USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 893 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 118 CYS SG : rot -20:sc= 0.997 USER MOD Set 1.2: A 119 GLN : amide:sc= -5.5! C(o=-4.5!,f=-8.6!) USER MOD Set 2.1: A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 108 THR OG1 : rot -43:sc= -0.0115 USER MOD Set 3.1: A 98 THR OG1 : rot -170:sc= 0.473 USER MOD Set 3.2: A 111 LYS NZ :NH3+ -124:sc= 0.495 (180deg=-0.00818) USER MOD Set 4.1: A 39 SER OG : rot -132:sc= 0.513 USER MOD Set 4.2: A 53 CYS SG : rot 56:sc= -1.02 USER MOD Set 4.3: A 75 TYR OH : rot 165:sc= 0.681 USER MOD Single : A 10 THR OG1 : rot 35:sc= 0.162 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -128:sc= -1.43 (180deg=-4.1!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 HIS : no HD1:sc= -3.86! K(o=-3.9!,f=-1.8) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= -0.0956 USER MOD Single : A 41 SER OG : rot -90:sc= 0.285 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot -134:sc= -4.13! USER MOD Single : A 65 LYS NZ :NH3+ -150:sc= -0.0655 (180deg=-0.389) USER MOD Single : A 66 HIS : no HD1:sc= -2.3 K(o=-2.3,f=-0.51) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 CYS SG : rot 159:sc= 0.393 USER MOD Single : A 76 CYS SG : rot 86:sc= 0.156 USER MOD Single : A 77 GLN : amide:sc= 0.0207 K(o=0.021,f=-0.79) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= -2.85! C(o=-2.8!,f=-3.9!) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -24:sc= -1.48! USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 CYS SG : rot 58:sc= -0.98 USER MOD Single : A 120 SER OG : rot 180:sc= 0.013 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -168:sc= 0 (180deg=-0.0929) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 102 N THR A 10 0.071 4.595 6.717 1.00 0.00 N ATOM 103 CA THR A 10 -0.573 3.679 7.650 1.00 0.00 C ATOM 104 C THR A 10 -0.694 2.282 7.053 1.00 0.00 C ATOM 105 O THR A 10 -1.266 2.102 5.978 1.00 0.00 O ATOM 106 CB THR A 10 -1.975 4.178 8.049 1.00 0.00 C ATOM 107 OG1 THR A 10 -2.747 4.461 6.876 1.00 0.00 O ATOM 108 CG2 THR A 10 -1.880 5.427 8.912 1.00 0.00 C ATOM 0 HA THR A 10 0.057 3.638 8.539 1.00 0.00 H new ATOM 0 HB THR A 10 -2.465 3.393 8.626 1.00 0.00 H new ATOM 0 HG1 THR A 10 -2.515 3.822 6.170 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.882 5.760 9.181 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.317 5.201 9.818 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.372 6.215 8.356 1.00 0.00 H new ATOM 116 N PHE A 11 -0.153 1.294 7.759 1.00 0.00 N ATOM 117 CA PHE A 11 -0.200 -0.089 7.298 1.00 0.00 C ATOM 118 C PHE A 11 -0.861 -0.987 8.340 1.00 0.00 C ATOM 119 O PHE A 11 -0.624 -0.841 9.539 1.00 0.00 O ATOM 120 CB PHE A 11 1.211 -0.595 6.992 1.00 0.00 C ATOM 121 CG PHE A 11 1.921 -1.153 8.193 1.00 0.00 C ATOM 122 CD1 PHE A 11 1.759 -2.480 8.556 1.00 0.00 C ATOM 123 CD2 PHE A 11 2.750 -0.349 8.959 1.00 0.00 C ATOM 124 CE1 PHE A 11 2.411 -2.996 9.660 1.00 0.00 C ATOM 125 CE2 PHE A 11 3.405 -0.860 10.064 1.00 0.00 C ATOM 126 CZ PHE A 11 3.234 -2.185 10.415 1.00 0.00 C ATOM 0 H PHE A 11 0.323 1.425 8.652 1.00 0.00 H new ATOM 0 HA PHE A 11 -0.795 -0.122 6.386 1.00 0.00 H new ATOM 0 HB2 PHE A 11 1.153 -1.366 6.223 1.00 0.00 H new ATOM 0 HB3 PHE A 11 1.800 0.224 6.579 1.00 0.00 H new ATOM 0 HD1 PHE A 11 1.116 -3.119 7.969 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.886 0.688 8.690 1.00 0.00 H new ATOM 0 HE1 PHE A 11 2.277 -4.033 9.932 1.00 0.00 H new ATOM 0 HE2 PHE A 11 4.050 -0.224 10.652 1.00 0.00 H new ATOM 0 HZ PHE A 11 3.743 -2.586 11.279 1.00 0.00 H new ATOM 136 N GLU A 12 -1.689 -1.915 7.873 1.00 0.00 N ATOM 137 CA GLU A 12 -2.385 -2.836 8.765 1.00 0.00 C ATOM 138 C GLU A 12 -2.251 -4.275 8.274 1.00 0.00 C ATOM 139 O GLU A 12 -2.478 -4.563 7.100 1.00 0.00 O ATOM 140 CB GLU A 12 -3.864 -2.458 8.873 1.00 0.00 C ATOM 141 CG GLU A 12 -4.653 -3.350 9.816 1.00 0.00 C ATOM 142 CD GLU A 12 -4.318 -3.099 11.273 1.00 0.00 C ATOM 143 OE1 GLU A 12 -3.123 -3.170 11.629 1.00 0.00 O ATOM 144 OE2 GLU A 12 -5.252 -2.831 12.058 1.00 0.00 O ATOM 0 H GLU A 12 -1.895 -2.050 6.883 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.926 -2.762 9.751 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.942 -1.425 9.213 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.315 -2.503 7.882 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -5.719 -3.186 9.659 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.452 -4.394 9.576 1.00 0.00 H new ATOM 151 N GLU A 13 -1.880 -5.172 9.182 1.00 0.00 N ATOM 152 CA GLU A 13 -1.715 -6.580 8.841 1.00 0.00 C ATOM 153 C GLU A 13 -3.000 -7.359 9.107 1.00 0.00 C ATOM 154 O GLU A 13 -3.492 -7.399 10.235 1.00 0.00 O ATOM 155 CB GLU A 13 -0.561 -7.189 9.641 1.00 0.00 C ATOM 156 CG GLU A 13 -0.017 -8.475 9.041 1.00 0.00 C ATOM 157 CD GLU A 13 -1.108 -9.482 8.732 1.00 0.00 C ATOM 158 OE1 GLU A 13 -1.729 -9.996 9.685 1.00 0.00 O ATOM 159 OE2 GLU A 13 -1.341 -9.754 7.536 1.00 0.00 O ATOM 0 H GLU A 13 -1.688 -4.949 10.159 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.485 -6.645 7.778 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.247 -6.460 9.710 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.900 -7.387 10.658 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.527 -8.243 8.126 1.00 0.00 H new ATOM 0 HG3 GLU A 13 0.698 -8.920 9.733 1.00 0.00 H new ATOM 166 N VAL A 14 -3.538 -7.976 8.060 1.00 0.00 N ATOM 167 CA VAL A 14 -4.765 -8.754 8.179 1.00 0.00 C ATOM 168 C VAL A 14 -4.541 -10.201 7.755 1.00 0.00 C ATOM 169 O VAL A 14 -4.297 -10.484 6.582 1.00 0.00 O ATOM 170 CB VAL A 14 -5.898 -8.150 7.328 1.00 0.00 C ATOM 171 CG1 VAL A 14 -7.155 -9.000 7.432 1.00 0.00 C ATOM 172 CG2 VAL A 14 -6.177 -6.717 7.754 1.00 0.00 C ATOM 0 H VAL A 14 -3.143 -7.952 7.120 1.00 0.00 H new ATOM 0 HA VAL A 14 -5.056 -8.727 9.229 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.580 -8.140 6.285 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.945 -8.558 6.824 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.943 -10.008 7.075 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.479 -9.044 8.472 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.980 -6.305 7.143 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.474 -6.700 8.803 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -5.277 -6.117 7.623 1.00 0.00 H new ATOM 182 N SER A 15 -4.628 -11.115 8.717 1.00 0.00 N ATOM 183 CA SER A 15 -4.431 -12.534 8.443 1.00 0.00 C ATOM 184 C SER A 15 -5.760 -13.216 8.133 1.00 0.00 C ATOM 185 O SER A 15 -6.691 -13.183 8.937 1.00 0.00 O ATOM 186 CB SER A 15 -3.761 -13.217 9.637 1.00 0.00 C ATOM 187 OG SER A 15 -3.731 -14.623 9.469 1.00 0.00 O ATOM 0 H SER A 15 -4.833 -10.898 9.692 1.00 0.00 H new ATOM 0 HA SER A 15 -3.783 -12.625 7.571 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.745 -12.840 9.753 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.299 -12.968 10.551 1.00 0.00 H new ATOM 0 HG SER A 15 -3.297 -15.036 10.244 1.00 0.00 H new ATOM 193 N VAL A 16 -5.841 -13.835 6.959 1.00 0.00 N ATOM 194 CA VAL A 16 -7.054 -14.526 6.541 1.00 0.00 C ATOM 195 C VAL A 16 -6.724 -15.835 5.832 1.00 0.00 C ATOM 196 O VAL A 16 -5.606 -16.031 5.355 1.00 0.00 O ATOM 197 CB VAL A 16 -7.906 -13.649 5.604 1.00 0.00 C ATOM 198 CG1 VAL A 16 -8.559 -12.516 6.381 1.00 0.00 C ATOM 199 CG2 VAL A 16 -7.056 -13.105 4.466 1.00 0.00 C ATOM 0 H VAL A 16 -5.080 -13.872 6.281 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.624 -14.739 7.445 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.696 -14.266 5.175 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -9.157 -11.907 5.703 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.201 -12.931 7.158 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.788 -11.897 6.840 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.674 -12.488 3.814 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -6.244 -12.503 4.874 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.640 -13.934 3.894 1.00 0.00 H new ATOM 209 N LEU A 17 -7.704 -16.730 5.768 1.00 0.00 N ATOM 210 CA LEU A 17 -7.519 -18.022 5.116 1.00 0.00 C ATOM 211 C LEU A 17 -8.624 -18.281 4.097 1.00 0.00 C ATOM 212 O LEU A 17 -9.797 -18.392 4.452 1.00 0.00 O ATOM 213 CB LEU A 17 -7.497 -19.142 6.158 1.00 0.00 C ATOM 214 CG LEU A 17 -6.649 -20.366 5.810 1.00 0.00 C ATOM 215 CD1 LEU A 17 -6.434 -21.233 7.041 1.00 0.00 C ATOM 216 CD2 LEU A 17 -7.305 -21.169 4.697 1.00 0.00 C ATOM 0 H LEU A 17 -8.635 -16.585 6.160 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.564 -18.003 4.591 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -7.133 -18.729 7.099 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.522 -19.472 6.329 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.676 -20.023 5.458 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.829 -22.099 6.775 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.921 -20.654 7.809 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.398 -21.568 7.423 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.688 -22.036 4.462 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.291 -21.502 5.021 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.407 -20.545 3.809 1.00 0.00 H new ATOM 228 N GLY A 18 -8.240 -18.379 2.828 1.00 0.00 N ATOM 229 CA GLY A 18 -9.210 -18.627 1.777 1.00 0.00 C ATOM 230 C GLY A 18 -9.606 -17.361 1.043 1.00 0.00 C ATOM 231 O GLY A 18 -9.125 -16.274 1.362 1.00 0.00 O ATOM 0 H GLY A 18 -7.275 -18.291 2.509 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.796 -19.341 1.066 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.099 -19.086 2.209 1.00 0.00 H new ATOM 235 N PHE A 19 -10.485 -17.502 0.056 1.00 0.00 N ATOM 236 CA PHE A 19 -10.943 -16.361 -0.727 1.00 0.00 C ATOM 237 C PHE A 19 -12.059 -15.616 -0.001 1.00 0.00 C ATOM 238 O PHE A 19 -12.016 -14.394 0.136 1.00 0.00 O ATOM 239 CB PHE A 19 -11.434 -16.822 -2.101 1.00 0.00 C ATOM 240 CG PHE A 19 -11.535 -15.710 -3.106 1.00 0.00 C ATOM 241 CD1 PHE A 19 -12.401 -14.649 -2.900 1.00 0.00 C ATOM 242 CD2 PHE A 19 -10.763 -15.726 -4.257 1.00 0.00 C ATOM 243 CE1 PHE A 19 -12.497 -13.625 -3.823 1.00 0.00 C ATOM 244 CE2 PHE A 19 -10.854 -14.705 -5.184 1.00 0.00 C ATOM 245 CZ PHE A 19 -11.721 -13.652 -4.966 1.00 0.00 C ATOM 0 H PHE A 19 -10.894 -18.395 -0.220 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.101 -15.681 -0.858 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.756 -17.585 -2.483 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.412 -17.291 -1.990 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.008 -14.622 -2.007 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -10.082 -16.546 -4.432 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -13.178 -12.804 -3.651 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -10.248 -14.730 -6.078 1.00 0.00 H new ATOM 0 HZ PHE A 19 -11.792 -12.851 -5.687 1.00 0.00 H new ATOM 255 N GLU A 20 -13.057 -16.362 0.462 1.00 0.00 N ATOM 256 CA GLU A 20 -14.185 -15.772 1.174 1.00 0.00 C ATOM 257 C GLU A 20 -13.708 -14.734 2.185 1.00 0.00 C ATOM 258 O GLU A 20 -14.060 -13.559 2.096 1.00 0.00 O ATOM 259 CB GLU A 20 -14.994 -16.859 1.885 1.00 0.00 C ATOM 260 CG GLU A 20 -15.703 -17.810 0.935 1.00 0.00 C ATOM 261 CD GLU A 20 -16.769 -17.119 0.106 1.00 0.00 C ATOM 262 OE1 GLU A 20 -17.858 -16.844 0.652 1.00 0.00 O ATOM 263 OE2 GLU A 20 -16.515 -16.854 -1.087 1.00 0.00 O ATOM 0 H GLU A 20 -13.108 -17.375 0.357 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.823 -15.275 0.443 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.328 -17.432 2.530 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.734 -16.386 2.531 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.970 -18.267 0.270 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -16.160 -18.617 1.508 1.00 0.00 H new ATOM 270 N GLU A 21 -12.905 -15.179 3.147 1.00 0.00 N ATOM 271 CA GLU A 21 -12.380 -14.289 4.176 1.00 0.00 C ATOM 272 C GLU A 21 -11.597 -13.138 3.552 1.00 0.00 C ATOM 273 O GLU A 21 -11.765 -11.979 3.935 1.00 0.00 O ATOM 274 CB GLU A 21 -11.483 -15.065 5.143 1.00 0.00 C ATOM 275 CG GLU A 21 -12.242 -15.717 6.287 1.00 0.00 C ATOM 276 CD GLU A 21 -12.546 -14.748 7.413 1.00 0.00 C ATOM 277 OE1 GLU A 21 -11.703 -14.615 8.324 1.00 0.00 O ATOM 278 OE2 GLU A 21 -13.627 -14.122 7.383 1.00 0.00 O ATOM 0 H GLU A 21 -12.604 -16.150 3.235 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.224 -13.875 4.727 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.946 -15.835 4.589 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.735 -14.388 5.554 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -13.176 -16.132 5.908 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -11.658 -16.550 6.678 1.00 0.00 H new ATOM 285 N PHE A 22 -10.741 -13.464 2.590 1.00 0.00 N ATOM 286 CA PHE A 22 -9.931 -12.458 1.913 1.00 0.00 C ATOM 287 C PHE A 22 -10.802 -11.318 1.393 1.00 0.00 C ATOM 288 O PHE A 22 -10.595 -10.156 1.741 1.00 0.00 O ATOM 289 CB PHE A 22 -9.155 -13.091 0.756 1.00 0.00 C ATOM 290 CG PHE A 22 -8.691 -12.097 -0.269 1.00 0.00 C ATOM 291 CD1 PHE A 22 -8.083 -10.914 0.119 1.00 0.00 C ATOM 292 CD2 PHE A 22 -8.862 -12.346 -1.622 1.00 0.00 C ATOM 293 CE1 PHE A 22 -7.656 -9.997 -0.823 1.00 0.00 C ATOM 294 CE2 PHE A 22 -8.436 -11.433 -2.568 1.00 0.00 C ATOM 295 CZ PHE A 22 -7.832 -10.257 -2.168 1.00 0.00 C ATOM 0 H PHE A 22 -10.590 -14.418 2.261 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.224 -12.051 2.636 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -8.290 -13.620 1.156 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -9.786 -13.835 0.270 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -7.941 -10.706 1.169 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.334 -13.264 -1.940 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.185 -9.078 -0.507 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -8.575 -11.639 -3.619 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.498 -9.542 -2.905 1.00 0.00 H new ATOM 305 N ASP A 23 -11.776 -11.660 0.557 1.00 0.00 N ATOM 306 CA ASP A 23 -12.679 -10.667 -0.012 1.00 0.00 C ATOM 307 C ASP A 23 -13.211 -9.733 1.071 1.00 0.00 C ATOM 308 O ASP A 23 -13.024 -8.518 1.005 1.00 0.00 O ATOM 309 CB ASP A 23 -13.843 -11.355 -0.727 1.00 0.00 C ATOM 310 CG ASP A 23 -14.850 -10.365 -1.279 1.00 0.00 C ATOM 311 OD1 ASP A 23 -14.500 -9.629 -2.226 1.00 0.00 O ATOM 312 OD2 ASP A 23 -15.987 -10.327 -0.766 1.00 0.00 O ATOM 0 H ASP A 23 -11.960 -12.618 0.258 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.119 -10.074 -0.735 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.455 -11.966 -1.542 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.344 -12.030 -0.033 1.00 0.00 H new ATOM 317 N LYS A 24 -13.876 -10.308 2.066 1.00 0.00 N ATOM 318 CA LYS A 24 -14.436 -9.529 3.164 1.00 0.00 C ATOM 319 C LYS A 24 -13.444 -8.474 3.643 1.00 0.00 C ATOM 320 O LYS A 24 -13.814 -7.326 3.888 1.00 0.00 O ATOM 321 CB LYS A 24 -14.820 -10.448 4.326 1.00 0.00 C ATOM 322 CG LYS A 24 -15.989 -9.934 5.147 1.00 0.00 C ATOM 323 CD LYS A 24 -17.316 -10.437 4.603 1.00 0.00 C ATOM 324 CE LYS A 24 -17.802 -9.583 3.442 1.00 0.00 C ATOM 325 NZ LYS A 24 -17.293 -10.083 2.135 1.00 0.00 N ATOM 0 H LYS A 24 -14.041 -11.312 2.135 1.00 0.00 H new ATOM 0 HA LYS A 24 -15.330 -9.024 2.799 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.069 -11.433 3.932 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -13.956 -10.575 4.979 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.875 -10.253 6.183 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.984 -8.844 5.146 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.208 -11.471 4.275 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -18.062 -10.431 5.398 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.892 -9.575 3.428 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.477 -8.553 3.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -16.841 -9.303 1.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -16.597 -10.838 2.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -18.085 -10.458 1.575 1.00 0.00 H new ATOM 339 N ALA A 25 -12.182 -8.870 3.773 1.00 0.00 N ATOM 340 CA ALA A 25 -11.137 -7.957 4.219 1.00 0.00 C ATOM 341 C ALA A 25 -10.917 -6.838 3.208 1.00 0.00 C ATOM 342 O ALA A 25 -10.645 -5.696 3.579 1.00 0.00 O ATOM 343 CB ALA A 25 -9.840 -8.717 4.460 1.00 0.00 C ATOM 0 H ALA A 25 -11.859 -9.817 3.576 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.460 -7.505 5.157 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.068 -8.023 4.793 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.000 -9.476 5.226 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.522 -9.197 3.534 1.00 0.00 H new ATOM 349 N VAL A 26 -11.036 -7.173 1.927 1.00 0.00 N ATOM 350 CA VAL A 26 -10.850 -6.195 0.861 1.00 0.00 C ATOM 351 C VAL A 26 -12.026 -5.227 0.792 1.00 0.00 C ATOM 352 O VAL A 26 -11.847 -4.010 0.846 1.00 0.00 O ATOM 353 CB VAL A 26 -10.684 -6.882 -0.508 1.00 0.00 C ATOM 354 CG1 VAL A 26 -10.554 -5.845 -1.613 1.00 0.00 C ATOM 355 CG2 VAL A 26 -9.481 -7.813 -0.494 1.00 0.00 C ATOM 0 H VAL A 26 -11.260 -8.114 1.602 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.941 -5.641 1.094 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.574 -7.479 -0.706 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -10.438 -6.349 -2.573 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -11.449 -5.223 -1.636 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.682 -5.219 -1.424 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.379 -8.290 -1.469 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.580 -7.240 -0.274 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.621 -8.577 0.271 1.00 0.00 H new ATOM 365 N LYS A 27 -13.230 -5.775 0.674 1.00 0.00 N ATOM 366 CA LYS A 27 -14.438 -4.962 0.600 1.00 0.00 C ATOM 367 C LYS A 27 -14.539 -4.027 1.801 1.00 0.00 C ATOM 368 O LYS A 27 -15.329 -3.083 1.799 1.00 0.00 O ATOM 369 CB LYS A 27 -15.677 -5.857 0.531 1.00 0.00 C ATOM 370 CG LYS A 27 -16.012 -6.324 -0.875 1.00 0.00 C ATOM 371 CD LYS A 27 -16.844 -5.295 -1.622 1.00 0.00 C ATOM 372 CE LYS A 27 -17.088 -5.715 -3.063 1.00 0.00 C ATOM 373 NZ LYS A 27 -15.891 -5.483 -3.918 1.00 0.00 N ATOM 0 H LYS A 27 -13.396 -6.780 0.627 1.00 0.00 H new ATOM 0 HA LYS A 27 -14.384 -4.357 -0.305 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.521 -6.728 1.167 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -16.530 -5.314 0.938 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -15.091 -6.516 -1.425 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -16.556 -7.267 -0.826 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -17.799 -5.160 -1.115 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -16.335 -4.331 -1.604 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -17.357 -6.771 -3.093 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -17.935 -5.159 -3.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -16.097 -5.782 -4.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -15.649 -4.472 -3.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -15.089 -6.033 -3.550 1.00 0.00 H new ATOM 387 N GLU A 28 -13.734 -4.296 2.824 1.00 0.00 N ATOM 388 CA GLU A 28 -13.734 -3.478 4.031 1.00 0.00 C ATOM 389 C GLU A 28 -12.730 -2.334 3.913 1.00 0.00 C ATOM 390 O GLU A 28 -12.978 -1.224 4.385 1.00 0.00 O ATOM 391 CB GLU A 28 -13.405 -4.335 5.255 1.00 0.00 C ATOM 392 CG GLU A 28 -14.628 -4.949 5.914 1.00 0.00 C ATOM 393 CD GLU A 28 -14.378 -5.342 7.358 1.00 0.00 C ATOM 394 OE1 GLU A 28 -14.287 -4.436 8.212 1.00 0.00 O ATOM 395 OE2 GLU A 28 -14.273 -6.555 7.632 1.00 0.00 O ATOM 0 H GLU A 28 -13.074 -5.073 2.841 1.00 0.00 H new ATOM 0 HA GLU A 28 -14.731 -3.053 4.151 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.724 -5.132 4.957 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -12.878 -3.722 5.986 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.454 -4.238 5.873 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.936 -5.829 5.350 1.00 0.00 H new ATOM 402 N HIS A 29 -11.595 -2.613 3.279 1.00 0.00 N ATOM 403 CA HIS A 29 -10.554 -1.609 3.098 1.00 0.00 C ATOM 404 C HIS A 29 -10.467 -1.173 1.639 1.00 0.00 C ATOM 405 O HIS A 29 -9.404 -0.774 1.163 1.00 0.00 O ATOM 406 CB HIS A 29 -9.203 -2.155 3.561 1.00 0.00 C ATOM 407 CG HIS A 29 -9.280 -2.947 4.830 1.00 0.00 C ATOM 408 ND1 HIS A 29 -9.673 -2.403 6.034 1.00 0.00 N ATOM 409 CD2 HIS A 29 -9.013 -4.251 5.077 1.00 0.00 C ATOM 410 CE1 HIS A 29 -9.643 -3.337 6.968 1.00 0.00 C ATOM 411 NE2 HIS A 29 -9.246 -4.468 6.413 1.00 0.00 N ATOM 0 H HIS A 29 -11.374 -3.526 2.882 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.813 -0.740 3.703 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -8.786 -2.784 2.775 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -8.513 -1.323 3.703 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -8.679 -4.984 4.358 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -9.899 -3.199 8.008 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -9.131 -5.358 6.898 1.00 0.00 H new ATOM 420 N GLU A 30 -11.591 -1.254 0.934 1.00 0.00 N ATOM 421 CA GLU A 30 -11.640 -0.870 -0.472 1.00 0.00 C ATOM 422 C GLU A 30 -11.448 0.636 -0.631 1.00 0.00 C ATOM 423 O GLU A 30 -11.300 1.139 -1.745 1.00 0.00 O ATOM 424 CB GLU A 30 -12.972 -1.294 -1.094 1.00 0.00 C ATOM 425 CG GLU A 30 -14.066 -0.249 -0.961 1.00 0.00 C ATOM 426 CD GLU A 30 -15.383 -0.703 -1.560 1.00 0.00 C ATOM 427 OE1 GLU A 30 -15.515 -1.910 -1.854 1.00 0.00 O ATOM 428 OE2 GLU A 30 -16.281 0.147 -1.735 1.00 0.00 O ATOM 0 H GLU A 30 -12.479 -1.582 1.313 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.828 -1.380 -0.990 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -12.817 -1.513 -2.150 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -13.305 -2.219 -0.623 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.213 -0.014 0.093 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -13.746 0.671 -1.451 1.00 0.00 H new ATOM 435 N SER A 31 -11.454 1.349 0.491 1.00 0.00 N ATOM 436 CA SER A 31 -11.285 2.797 0.476 1.00 0.00 C ATOM 437 C SER A 31 -9.816 3.172 0.309 1.00 0.00 C ATOM 438 O SER A 31 -9.489 4.209 -0.269 1.00 0.00 O ATOM 439 CB SER A 31 -11.836 3.408 1.767 1.00 0.00 C ATOM 440 OG SER A 31 -13.240 3.581 1.691 1.00 0.00 O ATOM 0 H SER A 31 -11.574 0.948 1.421 1.00 0.00 H new ATOM 0 HA SER A 31 -11.841 3.194 -0.373 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.591 2.764 2.611 1.00 0.00 H new ATOM 0 HB3 SER A 31 -11.357 4.370 1.951 1.00 0.00 H new ATOM 0 HG SER A 31 -13.567 3.971 2.528 1.00 0.00 H new ATOM 446 N LYS A 32 -8.933 2.320 0.819 1.00 0.00 N ATOM 447 CA LYS A 32 -7.498 2.558 0.727 1.00 0.00 C ATOM 448 C LYS A 32 -6.799 1.404 0.016 1.00 0.00 C ATOM 449 O LYS A 32 -7.371 0.326 -0.150 1.00 0.00 O ATOM 450 CB LYS A 32 -6.900 2.748 2.123 1.00 0.00 C ATOM 451 CG LYS A 32 -7.596 3.821 2.942 1.00 0.00 C ATOM 452 CD LYS A 32 -8.808 3.267 3.673 1.00 0.00 C ATOM 453 CE LYS A 32 -9.800 4.366 4.020 1.00 0.00 C ATOM 454 NZ LYS A 32 -9.392 5.117 5.240 1.00 0.00 N ATOM 0 H LYS A 32 -9.187 1.458 1.301 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.343 3.467 0.146 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -6.950 1.802 2.662 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.845 3.004 2.025 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.895 4.241 3.664 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.906 4.636 2.288 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.297 2.517 3.052 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.486 2.765 4.585 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.886 5.056 3.181 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.786 3.929 4.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -10.094 5.857 5.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -9.335 4.463 6.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -8.462 5.556 5.083 1.00 0.00 H new ATOM 468 N THR A 33 -5.558 1.636 -0.402 1.00 0.00 N ATOM 469 CA THR A 33 -4.782 0.615 -1.094 1.00 0.00 C ATOM 470 C THR A 33 -4.749 -0.685 -0.299 1.00 0.00 C ATOM 471 O THR A 33 -4.519 -0.678 0.910 1.00 0.00 O ATOM 472 CB THR A 33 -3.337 1.085 -1.348 1.00 0.00 C ATOM 473 OG1 THR A 33 -3.328 2.142 -2.314 1.00 0.00 O ATOM 474 CG2 THR A 33 -2.473 -0.066 -1.841 1.00 0.00 C ATOM 0 H THR A 33 -5.069 2.522 -0.273 1.00 0.00 H new ATOM 0 HA THR A 33 -5.273 0.439 -2.051 1.00 0.00 H new ATOM 0 HB THR A 33 -2.926 1.450 -0.407 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.406 2.436 -2.468 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.457 0.290 -2.014 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.458 -0.857 -1.091 1.00 0.00 H new ATOM 0 HG23 THR A 33 -2.884 -0.456 -2.772 1.00 0.00 H new ATOM 482 N ILE A 34 -4.980 -1.799 -0.986 1.00 0.00 N ATOM 483 CA ILE A 34 -4.975 -3.107 -0.343 1.00 0.00 C ATOM 484 C ILE A 34 -3.902 -4.010 -0.941 1.00 0.00 C ATOM 485 O ILE A 34 -3.725 -4.059 -2.159 1.00 0.00 O ATOM 486 CB ILE A 34 -6.344 -3.802 -0.470 1.00 0.00 C ATOM 487 CG1 ILE A 34 -7.397 -3.056 0.351 1.00 0.00 C ATOM 488 CG2 ILE A 34 -6.245 -5.253 -0.022 1.00 0.00 C ATOM 489 CD1 ILE A 34 -8.818 -3.352 -0.077 1.00 0.00 C ATOM 0 H ILE A 34 -5.173 -1.822 -1.987 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.758 -2.939 0.712 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.648 -3.785 -1.517 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.280 -3.320 1.402 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.217 -1.984 0.269 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.220 -5.731 -0.118 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.521 -5.778 -0.646 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.923 -5.291 1.019 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.511 -2.789 0.548 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.952 -3.062 -1.119 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.016 -4.418 0.031 1.00 0.00 H new ATOM 501 N PHE A 35 -3.188 -4.724 -0.077 1.00 0.00 N ATOM 502 CA PHE A 35 -2.132 -5.626 -0.520 1.00 0.00 C ATOM 503 C PHE A 35 -2.394 -7.050 -0.037 1.00 0.00 C ATOM 504 O PHE A 35 -2.250 -7.351 1.147 1.00 0.00 O ATOM 505 CB PHE A 35 -0.772 -5.145 -0.008 1.00 0.00 C ATOM 506 CG PHE A 35 -0.242 -3.950 -0.748 1.00 0.00 C ATOM 507 CD1 PHE A 35 0.357 -4.098 -1.989 1.00 0.00 C ATOM 508 CD2 PHE A 35 -0.343 -2.680 -0.204 1.00 0.00 C ATOM 509 CE1 PHE A 35 0.847 -3.000 -2.671 1.00 0.00 C ATOM 510 CE2 PHE A 35 0.145 -1.579 -0.882 1.00 0.00 C ATOM 511 CZ PHE A 35 0.739 -1.739 -2.118 1.00 0.00 C ATOM 0 H PHE A 35 -3.322 -4.695 0.934 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.123 -5.626 -1.610 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -0.857 -4.899 1.050 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.053 -5.960 -0.088 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.442 -5.081 -2.428 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.809 -2.549 0.762 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.314 -3.128 -3.636 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.062 -0.595 -0.445 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.118 -0.880 -2.651 1.00 0.00 H new ATOM 521 N ALA A 36 -2.782 -7.920 -0.964 1.00 0.00 N ATOM 522 CA ALA A 36 -3.063 -9.312 -0.634 1.00 0.00 C ATOM 523 C ALA A 36 -1.850 -10.196 -0.900 1.00 0.00 C ATOM 524 O ALA A 36 -1.391 -10.312 -2.036 1.00 0.00 O ATOM 525 CB ALA A 36 -4.264 -9.809 -1.425 1.00 0.00 C ATOM 0 H ALA A 36 -2.909 -7.686 -1.949 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.293 -9.368 0.430 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.463 -10.850 -1.169 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.136 -9.202 -1.182 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.054 -9.731 -2.492 1.00 0.00 H new ATOM 531 N TYR A 37 -1.334 -10.817 0.155 1.00 0.00 N ATOM 532 CA TYR A 37 -0.171 -11.688 0.036 1.00 0.00 C ATOM 533 C TYR A 37 -0.586 -13.156 0.048 1.00 0.00 C ATOM 534 O TYR A 37 -0.800 -13.744 1.108 1.00 0.00 O ATOM 535 CB TYR A 37 0.815 -11.416 1.173 1.00 0.00 C ATOM 536 CG TYR A 37 2.099 -12.208 1.064 1.00 0.00 C ATOM 537 CD1 TYR A 37 2.903 -12.113 -0.066 1.00 0.00 C ATOM 538 CD2 TYR A 37 2.507 -13.052 2.089 1.00 0.00 C ATOM 539 CE1 TYR A 37 4.076 -12.835 -0.170 1.00 0.00 C ATOM 540 CE2 TYR A 37 3.680 -13.776 1.994 1.00 0.00 C ATOM 541 CZ TYR A 37 4.460 -13.665 0.862 1.00 0.00 C ATOM 542 OH TYR A 37 5.628 -14.386 0.763 1.00 0.00 O ATOM 0 H TYR A 37 -1.703 -10.733 1.102 1.00 0.00 H new ATOM 0 HA TYR A 37 0.315 -11.474 -0.916 1.00 0.00 H new ATOM 0 HB2 TYR A 37 1.054 -10.353 1.189 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.334 -11.649 2.123 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.606 -11.464 -0.876 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.897 -13.144 2.975 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.689 -12.750 -1.055 1.00 0.00 H new ATOM 0 HE2 TYR A 37 3.984 -14.425 2.802 1.00 0.00 H new ATOM 0 HH TYR A 37 5.753 -14.920 1.575 1.00 0.00 H new ATOM 552 N PHE A 38 -0.698 -13.742 -1.140 1.00 0.00 N ATOM 553 CA PHE A 38 -1.087 -15.142 -1.268 1.00 0.00 C ATOM 554 C PHE A 38 0.105 -16.063 -1.028 1.00 0.00 C ATOM 555 O PHE A 38 0.964 -16.222 -1.895 1.00 0.00 O ATOM 556 CB PHE A 38 -1.677 -15.403 -2.655 1.00 0.00 C ATOM 557 CG PHE A 38 -2.671 -14.364 -3.090 1.00 0.00 C ATOM 558 CD1 PHE A 38 -3.915 -14.281 -2.487 1.00 0.00 C ATOM 559 CD2 PHE A 38 -2.361 -13.471 -4.103 1.00 0.00 C ATOM 560 CE1 PHE A 38 -4.832 -13.326 -2.884 1.00 0.00 C ATOM 561 CE2 PHE A 38 -3.273 -12.513 -4.504 1.00 0.00 C ATOM 562 CZ PHE A 38 -4.510 -12.441 -3.895 1.00 0.00 C ATOM 0 H PHE A 38 -0.525 -13.269 -2.027 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.844 -15.354 -0.512 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -0.867 -15.446 -3.383 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.160 -16.380 -2.657 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.172 -14.971 -1.697 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.396 -13.524 -4.585 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -5.798 -13.272 -2.405 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.018 -11.821 -5.293 1.00 0.00 H new ATOM 0 HZ PHE A 38 -5.225 -11.694 -4.208 1.00 0.00 H new ATOM 572 N SER A 39 0.151 -16.666 0.155 1.00 0.00 N ATOM 573 CA SER A 39 1.239 -17.568 0.512 1.00 0.00 C ATOM 574 C SER A 39 0.703 -18.829 1.181 1.00 0.00 C ATOM 575 O SER A 39 -0.173 -18.764 2.043 1.00 0.00 O ATOM 576 CB SER A 39 2.228 -16.864 1.444 1.00 0.00 C ATOM 577 OG SER A 39 2.941 -17.801 2.233 1.00 0.00 O ATOM 0 H SER A 39 -0.553 -16.546 0.883 1.00 0.00 H new ATOM 0 HA SER A 39 1.755 -17.855 -0.404 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.929 -16.272 0.855 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.691 -16.171 2.093 1.00 0.00 H new ATOM 0 HG SER A 39 2.926 -17.517 3.171 1.00 0.00 H new ATOM 583 N GLY A 40 1.236 -19.979 0.778 1.00 0.00 N ATOM 584 CA GLY A 40 0.799 -21.240 1.347 1.00 0.00 C ATOM 585 C GLY A 40 0.509 -21.136 2.831 1.00 0.00 C ATOM 586 O GLY A 40 1.062 -20.279 3.520 1.00 0.00 O ATOM 0 H GLY A 40 1.963 -20.059 0.067 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.097 -21.578 0.827 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.567 -21.995 1.182 1.00 0.00 H new ATOM 590 N SER A 41 -0.362 -22.011 3.325 1.00 0.00 N ATOM 591 CA SER A 41 -0.728 -22.010 4.737 1.00 0.00 C ATOM 592 C SER A 41 0.514 -22.055 5.621 1.00 0.00 C ATOM 593 O SER A 41 1.580 -22.497 5.192 1.00 0.00 O ATOM 594 CB SER A 41 -1.635 -23.202 5.050 1.00 0.00 C ATOM 595 OG SER A 41 -0.972 -24.428 4.793 1.00 0.00 O ATOM 0 H SER A 41 -0.827 -22.729 2.769 1.00 0.00 H new ATOM 0 HA SER A 41 -1.267 -21.086 4.947 1.00 0.00 H new ATOM 0 HB2 SER A 41 -1.944 -23.164 6.095 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.541 -23.142 4.447 1.00 0.00 H new ATOM 0 HG SER A 41 -1.134 -24.699 3.865 1.00 0.00 H new ATOM 601 N LYS A 42 0.369 -21.595 6.858 1.00 0.00 N ATOM 602 CA LYS A 42 1.477 -21.582 7.806 1.00 0.00 C ATOM 603 C LYS A 42 1.400 -22.778 8.750 1.00 0.00 C ATOM 604 O LYS A 42 0.332 -23.360 8.943 1.00 0.00 O ATOM 605 CB LYS A 42 1.471 -20.282 8.612 1.00 0.00 C ATOM 606 CG LYS A 42 1.625 -19.035 7.758 1.00 0.00 C ATOM 607 CD LYS A 42 1.769 -17.787 8.612 1.00 0.00 C ATOM 608 CE LYS A 42 0.414 -17.180 8.943 1.00 0.00 C ATOM 609 NZ LYS A 42 0.518 -15.727 9.252 1.00 0.00 N ATOM 0 H LYS A 42 -0.506 -21.225 7.229 1.00 0.00 H new ATOM 0 HA LYS A 42 2.406 -21.647 7.240 1.00 0.00 H new ATOM 0 HB2 LYS A 42 0.538 -20.216 9.172 1.00 0.00 H new ATOM 0 HB3 LYS A 42 2.279 -20.314 9.343 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.499 -19.139 7.115 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.759 -18.932 7.105 1.00 0.00 H new ATOM 0 HD2 LYS A 42 2.293 -18.035 9.535 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.379 -17.053 8.086 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.264 -17.325 8.102 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.020 -17.703 9.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -0.426 -15.350 9.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 1.145 -15.590 10.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 0.908 -15.224 8.429 1.00 0.00 H new ATOM 693 N SER A 48 5.455 -21.303 6.266 1.00 0.00 N ATOM 694 CA SER A 48 4.692 -21.884 5.168 1.00 0.00 C ATOM 695 C SER A 48 5.440 -23.062 4.550 1.00 0.00 C ATOM 696 O SER A 48 6.636 -22.975 4.275 1.00 0.00 O ATOM 697 CB SER A 48 4.411 -20.826 4.099 1.00 0.00 C ATOM 698 OG SER A 48 3.698 -21.381 3.007 1.00 0.00 O ATOM 0 HA SER A 48 3.745 -22.247 5.568 1.00 0.00 H new ATOM 0 HB2 SER A 48 3.837 -20.008 4.534 1.00 0.00 H new ATOM 0 HB3 SER A 48 5.351 -20.403 3.746 1.00 0.00 H new ATOM 0 HG SER A 48 3.529 -20.684 2.339 1.00 0.00 H new ATOM 704 N TRP A 49 4.725 -24.160 4.334 1.00 0.00 N ATOM 705 CA TRP A 49 5.320 -25.356 3.749 1.00 0.00 C ATOM 706 C TRP A 49 6.346 -24.988 2.683 1.00 0.00 C ATOM 707 O TRP A 49 7.320 -25.711 2.470 1.00 0.00 O ATOM 708 CB TRP A 49 4.234 -26.246 3.142 1.00 0.00 C ATOM 709 CG TRP A 49 3.216 -25.484 2.349 1.00 0.00 C ATOM 710 CD1 TRP A 49 2.026 -24.991 2.801 1.00 0.00 C ATOM 711 CD2 TRP A 49 3.299 -25.131 0.964 1.00 0.00 C ATOM 712 NE1 TRP A 49 1.363 -24.352 1.781 1.00 0.00 N ATOM 713 CE2 TRP A 49 2.123 -24.424 0.644 1.00 0.00 C ATOM 714 CE3 TRP A 49 4.251 -25.342 -0.037 1.00 0.00 C ATOM 715 CZ2 TRP A 49 1.878 -23.928 -0.634 1.00 0.00 C ATOM 716 CZ3 TRP A 49 4.006 -24.850 -1.304 1.00 0.00 C ATOM 717 CH2 TRP A 49 2.828 -24.149 -1.594 1.00 0.00 C ATOM 0 H TRP A 49 3.733 -24.247 4.555 1.00 0.00 H new ATOM 0 HA TRP A 49 5.828 -25.904 4.543 1.00 0.00 H new ATOM 0 HB2 TRP A 49 4.702 -26.991 2.498 1.00 0.00 H new ATOM 0 HB3 TRP A 49 3.730 -26.788 3.942 1.00 0.00 H new ATOM 0 HD1 TRP A 49 1.659 -25.089 3.812 1.00 0.00 H new ATOM 0 HE1 TRP A 49 0.453 -23.898 1.858 1.00 0.00 H new ATOM 0 HE3 TRP A 49 5.163 -25.880 0.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 0.970 -23.388 -0.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 4.735 -25.008 -2.085 1.00 0.00 H new ATOM 0 HH2 TRP A 49 2.667 -23.776 -2.595 1.00 0.00 H new ATOM 728 N CYS A 50 6.123 -23.860 2.018 1.00 0.00 N ATOM 729 CA CYS A 50 7.029 -23.396 0.973 1.00 0.00 C ATOM 730 C CYS A 50 8.108 -22.488 1.554 1.00 0.00 C ATOM 731 O CYS A 50 7.837 -21.596 2.357 1.00 0.00 O ATOM 732 CB CYS A 50 6.251 -22.654 -0.114 1.00 0.00 C ATOM 733 SG CYS A 50 6.977 -22.789 -1.764 1.00 0.00 S ATOM 0 H CYS A 50 5.323 -23.250 2.184 1.00 0.00 H new ATOM 0 HA CYS A 50 7.512 -24.268 0.531 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.232 -23.040 -0.144 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.185 -21.600 0.157 1.00 0.00 H new ATOM 0 HG CYS A 50 6.999 -21.617 -2.326 1.00 0.00 H new ATOM 739 N PRO A 51 9.363 -22.720 1.139 1.00 0.00 N ATOM 740 CA PRO A 51 10.508 -21.933 1.606 1.00 0.00 C ATOM 741 C PRO A 51 10.490 -20.507 1.069 1.00 0.00 C ATOM 742 O PRO A 51 10.693 -19.549 1.816 1.00 0.00 O ATOM 743 CB PRO A 51 11.713 -22.698 1.052 1.00 0.00 C ATOM 744 CG PRO A 51 11.187 -23.422 -0.139 1.00 0.00 C ATOM 745 CD PRO A 51 9.760 -23.767 0.183 1.00 0.00 C ATOM 0 HA PRO A 51 10.514 -21.827 2.691 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.521 -22.019 0.778 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.116 -23.391 1.791 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.246 -22.799 -1.032 1.00 0.00 H new ATOM 0 HG3 PRO A 51 11.770 -24.321 -0.338 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.133 -23.756 -0.708 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.676 -24.762 0.619 1.00 0.00 H new ATOM 753 N ASP A 52 10.245 -20.372 -0.230 1.00 0.00 N ATOM 754 CA ASP A 52 10.199 -19.061 -0.867 1.00 0.00 C ATOM 755 C ASP A 52 9.279 -18.116 -0.100 1.00 0.00 C ATOM 756 O ASP A 52 9.534 -16.914 -0.022 1.00 0.00 O ATOM 757 CB ASP A 52 9.724 -19.191 -2.316 1.00 0.00 C ATOM 758 CG ASP A 52 8.646 -20.244 -2.479 1.00 0.00 C ATOM 759 OD1 ASP A 52 7.521 -20.022 -1.984 1.00 0.00 O ATOM 760 OD2 ASP A 52 8.926 -21.290 -3.102 1.00 0.00 O ATOM 0 H ASP A 52 10.075 -21.154 -0.862 1.00 0.00 H new ATOM 0 HA ASP A 52 11.206 -18.645 -0.859 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.343 -18.229 -2.658 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.573 -19.442 -2.952 1.00 0.00 H new ATOM 765 N CYS A 53 8.209 -18.667 0.462 1.00 0.00 N ATOM 766 CA CYS A 53 7.250 -17.873 1.221 1.00 0.00 C ATOM 767 C CYS A 53 7.838 -17.448 2.563 1.00 0.00 C ATOM 768 O CYS A 53 7.618 -16.327 3.021 1.00 0.00 O ATOM 769 CB CYS A 53 5.962 -18.667 1.444 1.00 0.00 C ATOM 770 SG CYS A 53 5.040 -19.018 -0.072 1.00 0.00 S ATOM 0 H CYS A 53 7.984 -19.660 0.406 1.00 0.00 H new ATOM 0 HA CYS A 53 7.021 -16.977 0.645 1.00 0.00 H new ATOM 0 HB2 CYS A 53 6.209 -19.609 1.933 1.00 0.00 H new ATOM 0 HB3 CYS A 53 5.319 -18.112 2.127 1.00 0.00 H new ATOM 0 HG CYS A 53 5.812 -19.636 -0.916 1.00 0.00 H new ATOM 776 N VAL A 54 8.585 -18.351 3.189 1.00 0.00 N ATOM 777 CA VAL A 54 9.204 -18.070 4.479 1.00 0.00 C ATOM 778 C VAL A 54 10.422 -17.168 4.319 1.00 0.00 C ATOM 779 O VAL A 54 10.924 -16.608 5.293 1.00 0.00 O ATOM 780 CB VAL A 54 9.629 -19.368 5.192 1.00 0.00 C ATOM 781 CG1 VAL A 54 10.411 -19.050 6.458 1.00 0.00 C ATOM 782 CG2 VAL A 54 8.413 -20.225 5.508 1.00 0.00 C ATOM 0 H VAL A 54 8.776 -19.284 2.824 1.00 0.00 H new ATOM 0 HA VAL A 54 8.455 -17.560 5.085 1.00 0.00 H new ATOM 0 HB VAL A 54 10.279 -19.933 4.524 1.00 0.00 H new ATOM 0 HG11 VAL A 54 10.703 -19.979 6.948 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.303 -18.479 6.201 1.00 0.00 H new ATOM 0 HG13 VAL A 54 9.788 -18.464 7.133 1.00 0.00 H new ATOM 0 HG21 VAL A 54 8.732 -21.138 6.011 1.00 0.00 H new ATOM 0 HG22 VAL A 54 7.736 -19.670 6.157 1.00 0.00 H new ATOM 0 HG23 VAL A 54 7.899 -20.482 4.582 1.00 0.00 H new ATOM 792 N GLU A 55 10.893 -17.033 3.083 1.00 0.00 N ATOM 793 CA GLU A 55 12.054 -16.198 2.796 1.00 0.00 C ATOM 794 C GLU A 55 11.625 -14.796 2.372 1.00 0.00 C ATOM 795 O GLU A 55 12.213 -13.802 2.794 1.00 0.00 O ATOM 796 CB GLU A 55 12.909 -16.835 1.699 1.00 0.00 C ATOM 797 CG GLU A 55 14.051 -15.952 1.227 1.00 0.00 C ATOM 798 CD GLU A 55 15.313 -16.142 2.047 1.00 0.00 C ATOM 799 OE1 GLU A 55 15.648 -17.303 2.361 1.00 0.00 O ATOM 800 OE2 GLU A 55 15.966 -15.129 2.374 1.00 0.00 O ATOM 0 H GLU A 55 10.489 -17.490 2.266 1.00 0.00 H new ATOM 0 HA GLU A 55 12.646 -16.118 3.708 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.317 -17.776 2.069 1.00 0.00 H new ATOM 0 HB3 GLU A 55 12.272 -17.076 0.848 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.266 -16.170 0.181 1.00 0.00 H new ATOM 0 HG3 GLU A 55 13.743 -14.908 1.278 1.00 0.00 H new ATOM 807 N ALA A 56 10.595 -14.727 1.534 1.00 0.00 N ATOM 808 CA ALA A 56 10.086 -13.449 1.054 1.00 0.00 C ATOM 809 C ALA A 56 9.183 -12.792 2.093 1.00 0.00 C ATOM 810 O ALA A 56 8.883 -11.602 2.003 1.00 0.00 O ATOM 811 CB ALA A 56 9.336 -13.638 -0.256 1.00 0.00 C ATOM 0 H ALA A 56 10.097 -15.541 1.174 1.00 0.00 H new ATOM 0 HA ALA A 56 10.936 -12.789 0.881 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.961 -12.675 -0.603 1.00 0.00 H new ATOM 0 HB2 ALA A 56 10.010 -14.056 -1.004 1.00 0.00 H new ATOM 0 HB3 ALA A 56 8.499 -14.319 -0.101 1.00 0.00 H new ATOM 817 N GLU A 57 8.753 -13.576 3.076 1.00 0.00 N ATOM 818 CA GLU A 57 7.882 -13.070 4.131 1.00 0.00 C ATOM 819 C GLU A 57 8.518 -11.874 4.833 1.00 0.00 C ATOM 820 O GLU A 57 7.954 -10.781 4.887 1.00 0.00 O ATOM 821 CB GLU A 57 7.582 -14.172 5.148 1.00 0.00 C ATOM 822 CG GLU A 57 6.276 -14.903 4.886 1.00 0.00 C ATOM 823 CD GLU A 57 6.279 -16.318 5.432 1.00 0.00 C ATOM 824 OE1 GLU A 57 6.566 -16.488 6.636 1.00 0.00 O ATOM 825 OE2 GLU A 57 5.995 -17.254 4.657 1.00 0.00 O ATOM 0 H GLU A 57 8.993 -14.563 3.164 1.00 0.00 H new ATOM 0 HA GLU A 57 6.948 -12.746 3.672 1.00 0.00 H new ATOM 0 HB2 GLU A 57 8.400 -14.893 5.142 1.00 0.00 H new ATOM 0 HB3 GLU A 57 7.550 -13.735 6.146 1.00 0.00 H new ATOM 0 HG2 GLU A 57 5.455 -14.345 5.337 1.00 0.00 H new ATOM 0 HG3 GLU A 57 6.090 -14.932 3.812 1.00 0.00 H new ATOM 832 N PRO A 58 9.722 -12.084 5.386 1.00 0.00 N ATOM 833 CA PRO A 58 10.461 -11.036 6.096 1.00 0.00 C ATOM 834 C PRO A 58 10.974 -9.950 5.155 1.00 0.00 C ATOM 835 O PRO A 58 11.468 -8.913 5.599 1.00 0.00 O ATOM 836 CB PRO A 58 11.632 -11.793 6.727 1.00 0.00 C ATOM 837 CG PRO A 58 11.823 -12.988 5.859 1.00 0.00 C ATOM 838 CD PRO A 58 10.454 -13.361 5.361 1.00 0.00 C ATOM 0 HA PRO A 58 9.834 -10.514 6.819 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.531 -11.178 6.757 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.409 -12.082 7.754 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.493 -12.764 5.029 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.272 -13.809 6.418 1.00 0.00 H new ATOM 0 HD2 PRO A 58 10.493 -13.782 4.356 1.00 0.00 H new ATOM 0 HD3 PRO A 58 9.983 -14.107 6.001 1.00 0.00 H new ATOM 846 N VAL A 59 10.854 -10.195 3.855 1.00 0.00 N ATOM 847 CA VAL A 59 11.304 -9.238 2.851 1.00 0.00 C ATOM 848 C VAL A 59 10.173 -8.301 2.439 1.00 0.00 C ATOM 849 O VAL A 59 10.402 -7.126 2.150 1.00 0.00 O ATOM 850 CB VAL A 59 11.847 -9.951 1.599 1.00 0.00 C ATOM 851 CG1 VAL A 59 12.158 -8.943 0.503 1.00 0.00 C ATOM 852 CG2 VAL A 59 13.081 -10.770 1.946 1.00 0.00 C ATOM 0 H VAL A 59 10.449 -11.049 3.471 1.00 0.00 H new ATOM 0 HA VAL A 59 12.106 -8.657 3.305 1.00 0.00 H new ATOM 0 HB VAL A 59 11.080 -10.631 1.228 1.00 0.00 H new ATOM 0 HG11 VAL A 59 12.541 -9.465 -0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 59 11.249 -8.404 0.236 1.00 0.00 H new ATOM 0 HG13 VAL A 59 12.907 -8.237 0.860 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.452 -11.267 1.050 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.855 -10.112 2.342 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.822 -11.518 2.695 1.00 0.00 H new ATOM 862 N ILE A 60 8.954 -8.829 2.416 1.00 0.00 N ATOM 863 CA ILE A 60 7.788 -8.039 2.041 1.00 0.00 C ATOM 864 C ILE A 60 7.353 -7.125 3.182 1.00 0.00 C ATOM 865 O ILE A 60 6.957 -5.981 2.958 1.00 0.00 O ATOM 866 CB ILE A 60 6.604 -8.939 1.640 1.00 0.00 C ATOM 867 CG1 ILE A 60 6.936 -9.717 0.364 1.00 0.00 C ATOM 868 CG2 ILE A 60 5.346 -8.105 1.446 1.00 0.00 C ATOM 869 CD1 ILE A 60 5.774 -10.524 -0.171 1.00 0.00 C ATOM 0 H ILE A 60 8.748 -9.800 2.652 1.00 0.00 H new ATOM 0 HA ILE A 60 8.080 -7.432 1.184 1.00 0.00 H new ATOM 0 HB ILE A 60 6.422 -9.654 2.442 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.265 -9.017 -0.404 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.772 -10.387 0.564 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.518 -8.755 1.163 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.103 -7.592 2.376 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.515 -7.369 0.660 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.081 -11.049 -1.076 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.458 -11.249 0.579 1.00 0.00 H new ATOM 0 HD13 ILE A 60 4.944 -9.857 -0.403 1.00 0.00 H new ATOM 881 N ARG A 61 7.431 -7.638 4.406 1.00 0.00 N ATOM 882 CA ARG A 61 7.046 -6.867 5.582 1.00 0.00 C ATOM 883 C ARG A 61 8.119 -5.842 5.936 1.00 0.00 C ATOM 884 O ARG A 61 7.840 -4.839 6.592 1.00 0.00 O ATOM 885 CB ARG A 61 6.804 -7.799 6.771 1.00 0.00 C ATOM 886 CG ARG A 61 5.429 -8.446 6.767 1.00 0.00 C ATOM 887 CD ARG A 61 4.974 -8.797 8.176 1.00 0.00 C ATOM 888 NE ARG A 61 4.260 -7.693 8.811 1.00 0.00 N ATOM 889 CZ ARG A 61 3.120 -7.192 8.349 1.00 0.00 C ATOM 890 NH1 ARG A 61 2.567 -7.694 7.253 1.00 0.00 N ATOM 891 NH2 ARG A 61 2.530 -6.186 8.983 1.00 0.00 N ATOM 0 H ARG A 61 7.757 -8.583 4.609 1.00 0.00 H new ATOM 0 HA ARG A 61 6.123 -6.335 5.351 1.00 0.00 H new ATOM 0 HB2 ARG A 61 7.564 -8.580 6.770 1.00 0.00 H new ATOM 0 HB3 ARG A 61 6.928 -7.235 7.695 1.00 0.00 H new ATOM 0 HG2 ARG A 61 4.708 -7.769 6.309 1.00 0.00 H new ATOM 0 HG3 ARG A 61 5.452 -9.348 6.156 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.328 -9.674 8.140 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.841 -9.064 8.781 1.00 0.00 H new ATOM 0 HE ARG A 61 4.659 -7.284 9.656 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.017 -8.467 6.763 1.00 0.00 H new ATOM 0 HH12 ARG A 61 1.691 -7.307 6.900 1.00 0.00 H new ATOM 0 HH21 ARG A 61 2.952 -5.797 9.826 1.00 0.00 H new ATOM 0 HH22 ARG A 61 1.655 -5.802 8.627 1.00 0.00 H new ATOM 905 N GLU A 62 9.347 -6.102 5.496 1.00 0.00 N ATOM 906 CA GLU A 62 10.461 -5.202 5.768 1.00 0.00 C ATOM 907 C GLU A 62 10.259 -3.859 5.072 1.00 0.00 C ATOM 908 O GLU A 62 10.604 -2.809 5.613 1.00 0.00 O ATOM 909 CB GLU A 62 11.778 -5.833 5.310 1.00 0.00 C ATOM 910 CG GLU A 62 12.469 -6.650 6.388 1.00 0.00 C ATOM 911 CD GLU A 62 13.343 -5.802 7.292 1.00 0.00 C ATOM 912 OE1 GLU A 62 13.695 -4.674 6.888 1.00 0.00 O ATOM 913 OE2 GLU A 62 13.675 -6.266 8.403 1.00 0.00 O ATOM 0 H GLU A 62 9.595 -6.928 4.950 1.00 0.00 H new ATOM 0 HA GLU A 62 10.502 -5.031 6.844 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.584 -6.473 4.449 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.452 -5.044 4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 62 11.717 -7.160 6.990 1.00 0.00 H new ATOM 0 HG3 GLU A 62 13.079 -7.422 5.919 1.00 0.00 H new ATOM 920 N GLY A 63 9.696 -3.902 3.868 1.00 0.00 N ATOM 921 CA GLY A 63 9.458 -2.683 3.117 1.00 0.00 C ATOM 922 C GLY A 63 8.087 -2.094 3.388 1.00 0.00 C ATOM 923 O GLY A 63 7.896 -0.881 3.298 1.00 0.00 O ATOM 0 H GLY A 63 9.401 -4.759 3.400 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.222 -1.948 3.371 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.557 -2.891 2.052 1.00 0.00 H new ATOM 927 N LEU A 64 7.130 -2.955 3.718 1.00 0.00 N ATOM 928 CA LEU A 64 5.769 -2.513 4.001 1.00 0.00 C ATOM 929 C LEU A 64 5.765 -1.379 5.021 1.00 0.00 C ATOM 930 O LEU A 64 4.968 -0.446 4.926 1.00 0.00 O ATOM 931 CB LEU A 64 4.930 -3.683 4.518 1.00 0.00 C ATOM 932 CG LEU A 64 4.192 -4.500 3.458 1.00 0.00 C ATOM 933 CD1 LEU A 64 3.596 -5.757 4.072 1.00 0.00 C ATOM 934 CD2 LEU A 64 3.108 -3.662 2.796 1.00 0.00 C ATOM 0 H LEU A 64 7.271 -3.962 3.796 1.00 0.00 H new ATOM 0 HA LEU A 64 5.333 -2.143 3.073 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.584 -4.354 5.075 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.196 -3.294 5.224 1.00 0.00 H new ATOM 0 HG LEU A 64 4.909 -4.799 2.694 1.00 0.00 H new ATOM 0 HD11 LEU A 64 3.074 -6.326 3.302 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.393 -6.367 4.497 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.893 -5.480 4.857 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.594 -4.261 2.044 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.392 -3.332 3.549 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.560 -2.792 2.320 1.00 0.00 H new ATOM 946 N LYS A 65 6.664 -1.465 5.996 1.00 0.00 N ATOM 947 CA LYS A 65 6.768 -0.445 7.033 1.00 0.00 C ATOM 948 C LYS A 65 7.221 0.886 6.443 1.00 0.00 C ATOM 949 O LYS A 65 6.840 1.953 6.926 1.00 0.00 O ATOM 950 CB LYS A 65 7.747 -0.893 8.121 1.00 0.00 C ATOM 951 CG LYS A 65 7.289 -2.125 8.882 1.00 0.00 C ATOM 952 CD LYS A 65 8.452 -2.822 9.567 1.00 0.00 C ATOM 953 CE LYS A 65 9.344 -3.536 8.563 1.00 0.00 C ATOM 954 NZ LYS A 65 10.764 -3.574 9.010 1.00 0.00 N ATOM 0 H LYS A 65 7.331 -2.231 6.090 1.00 0.00 H new ATOM 0 HA LYS A 65 5.781 -0.309 7.475 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.715 -1.097 7.665 1.00 0.00 H new ATOM 0 HB3 LYS A 65 7.893 -0.074 8.826 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.546 -1.839 9.626 1.00 0.00 H new ATOM 0 HG3 LYS A 65 6.802 -2.818 8.196 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.040 -2.091 10.122 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.071 -3.541 10.292 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.982 -4.554 8.416 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.280 -3.032 7.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 11.390 -3.578 8.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.967 -2.737 9.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 10.928 -4.434 9.571 1.00 0.00 H new ATOM 968 N HIS A 66 8.037 0.817 5.396 1.00 0.00 N ATOM 969 CA HIS A 66 8.540 2.018 4.738 1.00 0.00 C ATOM 970 C HIS A 66 7.602 2.459 3.619 1.00 0.00 C ATOM 971 O HIS A 66 7.984 3.239 2.746 1.00 0.00 O ATOM 972 CB HIS A 66 9.941 1.769 4.178 1.00 0.00 C ATOM 973 CG HIS A 66 10.875 1.132 5.160 1.00 0.00 C ATOM 974 ND1 HIS A 66 12.093 1.680 5.504 1.00 0.00 N ATOM 975 CD2 HIS A 66 10.763 -0.012 5.874 1.00 0.00 C ATOM 976 CE1 HIS A 66 12.690 0.899 6.387 1.00 0.00 C ATOM 977 NE2 HIS A 66 11.904 -0.135 6.628 1.00 0.00 N ATOM 0 H HIS A 66 8.364 -0.057 4.985 1.00 0.00 H new ATOM 0 HA HIS A 66 8.590 2.815 5.480 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.863 1.131 3.297 1.00 0.00 H new ATOM 0 HB3 HIS A 66 10.365 2.717 3.848 1.00 0.00 H new ATOM 0 HD2 HIS A 66 9.931 -0.700 5.854 1.00 0.00 H new ATOM 0 HE1 HIS A 66 13.656 1.076 6.835 1.00 0.00 H new ATOM 0 HE2 HIS A 66 12.111 -0.900 7.270 1.00 0.00 H new ATOM 986 N VAL A 67 6.373 1.953 3.650 1.00 0.00 N ATOM 987 CA VAL A 67 5.380 2.295 2.638 1.00 0.00 C ATOM 988 C VAL A 67 5.007 3.771 2.711 1.00 0.00 C ATOM 989 O VAL A 67 4.896 4.343 3.797 1.00 0.00 O ATOM 990 CB VAL A 67 4.105 1.446 2.794 1.00 0.00 C ATOM 991 CG1 VAL A 67 3.377 1.806 4.080 1.00 0.00 C ATOM 992 CG2 VAL A 67 3.195 1.625 1.589 1.00 0.00 C ATOM 0 H VAL A 67 6.041 1.305 4.365 1.00 0.00 H new ATOM 0 HA VAL A 67 5.831 2.085 1.668 1.00 0.00 H new ATOM 0 HB VAL A 67 4.394 0.396 2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.479 1.196 4.173 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.031 1.621 4.932 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.099 2.860 4.058 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.299 1.018 1.716 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.913 2.674 1.499 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.720 1.312 0.687 1.00 0.00 H new ATOM 1002 N THR A 68 4.812 4.385 1.548 1.00 0.00 N ATOM 1003 CA THR A 68 4.451 5.796 1.480 1.00 0.00 C ATOM 1004 C THR A 68 3.022 5.974 0.980 1.00 0.00 C ATOM 1005 O THR A 68 2.704 6.965 0.324 1.00 0.00 O ATOM 1006 CB THR A 68 5.407 6.576 0.557 1.00 0.00 C ATOM 1007 OG1 THR A 68 5.158 6.231 -0.810 1.00 0.00 O ATOM 1008 CG2 THR A 68 6.858 6.278 0.905 1.00 0.00 C ATOM 0 H THR A 68 4.898 3.927 0.640 1.00 0.00 H new ATOM 0 HA THR A 68 4.531 6.192 2.492 1.00 0.00 H new ATOM 0 HB THR A 68 5.227 7.641 0.701 1.00 0.00 H new ATOM 0 HG1 THR A 68 5.768 6.732 -1.390 1.00 0.00 H new ATOM 0 HG21 THR A 68 7.514 6.840 0.240 1.00 0.00 H new ATOM 0 HG22 THR A 68 7.052 6.569 1.937 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.049 5.211 0.787 1.00 0.00 H new ATOM 1016 N GLU A 69 2.165 5.007 1.293 1.00 0.00 N ATOM 1017 CA GLU A 69 0.770 5.059 0.875 1.00 0.00 C ATOM 1018 C GLU A 69 -0.118 4.281 1.842 1.00 0.00 C ATOM 1019 O GLU A 69 -0.016 3.059 1.950 1.00 0.00 O ATOM 1020 CB GLU A 69 0.617 4.495 -0.540 1.00 0.00 C ATOM 1021 CG GLU A 69 1.004 3.031 -0.656 1.00 0.00 C ATOM 1022 CD GLU A 69 1.145 2.577 -2.096 1.00 0.00 C ATOM 1023 OE1 GLU A 69 1.988 3.150 -2.818 1.00 0.00 O ATOM 1024 OE2 GLU A 69 0.412 1.651 -2.501 1.00 0.00 O ATOM 0 H GLU A 69 2.413 4.179 1.834 1.00 0.00 H new ATOM 0 HA GLU A 69 0.455 6.103 0.879 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.418 4.615 -0.860 1.00 0.00 H new ATOM 0 HB3 GLU A 69 1.232 5.080 -1.224 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.946 2.866 -0.133 1.00 0.00 H new ATOM 0 HG3 GLU A 69 0.251 2.420 -0.158 1.00 0.00 H new ATOM 1031 N ASP A 70 -0.988 4.999 2.545 1.00 0.00 N ATOM 1032 CA ASP A 70 -1.894 4.378 3.503 1.00 0.00 C ATOM 1033 C ASP A 70 -2.587 3.165 2.889 1.00 0.00 C ATOM 1034 O ASP A 70 -3.601 3.299 2.204 1.00 0.00 O ATOM 1035 CB ASP A 70 -2.937 5.389 3.981 1.00 0.00 C ATOM 1036 CG ASP A 70 -3.369 6.339 2.881 1.00 0.00 C ATOM 1037 OD1 ASP A 70 -4.329 6.008 2.154 1.00 0.00 O ATOM 1038 OD2 ASP A 70 -2.746 7.413 2.747 1.00 0.00 O ATOM 0 H ASP A 70 -1.084 6.012 2.469 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.306 4.044 4.357 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -3.809 4.856 4.360 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -2.528 5.963 4.813 1.00 0.00 H new ATOM 1043 N CYS A 71 -2.032 1.984 3.139 1.00 0.00 N ATOM 1044 CA CYS A 71 -2.595 0.748 2.609 1.00 0.00 C ATOM 1045 C CYS A 71 -2.872 -0.248 3.731 1.00 0.00 C ATOM 1046 O CYS A 71 -2.488 -0.028 4.880 1.00 0.00 O ATOM 1047 CB CYS A 71 -1.645 0.128 1.583 1.00 0.00 C ATOM 1048 SG CYS A 71 -0.102 -0.496 2.289 1.00 0.00 S ATOM 0 H CYS A 71 -1.193 1.857 3.705 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.539 0.988 2.120 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -2.158 -0.690 1.077 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.409 0.874 0.824 1.00 0.00 H new ATOM 0 HG CYS A 71 0.423 -1.369 1.482 1.00 0.00 H new ATOM 1054 N VAL A 72 -3.542 -1.345 3.390 1.00 0.00 N ATOM 1055 CA VAL A 72 -3.871 -2.375 4.368 1.00 0.00 C ATOM 1056 C VAL A 72 -3.412 -3.749 3.894 1.00 0.00 C ATOM 1057 O VAL A 72 -4.033 -4.356 3.020 1.00 0.00 O ATOM 1058 CB VAL A 72 -5.384 -2.419 4.649 1.00 0.00 C ATOM 1059 CG1 VAL A 72 -5.711 -3.525 5.641 1.00 0.00 C ATOM 1060 CG2 VAL A 72 -5.871 -1.072 5.160 1.00 0.00 C ATOM 0 H VAL A 72 -3.867 -1.543 2.444 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.346 -2.118 5.288 1.00 0.00 H new ATOM 0 HB VAL A 72 -5.903 -2.636 3.715 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.785 -3.541 5.827 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.400 -4.486 5.231 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.183 -3.342 6.577 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.943 -1.122 5.353 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.347 -0.822 6.083 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.673 -0.305 4.411 1.00 0.00 H new ATOM 1070 N PHE A 73 -2.321 -4.237 4.475 1.00 0.00 N ATOM 1071 CA PHE A 73 -1.778 -5.540 4.112 1.00 0.00 C ATOM 1072 C PHE A 73 -2.726 -6.660 4.532 1.00 0.00 C ATOM 1073 O PHE A 73 -3.407 -6.561 5.553 1.00 0.00 O ATOM 1074 CB PHE A 73 -0.409 -5.745 4.762 1.00 0.00 C ATOM 1075 CG PHE A 73 0.342 -6.928 4.220 1.00 0.00 C ATOM 1076 CD1 PHE A 73 0.895 -6.891 2.950 1.00 0.00 C ATOM 1077 CD2 PHE A 73 0.494 -8.076 4.980 1.00 0.00 C ATOM 1078 CE1 PHE A 73 1.585 -7.978 2.448 1.00 0.00 C ATOM 1079 CE2 PHE A 73 1.183 -9.167 4.483 1.00 0.00 C ATOM 1080 CZ PHE A 73 1.730 -9.117 3.216 1.00 0.00 C ATOM 0 H PHE A 73 -1.795 -3.749 5.200 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.666 -5.570 3.028 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.191 -4.847 4.617 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.541 -5.870 5.837 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.786 -6.003 2.346 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.070 -8.119 5.972 1.00 0.00 H new ATOM 0 HE1 PHE A 73 2.010 -7.937 1.456 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.293 -10.057 5.085 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.270 -9.967 2.826 1.00 0.00 H new ATOM 1090 N ILE A 74 -2.763 -7.725 3.738 1.00 0.00 N ATOM 1091 CA ILE A 74 -3.626 -8.863 4.027 1.00 0.00 C ATOM 1092 C ILE A 74 -2.932 -10.179 3.690 1.00 0.00 C ATOM 1093 O ILE A 74 -2.742 -10.510 2.520 1.00 0.00 O ATOM 1094 CB ILE A 74 -4.950 -8.779 3.244 1.00 0.00 C ATOM 1095 CG1 ILE A 74 -5.606 -7.413 3.454 1.00 0.00 C ATOM 1096 CG2 ILE A 74 -5.890 -9.896 3.673 1.00 0.00 C ATOM 1097 CD1 ILE A 74 -6.904 -7.244 2.697 1.00 0.00 C ATOM 0 H ILE A 74 -2.205 -7.823 2.890 1.00 0.00 H new ATOM 0 HA ILE A 74 -3.842 -8.832 5.095 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.736 -8.898 2.182 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -5.794 -7.269 4.518 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -4.910 -6.633 3.145 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.821 -9.824 3.111 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.422 -10.861 3.477 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.101 -9.805 4.738 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.313 -6.253 2.893 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.719 -7.356 1.629 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.617 -8.001 3.023 1.00 0.00 H new ATOM 1109 N TYR A 75 -2.557 -10.924 4.724 1.00 0.00 N ATOM 1110 CA TYR A 75 -1.883 -12.204 4.538 1.00 0.00 C ATOM 1111 C TYR A 75 -2.891 -13.316 4.264 1.00 0.00 C ATOM 1112 O TYR A 75 -3.423 -13.930 5.190 1.00 0.00 O ATOM 1113 CB TYR A 75 -1.050 -12.549 5.773 1.00 0.00 C ATOM 1114 CG TYR A 75 -0.043 -13.652 5.535 1.00 0.00 C ATOM 1115 CD1 TYR A 75 -0.457 -14.946 5.244 1.00 0.00 C ATOM 1116 CD2 TYR A 75 1.322 -13.400 5.603 1.00 0.00 C ATOM 1117 CE1 TYR A 75 0.459 -15.957 5.027 1.00 0.00 C ATOM 1118 CE2 TYR A 75 2.245 -14.405 5.386 1.00 0.00 C ATOM 1119 CZ TYR A 75 1.809 -15.681 5.098 1.00 0.00 C ATOM 1120 OH TYR A 75 2.725 -16.685 4.882 1.00 0.00 O ATOM 0 H TYR A 75 -2.708 -10.664 5.699 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.223 -12.116 3.675 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.525 -11.655 6.108 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.719 -12.847 6.580 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.513 -15.165 5.186 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.667 -12.402 5.829 1.00 0.00 H new ATOM 0 HE1 TYR A 75 0.120 -16.958 4.803 1.00 0.00 H new ATOM 0 HE2 TYR A 75 3.302 -14.192 5.442 1.00 0.00 H new ATOM 0 HH TYR A 75 3.610 -16.293 4.731 1.00 0.00 H new ATOM 1130 N CYS A 76 -3.149 -13.570 2.986 1.00 0.00 N ATOM 1131 CA CYS A 76 -4.093 -14.608 2.587 1.00 0.00 C ATOM 1132 C CYS A 76 -3.368 -15.914 2.280 1.00 0.00 C ATOM 1133 O CYS A 76 -2.336 -15.918 1.610 1.00 0.00 O ATOM 1134 CB CYS A 76 -4.895 -14.155 1.366 1.00 0.00 C ATOM 1135 SG CYS A 76 -5.986 -15.427 0.687 1.00 0.00 S ATOM 0 H CYS A 76 -2.718 -13.071 2.208 1.00 0.00 H new ATOM 0 HA CYS A 76 -4.777 -14.781 3.418 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -5.494 -13.286 1.640 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -4.202 -13.833 0.589 1.00 0.00 H new ATOM 0 HG CYS A 76 -7.119 -15.413 1.325 1.00 0.00 H new ATOM 1141 N GLN A 77 -3.915 -17.019 2.776 1.00 0.00 N ATOM 1142 CA GLN A 77 -3.318 -18.331 2.556 1.00 0.00 C ATOM 1143 C GLN A 77 -4.055 -19.087 1.456 1.00 0.00 C ATOM 1144 O GLN A 77 -5.269 -19.278 1.526 1.00 0.00 O ATOM 1145 CB GLN A 77 -3.334 -19.146 3.850 1.00 0.00 C ATOM 1146 CG GLN A 77 -2.580 -18.487 4.994 1.00 0.00 C ATOM 1147 CD GLN A 77 -3.140 -18.858 6.353 1.00 0.00 C ATOM 1148 OE1 GLN A 77 -2.992 -19.992 6.810 1.00 0.00 O ATOM 1149 NE2 GLN A 77 -3.787 -17.901 7.008 1.00 0.00 N ATOM 0 H GLN A 77 -4.770 -17.032 3.332 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.285 -18.184 2.241 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.368 -19.309 4.154 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -2.900 -20.127 3.657 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -1.530 -18.777 4.947 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.618 -17.404 4.873 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.886 -16.975 6.591 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -4.185 -18.092 7.928 1.00 0.00 H new ATOM 1158 N VAL A 78 -3.314 -19.515 0.439 1.00 0.00 N ATOM 1159 CA VAL A 78 -3.897 -20.251 -0.676 1.00 0.00 C ATOM 1160 C VAL A 78 -4.486 -21.577 -0.211 1.00 0.00 C ATOM 1161 O VAL A 78 -5.506 -22.031 -0.728 1.00 0.00 O ATOM 1162 CB VAL A 78 -2.854 -20.522 -1.777 1.00 0.00 C ATOM 1163 CG1 VAL A 78 -2.403 -19.219 -2.419 1.00 0.00 C ATOM 1164 CG2 VAL A 78 -1.667 -21.284 -1.208 1.00 0.00 C ATOM 0 H VAL A 78 -2.308 -19.364 0.364 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.692 -19.628 -1.085 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.317 -21.137 -2.549 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -1.666 -19.431 -3.194 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.262 -18.716 -2.863 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -1.957 -18.575 -1.661 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.939 -21.467 -1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.202 -20.696 -0.417 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.007 -22.236 -0.800 1.00 0.00 H new ATOM 1174 N GLY A 79 -3.836 -22.196 0.770 1.00 0.00 N ATOM 1175 CA GLY A 79 -4.310 -23.465 1.290 1.00 0.00 C ATOM 1176 C GLY A 79 -3.178 -24.426 1.595 1.00 0.00 C ATOM 1177 O GLY A 79 -2.150 -24.031 2.145 1.00 0.00 O ATOM 0 H GLY A 79 -2.989 -21.841 1.214 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.888 -23.289 2.197 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.985 -23.922 0.566 1.00 0.00 H new ATOM 1181 N ASP A 80 -3.366 -25.692 1.238 1.00 0.00 N ATOM 1182 CA ASP A 80 -2.353 -26.713 1.478 1.00 0.00 C ATOM 1183 C ASP A 80 -1.333 -26.742 0.344 1.00 0.00 C ATOM 1184 O ASP A 80 -1.573 -26.202 -0.736 1.00 0.00 O ATOM 1185 CB ASP A 80 -3.008 -28.087 1.627 1.00 0.00 C ATOM 1186 CG ASP A 80 -4.300 -28.029 2.418 1.00 0.00 C ATOM 1187 OD1 ASP A 80 -5.249 -27.361 1.957 1.00 0.00 O ATOM 1188 OD2 ASP A 80 -4.362 -28.653 3.498 1.00 0.00 O ATOM 0 H ASP A 80 -4.211 -26.036 0.781 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.834 -26.465 2.404 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.209 -28.500 0.638 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.313 -28.766 2.121 1.00 0.00 H new ATOM 1193 N LYS A 81 -0.193 -27.376 0.597 1.00 0.00 N ATOM 1194 CA LYS A 81 0.865 -27.477 -0.402 1.00 0.00 C ATOM 1195 C LYS A 81 0.337 -28.096 -1.692 1.00 0.00 C ATOM 1196 O LYS A 81 0.397 -27.496 -2.766 1.00 0.00 O ATOM 1197 CB LYS A 81 2.027 -28.313 0.139 1.00 0.00 C ATOM 1198 CG LYS A 81 2.761 -29.099 -0.933 1.00 0.00 C ATOM 1199 CD LYS A 81 4.061 -29.683 -0.405 1.00 0.00 C ATOM 1200 CE LYS A 81 3.845 -31.059 0.208 1.00 0.00 C ATOM 1201 NZ LYS A 81 3.997 -32.145 -0.800 1.00 0.00 N ATOM 0 H LYS A 81 0.022 -27.828 1.486 1.00 0.00 H new ATOM 0 HA LYS A 81 1.221 -26.470 -0.622 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.734 -27.654 0.643 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.647 -29.006 0.890 1.00 0.00 H new ATOM 0 HG2 LYS A 81 2.122 -29.903 -1.298 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.972 -28.449 -1.782 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.785 -29.755 -1.216 1.00 0.00 H new ATOM 0 HD3 LYS A 81 4.485 -29.013 0.343 1.00 0.00 H new ATOM 0 HE2 LYS A 81 4.559 -31.212 1.017 1.00 0.00 H new ATOM 0 HE3 LYS A 81 2.849 -31.108 0.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 3.842 -33.067 -0.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 3.299 -32.014 -1.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 4.956 -32.114 -1.202 1.00 0.00 H new ATOM 1215 N PRO A 82 -0.193 -29.323 -1.588 1.00 0.00 N ATOM 1216 CA PRO A 82 -0.743 -30.049 -2.737 1.00 0.00 C ATOM 1217 C PRO A 82 -2.038 -29.427 -3.249 1.00 0.00 C ATOM 1218 O PRO A 82 -2.518 -29.771 -4.329 1.00 0.00 O ATOM 1219 CB PRO A 82 -1.007 -31.449 -2.178 1.00 0.00 C ATOM 1220 CG PRO A 82 -1.193 -31.245 -0.714 1.00 0.00 C ATOM 1221 CD PRO A 82 -0.296 -30.097 -0.339 1.00 0.00 C ATOM 0 HA PRO A 82 -0.065 -30.037 -3.590 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.892 -31.895 -2.631 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.172 -32.120 -2.381 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.234 -31.020 -0.480 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -0.929 -32.145 -0.158 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.722 -29.502 0.469 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.680 -30.444 0.001 1.00 0.00 H new ATOM 1229 N TYR A 83 -2.597 -28.510 -2.468 1.00 0.00 N ATOM 1230 CA TYR A 83 -3.838 -27.841 -2.842 1.00 0.00 C ATOM 1231 C TYR A 83 -3.563 -26.669 -3.780 1.00 0.00 C ATOM 1232 O TYR A 83 -4.335 -26.404 -4.702 1.00 0.00 O ATOM 1233 CB TYR A 83 -4.573 -27.349 -1.595 1.00 0.00 C ATOM 1234 CG TYR A 83 -5.671 -26.353 -1.892 1.00 0.00 C ATOM 1235 CD1 TYR A 83 -5.379 -25.015 -2.124 1.00 0.00 C ATOM 1236 CD2 TYR A 83 -7.002 -26.752 -1.943 1.00 0.00 C ATOM 1237 CE1 TYR A 83 -6.380 -24.102 -2.395 1.00 0.00 C ATOM 1238 CE2 TYR A 83 -8.009 -25.846 -2.215 1.00 0.00 C ATOM 1239 CZ TYR A 83 -7.693 -24.522 -2.440 1.00 0.00 C ATOM 1240 OH TYR A 83 -8.692 -23.616 -2.711 1.00 0.00 O ATOM 0 H TYR A 83 -2.211 -28.213 -1.572 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.467 -28.562 -3.365 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.002 -28.205 -1.075 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -3.853 -26.892 -0.916 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -4.352 -24.683 -2.092 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.253 -27.788 -1.767 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.136 -23.065 -2.571 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -9.038 -26.172 -2.251 1.00 0.00 H new ATOM 0 HH TYR A 83 -9.559 -24.074 -2.707 1.00 0.00 H new ATOM 1250 N TRP A 84 -2.459 -25.973 -3.538 1.00 0.00 N ATOM 1251 CA TRP A 84 -2.081 -24.829 -4.361 1.00 0.00 C ATOM 1252 C TRP A 84 -1.995 -25.221 -5.832 1.00 0.00 C ATOM 1253 O TRP A 84 -2.491 -24.509 -6.705 1.00 0.00 O ATOM 1254 CB TRP A 84 -0.741 -24.258 -3.893 1.00 0.00 C ATOM 1255 CG TRP A 84 -0.080 -23.382 -4.913 1.00 0.00 C ATOM 1256 CD1 TRP A 84 1.231 -23.415 -5.295 1.00 0.00 C ATOM 1257 CD2 TRP A 84 -0.698 -22.343 -5.680 1.00 0.00 C ATOM 1258 NE1 TRP A 84 1.465 -22.458 -6.253 1.00 0.00 N ATOM 1259 CE2 TRP A 84 0.298 -21.788 -6.508 1.00 0.00 C ATOM 1260 CE3 TRP A 84 -1.995 -21.829 -5.750 1.00 0.00 C ATOM 1261 CZ2 TRP A 84 0.034 -20.744 -7.391 1.00 0.00 C ATOM 1262 CZ3 TRP A 84 -2.255 -20.793 -6.627 1.00 0.00 C ATOM 1263 CH2 TRP A 84 -1.245 -20.260 -7.438 1.00 0.00 C ATOM 0 H TRP A 84 -1.810 -26.180 -2.779 1.00 0.00 H new ATOM 0 HA TRP A 84 -2.851 -24.065 -4.253 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -0.898 -23.685 -2.979 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.071 -25.081 -3.642 1.00 0.00 H new ATOM 0 HD1 TRP A 84 1.974 -24.093 -4.902 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.363 -22.276 -6.702 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -2.781 -22.234 -5.130 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.811 -20.331 -8.017 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -3.254 -20.387 -6.688 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.480 -19.451 -8.114 1.00 0.00 H new ATOM 1274 N LYS A 85 -1.362 -26.359 -6.100 1.00 0.00 N ATOM 1275 CA LYS A 85 -1.212 -26.847 -7.466 1.00 0.00 C ATOM 1276 C LYS A 85 -2.552 -26.845 -8.195 1.00 0.00 C ATOM 1277 O LYS A 85 -2.627 -26.496 -9.373 1.00 0.00 O ATOM 1278 CB LYS A 85 -0.624 -28.260 -7.462 1.00 0.00 C ATOM 1279 CG LYS A 85 0.745 -28.347 -6.809 1.00 0.00 C ATOM 1280 CD LYS A 85 1.181 -29.790 -6.619 1.00 0.00 C ATOM 1281 CE LYS A 85 2.486 -29.880 -5.843 1.00 0.00 C ATOM 1282 NZ LYS A 85 3.671 -29.803 -6.741 1.00 0.00 N ATOM 0 H LYS A 85 -0.945 -26.960 -5.389 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.531 -26.178 -7.992 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.309 -28.928 -6.940 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.551 -28.617 -8.489 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.477 -27.823 -7.424 1.00 0.00 H new ATOM 0 HG3 LYS A 85 0.721 -27.843 -5.843 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.403 -30.340 -6.089 1.00 0.00 H new ATOM 0 HD3 LYS A 85 1.301 -30.266 -7.592 1.00 0.00 H new ATOM 0 HE2 LYS A 85 2.531 -29.072 -5.113 1.00 0.00 H new ATOM 0 HE3 LYS A 85 2.513 -30.816 -5.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 4.541 -29.868 -6.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.642 -30.588 -7.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 3.659 -28.899 -7.255 1.00 0.00 H new ATOM 1296 N ASP A 86 -3.606 -27.234 -7.487 1.00 0.00 N ATOM 1297 CA ASP A 86 -4.944 -27.274 -8.066 1.00 0.00 C ATOM 1298 C ASP A 86 -5.153 -26.112 -9.031 1.00 0.00 C ATOM 1299 O ASP A 86 -5.430 -24.981 -8.629 1.00 0.00 O ATOM 1300 CB ASP A 86 -6.002 -27.234 -6.963 1.00 0.00 C ATOM 1301 CG ASP A 86 -5.749 -28.265 -5.880 1.00 0.00 C ATOM 1302 OD1 ASP A 86 -4.962 -29.202 -6.126 1.00 0.00 O ATOM 1303 OD2 ASP A 86 -6.339 -28.135 -4.787 1.00 0.00 O ATOM 0 H ASP A 86 -3.560 -27.526 -6.511 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.045 -28.207 -8.621 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.020 -26.240 -6.517 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.986 -27.405 -7.401 1.00 0.00 H new ATOM 1308 N PRO A 87 -5.018 -26.393 -10.336 1.00 0.00 N ATOM 1309 CA PRO A 87 -5.187 -25.384 -11.385 1.00 0.00 C ATOM 1310 C PRO A 87 -6.638 -24.938 -11.532 1.00 0.00 C ATOM 1311 O PRO A 87 -6.942 -24.025 -12.299 1.00 0.00 O ATOM 1312 CB PRO A 87 -4.719 -26.106 -12.651 1.00 0.00 C ATOM 1313 CG PRO A 87 -4.929 -27.552 -12.362 1.00 0.00 C ATOM 1314 CD PRO A 87 -4.689 -27.718 -10.886 1.00 0.00 C ATOM 0 HA PRO A 87 -4.630 -24.473 -11.167 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.292 -25.789 -13.522 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -3.671 -25.893 -12.864 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -5.939 -27.861 -12.630 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.242 -28.170 -12.941 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.321 -28.498 -10.461 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -3.656 -27.995 -10.675 1.00 0.00 H new ATOM 1322 N ASN A 88 -7.530 -25.588 -10.791 1.00 0.00 N ATOM 1323 CA ASN A 88 -8.949 -25.257 -10.839 1.00 0.00 C ATOM 1324 C ASN A 88 -9.383 -24.535 -9.567 1.00 0.00 C ATOM 1325 O ASN A 88 -10.529 -24.653 -9.134 1.00 0.00 O ATOM 1326 CB ASN A 88 -9.783 -26.526 -11.027 1.00 0.00 C ATOM 1327 CG ASN A 88 -9.143 -27.500 -11.997 1.00 0.00 C ATOM 1328 OD1 ASN A 88 -8.929 -28.668 -11.671 1.00 0.00 O ATOM 1329 ND2 ASN A 88 -8.833 -27.023 -13.197 1.00 0.00 N ATOM 0 H ASN A 88 -7.295 -26.346 -10.151 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.113 -24.592 -11.687 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -9.919 -27.015 -10.062 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.775 -26.255 -11.389 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.400 -27.632 -13.891 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -9.028 -26.048 -13.424 1.00 0.00 H new ATOM 1336 N ASN A 89 -8.459 -23.786 -8.974 1.00 0.00 N ATOM 1337 CA ASN A 89 -8.746 -23.043 -7.752 1.00 0.00 C ATOM 1338 C ASN A 89 -9.285 -21.653 -8.074 1.00 0.00 C ATOM 1339 O ASN A 89 -9.078 -21.134 -9.171 1.00 0.00 O ATOM 1340 CB ASN A 89 -7.485 -22.927 -6.894 1.00 0.00 C ATOM 1341 CG ASN A 89 -7.323 -24.097 -5.942 1.00 0.00 C ATOM 1342 OD1 ASN A 89 -8.277 -24.825 -5.668 1.00 0.00 O ATOM 1343 ND2 ASN A 89 -6.111 -24.282 -5.433 1.00 0.00 N ATOM 0 H ASN A 89 -7.505 -23.677 -9.320 1.00 0.00 H new ATOM 0 HA ASN A 89 -9.508 -23.588 -7.195 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -6.611 -22.867 -7.543 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.522 -22.000 -6.322 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -5.941 -25.053 -4.787 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.349 -23.654 -5.688 1.00 0.00 H new ATOM 1350 N ASP A 90 -9.978 -21.056 -7.111 1.00 0.00 N ATOM 1351 CA ASP A 90 -10.546 -19.725 -7.290 1.00 0.00 C ATOM 1352 C ASP A 90 -9.445 -18.674 -7.402 1.00 0.00 C ATOM 1353 O ASP A 90 -9.665 -17.583 -7.927 1.00 0.00 O ATOM 1354 CB ASP A 90 -11.477 -19.383 -6.126 1.00 0.00 C ATOM 1355 CG ASP A 90 -12.755 -20.198 -6.149 1.00 0.00 C ATOM 1356 OD1 ASP A 90 -12.739 -21.342 -5.648 1.00 0.00 O ATOM 1357 OD2 ASP A 90 -13.772 -19.691 -6.666 1.00 0.00 O ATOM 0 H ASP A 90 -10.160 -21.473 -6.198 1.00 0.00 H new ATOM 0 HA ASP A 90 -11.120 -19.724 -8.217 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.956 -19.556 -5.185 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.725 -18.322 -6.162 1.00 0.00 H new ATOM 1362 N PHE A 91 -8.260 -19.012 -6.905 1.00 0.00 N ATOM 1363 CA PHE A 91 -7.125 -18.097 -6.947 1.00 0.00 C ATOM 1364 C PHE A 91 -6.592 -17.957 -8.370 1.00 0.00 C ATOM 1365 O PHE A 91 -6.383 -16.846 -8.859 1.00 0.00 O ATOM 1366 CB PHE A 91 -6.011 -18.589 -6.020 1.00 0.00 C ATOM 1367 CG PHE A 91 -6.378 -18.542 -4.565 1.00 0.00 C ATOM 1368 CD1 PHE A 91 -6.267 -17.362 -3.847 1.00 0.00 C ATOM 1369 CD2 PHE A 91 -6.836 -19.676 -3.915 1.00 0.00 C ATOM 1370 CE1 PHE A 91 -6.603 -17.316 -2.507 1.00 0.00 C ATOM 1371 CE2 PHE A 91 -7.174 -19.636 -2.575 1.00 0.00 C ATOM 1372 CZ PHE A 91 -7.058 -18.454 -1.871 1.00 0.00 C ATOM 0 H PHE A 91 -8.061 -19.912 -6.469 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.466 -17.119 -6.607 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.752 -19.613 -6.288 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -5.120 -17.982 -6.182 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.914 -16.468 -4.340 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -6.930 -20.603 -4.462 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.510 -16.391 -1.958 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.528 -20.528 -2.080 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.323 -18.420 -0.825 1.00 0.00 H new ATOM 1382 N ARG A 92 -6.375 -19.090 -9.029 1.00 0.00 N ATOM 1383 CA ARG A 92 -5.866 -19.095 -10.395 1.00 0.00 C ATOM 1384 C ARG A 92 -6.995 -18.871 -11.397 1.00 0.00 C ATOM 1385 O ARG A 92 -6.749 -18.604 -12.573 1.00 0.00 O ATOM 1386 CB ARG A 92 -5.159 -20.418 -10.694 1.00 0.00 C ATOM 1387 CG ARG A 92 -4.199 -20.856 -9.600 1.00 0.00 C ATOM 1388 CD ARG A 92 -3.909 -22.347 -9.678 1.00 0.00 C ATOM 1389 NE ARG A 92 -2.577 -22.673 -9.174 1.00 0.00 N ATOM 1390 CZ ARG A 92 -1.453 -22.286 -9.766 1.00 0.00 C ATOM 1391 NH1 ARG A 92 -1.499 -21.564 -10.877 1.00 0.00 N ATOM 1392 NH2 ARG A 92 -0.279 -22.622 -9.246 1.00 0.00 N ATOM 0 H ARG A 92 -6.544 -20.017 -8.639 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.150 -18.279 -10.492 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -5.908 -21.196 -10.841 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.610 -20.323 -11.631 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.267 -20.298 -9.687 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.623 -20.617 -8.625 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.658 -22.892 -9.103 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -3.997 -22.680 -10.712 1.00 0.00 H new ATOM 0 HE ARG A 92 -2.507 -23.228 -8.321 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.400 -21.304 -11.279 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.634 -21.268 -11.329 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.240 -23.178 -8.391 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.584 -22.325 -9.701 1.00 0.00 H new ATOM 1406 N GLN A 93 -8.231 -18.982 -10.923 1.00 0.00 N ATOM 1407 CA GLN A 93 -9.397 -18.793 -11.778 1.00 0.00 C ATOM 1408 C GLN A 93 -9.920 -17.364 -11.677 1.00 0.00 C ATOM 1409 O GLN A 93 -10.395 -16.794 -12.659 1.00 0.00 O ATOM 1410 CB GLN A 93 -10.501 -19.781 -11.397 1.00 0.00 C ATOM 1411 CG GLN A 93 -10.100 -21.237 -11.569 1.00 0.00 C ATOM 1412 CD GLN A 93 -10.413 -21.769 -12.953 1.00 0.00 C ATOM 1413 OE1 GLN A 93 -11.556 -22.116 -13.253 1.00 0.00 O ATOM 1414 NE2 GLN A 93 -9.398 -21.835 -13.806 1.00 0.00 N ATOM 0 H GLN A 93 -8.451 -19.202 -9.952 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.094 -18.978 -12.809 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -10.786 -19.612 -10.359 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.382 -19.581 -12.006 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -9.032 -21.341 -11.377 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.618 -21.843 -10.825 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.467 -21.537 -13.515 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.549 -22.184 -14.752 1.00 0.00 H new ATOM 1423 N LYS A 94 -9.831 -16.789 -10.482 1.00 0.00 N ATOM 1424 CA LYS A 94 -10.294 -15.426 -10.251 1.00 0.00 C ATOM 1425 C LYS A 94 -9.117 -14.460 -10.157 1.00 0.00 C ATOM 1426 O LYS A 94 -9.056 -13.468 -10.885 1.00 0.00 O ATOM 1427 CB LYS A 94 -11.126 -15.359 -8.969 1.00 0.00 C ATOM 1428 CG LYS A 94 -12.268 -16.359 -8.931 1.00 0.00 C ATOM 1429 CD LYS A 94 -13.534 -15.784 -9.546 1.00 0.00 C ATOM 1430 CE LYS A 94 -14.694 -16.762 -9.450 1.00 0.00 C ATOM 1431 NZ LYS A 94 -15.819 -16.379 -10.348 1.00 0.00 N ATOM 0 H LYS A 94 -9.442 -17.247 -9.658 1.00 0.00 H new ATOM 0 HA LYS A 94 -10.916 -15.132 -11.096 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.474 -15.533 -8.113 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -11.532 -14.353 -8.861 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -11.980 -17.263 -9.468 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.464 -16.650 -7.899 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -13.797 -14.855 -9.039 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -13.352 -15.536 -10.592 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -14.348 -17.763 -9.709 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -15.049 -16.804 -8.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -16.590 -17.071 -10.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -16.167 -15.435 -10.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -15.487 -16.364 -11.333 1.00 0.00 H new ATOM 1445 N LEU A 95 -8.185 -14.757 -9.259 1.00 0.00 N ATOM 1446 CA LEU A 95 -7.008 -13.915 -9.071 1.00 0.00 C ATOM 1447 C LEU A 95 -5.924 -14.260 -10.087 1.00 0.00 C ATOM 1448 O LEU A 95 -4.880 -13.610 -10.143 1.00 0.00 O ATOM 1449 CB LEU A 95 -6.462 -14.076 -7.652 1.00 0.00 C ATOM 1450 CG LEU A 95 -7.430 -13.736 -6.518 1.00 0.00 C ATOM 1451 CD1 LEU A 95 -6.832 -14.117 -5.173 1.00 0.00 C ATOM 1452 CD2 LEU A 95 -7.786 -12.257 -6.546 1.00 0.00 C ATOM 0 H LEU A 95 -8.221 -15.574 -8.649 1.00 0.00 H new ATOM 0 HA LEU A 95 -7.306 -12.878 -9.223 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.133 -15.108 -7.525 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -5.579 -13.445 -7.550 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.344 -14.312 -6.662 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.535 -13.868 -4.378 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.629 -15.188 -5.155 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.902 -13.569 -5.020 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.476 -12.033 -5.732 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -6.880 -11.662 -6.428 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -8.258 -12.014 -7.498 1.00 0.00 H new ATOM 1464 N LYS A 96 -6.179 -15.287 -10.891 1.00 0.00 N ATOM 1465 CA LYS A 96 -5.227 -15.718 -11.908 1.00 0.00 C ATOM 1466 C LYS A 96 -3.797 -15.630 -11.387 1.00 0.00 C ATOM 1467 O LYS A 96 -2.905 -15.130 -12.074 1.00 0.00 O ATOM 1468 CB LYS A 96 -5.375 -14.863 -13.169 1.00 0.00 C ATOM 1469 CG LYS A 96 -6.610 -15.196 -13.989 1.00 0.00 C ATOM 1470 CD LYS A 96 -7.881 -14.739 -13.293 1.00 0.00 C ATOM 1471 CE LYS A 96 -8.993 -14.459 -14.292 1.00 0.00 C ATOM 1472 NZ LYS A 96 -8.840 -13.123 -14.932 1.00 0.00 N ATOM 0 H LYS A 96 -7.038 -15.837 -10.858 1.00 0.00 H new ATOM 0 HA LYS A 96 -5.442 -16.758 -12.154 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.412 -13.812 -12.883 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -4.490 -14.993 -13.792 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -6.538 -14.720 -14.967 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -6.655 -16.271 -14.161 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -8.207 -15.505 -12.589 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.676 -13.839 -12.713 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -8.994 -15.232 -15.061 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -9.957 -14.511 -13.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -9.617 -12.970 -15.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -8.865 -12.383 -14.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -7.931 -13.082 -15.436 1.00 0.00 H new ATOM 1486 N ILE A 97 -3.584 -16.121 -10.171 1.00 0.00 N ATOM 1487 CA ILE A 97 -2.261 -16.100 -9.559 1.00 0.00 C ATOM 1488 C ILE A 97 -1.251 -16.866 -10.408 1.00 0.00 C ATOM 1489 O ILE A 97 -1.516 -17.984 -10.850 1.00 0.00 O ATOM 1490 CB ILE A 97 -2.286 -16.702 -8.142 1.00 0.00 C ATOM 1491 CG1 ILE A 97 -3.331 -15.991 -7.280 1.00 0.00 C ATOM 1492 CG2 ILE A 97 -0.909 -16.606 -7.502 1.00 0.00 C ATOM 1493 CD1 ILE A 97 -3.089 -14.504 -7.142 1.00 0.00 C ATOM 0 H ILE A 97 -4.311 -16.538 -9.590 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.959 -15.055 -9.494 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.559 -17.755 -8.215 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.318 -16.152 -7.713 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.341 -16.443 -6.288 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -0.942 -17.036 -6.501 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.187 -17.154 -8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.610 -15.560 -7.438 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.868 -14.065 -6.518 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.116 -14.335 -6.681 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.109 -14.039 -8.128 1.00 0.00 H new ATOM 1505 N THR A 98 -0.091 -16.257 -10.630 1.00 0.00 N ATOM 1506 CA THR A 98 0.960 -16.881 -11.425 1.00 0.00 C ATOM 1507 C THR A 98 1.714 -17.929 -10.613 1.00 0.00 C ATOM 1508 O THR A 98 1.694 -19.114 -10.942 1.00 0.00 O ATOM 1509 CB THR A 98 1.962 -15.837 -11.951 1.00 0.00 C ATOM 1510 OG1 THR A 98 1.283 -14.869 -12.758 1.00 0.00 O ATOM 1511 CG2 THR A 98 3.061 -16.503 -12.765 1.00 0.00 C ATOM 0 H THR A 98 0.145 -15.332 -10.271 1.00 0.00 H new ATOM 0 HA THR A 98 0.472 -17.363 -12.272 1.00 0.00 H new ATOM 0 HB THR A 98 2.417 -15.340 -11.095 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.941 -14.305 -13.215 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.757 -15.745 -13.126 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.595 -17.217 -12.139 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.620 -17.024 -13.614 1.00 0.00 H new ATOM 1519 N ALA A 99 2.377 -17.483 -9.551 1.00 0.00 N ATOM 1520 CA ALA A 99 3.135 -18.383 -8.691 1.00 0.00 C ATOM 1521 C ALA A 99 3.318 -17.788 -7.300 1.00 0.00 C ATOM 1522 O ALA A 99 3.817 -16.672 -7.151 1.00 0.00 O ATOM 1523 CB ALA A 99 4.487 -18.696 -9.316 1.00 0.00 C ATOM 0 H ALA A 99 2.404 -16.504 -9.266 1.00 0.00 H new ATOM 0 HA ALA A 99 2.571 -19.310 -8.589 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.043 -19.369 -8.663 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.338 -19.171 -10.286 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.050 -17.772 -9.448 1.00 0.00 H new ATOM 1529 N VAL A 100 2.911 -18.540 -6.281 1.00 0.00 N ATOM 1530 CA VAL A 100 3.031 -18.086 -4.901 1.00 0.00 C ATOM 1531 C VAL A 100 4.460 -18.244 -4.393 1.00 0.00 C ATOM 1532 O VAL A 100 5.195 -19.143 -4.800 1.00 0.00 O ATOM 1533 CB VAL A 100 2.079 -18.861 -3.971 1.00 0.00 C ATOM 1534 CG1 VAL A 100 0.630 -18.520 -4.285 1.00 0.00 C ATOM 1535 CG2 VAL A 100 2.320 -20.359 -4.090 1.00 0.00 C ATOM 0 H VAL A 100 2.496 -19.466 -6.386 1.00 0.00 H new ATOM 0 HA VAL A 100 2.759 -17.031 -4.890 1.00 0.00 H new ATOM 0 HB VAL A 100 2.283 -18.564 -2.942 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.028 -19.077 -3.618 1.00 0.00 H new ATOM 0 HG12 VAL A 100 0.469 -17.451 -4.144 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.409 -18.787 -5.318 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.639 -20.891 -3.426 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.145 -20.675 -5.118 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.349 -20.585 -3.811 1.00 0.00 H new ATOM 1545 N PRO A 101 4.865 -17.348 -3.480 1.00 0.00 N ATOM 1546 CA PRO A 101 4.000 -16.273 -2.987 1.00 0.00 C ATOM 1547 C PRO A 101 3.730 -15.213 -4.050 1.00 0.00 C ATOM 1548 O PRO A 101 4.640 -14.787 -4.763 1.00 0.00 O ATOM 1549 CB PRO A 101 4.801 -15.675 -1.828 1.00 0.00 C ATOM 1550 CG PRO A 101 6.221 -15.993 -2.146 1.00 0.00 C ATOM 1551 CD PRO A 101 6.200 -17.317 -2.859 1.00 0.00 C ATOM 0 HA PRO A 101 3.016 -16.643 -2.697 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.644 -14.599 -1.751 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.502 -16.110 -0.874 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.663 -15.219 -2.773 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.821 -16.048 -1.238 1.00 0.00 H new ATOM 0 HD2 PRO A 101 6.992 -17.384 -3.605 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.341 -18.148 -2.168 1.00 0.00 H new ATOM 1559 N THR A 102 2.474 -14.790 -4.152 1.00 0.00 N ATOM 1560 CA THR A 102 2.084 -13.781 -5.129 1.00 0.00 C ATOM 1561 C THR A 102 1.587 -12.514 -4.442 1.00 0.00 C ATOM 1562 O THR A 102 0.542 -12.520 -3.788 1.00 0.00 O ATOM 1563 CB THR A 102 0.985 -14.305 -6.072 1.00 0.00 C ATOM 1564 OG1 THR A 102 1.419 -15.514 -6.705 1.00 0.00 O ATOM 1565 CG2 THR A 102 0.638 -13.268 -7.129 1.00 0.00 C ATOM 0 H THR A 102 1.709 -15.131 -3.570 1.00 0.00 H new ATOM 0 HA THR A 102 2.973 -13.549 -5.715 1.00 0.00 H new ATOM 0 HB THR A 102 0.093 -14.506 -5.479 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.398 -15.543 -6.718 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.140 -13.661 -7.783 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.280 -12.360 -6.644 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.526 -13.039 -7.719 1.00 0.00 H new ATOM 1573 N LEU A 103 2.339 -11.430 -4.594 1.00 0.00 N ATOM 1574 CA LEU A 103 1.973 -10.154 -3.988 1.00 0.00 C ATOM 1575 C LEU A 103 1.262 -9.256 -4.996 1.00 0.00 C ATOM 1576 O LEU A 103 1.901 -8.618 -5.833 1.00 0.00 O ATOM 1577 CB LEU A 103 3.218 -9.448 -3.448 1.00 0.00 C ATOM 1578 CG LEU A 103 2.978 -8.117 -2.735 1.00 0.00 C ATOM 1579 CD1 LEU A 103 2.168 -8.329 -1.466 1.00 0.00 C ATOM 1580 CD2 LEU A 103 4.302 -7.436 -2.417 1.00 0.00 C ATOM 0 H LEU A 103 3.206 -11.408 -5.131 1.00 0.00 H new ATOM 0 HA LEU A 103 1.290 -10.354 -3.163 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.722 -10.122 -2.756 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.902 -9.274 -4.279 1.00 0.00 H new ATOM 0 HG LEU A 103 2.409 -7.468 -3.401 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.007 -7.370 -0.972 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.205 -8.773 -1.719 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.710 -8.996 -0.796 1.00 0.00 H new ATOM 0 HD21 LEU A 103 4.112 -6.490 -1.910 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.897 -8.081 -1.771 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.846 -7.248 -3.343 1.00 0.00 H new ATOM 1592 N LEU A 104 -0.063 -9.211 -4.908 1.00 0.00 N ATOM 1593 CA LEU A 104 -0.861 -8.389 -5.811 1.00 0.00 C ATOM 1594 C LEU A 104 -1.284 -7.089 -5.134 1.00 0.00 C ATOM 1595 O LEU A 104 -1.726 -7.090 -3.985 1.00 0.00 O ATOM 1596 CB LEU A 104 -2.098 -9.161 -6.276 1.00 0.00 C ATOM 1597 CG LEU A 104 -3.312 -8.315 -6.659 1.00 0.00 C ATOM 1598 CD1 LEU A 104 -3.081 -7.622 -7.993 1.00 0.00 C ATOM 1599 CD2 LEU A 104 -4.566 -9.176 -6.713 1.00 0.00 C ATOM 0 H LEU A 104 -0.607 -9.734 -4.221 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.247 -8.143 -6.677 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.819 -9.771 -7.136 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.394 -9.846 -5.482 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.453 -7.550 -5.896 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.956 -7.024 -8.249 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.208 -6.974 -7.920 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.914 -8.370 -8.768 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.421 -8.557 -6.987 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.435 -9.963 -7.455 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.742 -9.625 -5.735 1.00 0.00 H new ATOM 1611 N LYS A 105 -1.147 -5.982 -5.855 1.00 0.00 N ATOM 1612 CA LYS A 105 -1.518 -4.674 -5.327 1.00 0.00 C ATOM 1613 C LYS A 105 -2.925 -4.287 -5.770 1.00 0.00 C ATOM 1614 O LYS A 105 -3.111 -3.688 -6.829 1.00 0.00 O ATOM 1615 CB LYS A 105 -0.517 -3.612 -5.789 1.00 0.00 C ATOM 1616 CG LYS A 105 -0.823 -2.220 -5.266 1.00 0.00 C ATOM 1617 CD LYS A 105 0.341 -1.270 -5.495 1.00 0.00 C ATOM 1618 CE LYS A 105 0.110 0.069 -4.812 1.00 0.00 C ATOM 1619 NZ LYS A 105 -0.664 1.005 -5.674 1.00 0.00 N ATOM 0 H LYS A 105 -0.782 -5.964 -6.807 1.00 0.00 H new ATOM 0 HA LYS A 105 -1.502 -4.732 -4.239 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.483 -3.901 -5.465 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.504 -3.587 -6.879 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.713 -1.832 -5.761 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -1.047 -2.272 -4.201 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.259 -1.719 -5.116 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.480 -1.115 -6.565 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.425 -0.089 -3.875 1.00 0.00 H new ATOM 0 HE3 LYS A 105 1.070 0.518 -4.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -0.800 1.906 -5.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.142 1.176 -6.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -1.591 0.588 -5.895 1.00 0.00 H new ATOM 1633 N TYR A 106 -3.913 -4.633 -4.952 1.00 0.00 N ATOM 1634 CA TYR A 106 -5.304 -4.322 -5.259 1.00 0.00 C ATOM 1635 C TYR A 106 -5.442 -2.894 -5.777 1.00 0.00 C ATOM 1636 O TYR A 106 -5.278 -1.932 -5.028 1.00 0.00 O ATOM 1637 CB TYR A 106 -6.178 -4.514 -4.018 1.00 0.00 C ATOM 1638 CG TYR A 106 -7.604 -4.901 -4.336 1.00 0.00 C ATOM 1639 CD1 TYR A 106 -7.884 -5.940 -5.216 1.00 0.00 C ATOM 1640 CD2 TYR A 106 -8.673 -4.229 -3.756 1.00 0.00 C ATOM 1641 CE1 TYR A 106 -9.186 -6.297 -5.510 1.00 0.00 C ATOM 1642 CE2 TYR A 106 -9.978 -4.580 -4.043 1.00 0.00 C ATOM 1643 CZ TYR A 106 -10.229 -5.614 -4.921 1.00 0.00 C ATOM 1644 OH TYR A 106 -11.527 -5.967 -5.209 1.00 0.00 O ATOM 0 H TYR A 106 -3.776 -5.129 -4.071 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.638 -5.006 -6.039 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.734 -5.283 -3.387 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -6.181 -3.590 -3.440 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.069 -6.478 -5.678 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.480 -3.418 -3.069 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.386 -7.106 -6.197 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.797 -4.048 -3.583 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.142 -5.388 -4.711 1.00 0.00 H new ATOM 1654 N GLY A 107 -5.746 -2.764 -7.065 1.00 0.00 N ATOM 1655 CA GLY A 107 -5.902 -1.451 -7.662 1.00 0.00 C ATOM 1656 C GLY A 107 -5.005 -1.252 -8.867 1.00 0.00 C ATOM 1657 O GLY A 107 -5.302 -0.441 -9.745 1.00 0.00 O ATOM 0 H GLY A 107 -5.887 -3.545 -7.706 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.941 -1.312 -7.960 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.679 -0.688 -6.917 1.00 0.00 H new ATOM 1661 N THR A 108 -3.902 -1.993 -8.911 1.00 0.00 N ATOM 1662 CA THR A 108 -2.957 -1.892 -10.017 1.00 0.00 C ATOM 1663 C THR A 108 -2.443 -3.267 -10.427 1.00 0.00 C ATOM 1664 O THR A 108 -2.341 -4.186 -9.614 1.00 0.00 O ATOM 1665 CB THR A 108 -1.759 -0.996 -9.651 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.003 -1.596 -8.594 1.00 0.00 O ATOM 1667 CG2 THR A 108 -2.227 0.387 -9.225 1.00 0.00 C ATOM 0 H THR A 108 -3.641 -2.670 -8.194 1.00 0.00 H new ATOM 0 HA THR A 108 -3.494 -1.444 -10.853 1.00 0.00 H new ATOM 0 HB THR A 108 -1.129 -0.892 -10.534 1.00 0.00 H new ATOM 0 HG1 THR A 108 -1.614 -1.952 -7.916 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.363 1.001 -8.971 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.776 0.853 -10.043 1.00 0.00 H new ATOM 0 HG23 THR A 108 -2.877 0.299 -8.355 1.00 0.00 H new ATOM 1675 N PRO A 109 -2.110 -3.414 -11.718 1.00 0.00 N ATOM 1676 CA PRO A 109 -1.598 -4.674 -12.265 1.00 0.00 C ATOM 1677 C PRO A 109 -0.195 -4.996 -11.765 1.00 0.00 C ATOM 1678 O PRO A 109 0.405 -5.992 -12.170 1.00 0.00 O ATOM 1679 CB PRO A 109 -1.584 -4.425 -13.775 1.00 0.00 C ATOM 1680 CG PRO A 109 -1.467 -2.946 -13.914 1.00 0.00 C ATOM 1681 CD PRO A 109 -2.206 -2.361 -12.743 1.00 0.00 C ATOM 0 HA PRO A 109 -2.208 -5.526 -11.965 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -0.747 -4.935 -14.253 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.494 -4.796 -14.246 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -0.422 -2.635 -13.911 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.898 -2.607 -14.856 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -1.751 -1.429 -12.406 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -3.243 -2.137 -12.993 1.00 0.00 H new ATOM 1689 N GLN A 110 0.323 -4.148 -10.882 1.00 0.00 N ATOM 1690 CA GLN A 110 1.657 -4.344 -10.327 1.00 0.00 C ATOM 1691 C GLN A 110 1.651 -5.442 -9.269 1.00 0.00 C ATOM 1692 O GLN A 110 1.085 -5.274 -8.188 1.00 0.00 O ATOM 1693 CB GLN A 110 2.177 -3.039 -9.722 1.00 0.00 C ATOM 1694 CG GLN A 110 2.945 -2.174 -10.709 1.00 0.00 C ATOM 1695 CD GLN A 110 4.013 -1.332 -10.039 1.00 0.00 C ATOM 1696 OE1 GLN A 110 5.186 -1.383 -10.413 1.00 0.00 O ATOM 1697 NE2 GLN A 110 3.613 -0.550 -9.043 1.00 0.00 N ATOM 0 H GLN A 110 -0.161 -3.319 -10.536 1.00 0.00 H new ATOM 0 HA GLN A 110 2.319 -4.650 -11.137 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.335 -2.469 -9.331 1.00 0.00 H new ATOM 0 HB3 GLN A 110 2.824 -3.273 -8.876 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.409 -2.812 -11.461 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.248 -1.520 -11.233 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.631 -0.539 -8.766 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.287 0.040 -8.555 1.00 0.00 H new ATOM 1706 N LYS A 111 2.284 -6.566 -9.586 1.00 0.00 N ATOM 1707 CA LYS A 111 2.352 -7.692 -8.663 1.00 0.00 C ATOM 1708 C LYS A 111 3.765 -8.266 -8.608 1.00 0.00 C ATOM 1709 O LYS A 111 4.491 -8.250 -9.603 1.00 0.00 O ATOM 1710 CB LYS A 111 1.364 -8.783 -9.082 1.00 0.00 C ATOM 1711 CG LYS A 111 1.630 -9.346 -10.467 1.00 0.00 C ATOM 1712 CD LYS A 111 2.582 -10.530 -10.414 1.00 0.00 C ATOM 1713 CE LYS A 111 1.844 -11.824 -10.106 1.00 0.00 C ATOM 1714 NZ LYS A 111 1.137 -12.357 -11.304 1.00 0.00 N ATOM 0 H LYS A 111 2.758 -6.721 -10.476 1.00 0.00 H new ATOM 0 HA LYS A 111 2.086 -7.331 -7.670 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.403 -9.595 -8.356 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.353 -8.377 -9.052 1.00 0.00 H new ATOM 0 HG2 LYS A 111 0.689 -9.655 -10.922 1.00 0.00 H new ATOM 0 HG3 LYS A 111 2.051 -8.567 -11.103 1.00 0.00 H new ATOM 0 HD2 LYS A 111 3.101 -10.624 -11.368 1.00 0.00 H new ATOM 0 HD3 LYS A 111 3.342 -10.353 -9.653 1.00 0.00 H new ATOM 0 HE2 LYS A 111 2.552 -12.568 -9.741 1.00 0.00 H new ATOM 0 HE3 LYS A 111 1.124 -11.650 -9.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 0.128 -12.479 -11.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 1.242 -11.689 -12.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 1.547 -13.275 -11.569 1.00 0.00 H new ATOM 1728 N LEU A 112 4.148 -8.773 -7.442 1.00 0.00 N ATOM 1729 CA LEU A 112 5.474 -9.354 -7.259 1.00 0.00 C ATOM 1730 C LEU A 112 5.383 -10.861 -7.040 1.00 0.00 C ATOM 1731 O LEU A 112 4.681 -11.328 -6.143 1.00 0.00 O ATOM 1732 CB LEU A 112 6.180 -8.697 -6.071 1.00 0.00 C ATOM 1733 CG LEU A 112 6.279 -7.172 -6.110 1.00 0.00 C ATOM 1734 CD1 LEU A 112 6.897 -6.644 -4.824 1.00 0.00 C ATOM 1735 CD2 LEU A 112 7.089 -6.720 -7.317 1.00 0.00 C ATOM 0 H LEU A 112 3.560 -8.794 -6.609 1.00 0.00 H new ATOM 0 HA LEU A 112 6.052 -9.171 -8.165 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.657 -8.984 -5.159 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.188 -9.105 -6.002 1.00 0.00 H new ATOM 0 HG LEU A 112 5.272 -6.764 -6.200 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.959 -5.557 -4.870 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.278 -6.936 -3.976 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.897 -7.060 -4.703 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.149 -5.632 -7.328 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.094 -7.138 -7.258 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.605 -7.066 -8.230 1.00 0.00 H new ATOM 1747 N VAL A 113 6.099 -11.618 -7.866 1.00 0.00 N ATOM 1748 CA VAL A 113 6.102 -13.072 -7.761 1.00 0.00 C ATOM 1749 C VAL A 113 7.127 -13.547 -6.738 1.00 0.00 C ATOM 1750 O VAL A 113 7.879 -12.748 -6.182 1.00 0.00 O ATOM 1751 CB VAL A 113 6.405 -13.732 -9.120 1.00 0.00 C ATOM 1752 CG1 VAL A 113 5.706 -15.078 -9.227 1.00 0.00 C ATOM 1753 CG2 VAL A 113 5.992 -12.815 -10.261 1.00 0.00 C ATOM 0 H VAL A 113 6.684 -11.248 -8.615 1.00 0.00 H new ATOM 0 HA VAL A 113 5.105 -13.368 -7.436 1.00 0.00 H new ATOM 0 HB VAL A 113 7.479 -13.901 -9.191 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.931 -15.529 -10.193 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.056 -15.734 -8.430 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.629 -14.937 -9.135 1.00 0.00 H new ATOM 0 HG21 VAL A 113 6.213 -13.297 -11.213 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.923 -12.613 -10.196 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.544 -11.877 -10.192 1.00 0.00 H new ATOM 1763 N GLU A 114 7.150 -14.854 -6.494 1.00 0.00 N ATOM 1764 CA GLU A 114 8.083 -15.435 -5.537 1.00 0.00 C ATOM 1765 C GLU A 114 9.395 -14.656 -5.514 1.00 0.00 C ATOM 1766 O GLU A 114 9.774 -14.088 -4.489 1.00 0.00 O ATOM 1767 CB GLU A 114 8.354 -16.901 -5.880 1.00 0.00 C ATOM 1768 CG GLU A 114 7.105 -17.679 -6.259 1.00 0.00 C ATOM 1769 CD GLU A 114 7.315 -19.180 -6.212 1.00 0.00 C ATOM 1770 OE1 GLU A 114 8.109 -19.642 -5.367 1.00 0.00 O ATOM 1771 OE2 GLU A 114 6.684 -19.892 -7.020 1.00 0.00 O ATOM 0 H GLU A 114 6.533 -15.529 -6.946 1.00 0.00 H new ATOM 0 HA GLU A 114 7.630 -15.379 -4.547 1.00 0.00 H new ATOM 0 HB2 GLU A 114 9.065 -16.947 -6.705 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.827 -17.384 -5.025 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.294 -17.408 -5.583 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.793 -17.391 -7.263 1.00 0.00 H new ATOM 1778 N SER A 115 10.084 -14.635 -6.650 1.00 0.00 N ATOM 1779 CA SER A 115 11.356 -13.930 -6.760 1.00 0.00 C ATOM 1780 C SER A 115 11.194 -12.457 -6.394 1.00 0.00 C ATOM 1781 O SER A 115 11.962 -11.917 -5.599 1.00 0.00 O ATOM 1782 CB SER A 115 11.912 -14.056 -8.180 1.00 0.00 C ATOM 1783 OG SER A 115 12.472 -15.339 -8.396 1.00 0.00 O ATOM 0 H SER A 115 9.783 -15.098 -7.508 1.00 0.00 H new ATOM 0 HA SER A 115 12.057 -14.385 -6.061 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.116 -13.877 -8.903 1.00 0.00 H new ATOM 0 HB3 SER A 115 12.671 -13.292 -8.346 1.00 0.00 H new ATOM 0 HG SER A 115 12.819 -15.395 -9.311 1.00 0.00 H new ATOM 1789 N GLU A 116 10.189 -11.815 -6.981 1.00 0.00 N ATOM 1790 CA GLU A 116 9.927 -10.405 -6.717 1.00 0.00 C ATOM 1791 C GLU A 116 9.414 -10.204 -5.294 1.00 0.00 C ATOM 1792 O GLU A 116 9.305 -9.074 -4.816 1.00 0.00 O ATOM 1793 CB GLU A 116 8.909 -9.856 -7.720 1.00 0.00 C ATOM 1794 CG GLU A 116 9.260 -10.154 -9.168 1.00 0.00 C ATOM 1795 CD GLU A 116 8.523 -9.257 -10.143 1.00 0.00 C ATOM 1796 OE1 GLU A 116 9.009 -8.136 -10.402 1.00 0.00 O ATOM 1797 OE2 GLU A 116 7.460 -9.676 -10.647 1.00 0.00 O ATOM 0 H GLU A 116 9.544 -12.248 -7.642 1.00 0.00 H new ATOM 0 HA GLU A 116 10.865 -9.861 -6.827 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.929 -10.278 -7.498 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.828 -8.777 -7.589 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.334 -10.034 -9.310 1.00 0.00 H new ATOM 0 HG3 GLU A 116 9.024 -11.195 -9.388 1.00 0.00 H new ATOM 1804 N CYS A 117 9.100 -11.307 -4.623 1.00 0.00 N ATOM 1805 CA CYS A 117 8.598 -11.252 -3.255 1.00 0.00 C ATOM 1806 C CYS A 117 9.739 -11.378 -2.251 1.00 0.00 C ATOM 1807 O CYS A 117 9.558 -11.137 -1.057 1.00 0.00 O ATOM 1808 CB CYS A 117 7.573 -12.363 -3.022 1.00 0.00 C ATOM 1809 SG CYS A 117 5.942 -12.023 -3.725 1.00 0.00 S ATOM 0 H CYS A 117 9.184 -12.249 -5.004 1.00 0.00 H new ATOM 0 HA CYS A 117 8.116 -10.285 -3.110 1.00 0.00 H new ATOM 0 HB2 CYS A 117 7.955 -13.290 -3.449 1.00 0.00 H new ATOM 0 HB3 CYS A 117 7.468 -12.526 -1.949 1.00 0.00 H new ATOM 0 HG CYS A 117 6.054 -11.826 -5.005 1.00 0.00 H new ATOM 1815 N CYS A 118 10.913 -11.758 -2.743 1.00 0.00 N ATOM 1816 CA CYS A 118 12.084 -11.918 -1.888 1.00 0.00 C ATOM 1817 C CYS A 118 13.081 -10.786 -2.114 1.00 0.00 C ATOM 1818 O CYS A 118 14.063 -10.657 -1.383 1.00 0.00 O ATOM 1819 CB CYS A 118 12.756 -13.266 -2.156 1.00 0.00 C ATOM 1820 SG CYS A 118 14.390 -13.439 -1.401 1.00 0.00 S ATOM 0 H CYS A 118 11.079 -11.961 -3.729 1.00 0.00 H new ATOM 0 HA CYS A 118 11.753 -11.885 -0.850 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.110 -14.062 -1.785 1.00 0.00 H new ATOM 0 HB3 CYS A 118 12.848 -13.406 -3.233 1.00 0.00 H new ATOM 0 HG CYS A 118 14.869 -12.262 -1.129 1.00 0.00 H new ATOM 1826 N GLN A 119 12.821 -9.969 -3.130 1.00 0.00 N ATOM 1827 CA GLN A 119 13.697 -8.849 -3.452 1.00 0.00 C ATOM 1828 C GLN A 119 13.240 -7.579 -2.744 1.00 0.00 C ATOM 1829 O GLN A 119 12.442 -6.810 -3.280 1.00 0.00 O ATOM 1830 CB GLN A 119 13.731 -8.620 -4.964 1.00 0.00 C ATOM 1831 CG GLN A 119 14.717 -9.518 -5.694 1.00 0.00 C ATOM 1832 CD GLN A 119 14.764 -10.921 -5.120 1.00 0.00 C ATOM 1833 OE1 GLN A 119 15.118 -11.117 -3.957 1.00 0.00 O ATOM 1834 NE2 GLN A 119 14.404 -11.906 -5.934 1.00 0.00 N ATOM 0 H GLN A 119 12.012 -10.062 -3.744 1.00 0.00 H new ATOM 0 HA GLN A 119 14.701 -9.094 -3.106 1.00 0.00 H new ATOM 0 HB2 GLN A 119 12.733 -8.784 -5.370 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.987 -7.579 -5.160 1.00 0.00 H new ATOM 0 HG2 GLN A 119 14.444 -9.570 -6.748 1.00 0.00 H new ATOM 0 HG3 GLN A 119 15.712 -9.075 -5.644 1.00 0.00 H new ATOM 0 HE21 GLN A 119 14.117 -11.698 -6.891 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.414 -12.871 -5.603 1.00 0.00 H new ATOM 1843 N SER A 120 13.751 -7.364 -1.535 1.00 0.00 N ATOM 1844 CA SER A 120 13.391 -6.189 -0.751 1.00 0.00 C ATOM 1845 C SER A 120 13.272 -4.957 -1.642 1.00 0.00 C ATOM 1846 O SER A 120 12.246 -4.277 -1.647 1.00 0.00 O ATOM 1847 CB SER A 120 14.432 -5.942 0.343 1.00 0.00 C ATOM 1848 OG SER A 120 15.704 -6.432 -0.043 1.00 0.00 O ATOM 0 H SER A 120 14.415 -7.989 -1.078 1.00 0.00 H new ATOM 0 HA SER A 120 12.423 -6.375 -0.287 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.498 -4.874 0.552 1.00 0.00 H new ATOM 0 HB3 SER A 120 14.116 -6.428 1.266 1.00 0.00 H new ATOM 0 HG SER A 120 16.352 -6.260 0.672 1.00 0.00 H new ATOM 1854 N SER A 121 14.330 -4.675 -2.397 1.00 0.00 N ATOM 1855 CA SER A 121 14.347 -3.523 -3.290 1.00 0.00 C ATOM 1856 C SER A 121 12.994 -3.347 -3.975 1.00 0.00 C ATOM 1857 O SER A 121 12.501 -2.228 -4.121 1.00 0.00 O ATOM 1858 CB SER A 121 15.446 -3.683 -4.342 1.00 0.00 C ATOM 1859 OG SER A 121 15.909 -2.421 -4.792 1.00 0.00 O ATOM 0 H SER A 121 15.186 -5.229 -2.407 1.00 0.00 H new ATOM 0 HA SER A 121 14.552 -2.634 -2.693 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.277 -4.250 -3.921 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.064 -4.256 -5.187 1.00 0.00 H new ATOM 0 HG SER A 121 16.612 -2.551 -5.462 1.00 0.00 H new ATOM 1865 N LEU A 122 12.400 -4.459 -4.393 1.00 0.00 N ATOM 1866 CA LEU A 122 11.105 -4.429 -5.062 1.00 0.00 C ATOM 1867 C LEU A 122 9.978 -4.209 -4.058 1.00 0.00 C ATOM 1868 O LEU A 122 9.087 -3.388 -4.278 1.00 0.00 O ATOM 1869 CB LEU A 122 10.874 -5.733 -5.827 1.00 0.00 C ATOM 1870 CG LEU A 122 11.645 -5.888 -7.138 1.00 0.00 C ATOM 1871 CD1 LEU A 122 11.563 -7.321 -7.640 1.00 0.00 C ATOM 1872 CD2 LEU A 122 11.114 -4.922 -8.187 1.00 0.00 C ATOM 0 H LEU A 122 12.795 -5.393 -4.280 1.00 0.00 H new ATOM 0 HA LEU A 122 11.107 -3.597 -5.766 1.00 0.00 H new ATOM 0 HB2 LEU A 122 11.137 -6.565 -5.174 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.809 -5.821 -6.043 1.00 0.00 H new ATOM 0 HG LEU A 122 12.692 -5.650 -6.951 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.118 -7.412 -8.574 1.00 0.00 H new ATOM 0 HD12 LEU A 122 11.992 -7.992 -6.896 1.00 0.00 H new ATOM 0 HD13 LEU A 122 10.520 -7.588 -7.810 1.00 0.00 H new ATOM 0 HD21 LEU A 122 11.675 -5.047 -9.113 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.059 -5.128 -8.371 1.00 0.00 H new ATOM 0 HD23 LEU A 122 11.227 -3.899 -7.829 1.00 0.00 H new ATOM 1884 N VAL A 123 10.024 -4.947 -2.953 1.00 0.00 N ATOM 1885 CA VAL A 123 9.009 -4.830 -1.913 1.00 0.00 C ATOM 1886 C VAL A 123 8.765 -3.371 -1.545 1.00 0.00 C ATOM 1887 O VAL A 123 7.621 -2.921 -1.479 1.00 0.00 O ATOM 1888 CB VAL A 123 9.413 -5.607 -0.646 1.00 0.00 C ATOM 1889 CG1 VAL A 123 8.592 -5.143 0.549 1.00 0.00 C ATOM 1890 CG2 VAL A 123 9.252 -7.103 -0.865 1.00 0.00 C ATOM 0 H VAL A 123 10.753 -5.632 -2.755 1.00 0.00 H new ATOM 0 HA VAL A 123 8.091 -5.258 -2.316 1.00 0.00 H new ATOM 0 HB VAL A 123 10.463 -5.405 -0.436 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.891 -5.703 1.435 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.763 -4.080 0.717 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.534 -5.314 0.352 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.542 -7.637 0.040 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.211 -7.326 -1.100 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.887 -7.420 -1.692 1.00 0.00 H new ATOM 1900 N GLU A 124 9.847 -2.637 -1.306 1.00 0.00 N ATOM 1901 CA GLU A 124 9.749 -1.228 -0.944 1.00 0.00 C ATOM 1902 C GLU A 124 9.351 -0.383 -2.151 1.00 0.00 C ATOM 1903 O GLU A 124 8.732 0.671 -2.007 1.00 0.00 O ATOM 1904 CB GLU A 124 11.080 -0.730 -0.377 1.00 0.00 C ATOM 1905 CG GLU A 124 12.212 -0.729 -1.391 1.00 0.00 C ATOM 1906 CD GLU A 124 13.545 -0.351 -0.776 1.00 0.00 C ATOM 1907 OE1 GLU A 124 13.813 0.861 -0.635 1.00 0.00 O ATOM 1908 OE2 GLU A 124 14.322 -1.268 -0.435 1.00 0.00 O ATOM 0 H GLU A 124 10.801 -2.994 -1.356 1.00 0.00 H new ATOM 0 HA GLU A 124 8.977 -1.128 -0.181 1.00 0.00 H new ATOM 0 HB2 GLU A 124 10.946 0.282 0.006 1.00 0.00 H new ATOM 0 HB3 GLU A 124 11.362 -1.357 0.469 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.292 -1.718 -1.842 1.00 0.00 H new ATOM 0 HG3 GLU A 124 11.975 -0.031 -2.194 1.00 0.00 H new ATOM 1915 N MET A 125 9.712 -0.853 -3.340 1.00 0.00 N ATOM 1916 CA MET A 125 9.392 -0.141 -4.572 1.00 0.00 C ATOM 1917 C MET A 125 7.883 -0.078 -4.788 1.00 0.00 C ATOM 1918 O MET A 125 7.303 1.005 -4.870 1.00 0.00 O ATOM 1919 CB MET A 125 10.062 -0.821 -5.768 1.00 0.00 C ATOM 1920 CG MET A 125 9.887 -0.063 -7.074 1.00 0.00 C ATOM 1921 SD MET A 125 8.408 -0.564 -7.975 1.00 0.00 S ATOM 1922 CE MET A 125 8.945 -2.127 -8.666 1.00 0.00 C ATOM 0 H MET A 125 10.226 -1.723 -3.477 1.00 0.00 H new ATOM 0 HA MET A 125 9.771 0.877 -4.482 1.00 0.00 H new ATOM 0 HB2 MET A 125 11.127 -0.933 -5.562 1.00 0.00 H new ATOM 0 HB3 MET A 125 9.652 -1.824 -5.882 1.00 0.00 H new ATOM 0 HG2 MET A 125 9.836 1.006 -6.865 1.00 0.00 H new ATOM 0 HG3 MET A 125 10.763 -0.224 -7.703 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.228 -2.458 -9.417 1.00 0.00 H new ATOM 0 HE2 MET A 125 9.924 -2.003 -9.129 1.00 0.00 H new ATOM 0 HE3 MET A 125 9.010 -2.872 -7.873 1.00 0.00 H new ATOM 1932 N ILE A 126 7.254 -1.245 -4.879 1.00 0.00 N ATOM 1933 CA ILE A 126 5.813 -1.321 -5.084 1.00 0.00 C ATOM 1934 C ILE A 126 5.070 -0.421 -4.103 1.00 0.00 C ATOM 1935 O ILE A 126 4.009 0.118 -4.420 1.00 0.00 O ATOM 1936 CB ILE A 126 5.298 -2.765 -4.929 1.00 0.00 C ATOM 1937 CG1 ILE A 126 3.890 -2.892 -5.513 1.00 0.00 C ATOM 1938 CG2 ILE A 126 5.309 -3.177 -3.464 1.00 0.00 C ATOM 1939 CD1 ILE A 126 3.566 -4.283 -6.012 1.00 0.00 C ATOM 0 H ILE A 126 7.719 -2.150 -4.814 1.00 0.00 H new ATOM 0 HA ILE A 126 5.621 -0.982 -6.102 1.00 0.00 H new ATOM 0 HB ILE A 126 5.961 -3.433 -5.479 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.163 -2.609 -4.752 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.781 -2.185 -6.336 1.00 0.00 H new ATOM 0 HG21 ILE A 126 4.943 -4.199 -3.371 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.327 -3.120 -3.078 1.00 0.00 H new ATOM 0 HG23 ILE A 126 4.666 -2.508 -2.893 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.552 -4.299 -6.412 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.270 -4.561 -6.796 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.642 -4.992 -5.188 1.00 0.00 H new ATOM 1951 N PHE A 127 5.635 -0.259 -2.911 1.00 0.00 N ATOM 1952 CA PHE A 127 5.026 0.578 -1.884 1.00 0.00 C ATOM 1953 C PHE A 127 5.327 2.053 -2.135 1.00 0.00 C ATOM 1954 O PHE A 127 4.437 2.900 -2.061 1.00 0.00 O ATOM 1955 CB PHE A 127 5.533 0.171 -0.499 1.00 0.00 C ATOM 1956 CG PHE A 127 5.254 -1.264 -0.155 1.00 0.00 C ATOM 1957 CD1 PHE A 127 4.072 -1.868 -0.554 1.00 0.00 C ATOM 1958 CD2 PHE A 127 6.172 -2.010 0.565 1.00 0.00 C ATOM 1959 CE1 PHE A 127 3.812 -3.188 -0.239 1.00 0.00 C ATOM 1960 CE2 PHE A 127 5.918 -3.331 0.883 1.00 0.00 C ATOM 1961 CZ PHE A 127 4.736 -3.921 0.480 1.00 0.00 C ATOM 0 H PHE A 127 6.513 -0.696 -2.633 1.00 0.00 H new ATOM 0 HA PHE A 127 3.946 0.434 -1.926 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.608 0.346 -0.449 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.070 0.812 0.251 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.346 -1.301 -1.117 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.098 -1.554 0.882 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.887 -3.647 -0.555 1.00 0.00 H new ATOM 0 HE2 PHE A 127 6.643 -3.901 1.446 1.00 0.00 H new ATOM 0 HZ PHE A 127 4.535 -4.953 0.726 1.00 0.00 H new ATOM 1971 N SER A 128 6.588 2.351 -2.432 1.00 0.00 N ATOM 1972 CA SER A 128 7.008 3.723 -2.690 1.00 0.00 C ATOM 1973 C SER A 128 6.202 4.333 -3.833 1.00 0.00 C ATOM 1974 O SER A 128 5.644 5.422 -3.701 1.00 0.00 O ATOM 1975 CB SER A 128 8.501 3.768 -3.023 1.00 0.00 C ATOM 1976 OG SER A 128 8.993 5.096 -2.981 1.00 0.00 O ATOM 0 H SER A 128 7.336 1.661 -2.500 1.00 0.00 H new ATOM 0 HA SER A 128 6.826 4.308 -1.788 1.00 0.00 H new ATOM 0 HB2 SER A 128 9.053 3.150 -2.315 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.669 3.346 -4.014 1.00 0.00 H new ATOM 0 HG SER A 128 9.949 5.098 -3.196 1.00 0.00 H new