.00 0.00 C ATOM 584 O LYS A 38 -8.202 -6.958 -18.835 1.00 0.00 O ATOM 585 CB LYS A 38 -10.365 -8.485 -17.591 1.00 0.00 C ATOM 586 CG LYS A 38 -10.794 -8.758 -19.046 1.00 0.00 C ATOM 587 CD LYS A 38 -12.039 -7.973 -19.487 1.00 0.00 C ATOM 588 CE LYS A 38 -11.898 -6.445 -19.394 1.00 0.00 C ATOM 589 NZ LYS A 38 -10.605 -5.965 -19.929 1.00 0.00 N ATOM 0 H LYS A 38 -9.373 -8.905 -15.371 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.519 -9.543 -18.068 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -10.950 -9.108 -16.914 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -10.580 -7.448 -17.335 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -9.966 -8.510 -19.711 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -10.989 -9.824 -19.163 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -12.275 -8.241 -20.517 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -12.885 -8.285 -18.874 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -12.713 -5.973 -19.943 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -11.995 -6.136 -18.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -10.647 -4.935 -20.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.845 -6.194 -19.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -10.413 -6.428 -20.840 1.00 0.00 H new ATOM 603 N SER A 39 -7.032 -7.163 -16.917 1.00 0.00 N ATOM 604 CA SER A 39 -5.934 -6.235 -17.233 1.00 0.00 C ATOM 605 C SER A 39 -5.021 -6.779 -18.342 1.00 0.00 C ATOM 606 O SER A 39 -5.224 -7.908 -18.794 1.00 0.00 O ATOM 607 CB SER A 39 -5.129 -5.968 -15.960 1.00 0.00 C ATOM 608 OG SER A 39 -4.654 -7.180 -15.414 1.00 0.00 O ATOM 0 H SER A 39 -6.997 -7.498 -15.954 1.00 0.00 H new ATOM 0 HA SER A 39 -6.364 -5.305 -17.606 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.290 -5.309 -16.184 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.752 -5.452 -15.229 1.00 0.00 H new ATOM 0 HG SER A 39 -4.063 -7.620 -16.060 1.00 0.00 H new ATOM 614 N LYS A 40 -4.051 -5.979 -18.832 1.00 0.00 N ATOM 615 CA LYS A 40 -3.266 -6.431 -19.995 1.00 0.00 C ATOM 616 C LYS A 40 -1.839 -5.862 -20.062 1.00 0.00 C ATOM 617 O LYS A 40 -0.944 -6.533 -20.576 1.00 0.00 O ATOM 618 CB LYS A 40 -4.101 -6.065 -21.230 1.00 0.00 C ATOM 619 CG LYS A 40 -3.975 -7.061 -22.396 1.00 0.00 C ATOM 620 CD LYS A 40 -5.341 -7.358 -23.060 1.00 0.00 C ATOM 621 CE LYS A 40 -6.378 -7.984 -22.100 1.00 0.00 C ATOM 622 NZ LYS A 40 -7.318 -6.984 -21.528 1.00 0.00 N ATOM 0 H LYS A 40 -3.802 -5.062 -18.462 1.00 0.00 H new ATOM 0 HA LYS A 40 -3.092 -7.505 -19.926 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.149 -5.996 -20.938 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.801 -5.077 -21.578 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -3.290 -6.659 -23.142 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -3.540 -7.992 -22.032 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -5.747 -6.431 -23.464 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -5.186 -8.032 -23.902 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -6.947 -8.745 -22.634 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -5.855 -8.489 -21.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -7.530 -7.232 -20.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -6.883 -6.040 -21.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -8.199 -6.980 -22.081 1.00 0.00 H new ATOM 636 N LEU A 41 -1.586 -4.686 -19.474 1.00 0.00 N ATOM 637 CA LEU A 41 -0.242 -4.123 -19.270 1.00 0.00 C ATOM 638 C LEU A 41 -0.206 -3.301 -17.965 1.00 0.00 C ATOM 639 O LEU A 41 -1.062 -2.440 -17.786 1.00 0.00 O ATOM 640 CB LEU A 41 0.102 -3.334 -20.554 1.00 0.00 C ATOM 641 CG LEU A 41 1.281 -2.344 -20.604 1.00 0.00 C ATOM 642 CD1 LEU A 41 0.939 -1.008 -19.947 1.00 0.00 C ATOM 643 CD2 LEU A 41 2.602 -2.890 -20.060 1.00 0.00 C ATOM 0 H LEU A 41 -2.328 -4.083 -19.117 1.00 0.00 H new ATOM 0 HA LEU A 41 0.526 -4.883 -19.128 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.273 -4.069 -21.340 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.792 -2.775 -20.830 1.00 0.00 H new ATOM 0 HG LEU A 41 1.444 -2.181 -21.669 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.800 -0.342 -20.006 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.093 -0.554 -20.464 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.679 -1.173 -18.901 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.372 -2.122 -20.137 1.00 0.00 H new ATOM 0 HD22 LEU A 41 2.476 -3.174 -19.015 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.901 -3.763 -20.640 1.00 0.00 H new ATOM 655 N ILE A 42 0.760 -3.540 -17.065 1.00 0.00 N ATOM 656 CA ILE A 42 1.058 -2.675 -15.908 1.00 0.00 C ATOM 657 C ILE A 42 2.329 -1.844 -16.134 1.00 0.00 C ATOM 658 O ILE A 42 3.320 -2.344 -16.667 1.00 0.00 O ATOM 659 CB ILE A 42 1.121 -3.430 -14.551 1.00 0.00 C ATOM 660 CG1 ILE A 42 2.365 -4.315 -14.304 1.00 0.00 C ATOM 661 CG2 ILE A 42 -0.131 -4.276 -14.282 1.00 0.00 C ATOM 662 CD1 ILE A 42 2.459 -4.801 -12.852 1.00 0.00 C ATOM 0 H ILE A 42 1.369 -4.356 -17.120 1.00 0.00 H new ATOM 0 HA ILE A 42 0.208 -1.997 -15.833 1.00 0.00 H new ATOM 0 HB ILE A 42 1.189 -2.599 -13.849 1.00 0.00 H new ATOM 0 HG12 ILE A 42 2.333 -5.176 -14.971 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.264 -3.751 -14.554 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -0.030 -4.780 -13.321 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -1.009 -3.630 -14.263 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.244 -5.019 -15.071 1.00 0.00 H new ATOM 0 HD11 ILE A 42 3.349 -5.418 -12.732 1.00 0.00 H new ATOM 0 HD12 ILE A 42 2.520 -3.942 -12.184 1.00 0.00 H new ATOM 0 HD13 ILE A 42 1.574 -5.389 -12.607 1.00 0.00 H new ATOM 674 N ILE A 43 2.321 -0.593 -15.660 1.00 0.00 N ATOM 675 CA ILE A 43 3.506 0.262 -15.546 1.00 0.00 C ATOM 676 C ILE A 43 3.754 0.546 -14.074 1.00 0.00 C ATOM 677 O ILE A 43 2.825 0.900 -13.347 1.00 0.00 O ATOM 678 CB ILE A 43 3.333 1.628 -16.239 1.00 0.00 C ATOM 679 CG1 ILE A 43 2.766 1.584 -17.669 1.00 0.00 C ATOM 680 CG2 ILE A 43 4.669 2.396 -16.218 1.00 0.00 C ATOM 681 CD1 ILE A 43 3.641 0.856 -18.694 1.00 0.00 C ATOM 0 H ILE A 43 1.468 -0.136 -15.337 1.00 0.00 H new ATOM 0 HA ILE A 43 4.328 -0.270 -16.025 1.00 0.00 H new ATOM 0 HB ILE A 43 2.571 2.147 -15.658 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.789 1.102 -17.641 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.607 2.606 -18.012 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.542 3.361 -16.709 1.00 0.00 H new ATOM 0 HG22 ILE A 43 4.982 2.553 -15.186 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.429 1.819 -16.744 1.00 0.00 H new ATOM 0 HD11 ILE A 43 3.155 0.880 -19.669 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.611 1.349 -18.760 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.780 -0.179 -18.383 1.00 0.00 H new ATOM 693 N ILE A 44 5.015 0.480 -13.658 1.00 0.00 N ATOM 694 CA ILE A 44 5.427 0.809 -12.300 1.00 0.00 C ATOM 695 C ILE A 44 6.426 1.982 -12.375 1.00 0.00 C ATOM 696 O ILE A 44 7.641 1.786 -12.439 1.00 0.00 O ATOM 697 CB ILE A 44 5.908 -0.477 -11.575 1.00 0.00 C ATOM 698 CG1 ILE A 44 4.874 -1.643 -11.641 1.00 0.00 C ATOM 699 CG2 ILE A 44 6.184 -0.156 -10.098 1.00 0.00 C ATOM 700 CD1 ILE A 44 5.484 -3.029 -11.431 1.00 0.00 C ATOM 0 H ILE A 44 5.786 0.194 -14.261 1.00 0.00 H new ATOM 0 HA ILE A 44 4.608 1.166 -11.676 1.00 0.00 H new ATOM 0 HB ILE A 44 6.811 -0.807 -12.089 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.106 -1.477 -10.885 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.377 -1.619 -12.611 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.522 -1.057 -9.587 1.00 0.00 H new ATOM 0 HG22 ILE A 44 6.956 0.611 -10.030 1.00 0.00 H new ATOM 0 HG23 ILE A 44 5.270 0.207 -9.628 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.700 -3.784 -11.492 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.231 -3.218 -12.202 1.00 0.00 H new ATOM 0 HD13 ILE A 44 5.956 -3.074 -10.450 1.00 0.00 H new ATOM 712 N ALA A 45 5.896 3.220 -12.398 1.00 0.00 N ATOM 713 CA ALA A 45 6.625 4.474 -12.139 1.00 0.00 C ATOM 714 C ALA A 45 6.428 4.971 -10.690 1.00 0.00 C ATOM 715 O ALA A 45 6.734 6.124 -10.372 1.00 0.00 O ATOM 716 CB ALA A 45 6.239 5.559 -13.160 1.00 0.00 C ATOM 0 H ALA A 45 4.910 3.379 -12.606 1.00 0.00 H new ATOM 0 HA ALA A 45 7.687 4.260 -12.259 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.792 6.474 -12.945 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.482 5.215 -14.165 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.169 5.757 -13.093 1.00 0.00 H new ATOM 722 N ALA A 46 5.876 4.122 -9.815 1.00 0.00 N ATOM 723 CA ALA A 46 5.825 4.334 -8.374 1.00 0.00 C ATOM 724 C ALA A 46 7.129 3.883 -7.701 1.00 0.00 C ATOM 725 O ALA A 46 7.782 2.940 -8.161 1.00 0.00 O ATOM 726 CB ALA A 46 4.635 3.554 -7.806 1.00 0.00 C ATOM 0 H ALA A 46 5.442 3.245 -10.104 1.00 0.00 H new ATOM 0 HA ALA A 46 5.704 5.398 -8.172 1.00 0.00 H new ATOM 0 HB1 ALA A 46 4.584 3.703 -6.727 1.00 0.00 H new ATOM 0 HB2 ALA A 46 3.713 3.911 -8.266 1.00 0.00 H new ATOM 0 HB3 ALA A 46 4.760 2.493 -8.020 1.00 0.00 H new ATOM 732 N ASN A 47 7.462 4.496 -6.560 1.00 0.00 N ATOM 733 CA ASN A 47 8.659 4.215 -5.760 1.00 0.00 C ATOM 734 C ASN A 47 8.527 2.873 -5.017 1.00 0.00 C ATOM 735 O ASN A 47 8.202 2.815 -3.833 1.00 0.00 O ATOM 736 CB ASN A 47 8.943 5.425 -4.852 1.00 0.00 C ATOM 737 CG ASN A 47 9.127 6.677 -5.698 1.00 0.00 C ATOM 738 OD1 ASN A 47 9.988 6.725 -6.569 1.00 0.00 O ATOM 739 ND2 ASN A 47 8.278 7.674 -5.537 1.00 0.00 N ATOM 0 H ASN A 47 6.883 5.230 -6.153 1.00 0.00 H new ATOM 0 HA ASN A 47 9.531 4.086 -6.401 1.00 0.00 H new ATOM 0 HB2 ASN A 47 8.119 5.567 -4.152 1.00 0.00 H new ATOM 0 HB3 ASN A 47 9.838 5.242 -4.258 1.00 0.00 H new ATOM 0 HD21 ASN A 47 8.335 8.494 -6.140 1.00 0.00 H new ATOM 0 HD22 ASN A 47 7.565 7.624 -4.809 1.00 0.00 H new ATOM 746 N THR A 48 8.703 1.792 -5.781 1.00 0.00 N ATOM 747 CA THR A 48 8.199 0.449 -5.486 1.00 0.00 C ATOM 748 C THR A 48 9.326 -0.498 -5.045 1.00 0.00 C ATOM 749 O THR A 48 10.089 -0.942 -5.903 1.00 0.00 O ATOM 750 CB THR A 48 7.462 -0.102 -6.717 1.00 0.00 C ATOM 751 OG1 THR A 48 6.526 0.840 -7.179 1.00 0.00 O ATOM 752 CG2 THR A 48 6.674 -1.366 -6.395 1.00 0.00 C ATOM 0 H THR A 48 9.222 1.831 -6.658 1.00 0.00 H new ATOM 0 HA THR A 48 7.501 0.516 -4.651 1.00 0.00 H new ATOM 0 HB THR A 48 8.228 -0.319 -7.462 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.956 1.440 -7.823 1.00 0.00 H new ATOM 0 HG21 THR A 48 6.170 -1.719 -7.294 1.00 0.00 H new ATOM 0 HG22 THR A 48 7.355 -2.137 -6.034 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.933 -1.147 -5.626 1.00 0.00 H new ATOM 760 N PRO A 49 9.459 -0.840 -3.747 1.00 0.00 N ATOM 761 CA PRO A 49 10.489 -1.774 -3.287 1.00 0.00 C ATOM 762 C PRO A 49 10.210 -3.215 -3.749 1.00 0.00 C ATOM 763 O PRO A 49 9.093 -3.558 -4.140 1.00 0.00 O ATOM 764 CB PRO A 49 10.502 -1.635 -1.762 1.00 0.00 C ATOM 765 CG PRO A 49 9.067 -1.232 -1.429 1.00 0.00 C ATOM 766 CD PRO A 49 8.653 -0.377 -2.626 1.00 0.00 C ATOM 0 HA PRO A 49 11.466 -1.542 -3.712 1.00 0.00 H new ATOM 0 HB2 PRO A 49 10.779 -2.570 -1.276 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.217 -0.881 -1.434 1.00 0.00 H new ATOM 0 HG2 PRO A 49 8.421 -2.103 -1.315 1.00 0.00 H new ATOM 0 HG3 PRO A 49 9.013 -0.671 -0.496 1.00 0.00 H new ATOM 0 HD2 PRO A 49 7.590 -0.490 -2.837 1.00 0.00 H new ATOM 0 HD3 PRO A 49 8.829 0.681 -2.430 1.00 0.00 H new ATOM 774 N VAL A 50 11.237 -4.073 -3.667 1.00 0.00 N ATOM 775 CA VAL A 50 11.284 -5.418 -4.273 1.00 0.00 C ATOM 776 C VAL A 50 10.056 -6.272 -3.937 1.00 0.00 C ATOM 777 O VAL A 50 9.421 -6.810 -4.840 1.00 0.00 O ATOM 778 CB VAL A 50 12.591 -6.153 -3.897 1.00 0.00 C ATOM 779 CG1 VAL A 50 12.680 -7.533 -4.568 1.00 0.00 C ATOM 780 CG2 VAL A 50 13.829 -5.347 -4.322 1.00 0.00 C ATOM 0 H VAL A 50 12.091 -3.844 -3.159 1.00 0.00 H new ATOM 0 HA VAL A 50 11.268 -5.268 -5.353 1.00 0.00 H new ATOM 0 HB VAL A 50 12.571 -6.269 -2.813 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.612 -8.018 -4.279 1.00 0.00 H new ATOM 0 HG12 VAL A 50 11.838 -8.147 -4.250 1.00 0.00 H new ATOM 0 HG13 VAL A 50 12.653 -7.413 -5.651 1.00 0.00 H new ATOM 0 HG21 VAL A 50 14.731 -5.892 -4.043 1.00 0.00 H new ATOM 0 HG22 VAL A 50 13.814 -5.199 -5.402 1.00 0.00 H new ATOM 0 HG23 VAL A 50 13.821 -4.378 -3.823 1.00 0.00 H new ATOM 790 N LEU A 51 9.686 -6.376 -2.657 1.00 0.00 N ATOM 791 CA LEU A 51 8.513 -7.144 -2.230 1.00 0.00 C ATOM 792 C LEU A 51 7.233 -6.614 -2.898 1.00 0.00 C ATOM 793 O LEU A 51 6.461 -7.390 -3.464 1.00 0.00 O ATOM 794 CB LEU A 51 8.385 -7.123 -0.692 1.00 0.00 C ATOM 795 CG LEU A 51 9.398 -7.959 0.122 1.00 0.00 C ATOM 796 CD1 LEU A 51 9.368 -9.443 -0.256 1.00 0.00 C ATOM 797 CD2 LEU A 51 10.841 -7.450 0.035 1.00 0.00 C ATOM 0 H LEU A 51 10.190 -5.931 -1.890 1.00 0.00 H new ATOM 0 HA LEU A 51 8.648 -8.178 -2.547 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.463 -6.087 -0.363 1.00 0.00 H new ATOM 0 HB3 LEU A 51 7.383 -7.465 -0.434 1.00 0.00 H new ATOM 0 HG LEU A 51 9.067 -7.840 1.154 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.098 -9.986 0.344 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.373 -9.846 -0.069 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.612 -9.554 -1.312 1.00 0.00 H new ATOM 0 HD21 LEU A 51 11.489 -8.090 0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 51 11.171 -7.468 -1.004 1.00 0.00 H new ATOM 0 HD23 LEU A 51 10.890 -6.429 0.414 1.00 0.00 H new ATOM 809 N ARG A 52 7.040 -5.289 -2.880 1.00 0.00 N ATOM 810 CA ARG A 52 5.877 -4.593 -3.441 1.00 0.00 C ATOM 811 C ARG A 52 5.821 -4.766 -4.961 1.00 0.00 C ATOM 812 O ARG A 52 4.745 -5.075 -5.479 1.00 0.00 O ATOM 813 CB ARG A 52 5.921 -3.118 -2.996 1.00 0.00 C ATOM 814 CG ARG A 52 4.514 -2.506 -2.891 1.00 0.00 C ATOM 815 CD ARG A 52 3.949 -2.576 -1.456 1.00 0.00 C ATOM 816 NE ARG A 52 4.071 -3.921 -0.852 1.00 0.00 N ATOM 817 CZ ARG A 52 3.182 -4.905 -0.870 1.00 0.00 C ATOM 818 NH1 ARG A 52 1.955 -4.754 -1.286 1.00 0.00 N ATOM 819 NH2 ARG A 52 3.498 -6.121 -0.510 1.00 0.00 N ATOM 0 H ARG A 52 7.714 -4.650 -2.459 1.00 0.00 H new ATOM 0 HA ARG A 52 4.952 -5.028 -3.062 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.421 -3.045 -2.030 1.00 0.00 H new ATOM 0 HB3 ARG A 52 6.515 -2.543 -3.706 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.548 -1.466 -3.215 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.841 -3.030 -3.570 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.472 -1.854 -0.830 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.899 -2.284 -1.470 1.00 0.00 H new ATOM 0 HE ARG A 52 4.945 -4.115 -0.362 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.638 -3.844 -1.619 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.313 -5.546 -1.278 1.00 0.00 H new ATOM 0 HH21 ARG A 52 4.448 -6.332 -0.206 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.794 -6.859 -0.533 1.00 0.00 H new ATOM 833 N LYS A 53 6.962 -4.659 -5.672 1.00 0.00 N ATOM 834 CA LYS A 53 6.969 -4.922 -7.119 1.00 0.00 C ATOM 835 C LYS A 53 6.630 -6.390 -7.364 1.00 0.00 C ATOM 836 O LYS A 53 5.800 -6.663 -8.218 1.00 0.00 O ATOM 837 CB LYS A 53 8.255 -4.495 -7.866 1.00 0.00 C ATOM 838 CG LYS A 53 9.393 -5.529 -7.970 1.00 0.00 C ATOM 839 CD LYS A 53 10.568 -5.046 -8.834 1.00 0.00 C ATOM 840 CE LYS A 53 11.396 -6.210 -9.402 1.00 0.00 C ATOM 841 NZ LYS A 53 10.699 -6.925 -10.504 1.00 0.00 N ATOM 0 H LYS A 53 7.866 -4.399 -5.278 1.00 0.00 H new ATOM 0 HA LYS A 53 6.202 -4.279 -7.551 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.975 -4.200 -8.877 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.651 -3.607 -7.373 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.757 -5.762 -6.969 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.998 -6.455 -8.389 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.186 -4.441 -9.656 1.00 0.00 H new ATOM 0 HD3 LYS A 53 11.214 -4.402 -8.237 1.00 0.00 H new ATOM 0 HE2 LYS A 53 12.349 -5.828 -9.768 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.621 -6.915 -8.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.384 -7.167 -11.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.268 -7.796 -10.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.958 -6.313 -10.901 1.00 0.00 H new ATOM 855 N SER A 54 7.211 -7.312 -6.581 1.00 0.00 N ATOM 856 CA SER A 54 6.969 -8.750 -6.714 1.00 0.00 C ATOM 857 C SER A 54 5.488 -9.105 -6.579 1.00 0.00 C ATOM 858 O SER A 54 5.013 -9.966 -7.306 1.00 0.00 O ATOM 859 CB SER A 54 7.833 -9.565 -5.742 1.00 0.00 C ATOM 860 OG SER A 54 7.323 -9.604 -4.420 1.00 0.00 O ATOM 0 H SER A 54 7.865 -7.076 -5.835 1.00 0.00 H new ATOM 0 HA SER A 54 7.268 -9.023 -7.726 1.00 0.00 H new ATOM 0 HB2 SER A 54 7.923 -10.584 -6.117 1.00 0.00 H new ATOM 0 HB3 SER A 54 8.838 -9.143 -5.722 1.00 0.00 H new ATOM 0 HG SER A 54 6.937 -8.732 -4.192 1.00 0.00 H new ATOM 866 N GLU A 55 4.736 -8.403 -5.722 1.00 0.00 N ATOM 867 CA GLU A 55 3.287 -8.568 -5.601 1.00 0.00 C ATOM 868 C GLU A 55 2.550 -8.065 -6.862 1.00 0.00 C ATOM 869 O GLU A 55 1.693 -8.772 -7.388 1.00 0.00 O ATOM 870 CB GLU A 55 2.816 -7.840 -4.329 1.00 0.00 C ATOM 871 CG GLU A 55 1.524 -8.434 -3.757 1.00 0.00 C ATOM 872 CD GLU A 55 0.881 -7.483 -2.741 1.00 0.00 C ATOM 873 OE1 GLU A 55 1.415 -7.342 -1.616 1.00 0.00 O ATOM 874 OE2 GLU A 55 -0.107 -6.791 -3.109 1.00 0.00 O ATOM 0 H GLU A 55 5.121 -7.701 -5.090 1.00 0.00 H new ATOM 0 HA GLU A 55 3.046 -9.628 -5.516 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.601 -7.890 -3.574 1.00 0.00 H new ATOM 0 HB3 GLU A 55 2.658 -6.785 -4.555 1.00 0.00 H new ATOM 0 HG2 GLU A 55 0.822 -8.634 -4.567 1.00 0.00 H new ATOM 0 HG3 GLU A 55 1.740 -9.390 -3.279 1.00 0.00 H new ATOM 881 N LEU A 56 2.912 -6.888 -7.399 1.00 0.00 N ATOM 882 CA LEU A 56 2.395 -6.387 -8.691 1.00 0.00 C ATOM 883 C LEU A 56 2.665 -7.333 -9.854 1.00 0.00 C ATOM 884 O LEU A 56 1.793 -7.612 -10.672 1.00 0.00 O ATOM 885 CB LEU A 56 2.929 -4.980 -8.977 1.00 0.00 C ATOM 886 CG LEU A 56 2.411 -3.946 -7.967 1.00 0.00 C ATOM 887 CD1 LEU A 56 2.452 -2.586 -8.628 1.00 0.00 C ATOM 888 CD2 LEU A 56 0.960 -4.191 -7.547 1.00 0.00 C ATOM 0 H LEU A 56 3.573 -6.253 -6.951 1.00 0.00 H new ATOM 0 HA LEU A 56 1.310 -6.336 -8.596 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.019 -4.995 -8.952 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.637 -4.680 -9.983 1.00 0.00 H new ATOM 0 HG LEU A 56 3.042 -4.017 -7.081 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.088 -1.831 -7.931 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.477 -2.351 -8.914 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.820 -2.594 -9.516 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.654 -3.427 -6.833 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.315 -4.147 -8.424 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.876 -5.174 -7.084 1.00 0.00 H new ATOM 900 N GLU A 57 3.886 -7.834 -9.880 1.00 0.00 N ATOM 901 CA GLU A 57 4.425 -8.819 -10.819 1.00 0.00 C ATOM 902 C GLU A 57 3.683 -10.168 -10.692 1.00 0.00 C ATOM 903 O GLU A 57 3.305 -10.767 -11.700 1.00 0.00 O ATOM 904 CB GLU A 57 5.936 -8.895 -10.538 1.00 0.00 C ATOM 905 CG GLU A 57 6.850 -9.341 -11.680 1.00 0.00 C ATOM 906 CD GLU A 57 8.194 -8.611 -11.518 1.00 0.00 C ATOM 907 OE1 GLU A 57 8.959 -8.921 -10.577 1.00 0.00 O ATOM 908 OE2 GLU A 57 8.424 -7.606 -12.236 1.00 0.00 O ATOM 0 H GLU A 57 4.585 -7.545 -9.196 1.00 0.00 H new ATOM 0 HA GLU A 57 4.272 -8.532 -11.859 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.266 -7.909 -10.210 1.00 0.00 H new ATOM 0 HB3 GLU A 57 6.088 -9.577 -9.701 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.996 -10.421 -11.653 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.400 -9.104 -12.644 1.00 0.00 H new ATOM 915 N TYR A 58 3.373 -10.601 -9.462 1.00 0.00 N ATOM 916 CA TYR A 58 2.501 -11.739 -9.155 1.00 0.00 C ATOM 917 C TYR A 58 1.078 -11.527 -9.693 1.00 0.00 C ATOM 918 O TYR A 58 0.541 -12.413 -10.356 1.00 0.00 O ATOM 919 CB TYR A 58 2.498 -11.987 -7.638 1.00 0.00 C ATOM 920 CG TYR A 58 2.006 -13.348 -7.199 1.00 0.00 C ATOM 921 CD1 TYR A 58 2.924 -14.411 -7.129 1.00 0.00 C ATOM 922 CD2 TYR A 58 0.674 -13.535 -6.783 1.00 0.00 C ATOM 923 CE1 TYR A 58 2.508 -15.674 -6.668 1.00 0.00 C ATOM 924 CE2 TYR A 58 0.261 -14.788 -6.291 1.00 0.00 C ATOM 925 CZ TYR A 58 1.175 -15.865 -6.247 1.00 0.00 C ATOM 926 OH TYR A 58 0.784 -17.082 -5.784 1.00 0.00 O ATOM 0 H TYR A 58 3.738 -10.150 -8.623 1.00 0.00 H new ATOM 0 HA TYR A 58 2.893 -12.624 -9.657 1.00 0.00 H new ATOM 0 HB2 TYR A 58 3.512 -11.849 -7.263 1.00 0.00 H new ATOM 0 HB3 TYR A 58 1.877 -11.226 -7.165 1.00 0.00 H new ATOM 0 HD1 TYR A 58 3.950 -14.258 -7.430 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -0.030 -12.718 -6.841 1.00 0.00 H new ATOM 0 HE1 TYR A 58 3.208 -16.496 -6.637 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -0.754 -14.926 -5.947 1.00 0.00 H new ATOM 0 HH TYR A 58 -0.163 -17.048 -5.533 1.00 0.00 H new ATOM 936 N TYR A 59 0.459 -10.359 -9.470 1.00 0.00 N ATOM 937 CA TYR A 59 -0.847 -10.070 -10.073 1.00 0.00 C ATOM 938 C TYR A 59 -0.786 -9.988 -11.606 1.00 0.00 C ATOM 939 O TYR A 59 -1.699 -10.485 -12.270 1.00 0.00 O ATOM 940 CB TYR A 59 -1.467 -8.787 -9.524 1.00 0.00 C ATOM 941 CG TYR A 59 -1.591 -8.683 -8.018 1.00 0.00 C ATOM 942 CD1 TYR A 59 -2.225 -9.693 -7.265 1.00 0.00 C ATOM 943 CD2 TYR A 59 -1.086 -7.546 -7.373 1.00 0.00 C ATOM 944 CE1 TYR A 59 -2.325 -9.571 -5.867 1.00 0.00 C ATOM 945 CE2 TYR A 59 -1.175 -7.421 -5.980 1.00 0.00 C ATOM 946 CZ TYR A 59 -1.807 -8.425 -5.221 1.00 0.00 C ATOM 947 OH TYR A 59 -1.937 -8.256 -3.875 1.00 0.00 O ATOM 0 H TYR A 59 0.835 -9.611 -8.887 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.481 -10.913 -9.798 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.872 -7.944 -9.876 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -2.462 -8.678 -9.956 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -2.634 -10.560 -7.762 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -0.625 -6.761 -7.953 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -2.797 -10.351 -5.288 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -0.759 -6.554 -5.488 1.00 0.00 H new ATOM 0 HH TYR A 59 -1.485 -7.430 -3.604 1.00 0.00 H new ATOM 957 N ALA A 60 0.272 -9.403 -12.184 1.00 0.00 N ATOM 958 CA ALA A 60 0.528 -9.417 -13.623 1.00 0.00 C ATOM 959 C ALA A 60 0.614 -10.848 -14.204 1.00 0.00 C ATOM 960 O ALA A 60 0.129 -11.086 -15.308 1.00 0.00 O ATOM 961 CB ALA A 60 1.791 -8.612 -13.929 1.00 0.00 C ATOM 0 H ALA A 60 0.983 -8.900 -11.653 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.324 -8.948 -14.116 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.979 -8.624 -15.003 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.656 -7.583 -13.596 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.640 -9.054 -13.407 1.00 0.00 H new ATOM 967 N MET A 61 1.190 -11.793 -13.445 1.00 0.00 N ATOM 968 CA MET A 61 1.258 -13.232 -13.743 1.00 0.00 C ATOM 969 C MET A 61 -0.088 -13.967 -13.559 1.00 0.00 C ATOM 970 O MET A 61 -0.413 -14.839 -14.372 1.00 0.00 O ATOM 971 CB MET A 61 2.349 -13.847 -12.847 1.00 0.00 C ATOM 972 CG MET A 61 2.539 -15.359 -13.024 1.00 0.00 C ATOM 973 SD MET A 61 3.638 -16.118 -11.796 1.00 0.00 S ATOM 974 CE MET A 61 2.582 -16.055 -10.319 1.00 0.00 C ATOM 0 H MET A 61 1.644 -11.562 -12.561 1.00 0.00 H new ATOM 0 HA MET A 61 1.502 -13.352 -14.798 1.00 0.00 H new ATOM 0 HB2 MET A 61 3.296 -13.348 -13.054 1.00 0.00 H new ATOM 0 HB3 MET A 61 2.103 -13.644 -11.805 1.00 0.00 H new ATOM 0 HG2 MET A 61 1.565 -15.845 -12.973 1.00 0.00 H new ATOM 0 HG3 MET A 61 2.939 -15.550 -14.020 1.00 0.00 H new ATOM 0 HE1 MET A 61 3.011 -16.683 -9.538 1.00 0.00 H new ATOM 0 HE2 MET A 61 2.516 -15.027 -9.962 1.00 0.00 H new ATOM 0 HE3 MET A 61 1.585 -16.417 -10.569 1.00 0.00 H new ATOM 984 N LEU A 62 -0.854 -13.657 -12.500 1.00 0.00 N ATOM 985 CA LEU A 62 -2.200 -14.203 -12.249 1.00 0.00 C ATOM 986 C LEU A 62 -3.188 -13.760 -13.337 1.00 0.00 C ATOM 987 O LEU A 62 -3.719 -14.591 -14.077 1.00 0.00 O ATOM 988 CB LEU A 62 -2.712 -13.759 -10.866 1.00 0.00 C ATOM 989 CG LEU A 62 -2.055 -14.441 -9.652 1.00 0.00 C ATOM 990 CD1 LEU A 62 -2.552 -13.731 -8.389 1.00 0.00 C ATOM 991 CD2 LEU A 62 -2.419 -15.923 -9.542 1.00 0.00 C ATOM 0 H LEU A 62 -0.548 -13.005 -11.778 1.00 0.00 H new ATOM 0 HA LEU A 62 -2.128 -15.290 -12.271 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -2.567 -12.682 -10.775 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.786 -13.941 -10.823 1.00 0.00 H new ATOM 0 HG LEU A 62 -0.974 -14.373 -9.770 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.102 -14.194 -7.511 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -2.271 -12.679 -8.429 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.637 -13.815 -8.328 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.929 -16.354 -8.669 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -3.499 -16.026 -9.439 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.088 -16.446 -10.439 1.00 0.00 H new ATOM 1003 N SER A 63 -3.386 -12.442 -13.466 1.00 0.00 N ATOM 1004 CA SER A 63 -3.975 -11.810 -14.655 1.00 0.00 C ATOM 1005 C SER A 63 -3.148 -12.137 -15.907 1.00 0.00 C ATOM 1006 O SER A 63 -2.125 -12.812 -15.817 1.00 0.00 O ATOM 1007 CB SER A 63 -4.074 -10.296 -14.443 1.00 0.00 C ATOM 1008 OG SER A 63 -2.794 -9.701 -14.399 1.00 0.00 O ATOM 0 H SER A 63 -3.138 -11.774 -12.736 1.00 0.00 H new ATOM 0 HA SER A 63 -4.979 -12.206 -14.807 1.00 0.00 H new ATOM 0 HB2 SER A 63 -4.657 -9.851 -15.249 1.00 0.00 H new ATOM 0 HB3 SER A 63 -4.606 -10.090 -13.514 1.00 0.00 H new ATOM 0 HG SER A 63 -2.230 -10.184 -13.759 1.00 0.00 H new ATOM 1014 N LYS A 64 -3.563 -11.708 -17.102 1.00 0.00 N ATOM 1015 CA LYS A 64 -2.800 -11.985 -18.330 1.00 0.00 C ATOM 1016 C LYS A 64 -2.232 -10.675 -18.868 1.00 0.00 C ATOM 1017 O LYS A 64 -2.749 -10.084 -19.814 1.00 0.00 O ATOM 1018 CB LYS A 64 -3.631 -12.837 -19.299 1.00 0.00 C ATOM 1019 CG LYS A 64 -4.008 -14.230 -18.734 1.00 0.00 C ATOM 1020 CD LYS A 64 -2.922 -15.328 -18.781 1.00 0.00 C ATOM 1021 CE LYS A 64 -1.770 -15.280 -17.757 1.00 0.00 C ATOM 1022 NZ LYS A 64 -2.206 -15.458 -16.349 1.00 0.00 N ATOM 0 H LYS A 64 -4.417 -11.170 -17.249 1.00 0.00 H new ATOM 0 HA LYS A 64 -1.927 -12.609 -18.140 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -4.544 -12.298 -19.552 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -3.071 -12.969 -20.225 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -4.314 -14.102 -17.696 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -4.879 -14.592 -19.281 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -3.421 -16.291 -18.671 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.479 -15.311 -19.777 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -1.046 -16.057 -18.003 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -1.255 -14.324 -17.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.374 -15.617 -15.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -2.707 -14.604 -16.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -2.843 -16.277 -16.284 1.00 0.00 H new ATOM 1036 N THR A 65 -1.178 -10.218 -18.182 1.00 0.00 N ATOM 1037 CA THR A 65 -0.761 -8.816 -18.138 1.00 0.00 C ATOM 1038 C THR A 65 0.758 -8.677 -18.295 1.00 0.00 C ATOM 1039 O THR A 65 1.520 -9.304 -17.563 1.00 0.00 O ATOM 1040 CB THR A 65 -1.200 -8.233 -16.787 1.00 0.00 C ATOM 1041 OG1 THR A 65 -2.589 -8.355 -16.566 1.00 0.00 O ATOM 1042 CG2 THR A 65 -0.862 -6.768 -16.570 1.00 0.00 C ATOM 0 H THR A 65 -0.578 -10.830 -17.629 1.00 0.00 H new ATOM 0 HA THR A 65 -1.225 -8.277 -18.964 1.00 0.00 H new ATOM 0 HB THR A 65 -0.625 -8.836 -16.085 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.750 -8.631 -15.640 1.00 0.00 H new ATOM 0 HG21 THR A 65 -1.214 -6.455 -15.587 1.00 0.00 H new ATOM 0 HG22 THR A 65 0.218 -6.631 -16.629 1.00 0.00 H new ATOM 0 HG23 THR A 65 -1.346 -6.165 -17.338 1.00 0.00 H new ATOM 1050 N LYS A 66 1.208 -7.818 -19.217 1.00 0.00 N ATOM 1051 CA LYS A 66 2.627 -7.466 -19.404 1.00 0.00 C ATOM 1052 C LYS A 66 3.087 -6.448 -18.339 1.00 0.00 C ATOM 1053 O LYS A 66 2.262 -5.723 -17.793 1.00 0.00 O ATOM 1054 CB LYS A 66 2.761 -6.924 -20.839 1.00 0.00 C ATOM 1055 CG LYS A 66 4.209 -6.678 -21.303 1.00 0.00 C ATOM 1056 CD LYS A 66 4.264 -6.306 -22.793 1.00 0.00 C ATOM 1057 CE LYS A 66 3.741 -4.885 -23.030 1.00 0.00 C ATOM 1058 NZ LYS A 66 3.398 -4.659 -24.448 1.00 0.00 N ATOM 0 H LYS A 66 0.587 -7.337 -19.868 1.00 0.00 H new ATOM 0 HA LYS A 66 3.275 -8.333 -19.275 1.00 0.00 H new ATOM 0 HB2 LYS A 66 2.289 -7.628 -21.524 1.00 0.00 H new ATOM 0 HB3 LYS A 66 2.207 -5.988 -20.912 1.00 0.00 H new ATOM 0 HG2 LYS A 66 4.652 -5.878 -20.710 1.00 0.00 H new ATOM 0 HG3 LYS A 66 4.806 -7.573 -21.127 1.00 0.00 H new ATOM 0 HD2 LYS A 66 5.290 -6.383 -23.152 1.00 0.00 H new ATOM 0 HD3 LYS A 66 3.671 -7.015 -23.370 1.00 0.00 H new ATOM 0 HE2 LYS A 66 2.861 -4.713 -22.411 1.00 0.00 H new ATOM 0 HE3 LYS A 66 4.496 -4.163 -22.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 2.954 -3.725 -24.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 4.263 -4.698 -25.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 2.736 -5.395 -24.767 1.00 0.00 H new ATOM 1072 N VAL A 67 4.391 -6.360 -18.056 1.00 0.00 N ATOM 1073 CA VAL A 67 4.966 -5.479 -17.018 1.00 0.00 C ATOM 1074 C VAL A 67 5.973 -4.497 -17.620 1.00 0.00 C ATOM 1075 O VAL A 67 6.760 -4.873 -18.487 1.00 0.00 O ATOM 1076 CB VAL A 67 5.662 -6.319 -15.922 1.00 0.00 C ATOM 1077 CG1 VAL A 67 6.109 -5.469 -14.724 1.00 0.00 C ATOM 1078 CG2 VAL A 67 4.749 -7.427 -15.386 1.00 0.00 C ATOM 0 H VAL A 67 5.096 -6.908 -18.549 1.00 0.00 H new ATOM 0 HA VAL A 67 4.146 -4.912 -16.577 1.00 0.00 H new ATOM 0 HB VAL A 67 6.536 -6.752 -16.410 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.591 -6.108 -13.984 1.00 0.00 H new ATOM 0 HG12 VAL A 67 6.813 -4.708 -15.060 1.00 0.00 H new ATOM 0 HG13 VAL A 67 5.240 -4.987 -14.276 1.00 0.00 H new ATOM 0 HG21 VAL A 67 5.276 -7.993 -14.618 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.851 -6.983 -14.957 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.469 -8.094 -16.201 1.00 0.00 H new ATOM 1088 N TYR A 68 5.996 -3.259 -17.111 1.00 0.00 N ATOM 1089 CA TYR A 68 7.039 -2.270 -17.379 1.00 0.00 C ATOM 1090 C TYR A 68 7.433 -1.471 -16.126 1.00 0.00 C ATOM 1091 O TYR A 68 6.637 -1.304 -15.198 1.00 0.00 O ATOM 1092 CB TYR A 68 6.534 -1.336 -18.476 1.00 0.00 C ATOM 1093 CG TYR A 68 7.616 -0.486 -19.104 1.00 0.00 C ATOM 1094 CD1 TYR A 68 8.549 -1.081 -19.973 1.00 0.00 C ATOM 1095 CD2 TYR A 68 7.701 0.890 -18.817 1.00 0.00 C ATOM 1096 CE1 TYR A 68 9.556 -0.303 -20.571 1.00 0.00 C ATOM 1097 CE2 TYR A 68 8.710 1.671 -19.406 1.00 0.00 C ATOM 1098 CZ TYR A 68 9.639 1.076 -20.289 1.00 0.00 C ATOM 1099 OH TYR A 68 10.607 1.820 -20.882 1.00 0.00 O ATOM 0 H TYR A 68 5.269 -2.912 -16.485 1.00 0.00 H new ATOM 0 HA TYR A 68 7.941 -2.791 -17.699 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.056 -1.931 -19.254 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.768 -0.682 -18.059 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.491 -2.139 -20.181 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.990 1.346 -18.144 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.265 -0.761 -21.245 1.00 0.00 H new ATOM 0 HE2 TYR A 68 8.775 2.726 -19.184 1.00 0.00 H new ATOM 0 HH TYR A 68 10.531 2.751 -20.586 1.00 0.00 H new ATOM 1109 N TYR A 69 8.653 -0.922 -16.131 1.00 0.00 N ATOM 1110 CA TYR A 69 9.294 -0.253 -14.997 1.00 0.00 C ATOM 1111 C TYR A 69 9.849 1.115 -15.405 1.00 0.00 C ATOM 1112 O TYR A 69 10.677 1.218 -16.308 1.00 0.00 O ATOM 1113 CB TYR A 69 10.397 -1.155 -14.429 1.00 0.00 C ATOM 1114 CG TYR A 69 9.848 -2.309 -13.619 1.00 0.00 C ATOM 1115 CD1 TYR A 69 9.403 -2.063 -12.308 1.00 0.00 C ATOM 1116 CD2 TYR A 69 9.738 -3.603 -14.171 1.00 0.00 C ATOM 1117 CE1 TYR A 69 8.846 -3.104 -11.551 1.00 0.00 C ATOM 1118 CE2 TYR A 69 9.178 -4.651 -13.415 1.00 0.00 C ATOM 1119 CZ TYR A 69 8.730 -4.399 -12.101 1.00 0.00 C ATOM 1120 OH TYR A 69 8.218 -5.402 -11.341 1.00 0.00 O ATOM 0 H TYR A 69 9.245 -0.933 -16.962 1.00 0.00 H new ATOM 0 HA TYR A 69 8.549 -0.077 -14.221 1.00 0.00 H new ATOM 0 HB2 TYR A 69 10.999 -1.546 -15.249 1.00 0.00 H new ATOM 0 HB3 TYR A 69 11.061 -0.560 -13.802 1.00 0.00 H new ATOM 0 HD1 TYR A 69 9.490 -1.073 -11.884 1.00 0.00 H new ATOM 0 HD2 TYR A 69 10.084 -3.790 -15.177 1.00 0.00 H new ATOM 0 HE1 TYR A 69 8.505 -2.914 -10.544 1.00 0.00 H new ATOM 0 HE2 TYR A 69 9.092 -5.641 -13.838 1.00 0.00 H new ATOM 0 HH TYR A 69 8.006 -6.169 -11.912 1.00 0.00 H new ATOM 1130 N PHE A 70 9.357 2.173 -14.751 1.00 0.00 N ATOM 1131 CA PHE A 70 9.563 3.553 -15.177 1.00 0.00 C ATOM 1132 C PHE A 70 9.686 4.513 -13.979 1.00 0.00 C ATOM 1133 O PHE A 70 9.174 5.626 -14.016 1.00 0.00 O ATOM 1134 CB PHE A 70 8.399 3.887 -16.126 1.00 0.00 C ATOM 1135 CG PHE A 70 8.476 5.138 -16.983 1.00 0.00 C ATOM 1136 CD1 PHE A 70 9.536 6.065 -16.921 1.00 0.00 C ATOM 1137 CD2 PHE A 70 7.434 5.343 -17.899 1.00 0.00 C ATOM 1138 CE1 PHE A 70 9.546 7.183 -17.775 1.00 0.00 C ATOM 1139 CE2 PHE A 70 7.449 6.449 -18.769 1.00 0.00 C ATOM 1140 CZ PHE A 70 8.508 7.370 -18.706 1.00 0.00 C ATOM 0 H PHE A 70 8.799 2.089 -13.902 1.00 0.00 H new ATOM 0 HA PHE A 70 10.510 3.675 -15.702 1.00 0.00 H new ATOM 0 HB2 PHE A 70 8.269 3.038 -16.797 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.494 3.958 -15.523 1.00 0.00 H new ATOM 0 HD1 PHE A 70 10.342 5.917 -16.217 1.00 0.00 H new ATOM 0 HD2 PHE A 70 6.611 4.645 -17.937 1.00 0.00 H new ATOM 0 HE1 PHE A 70 10.352 7.899 -17.716 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.650 6.589 -19.482 1.00 0.00 H new ATOM 0 HZ PHE A 70 8.525 8.220 -19.371 1.00 0.00 H new ATOM 1224 N LEU A 77 5.281 10.233 -16.263 1.00 0.00 N ATOM 1225 CA LEU A 77 4.143 9.345 -16.500 1.00 0.00 C ATOM 1226 C LEU A 77 2.893 9.866 -15.773 1.00 0.00 C ATOM 1227 O LEU A 77 1.797 9.791 -16.320 1.00 0.00 O ATOM 1228 CB LEU A 77 4.498 7.914 -16.077 1.00 0.00 C ATOM 1229 CG LEU A 77 3.478 6.884 -16.600 1.00 0.00 C ATOM 1230 CD1 LEU A 77 3.657 6.585 -18.093 1.00 0.00 C ATOM 1231 CD2 LEU A 77 3.658 5.584 -15.832 1.00 0.00 C ATOM 0 HA LEU A 77 3.914 9.330 -17.565 1.00 0.00 H new ATOM 0 HB2 LEU A 77 5.491 7.662 -16.450 1.00 0.00 H new ATOM 0 HB3 LEU A 77 4.543 7.859 -14.989 1.00 0.00 H new ATOM 0 HG LEU A 77 2.484 7.307 -16.457 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.913 5.854 -18.409 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.529 7.503 -18.666 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.656 6.185 -18.267 1.00 0.00 H new ATOM 0 HD21 LEU A 77 2.941 4.846 -16.193 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.671 5.210 -15.982 1.00 0.00 H new ATOM 0 HD23 LEU A 77 3.491 5.763 -14.770 1.00 0.00 H new ATOM 1243 N GLY A 78 3.064 10.515 -14.612 1.00 0.00 N ATOM 1244 CA GLY A 78 2.022 11.332 -13.978 1.00 0.00 C ATOM 1245 C GLY A 78 1.462 12.429 -14.895 1.00 0.00 C ATOM 1246 O GLY A 78 0.335 12.885 -14.709 1.00 0.00 O ATOM 0 H GLY A 78 3.936 10.487 -14.084 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.206 10.683 -13.660 1.00 0.00 H new ATOM 0 HA3 GLY A 78 2.430 11.794 -13.079 1.00 0.00 H new ATOM 1250 N THR A 79 2.222 12.843 -15.910 1.00 0.00 N ATOM 1251 CA THR A 79 1.819 13.837 -16.908 1.00 0.00 C ATOM 1252 C THR A 79 1.295 13.174 -18.191 1.00 0.00 C ATOM 1253 O THR A 79 0.456 13.766 -18.864 1.00 0.00 O ATOM 1254 CB THR A 79 2.982 14.815 -17.151 1.00 0.00 C ATOM 1255 OG1 THR A 79 3.378 15.352 -15.901 1.00 0.00 O ATOM 1256 CG2 THR A 79 2.597 16.000 -18.036 1.00 0.00 C ATOM 0 H THR A 79 3.164 12.485 -16.066 1.00 0.00 H new ATOM 0 HA THR A 79 0.977 14.416 -16.528 1.00 0.00 H new ATOM 0 HB THR A 79 3.771 14.253 -17.651 1.00 0.00 H new ATOM 0 HG1 THR A 79 4.121 15.977 -16.034 1.00 0.00 H new ATOM 0 HG21 THR A 79 3.461 16.651 -18.168 1.00 0.00 H new ATOM 0 HG22 THR A 79 2.265 15.635 -19.008 1.00 0.00 H new ATOM 0 HG23 THR A 79 1.790 16.560 -17.564 1.00 0.00 H new ATOM 1264 N ALA A 80 1.673 11.916 -18.473 1.00 0.00 N ATOM 1265 CA ALA A 80 1.026 11.072 -19.480 1.00 0.00 C ATOM 1266 C ALA A 80 -0.408 10.701 -19.071 1.00 0.00 C ATOM 1267 O ALA A 80 -1.335 10.844 -19.866 1.00 0.00 O ATOM 1268 CB ALA A 80 1.854 9.801 -19.704 1.00 0.00 C ATOM 0 H ALA A 80 2.449 11.454 -17.998 1.00 0.00 H new ATOM 0 HA ALA A 80 0.970 11.640 -20.409 1.00 0.00 H new ATOM 0 HB1 ALA A 80 1.368 9.177 -20.454 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.851 10.073 -20.049 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.932 9.248 -18.768 1.00 0.00 H new ATOM 1274 N VAL A 81 -0.596 10.233 -17.830 1.00 0.00 N ATOM 1275 CA VAL A 81 -1.933 9.979 -17.267 1.00 0.00 C ATOM 1276 C VAL A 81 -2.652 11.295 -16.941 1.00 0.00 C ATOM 1277 O VAL A 81 -3.877 11.363 -17.026 1.00 0.00 O ATOM 1278 CB VAL A 81 -1.888 9.031 -16.050 1.00 0.00 C ATOM 1279 CG1 VAL A 81 -1.030 7.790 -16.340 1.00 0.00 C ATOM 1280 CG2 VAL A 81 -1.372 9.696 -14.770 1.00 0.00 C ATOM 0 H VAL A 81 0.169 10.020 -17.189 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.513 9.464 -18.033 1.00 0.00 H new ATOM 0 HB VAL A 81 -2.925 8.743 -15.880 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -1.019 7.143 -15.463 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -1.450 7.247 -17.187 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -0.012 8.099 -16.576 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -1.369 8.969 -13.958 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.358 10.062 -14.933 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.021 10.531 -14.507 1.00 0.00 H new ATOM 1405 N VAL A 89 2.298 4.239 -10.553 1.00 0.00 N ATOM 1406 CA VAL A 89 1.791 2.903 -10.885 1.00 0.00 C ATOM 1407 C VAL A 89 0.476 3.032 -11.663 1.00 0.00 C ATOM 1408 O VAL A 89 -0.504 3.616 -11.193 1.00 0.00 O ATOM 1409 CB VAL A 89 1.719 1.964 -9.670 1.00 0.00 C ATOM 1410 CG1 VAL A 89 0.657 2.326 -8.632 1.00 0.00 C ATOM 1411 CG2 VAL A 89 1.494 0.530 -10.148 1.00 0.00 C ATOM 0 HA VAL A 89 2.509 2.409 -11.540 1.00 0.00 H new ATOM 0 HB VAL A 89 2.676 2.073 -9.160 1.00 0.00 H new ATOM 0 HG11 VAL A 89 0.686 1.605 -7.815 1.00 0.00 H new ATOM 0 HG12 VAL A 89 0.855 3.324 -8.242 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -0.328 2.307 -9.098 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.443 -0.137 -9.287 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.559 0.475 -10.706 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.319 0.228 -10.793 1.00 0.00 H new ATOM 1421 N VAL A 90 0.496 2.506 -12.888 1.00 0.00 N ATOM 1422 CA VAL A 90 -0.583 2.565 -13.879 1.00 0.00 C ATOM 1423 C VAL A 90 -0.867 1.143 -14.346 1.00 0.00 C ATOM 1424 O VAL A 90 -0.009 0.255 -14.284 1.00 0.00 O ATOM 1425 CB VAL A 90 -0.181 3.449 -15.090 1.00 0.00 C ATOM 1426 CG1 VAL A 90 -1.328 3.680 -16.090 1.00 0.00 C ATOM 1427 CG2 VAL A 90 0.376 4.810 -14.655 1.00 0.00 C ATOM 0 H VAL A 90 1.310 1.999 -13.236 1.00 0.00 H new ATOM 0 HA VAL A 90 -1.471 3.009 -13.428 1.00 0.00 H new ATOM 0 HB VAL A 90 0.599 2.879 -15.594 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.975 4.306 -16.910 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -1.666 2.721 -16.484 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.156 4.177 -15.585 1.00 0.00 H new ATOM 0 HG21 VAL A 90 0.643 5.392 -15.537 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.380 5.346 -14.081 1.00 0.00 H new ATOM 0 HG23 VAL A 90 1.261 4.660 -14.037 1.00 0.00 H new ATOM 1437 N SER A 91 -2.060 0.877 -14.865 1.00 0.00 N ATOM 1438 CA SER A 91 -2.264 -0.304 -15.699 1.00 0.00 C ATOM 1439 C SER A 91 -3.301 -0.019 -16.777 1.00 0.00 C ATOM 1440 O SER A 91 -4.208 0.785 -16.572 1.00 0.00 O ATOM 1441 CB SER A 91 -2.655 -1.500 -14.829 1.00 0.00 C ATOM 1442 OG SER A 91 -1.760 -1.626 -13.736 1.00 0.00 O ATOM 0 H SER A 91 -2.890 1.453 -14.727 1.00 0.00 H new ATOM 0 HA SER A 91 -1.331 -0.555 -16.205 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.673 -1.374 -14.461 1.00 0.00 H new ATOM 0 HB3 SER A 91 -2.642 -2.412 -15.426 1.00 0.00 H new ATOM 0 HG SER A 91 -0.901 -1.215 -13.968 1.00 0.00 H new ATOM 1448 N ILE A 92 -3.161 -0.692 -17.918 1.00 0.00 N ATOM 1449 CA ILE A 92 -4.047 -0.621 -19.075 1.00 0.00 C ATOM 1450 C ILE A 92 -4.732 -1.984 -19.225 1.00 0.00 C ATOM 1451 O ILE A 92 -4.092 -3.044 -19.182 1.00 0.00 O ATOM 1452 CB ILE A 92 -3.283 -0.209 -20.356 1.00 0.00 C ATOM 1453 CG1 ILE A 92 -2.344 1.013 -20.193 1.00 0.00 C ATOM 1454 CG2 ILE A 92 -4.287 0.057 -21.495 1.00 0.00 C ATOM 1455 CD1 ILE A 92 -3.025 2.323 -19.790 1.00 0.00 C ATOM 0 H ILE A 92 -2.384 -1.336 -18.066 1.00 0.00 H new ATOM 0 HA ILE A 92 -4.800 0.152 -18.922 1.00 0.00 H new ATOM 0 HB ILE A 92 -2.631 -1.050 -20.591 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -1.590 0.771 -19.444 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -1.818 1.173 -21.135 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.747 0.347 -22.396 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -4.862 -0.848 -21.692 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -4.964 0.860 -21.203 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -2.277 3.111 -19.704 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -3.758 2.600 -20.548 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -3.526 2.193 -18.831 1.00 0.00 H new ATOM 1467 N LEU A 93 -6.055 -1.934 -19.382 1.00 0.00 N ATOM 1468 CA LEU A 93 -6.920 -3.072 -19.634 1.00 0.00 C ATOM 1469 C LEU A 93 -7.097 -3.249 -21.146 1.00 0.00 C ATOM 1470 O LEU A 93 -6.792 -4.321 -21.667 1.00 0.00 O ATOM 1471 CB LEU A 93 -8.265 -2.893 -18.901 1.00 0.00 C ATOM 1472 CG LEU A 93 -8.172 -2.797 -17.357 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -7.920 -1.375 -16.835 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -9.483 -3.289 -16.736 1.00 0.00 C ATOM 0 H LEU A 93 -6.570 -1.055 -19.334 1.00 0.00 H new ATOM 0 HA LEU A 93 -6.466 -3.982 -19.242 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.747 -1.990 -19.276 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.914 -3.730 -19.158 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.319 -3.413 -17.072 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.868 -1.391 -15.746 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.979 -1.001 -17.238 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -8.734 -0.722 -17.150 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -9.419 -3.222 -15.650 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.308 -2.670 -17.090 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -9.657 -4.325 -17.026 1.00 0.00 H new ATOM 1486 N GLU A 94 -7.525 -2.200 -21.859 1.00 0.00 N ATOM 1487 CA GLU A 94 -7.697 -2.194 -23.315 1.00 0.00 C ATOM 1488 C GLU A 94 -7.096 -0.922 -23.933 1.00 0.00 C ATOM 1489 O GLU A 94 -7.477 0.204 -23.591 1.00 0.00 O ATOM 1490 CB GLU A 94 -9.178 -2.349 -23.712 1.00 0.00 C ATOM 1491 CG GLU A 94 -9.660 -3.811 -23.786 1.00 0.00 C ATOM 1492 CD GLU A 94 -9.799 -4.520 -22.434 1.00 0.00 C ATOM 1493 OE1 GLU A 94 -10.217 -3.877 -21.442 1.00 0.00 O ATOM 1494 OE2 GLU A 94 -9.528 -5.748 -22.353 1.00 0.00 O ATOM 0 H GLU A 94 -7.767 -1.309 -21.427 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.158 -3.055 -23.712 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.794 -1.811 -22.992 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.334 -1.877 -24.682 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.626 -3.834 -24.291 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -8.963 -4.376 -24.405 1.00 0.00 H new ATOM 1501 N ALA A 95 -6.146 -1.117 -24.857 1.00 0.00 N ATOM 1502 CA ALA A 95 -5.449 -0.053 -25.571 1.00 0.00 C ATOM 1503 C ALA A 95 -6.305 0.513 -26.714 1.00 0.00 C ATOM 1504 O ALA A 95 -6.050 0.259 -27.888 1.00 0.00 O ATOM 1505 CB ALA A 95 -4.085 -0.543 -26.065 1.00 0.00 C ATOM 0 H ALA A 95 -5.836 -2.049 -25.132 1.00 0.00 H new ATOM 0 HA ALA A 95 -5.275 0.768 -24.875 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -3.579 0.264 -26.595 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -3.480 -0.853 -25.213 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.224 -1.389 -26.738 1.00 0.00 H new ATOM 1511 N GLY A 96 -7.314 1.315 -26.364 1.00 0.00 N ATOM 1512 CA GLY A 96 -8.239 1.970 -27.297 1.00 0.00 C ATOM 1513 C GLY A 96 -7.635 3.091 -28.156 1.00 0.00 C ATOM 1514 O GLY A 96 -8.300 4.104 -28.361 1.00 0.00 O ATOM 0 H GLY A 96 -7.518 1.535 -25.389 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -8.654 1.212 -27.961 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -9.071 2.383 -26.726 1.00 0.00 H new ATOM 1518 N ASP A 97 -6.398 2.926 -28.640 1.00 0.00 N ATOM 1519 CA ASP A 97 -5.798 3.688 -29.741 1.00 0.00 C ATOM 1520 C ASP A 97 -4.701 2.839 -30.419 1.00 0.00 C ATOM 1521 O ASP A 97 -5.004 2.075 -31.332 1.00 0.00 O ATOM 1522 CB ASP A 97 -5.295 5.063 -29.256 1.00 0.00 C ATOM 1523 CG ASP A 97 -4.944 5.993 -30.424 1.00 0.00 C ATOM 1524 OD1 ASP A 97 -4.087 5.605 -31.243 1.00 0.00 O ATOM 1525 OD2 ASP A 97 -5.528 7.099 -30.465 1.00 0.00 O ATOM 0 H ASP A 97 -5.761 2.227 -28.258 1.00 0.00 H new ATOM 0 HA ASP A 97 -6.555 3.902 -30.496 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -6.061 5.531 -28.638 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -4.416 4.926 -28.626 1.00 0.00 H new ATOM 1530 N SER A 98 -3.446 2.936 -29.952 1.00 0.00 N ATOM 1531 CA SER A 98 -2.292 2.205 -30.482 1.00 0.00 C ATOM 1532 C SER A 98 -1.833 1.083 -29.541 1.00 0.00 C ATOM 1533 O SER A 98 -2.093 1.093 -28.342 1.00 0.00 O ATOM 1534 CB SER A 98 -1.172 3.195 -30.802 1.00 0.00 C ATOM 1535 OG SER A 98 -0.172 2.569 -31.579 1.00 0.00 O ATOM 0 H SER A 98 -3.203 3.545 -29.171 1.00 0.00 H new ATOM 0 HA SER A 98 -2.586 1.704 -31.405 1.00 0.00 H new ATOM 0 HB2 SER A 98 -1.577 4.052 -31.340 1.00 0.00 H new ATOM 0 HB3 SER A 98 -0.739 3.576 -29.877 1.00 0.00 H new ATOM 0 HG SER A 98 0.454 3.245 -31.912 1.00 0.00 H new ATOM 1541 N ASP A 99 -1.118 0.099 -30.083 1.00 0.00 N ATOM 1542 CA ASP A 99 -1.032 -1.286 -29.608 1.00 0.00 C ATOM 1543 C ASP A 99 -0.118 -1.535 -28.385 1.00 0.00 C ATOM 1544 O ASP A 99 0.498 -2.595 -28.289 1.00 0.00 O ATOM 1545 CB ASP A 99 -0.651 -2.156 -30.822 1.00 0.00 C ATOM 1546 CG ASP A 99 0.811 -2.004 -31.256 1.00 0.00 C ATOM 1547 OD1 ASP A 99 1.291 -0.848 -31.342 1.00 0.00 O ATOM 1548 OD2 ASP A 99 1.459 -3.051 -31.480 1.00 0.00 O ATOM 0 H ASP A 99 -0.548 0.253 -30.915 1.00 0.00 H new ATOM 0 HA ASP A 99 -2.008 -1.560 -29.206 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -0.842 -3.202 -30.582 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -1.298 -1.897 -31.660 1.00 0.00 H new ATOM 1553 N ILE A 100 -0.023 -0.593 -27.434 1.00 0.00 N ATOM 1554 CA ILE A 100 0.994 -0.563 -26.363 1.00 0.00 C ATOM 1555 C ILE A 100 1.115 -1.859 -25.533 1.00 0.00 C ATOM 1556 O ILE A 100 2.211 -2.264 -25.133 1.00 0.00 O ATOM 1557 CB ILE A 100 0.792 0.687 -25.476 1.00 0.00 C ATOM 1558 CG1 ILE A 100 2.127 1.072 -24.814 1.00 0.00 C ATOM 1559 CG2 ILE A 100 -0.285 0.492 -24.395 1.00 0.00 C ATOM 1560 CD1 ILE A 100 2.086 2.451 -24.156 1.00 0.00 C ATOM 0 H ILE A 100 -0.670 0.194 -27.385 1.00 0.00 H new ATOM 0 HA ILE A 100 1.959 -0.496 -26.866 1.00 0.00 H new ATOM 0 HB ILE A 100 0.444 1.487 -26.129 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.384 0.324 -24.064 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.917 1.056 -25.564 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -0.379 1.404 -23.806 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -1.240 0.266 -24.869 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -0.000 -0.333 -23.742 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.055 2.668 -23.706 1.00 0.00 H new ATOM 0 HD12 ILE A 100 1.858 3.206 -24.908 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.316 2.463 -23.384 1.00 0.00 H new ATOM 1572 N LEU A 101 -0.012 -2.542 -25.295 1.00 0.00 N ATOM 1573 CA LEU A 101 -0.086 -3.874 -24.686 1.00 0.00 C ATOM 1574 C LEU A 101 0.533 -5.035 -25.480 1.00 0.00 C ATOM 1575 O LEU A 101 0.964 -5.993 -24.838 1.00 0.00 O ATOM 1576 CB LEU A 101 -1.442 -4.170 -24.004 1.00 0.00 C ATOM 1577 CG LEU A 101 -2.700 -3.430 -24.512 1.00 0.00 C ATOM 1578 CD1 LEU A 101 -3.915 -4.294 -24.832 1.00 0.00 C ATOM 1579 CD2 LEU A 101 -3.106 -2.473 -23.382 1.00 0.00 C ATOM 0 H LEU A 101 -0.931 -2.167 -25.530 1.00 0.00 H new ATOM 0 HA LEU A 101 0.625 -3.809 -23.862 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.630 -5.240 -24.090 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.334 -3.950 -22.942 1.00 0.00 H new ATOM 0 HG LEU A 101 -2.426 -2.963 -25.458 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.731 -3.660 -25.178 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -3.657 -5.011 -25.611 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.227 -4.830 -23.935 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.995 -1.916 -23.679 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.321 -3.046 -22.480 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -2.291 -1.777 -23.184 1.00 0.00 H new