USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 888 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 133 SER OG : rot -96:sc= 0.0299 USER MOD Set 1.2: A 137 GLN :FLIP amide:sc= 0.0267 F(o=-0.93,f=0.057) USER MOD Set 2.1: A 96 ASN : amide:sc= -0.364 K(o=0.85,f=0.34) USER MOD Set 2.2: A 121 SER OG : rot 40:sc= 0.266 USER MOD Set 2.3: A 125 GLN : amide:sc= 0.948 K(o=0.85,f=0.34) USER MOD Set 3.1: A 23 ASN : amide:sc= -2.73! C(o=-2.7!,f=-6.2!) USER MOD Set 3.2: A 91 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 41 GLN : amide:sc= 1.05 K(o=0.3,f=-5.9) USER MOD Set 4.2: A 49 GLN : amide:sc= -0.745! C(o=0.3!,f=-3.6!) USER MOD Set 5.1: A 29 SER OG : rot 176:sc= 1.2 USER MOD Set 5.2: A 143 SER OG : rot 22:sc= -2.42! USER MOD Set 6.1: A 14 SER OG : rot -75:sc= 0.675 USER MOD Set 6.2: A 104 ASN : amide:sc= 1.29 K(o=2,f=-1.2) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.0874 X(o=-0.087,f=-0.23) USER MOD Single : A 28 THR OG1 : rot 180:sc=0.000979 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.00723 USER MOD Single : A 40 SER OG : rot -130:sc= 0.0221 USER MOD Single : A 42 GLN : amide:sc= -0.117 K(o=-0.12,f=-0.86) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -1.62 K(o=-1.6,f=-4.3!) USER MOD Single : A 54 SER OG : rot 180:sc= 0.153 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 65 ASN : amide:sc= -3.91! C(o=-3.9!,f=-12!) USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 75 SER OG : rot -89:sc= 1.23 USER MOD Single : A 86 TYR OH : rot -111:sc= 0.274 USER MOD Single : A 88 GLN : amide:sc= -1.83! X(o=-1.8!,f=-1.6) USER MOD Single : A 92 SER OG : rot -169:sc= -0.201! USER MOD Single : A 101 ASN : amide:sc= -1.26 K(o=-1.3,f=-6.5!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 53:sc= 1.24 USER MOD Single : A 110 SER OG : rot -170:sc= 0.658 USER MOD Single : A 114 SER OG : rot 180:sc= -0.0203 USER MOD Single : A 118 ASN : amide:sc= -0.303! X(o=-0.3!,f=-0.013) USER MOD Single : A 122 SER OG : rot 77:sc= 0.0683 USER MOD Single : A 130 ASN : amide:sc= -0.0356 K(o=-0.036,f=-1.1) USER MOD Single : A 135 SER OG : rot 180:sc= 0.0051 USER MOD Single : A 138 SER OG : rot -140:sc= 1.15 USER MOD Single : A 141 SER OG : rot 66:sc= 1.32 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 123 N GLY A 12 -3.100 -6.457 -12.473 1.00 0.00 N ATOM 124 CA GLY A 12 -2.807 -6.011 -13.810 1.00 0.00 C ATOM 125 C GLY A 12 -1.442 -6.460 -14.270 1.00 0.00 C ATOM 126 O GLY A 12 -0.843 -7.358 -13.670 1.00 0.00 O ATOM 0 HA2 GLY A 12 -3.564 -6.394 -14.494 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.863 -4.923 -13.850 1.00 0.00 H new ATOM 130 N ALA A 13 -0.938 -5.824 -15.319 1.00 0.00 N ATOM 131 CA ALA A 13 0.365 -6.159 -15.891 1.00 0.00 C ATOM 132 C ALA A 13 1.500 -5.934 -14.893 1.00 0.00 C ATOM 133 O ALA A 13 2.596 -6.481 -15.047 1.00 0.00 O ATOM 134 CB ALA A 13 0.606 -5.349 -17.153 1.00 0.00 C ATOM 0 H ALA A 13 -1.418 -5.062 -15.799 1.00 0.00 H new ATOM 0 HA ALA A 13 0.353 -7.220 -16.140 1.00 0.00 H new ATOM 0 HB1 ALA A 13 1.579 -5.607 -17.570 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -0.172 -5.572 -17.883 1.00 0.00 H new ATOM 0 HB3 ALA A 13 0.584 -4.286 -16.913 1.00 0.00 H new ATOM 140 N SER A 14 1.234 -5.138 -13.867 1.00 0.00 N ATOM 141 CA SER A 14 2.219 -4.855 -12.849 1.00 0.00 C ATOM 142 C SER A 14 2.597 -6.129 -12.082 1.00 0.00 C ATOM 143 O SER A 14 3.666 -6.202 -11.486 1.00 0.00 O ATOM 144 CB SER A 14 1.684 -3.795 -11.889 1.00 0.00 C ATOM 145 OG SER A 14 1.212 -2.662 -12.602 1.00 0.00 O ATOM 0 H SER A 14 0.336 -4.677 -13.723 1.00 0.00 H new ATOM 0 HA SER A 14 3.118 -4.475 -13.334 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.877 -4.215 -11.289 1.00 0.00 H new ATOM 0 HB3 SER A 14 2.471 -3.493 -11.198 1.00 0.00 H new ATOM 0 HG SER A 14 1.974 -2.138 -12.925 1.00 0.00 H new ATOM 151 N ALA A 15 1.726 -7.145 -12.140 1.00 0.00 N ATOM 152 CA ALA A 15 1.954 -8.410 -11.438 1.00 0.00 C ATOM 153 C ALA A 15 3.214 -9.122 -11.935 1.00 0.00 C ATOM 154 O ALA A 15 3.790 -9.954 -11.232 1.00 0.00 O ATOM 155 CB ALA A 15 0.744 -9.318 -11.578 1.00 0.00 C ATOM 0 H ALA A 15 0.854 -7.113 -12.669 1.00 0.00 H new ATOM 0 HA ALA A 15 2.105 -8.176 -10.384 1.00 0.00 H new ATOM 0 HB1 ALA A 15 0.929 -10.254 -11.051 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -0.130 -8.827 -11.151 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.564 -9.525 -12.633 1.00 0.00 H new ATOM 161 N GLY A 16 3.640 -8.794 -13.140 1.00 0.00 N ATOM 162 CA GLY A 16 4.836 -9.400 -13.680 1.00 0.00 C ATOM 163 C GLY A 16 6.101 -8.718 -13.187 1.00 0.00 C ATOM 164 O GLY A 16 7.129 -9.363 -12.998 1.00 0.00 O ATOM 0 H GLY A 16 3.182 -8.121 -13.754 1.00 0.00 H new ATOM 0 HA2 GLY A 16 4.863 -10.454 -13.404 1.00 0.00 H new ATOM 0 HA3 GLY A 16 4.803 -9.356 -14.769 1.00 0.00 H new ATOM 168 N LEU A 17 6.032 -7.414 -13.002 1.00 0.00 N ATOM 169 CA LEU A 17 7.188 -6.638 -12.557 1.00 0.00 C ATOM 170 C LEU A 17 7.333 -6.566 -11.023 1.00 0.00 C ATOM 171 O LEU A 17 8.448 -6.511 -10.514 1.00 0.00 O ATOM 172 CB LEU A 17 7.163 -5.232 -13.184 1.00 0.00 C ATOM 173 CG LEU A 17 5.859 -4.433 -13.017 1.00 0.00 C ATOM 174 CD1 LEU A 17 5.872 -3.598 -11.746 1.00 0.00 C ATOM 175 CD2 LEU A 17 5.597 -3.562 -14.236 1.00 0.00 C ATOM 0 H LEU A 17 5.187 -6.862 -13.152 1.00 0.00 H new ATOM 0 HA LEU A 17 8.072 -7.170 -12.908 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.978 -4.651 -12.752 1.00 0.00 H new ATOM 0 HB3 LEU A 17 7.370 -5.329 -14.250 1.00 0.00 H new ATOM 0 HG LEU A 17 5.044 -5.151 -12.928 1.00 0.00 H new ATOM 0 HD11 LEU A 17 4.935 -3.048 -11.662 1.00 0.00 H new ATOM 0 HD12 LEU A 17 5.987 -4.252 -10.882 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.704 -2.894 -11.781 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.670 -3.007 -14.094 1.00 0.00 H new ATOM 0 HD22 LEU A 17 6.422 -2.862 -14.367 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.511 -4.192 -15.121 1.00 0.00 H new ATOM 187 N ILE A 18 6.199 -6.585 -10.306 1.00 0.00 N ATOM 188 CA ILE A 18 6.160 -6.377 -8.831 1.00 0.00 C ATOM 189 C ILE A 18 7.261 -7.090 -8.036 1.00 0.00 C ATOM 190 O ILE A 18 8.027 -6.440 -7.329 1.00 0.00 O ATOM 191 CB ILE A 18 4.790 -6.740 -8.212 1.00 0.00 C ATOM 192 CG1 ILE A 18 4.311 -8.116 -8.694 1.00 0.00 C ATOM 193 CG2 ILE A 18 3.758 -5.660 -8.505 1.00 0.00 C ATOM 194 CD1 ILE A 18 3.032 -8.584 -8.033 1.00 0.00 C ATOM 0 H ILE A 18 5.281 -6.744 -10.721 1.00 0.00 H new ATOM 0 HA ILE A 18 6.341 -5.306 -8.740 1.00 0.00 H new ATOM 0 HB ILE A 18 4.914 -6.797 -7.131 1.00 0.00 H new ATOM 0 HG12 ILE A 18 4.159 -8.080 -9.773 1.00 0.00 H new ATOM 0 HG13 ILE A 18 5.095 -8.849 -8.507 1.00 0.00 H new ATOM 0 HG21 ILE A 18 2.803 -5.939 -8.059 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.093 -4.713 -8.083 1.00 0.00 H new ATOM 0 HG23 ILE A 18 3.638 -5.554 -9.583 1.00 0.00 H new ATOM 0 HD11 ILE A 18 2.757 -9.563 -8.425 1.00 0.00 H new ATOM 0 HD12 ILE A 18 3.184 -8.654 -6.956 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.233 -7.872 -8.242 1.00 0.00 H new ATOM 206 N SER A 19 7.350 -8.399 -8.158 1.00 0.00 N ATOM 207 CA SER A 19 8.274 -9.177 -7.350 1.00 0.00 C ATOM 208 C SER A 19 9.739 -8.869 -7.682 1.00 0.00 C ATOM 209 O SER A 19 10.627 -9.174 -6.902 1.00 0.00 O ATOM 210 CB SER A 19 7.987 -10.669 -7.507 1.00 0.00 C ATOM 211 OG SER A 19 6.600 -10.944 -7.327 1.00 0.00 O ATOM 0 H SER A 19 6.793 -8.950 -8.811 1.00 0.00 H new ATOM 0 HA SER A 19 8.118 -8.891 -6.310 1.00 0.00 H new ATOM 0 HB2 SER A 19 8.302 -11.001 -8.496 1.00 0.00 H new ATOM 0 HB3 SER A 19 8.571 -11.234 -6.780 1.00 0.00 H new ATOM 0 HG SER A 19 6.440 -11.905 -7.434 1.00 0.00 H new ATOM 217 N ARG A 20 9.982 -8.314 -8.859 1.00 0.00 N ATOM 218 CA ARG A 20 11.341 -7.958 -9.270 1.00 0.00 C ATOM 219 C ARG A 20 11.716 -6.546 -8.835 1.00 0.00 C ATOM 220 O ARG A 20 12.887 -6.261 -8.592 1.00 0.00 O ATOM 221 CB ARG A 20 11.494 -8.066 -10.777 1.00 0.00 C ATOM 222 CG ARG A 20 11.252 -9.443 -11.341 1.00 0.00 C ATOM 223 CD ARG A 20 11.256 -9.398 -12.857 1.00 0.00 C ATOM 224 NE ARG A 20 11.265 -10.729 -13.456 1.00 0.00 N ATOM 225 CZ ARG A 20 10.475 -11.108 -14.459 1.00 0.00 C ATOM 226 NH1 ARG A 20 9.550 -10.283 -14.934 1.00 0.00 N ATOM 227 NH2 ARG A 20 10.606 -12.316 -14.979 1.00 0.00 N ATOM 0 H ARG A 20 9.262 -8.099 -9.548 1.00 0.00 H new ATOM 0 HA ARG A 20 12.011 -8.663 -8.779 1.00 0.00 H new ATOM 0 HB2 ARG A 20 10.802 -7.369 -11.249 1.00 0.00 H new ATOM 0 HB3 ARG A 20 12.501 -7.749 -11.049 1.00 0.00 H new ATOM 0 HG2 ARG A 20 12.023 -10.129 -10.989 1.00 0.00 H new ATOM 0 HG3 ARG A 20 10.296 -9.827 -10.984 1.00 0.00 H new ATOM 0 HD2 ARG A 20 10.378 -8.853 -13.203 1.00 0.00 H new ATOM 0 HD3 ARG A 20 12.130 -8.844 -13.198 1.00 0.00 H new ATOM 0 HE ARG A 20 11.920 -11.415 -13.081 1.00 0.00 H new ATOM 0 HH11 ARG A 20 9.441 -9.352 -14.531 1.00 0.00 H new ATOM 0 HH12 ARG A 20 8.948 -10.580 -15.702 1.00 0.00 H new ATOM 0 HH21 ARG A 20 11.311 -12.956 -14.612 1.00 0.00 H new ATOM 0 HH22 ARG A 20 10.002 -12.609 -15.747 1.00 0.00 H new ATOM 241 N VAL A 21 10.713 -5.665 -8.776 1.00 0.00 N ATOM 242 CA VAL A 21 10.908 -4.248 -8.423 1.00 0.00 C ATOM 243 C VAL A 21 11.747 -4.099 -7.137 1.00 0.00 C ATOM 244 O VAL A 21 11.830 -5.019 -6.353 1.00 0.00 O ATOM 245 CB VAL A 21 9.525 -3.537 -8.261 1.00 0.00 C ATOM 246 CG1 VAL A 21 9.669 -2.103 -7.773 1.00 0.00 C ATOM 247 CG2 VAL A 21 8.761 -3.559 -9.575 1.00 0.00 C ATOM 0 H VAL A 21 9.742 -5.910 -8.971 1.00 0.00 H new ATOM 0 HA VAL A 21 11.458 -3.771 -9.234 1.00 0.00 H new ATOM 0 HB VAL A 21 8.968 -4.090 -7.505 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.682 -1.651 -7.676 1.00 0.00 H new ATOM 0 HG12 VAL A 21 10.168 -2.097 -6.804 1.00 0.00 H new ATOM 0 HG13 VAL A 21 10.260 -1.533 -8.489 1.00 0.00 H new ATOM 0 HG21 VAL A 21 7.800 -3.060 -9.446 1.00 0.00 H new ATOM 0 HG22 VAL A 21 9.339 -3.041 -10.341 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.595 -4.592 -9.882 1.00 0.00 H new ATOM 257 N ALA A 22 12.359 -2.913 -6.951 1.00 0.00 N ATOM 258 CA ALA A 22 13.239 -2.592 -5.796 1.00 0.00 C ATOM 259 C ALA A 22 12.739 -3.141 -4.446 1.00 0.00 C ATOM 260 O ALA A 22 13.533 -3.360 -3.533 1.00 0.00 O ATOM 261 CB ALA A 22 13.423 -1.092 -5.701 1.00 0.00 C ATOM 0 H ALA A 22 12.258 -2.136 -7.604 1.00 0.00 H new ATOM 0 HA ALA A 22 14.188 -3.092 -5.990 1.00 0.00 H new ATOM 0 HB1 ALA A 22 14.068 -0.857 -4.854 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.880 -0.723 -6.619 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.453 -0.615 -5.561 1.00 0.00 H new ATOM 267 N ASN A 23 11.436 -3.351 -4.325 1.00 0.00 N ATOM 268 CA ASN A 23 10.851 -3.907 -3.106 1.00 0.00 C ATOM 269 C ASN A 23 11.412 -5.322 -2.851 1.00 0.00 C ATOM 270 O ASN A 23 11.530 -5.760 -1.708 1.00 0.00 O ATOM 271 CB ASN A 23 9.326 -3.935 -3.233 1.00 0.00 C ATOM 272 CG ASN A 23 8.614 -4.288 -1.943 1.00 0.00 C ATOM 273 OD1 ASN A 23 8.359 -5.443 -1.665 1.00 0.00 O ATOM 274 ND2 ASN A 23 8.273 -3.280 -1.156 1.00 0.00 N ATOM 0 H ASN A 23 10.758 -3.145 -5.059 1.00 0.00 H new ATOM 0 HA ASN A 23 11.115 -3.279 -2.255 1.00 0.00 H new ATOM 0 HB2 ASN A 23 8.981 -2.959 -3.573 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.047 -4.657 -4.001 1.00 0.00 H new ATOM 0 HD21 ASN A 23 7.779 -3.460 -0.282 1.00 0.00 H new ATOM 0 HD22 ASN A 23 8.505 -2.323 -1.423 1.00 0.00 H new ATOM 281 N ALA A 24 11.782 -6.007 -3.943 1.00 0.00 N ATOM 282 CA ALA A 24 12.406 -7.327 -3.885 1.00 0.00 C ATOM 283 C ALA A 24 13.693 -7.256 -3.085 1.00 0.00 C ATOM 284 O ALA A 24 13.951 -8.080 -2.205 1.00 0.00 O ATOM 285 CB ALA A 24 12.727 -7.808 -5.289 1.00 0.00 C ATOM 0 H ALA A 24 11.654 -5.656 -4.892 1.00 0.00 H new ATOM 0 HA ALA A 24 11.714 -8.020 -3.407 1.00 0.00 H new ATOM 0 HB1 ALA A 24 13.192 -8.793 -5.239 1.00 0.00 H new ATOM 0 HB2 ALA A 24 11.808 -7.870 -5.871 1.00 0.00 H new ATOM 0 HB3 ALA A 24 13.412 -7.107 -5.766 1.00 0.00 H new ATOM 291 N LEU A 25 14.486 -6.236 -3.395 1.00 0.00 N ATOM 292 CA LEU A 25 15.774 -6.015 -2.762 1.00 0.00 C ATOM 293 C LEU A 25 15.612 -5.631 -1.299 1.00 0.00 C ATOM 294 O LEU A 25 16.490 -5.899 -0.483 1.00 0.00 O ATOM 295 CB LEU A 25 16.544 -4.927 -3.513 1.00 0.00 C ATOM 296 CG LEU A 25 17.915 -4.557 -2.942 1.00 0.00 C ATOM 297 CD1 LEU A 25 18.839 -5.767 -2.934 1.00 0.00 C ATOM 298 CD2 LEU A 25 18.528 -3.417 -3.739 1.00 0.00 C ATOM 0 H LEU A 25 14.248 -5.536 -4.098 1.00 0.00 H new ATOM 0 HA LEU A 25 16.337 -6.947 -2.802 1.00 0.00 H new ATOM 0 HB2 LEU A 25 16.678 -5.252 -4.545 1.00 0.00 H new ATOM 0 HB3 LEU A 25 15.929 -4.027 -3.539 1.00 0.00 H new ATOM 0 HG LEU A 25 17.783 -4.226 -1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 25 19.808 -5.482 -2.524 1.00 0.00 H new ATOM 0 HD12 LEU A 25 18.402 -6.554 -2.319 1.00 0.00 H new ATOM 0 HD13 LEU A 25 18.969 -6.132 -3.953 1.00 0.00 H new ATOM 0 HD21 LEU A 25 19.503 -3.164 -3.322 1.00 0.00 H new ATOM 0 HD22 LEU A 25 18.646 -3.722 -4.779 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.875 -2.546 -3.689 1.00 0.00 H new ATOM 310 N ALA A 26 14.492 -4.999 -0.970 1.00 0.00 N ATOM 311 CA ALA A 26 14.221 -4.606 0.406 1.00 0.00 C ATOM 312 C ALA A 26 14.195 -5.832 1.305 1.00 0.00 C ATOM 313 O ALA A 26 14.695 -5.801 2.432 1.00 0.00 O ATOM 314 CB ALA A 26 12.905 -3.845 0.497 1.00 0.00 C ATOM 0 H ALA A 26 13.760 -4.749 -1.635 1.00 0.00 H new ATOM 0 HA ALA A 26 15.019 -3.944 0.743 1.00 0.00 H new ATOM 0 HB1 ALA A 26 12.720 -3.560 1.533 1.00 0.00 H new ATOM 0 HB2 ALA A 26 12.959 -2.949 -0.122 1.00 0.00 H new ATOM 0 HB3 ALA A 26 12.092 -4.480 0.145 1.00 0.00 H new ATOM 320 N ASN A 27 13.598 -6.917 0.783 1.00 0.00 N ATOM 321 CA ASN A 27 13.513 -8.216 1.468 1.00 0.00 C ATOM 322 C ASN A 27 12.775 -8.124 2.823 1.00 0.00 C ATOM 323 O ASN A 27 12.634 -9.119 3.533 1.00 0.00 O ATOM 324 CB ASN A 27 14.923 -8.806 1.637 1.00 0.00 C ATOM 325 CG ASN A 27 14.919 -10.286 1.970 1.00 0.00 C ATOM 326 OD1 ASN A 27 14.959 -10.680 3.136 1.00 0.00 O ATOM 327 ND2 ASN A 27 14.863 -11.115 0.944 1.00 0.00 N ATOM 0 H ASN A 27 13.156 -6.916 -0.136 1.00 0.00 H new ATOM 0 HA ASN A 27 12.918 -8.884 0.845 1.00 0.00 H new ATOM 0 HB2 ASN A 27 15.487 -8.649 0.718 1.00 0.00 H new ATOM 0 HB3 ASN A 27 15.443 -8.264 2.427 1.00 0.00 H new ATOM 0 HD21 ASN A 27 14.852 -12.123 1.102 1.00 0.00 H new ATOM 0 HD22 ASN A 27 14.831 -10.748 -0.007 1.00 0.00 H new ATOM 334 N THR A 28 12.278 -6.938 3.147 1.00 0.00 N ATOM 335 CA THR A 28 11.594 -6.701 4.395 1.00 0.00 C ATOM 336 C THR A 28 10.239 -7.443 4.442 1.00 0.00 C ATOM 337 O THR A 28 9.718 -7.884 3.421 1.00 0.00 O ATOM 338 CB THR A 28 11.395 -5.178 4.610 1.00 0.00 C ATOM 339 OG1 THR A 28 12.607 -4.493 4.263 1.00 0.00 O ATOM 340 CG2 THR A 28 11.055 -4.863 6.063 1.00 0.00 C ATOM 0 H THR A 28 12.342 -6.117 2.546 1.00 0.00 H new ATOM 0 HA THR A 28 12.211 -7.093 5.204 1.00 0.00 H new ATOM 0 HB THR A 28 10.569 -4.850 3.980 1.00 0.00 H new ATOM 0 HG1 THR A 28 12.487 -3.529 4.395 1.00 0.00 H new ATOM 0 HG21 THR A 28 10.922 -3.788 6.181 1.00 0.00 H new ATOM 0 HG22 THR A 28 10.134 -5.375 6.340 1.00 0.00 H new ATOM 0 HG23 THR A 28 11.866 -5.201 6.708 1.00 0.00 H new ATOM 348 N SER A 29 9.694 -7.578 5.634 1.00 0.00 N ATOM 349 CA SER A 29 8.433 -8.269 5.862 1.00 0.00 C ATOM 350 C SER A 29 7.263 -7.645 5.082 1.00 0.00 C ATOM 351 O SER A 29 6.217 -8.272 4.941 1.00 0.00 O ATOM 352 CB SER A 29 8.130 -8.257 7.342 1.00 0.00 C ATOM 353 OG SER A 29 9.278 -8.607 8.081 1.00 0.00 O ATOM 0 H SER A 29 10.117 -7.207 6.485 1.00 0.00 H new ATOM 0 HA SER A 29 8.542 -9.291 5.498 1.00 0.00 H new ATOM 0 HB2 SER A 29 7.785 -7.267 7.641 1.00 0.00 H new ATOM 0 HB3 SER A 29 7.322 -8.956 7.560 1.00 0.00 H new ATOM 0 HG SER A 29 9.084 -8.538 9.039 1.00 0.00 H new ATOM 359 N THR A 30 7.464 -6.426 4.585 1.00 0.00 N ATOM 360 CA THR A 30 6.443 -5.669 3.847 1.00 0.00 C ATOM 361 C THR A 30 5.869 -6.444 2.651 1.00 0.00 C ATOM 362 O THR A 30 4.724 -6.235 2.261 1.00 0.00 O ATOM 363 CB THR A 30 7.036 -4.347 3.345 1.00 0.00 C ATOM 364 OG1 THR A 30 8.277 -4.609 2.666 1.00 0.00 O ATOM 365 CG2 THR A 30 7.292 -3.403 4.503 1.00 0.00 C ATOM 0 H THR A 30 8.348 -5.927 4.682 1.00 0.00 H new ATOM 0 HA THR A 30 5.625 -5.487 4.544 1.00 0.00 H new ATOM 0 HB THR A 30 6.325 -3.882 2.662 1.00 0.00 H new ATOM 0 HG1 THR A 30 8.657 -3.766 2.343 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.713 -2.471 4.126 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.354 -3.196 5.018 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.994 -3.863 5.199 1.00 0.00 H new ATOM 373 N LEU A 31 6.683 -7.300 2.059 1.00 0.00 N ATOM 374 CA LEU A 31 6.246 -8.119 0.933 1.00 0.00 C ATOM 375 C LEU A 31 6.057 -9.564 1.367 1.00 0.00 C ATOM 376 O LEU A 31 5.402 -10.352 0.689 1.00 0.00 O ATOM 377 CB LEU A 31 7.228 -8.043 -0.261 1.00 0.00 C ATOM 378 CG LEU A 31 8.677 -8.494 -0.002 1.00 0.00 C ATOM 379 CD1 LEU A 31 9.294 -9.033 -1.284 1.00 0.00 C ATOM 380 CD2 LEU A 31 9.514 -7.333 0.517 1.00 0.00 C ATOM 0 H LEU A 31 7.653 -7.449 2.337 1.00 0.00 H new ATOM 0 HA LEU A 31 5.290 -7.718 0.596 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.824 -8.650 -1.072 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.252 -7.012 -0.615 1.00 0.00 H new ATOM 0 HG LEU A 31 8.661 -9.282 0.751 1.00 0.00 H new ATOM 0 HD11 LEU A 31 10.319 -9.349 -1.090 1.00 0.00 H new ATOM 0 HD12 LEU A 31 8.712 -9.884 -1.638 1.00 0.00 H new ATOM 0 HD13 LEU A 31 9.293 -8.252 -2.044 1.00 0.00 H new ATOM 0 HD21 LEU A 31 10.535 -7.671 0.694 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.520 -6.531 -0.221 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.087 -6.965 1.450 1.00 0.00 H new ATOM 392 N ARG A 32 6.659 -9.902 2.495 1.00 0.00 N ATOM 393 CA ARG A 32 6.639 -11.260 3.012 1.00 0.00 C ATOM 394 C ARG A 32 5.287 -11.614 3.654 1.00 0.00 C ATOM 395 O ARG A 32 4.604 -12.539 3.207 1.00 0.00 O ATOM 396 CB ARG A 32 7.757 -11.433 4.036 1.00 0.00 C ATOM 397 CG ARG A 32 8.062 -12.877 4.398 1.00 0.00 C ATOM 398 CD ARG A 32 9.098 -12.950 5.509 1.00 0.00 C ATOM 399 NE ARG A 32 10.256 -12.094 5.228 1.00 0.00 N ATOM 400 CZ ARG A 32 10.841 -11.296 6.132 1.00 0.00 C ATOM 401 NH1 ARG A 32 10.458 -11.329 7.408 1.00 0.00 N ATOM 402 NH2 ARG A 32 11.821 -10.491 5.762 1.00 0.00 N ATOM 0 H ARG A 32 7.175 -9.243 3.078 1.00 0.00 H new ATOM 0 HA ARG A 32 6.791 -11.938 2.172 1.00 0.00 H new ATOM 0 HB2 ARG A 32 8.664 -10.970 3.647 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.488 -10.893 4.944 1.00 0.00 H new ATOM 0 HG2 ARG A 32 7.147 -13.378 4.715 1.00 0.00 H new ATOM 0 HG3 ARG A 32 8.428 -13.407 3.519 1.00 0.00 H new ATOM 0 HD2 ARG A 32 8.642 -12.648 6.452 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.429 -13.981 5.631 1.00 0.00 H new ATOM 0 HE ARG A 32 10.641 -12.107 4.283 1.00 0.00 H new ATOM 0 HH11 ARG A 32 9.716 -11.964 7.701 1.00 0.00 H new ATOM 0 HH12 ARG A 32 10.907 -10.719 8.091 1.00 0.00 H new ATOM 0 HH21 ARG A 32 12.131 -10.478 4.790 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.268 -9.883 6.448 1.00 0.00 H new ATOM 416 N THR A 33 4.900 -10.872 4.686 1.00 0.00 N ATOM 417 CA THR A 33 3.679 -11.192 5.420 1.00 0.00 C ATOM 418 C THR A 33 3.087 -9.968 6.123 1.00 0.00 C ATOM 419 O THR A 33 1.872 -9.870 6.292 1.00 0.00 O ATOM 420 CB THR A 33 3.929 -12.321 6.456 1.00 0.00 C ATOM 421 OG1 THR A 33 2.708 -12.663 7.130 1.00 0.00 O ATOM 422 CG2 THR A 33 4.979 -11.907 7.483 1.00 0.00 C ATOM 0 H THR A 33 5.405 -10.056 5.030 1.00 0.00 H new ATOM 0 HA THR A 33 2.956 -11.537 4.681 1.00 0.00 H new ATOM 0 HB THR A 33 4.299 -13.191 5.913 1.00 0.00 H new ATOM 0 HG1 THR A 33 2.881 -13.377 7.779 1.00 0.00 H new ATOM 0 HG21 THR A 33 5.132 -12.718 8.195 1.00 0.00 H new ATOM 0 HG22 THR A 33 5.918 -11.688 6.975 1.00 0.00 H new ATOM 0 HG23 THR A 33 4.638 -11.018 8.014 1.00 0.00 H new ATOM 430 N VAL A 34 3.941 -9.050 6.539 1.00 0.00 N ATOM 431 CA VAL A 34 3.486 -7.835 7.201 1.00 0.00 C ATOM 432 C VAL A 34 2.905 -6.886 6.176 1.00 0.00 C ATOM 433 O VAL A 34 3.447 -6.742 5.086 1.00 0.00 O ATOM 434 CB VAL A 34 4.632 -7.143 7.979 1.00 0.00 C ATOM 435 CG1 VAL A 34 4.164 -5.831 8.601 1.00 0.00 C ATOM 436 CG2 VAL A 34 5.163 -8.072 9.054 1.00 0.00 C ATOM 0 H VAL A 34 4.953 -9.120 6.432 1.00 0.00 H new ATOM 0 HA VAL A 34 2.718 -8.111 7.924 1.00 0.00 H new ATOM 0 HB VAL A 34 5.432 -6.914 7.274 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.991 -5.369 9.140 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.822 -5.158 7.815 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.345 -6.028 9.292 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.969 -7.578 9.597 1.00 0.00 H new ATOM 0 HG22 VAL A 34 4.360 -8.323 9.747 1.00 0.00 H new ATOM 0 HG23 VAL A 34 5.542 -8.984 8.592 1.00 0.00 H new ATOM 446 N LEU A 35 1.787 -6.269 6.518 1.00 0.00 N ATOM 447 CA LEU A 35 1.090 -5.374 5.609 1.00 0.00 C ATOM 448 C LEU A 35 1.993 -4.252 5.107 1.00 0.00 C ATOM 449 O LEU A 35 2.874 -3.771 5.824 1.00 0.00 O ATOM 450 CB LEU A 35 -0.171 -4.778 6.258 1.00 0.00 C ATOM 451 CG LEU A 35 0.054 -3.739 7.373 1.00 0.00 C ATOM 452 CD1 LEU A 35 -1.215 -2.940 7.607 1.00 0.00 C ATOM 453 CD2 LEU A 35 0.489 -4.412 8.667 1.00 0.00 C ATOM 0 H LEU A 35 1.338 -6.373 7.428 1.00 0.00 H new ATOM 0 HA LEU A 35 0.790 -5.979 4.753 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -0.770 -4.313 5.475 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.762 -5.596 6.669 1.00 0.00 H new ATOM 0 HG LEU A 35 0.849 -3.065 7.053 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -1.044 -2.209 8.397 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.494 -2.423 6.689 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -2.019 -3.613 7.903 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.641 -3.656 9.437 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -0.283 -5.110 8.991 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.421 -4.953 8.501 1.00 0.00 H new ATOM 465 N ARG A 36 1.764 -3.862 3.864 1.00 0.00 N ATOM 466 CA ARG A 36 2.499 -2.787 3.219 1.00 0.00 C ATOM 467 C ARG A 36 2.481 -1.511 4.060 1.00 0.00 C ATOM 468 O ARG A 36 1.419 -1.068 4.513 1.00 0.00 O ATOM 469 CB ARG A 36 1.879 -2.500 1.845 1.00 0.00 C ATOM 470 CG ARG A 36 2.288 -1.165 1.251 1.00 0.00 C ATOM 471 CD ARG A 36 1.423 -0.784 0.074 1.00 0.00 C ATOM 472 NE ARG A 36 1.647 0.606 -0.315 1.00 0.00 N ATOM 473 CZ ARG A 36 0.683 1.468 -0.649 1.00 0.00 C ATOM 474 NH1 ARG A 36 -0.590 1.067 -0.709 1.00 0.00 N ATOM 475 NH2 ARG A 36 0.994 2.722 -0.938 1.00 0.00 N ATOM 0 H ARG A 36 1.054 -4.288 3.268 1.00 0.00 H new ATOM 0 HA ARG A 36 3.536 -3.104 3.108 1.00 0.00 H new ATOM 0 HB2 ARG A 36 2.164 -3.295 1.156 1.00 0.00 H new ATOM 0 HB3 ARG A 36 0.793 -2.529 1.934 1.00 0.00 H new ATOM 0 HG2 ARG A 36 2.221 -0.392 2.016 1.00 0.00 H new ATOM 0 HG3 ARG A 36 3.330 -1.212 0.935 1.00 0.00 H new ATOM 0 HD2 ARG A 36 1.641 -1.440 -0.769 1.00 0.00 H new ATOM 0 HD3 ARG A 36 0.373 -0.929 0.328 1.00 0.00 H new ATOM 0 HE ARG A 36 2.610 0.943 -0.333 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -0.830 0.098 -0.499 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -1.322 1.730 -0.965 1.00 0.00 H new ATOM 0 HH21 ARG A 36 1.967 3.027 -0.905 1.00 0.00 H new ATOM 0 HH22 ARG A 36 0.261 3.383 -1.194 1.00 0.00 H new ATOM 489 N THR A 37 3.653 -0.933 4.269 1.00 0.00 N ATOM 490 CA THR A 37 3.760 0.316 4.976 1.00 0.00 C ATOM 491 C THR A 37 3.095 1.420 4.153 1.00 0.00 C ATOM 492 O THR A 37 3.566 1.771 3.071 1.00 0.00 O ATOM 493 CB THR A 37 5.235 0.681 5.230 1.00 0.00 C ATOM 494 OG1 THR A 37 5.961 -0.500 5.601 1.00 0.00 O ATOM 495 CG2 THR A 37 5.348 1.707 6.351 1.00 0.00 C ATOM 0 H THR A 37 4.543 -1.318 3.954 1.00 0.00 H new ATOM 0 HA THR A 37 3.261 0.215 5.939 1.00 0.00 H new ATOM 0 HB THR A 37 5.651 1.107 4.317 1.00 0.00 H new ATOM 0 HG1 THR A 37 6.900 -0.270 5.761 1.00 0.00 H new ATOM 0 HG21 THR A 37 6.397 1.952 6.516 1.00 0.00 H new ATOM 0 HG22 THR A 37 4.804 2.610 6.074 1.00 0.00 H new ATOM 0 HG23 THR A 37 4.924 1.294 7.266 1.00 0.00 H new ATOM 503 N GLY A 38 1.988 1.933 4.651 1.00 0.00 N ATOM 504 CA GLY A 38 1.256 2.940 3.926 1.00 0.00 C ATOM 505 C GLY A 38 0.217 2.320 3.035 1.00 0.00 C ATOM 506 O GLY A 38 -0.103 2.848 1.965 1.00 0.00 O ATOM 0 H GLY A 38 1.582 1.669 5.548 1.00 0.00 H new ATOM 0 HA2 GLY A 38 0.777 3.622 4.629 1.00 0.00 H new ATOM 0 HA3 GLY A 38 1.946 3.534 3.326 1.00 0.00 H new ATOM 510 N VAL A 39 -0.303 1.192 3.485 1.00 0.00 N ATOM 511 CA VAL A 39 -1.280 0.417 2.751 1.00 0.00 C ATOM 512 C VAL A 39 -2.564 1.222 2.457 1.00 0.00 C ATOM 513 O VAL A 39 -2.816 2.267 3.061 1.00 0.00 O ATOM 514 CB VAL A 39 -1.627 -0.881 3.527 1.00 0.00 C ATOM 515 CG1 VAL A 39 -2.580 -0.608 4.688 1.00 0.00 C ATOM 516 CG2 VAL A 39 -2.174 -1.943 2.599 1.00 0.00 C ATOM 0 H VAL A 39 -0.052 0.784 4.386 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.833 0.158 1.791 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.700 -1.262 3.956 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.799 -1.542 5.206 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.116 0.093 5.382 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -3.506 -0.180 4.305 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.408 -2.841 3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -3.079 -1.574 2.117 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -1.429 -2.181 1.839 1.00 0.00 H new ATOM 526 N SER A 40 -3.347 0.725 1.513 1.00 0.00 N ATOM 527 CA SER A 40 -4.591 1.358 1.125 1.00 0.00 C ATOM 528 C SER A 40 -5.794 0.523 1.586 1.00 0.00 C ATOM 529 O SER A 40 -5.663 -0.677 1.856 1.00 0.00 O ATOM 530 CB SER A 40 -4.628 1.539 -0.388 1.00 0.00 C ATOM 531 OG SER A 40 -3.556 2.369 -0.839 1.00 0.00 O ATOM 0 H SER A 40 -3.136 -0.128 0.996 1.00 0.00 H new ATOM 0 HA SER A 40 -4.649 2.334 1.606 1.00 0.00 H new ATOM 0 HB2 SER A 40 -4.566 0.565 -0.874 1.00 0.00 H new ATOM 0 HB3 SER A 40 -5.581 1.981 -0.680 1.00 0.00 H new ATOM 0 HG SER A 40 -3.910 3.071 -1.425 1.00 0.00 H new ATOM 537 N GLN A 41 -6.966 1.159 1.639 1.00 0.00 N ATOM 538 CA GLN A 41 -8.199 0.509 2.105 1.00 0.00 C ATOM 539 C GLN A 41 -8.637 -0.625 1.193 1.00 0.00 C ATOM 540 O GLN A 41 -9.474 -1.426 1.574 1.00 0.00 O ATOM 541 CB GLN A 41 -9.340 1.516 2.208 1.00 0.00 C ATOM 542 CG GLN A 41 -9.808 2.051 0.864 1.00 0.00 C ATOM 543 CD GLN A 41 -11.026 2.936 0.982 1.00 0.00 C ATOM 544 OE1 GLN A 41 -11.224 3.615 1.986 1.00 0.00 O ATOM 545 NE2 GLN A 41 -11.857 2.922 -0.030 1.00 0.00 N ATOM 0 H GLN A 41 -7.090 2.133 1.363 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.971 0.097 3.088 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.183 1.046 2.715 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.020 2.352 2.830 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.998 2.614 0.400 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -10.034 1.214 0.203 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.657 2.344 -0.846 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.705 3.489 -0.002 1.00 0.00 H new ATOM 554 N GLN A 42 -8.079 -0.678 -0.007 1.00 0.00 N ATOM 555 CA GLN A 42 -8.448 -1.700 -0.982 1.00 0.00 C ATOM 556 C GLN A 42 -8.330 -3.095 -0.385 1.00 0.00 C ATOM 557 O GLN A 42 -9.228 -3.917 -0.519 1.00 0.00 O ATOM 558 CB GLN A 42 -7.571 -1.595 -2.232 1.00 0.00 C ATOM 559 CG GLN A 42 -7.662 -0.254 -2.941 1.00 0.00 C ATOM 560 CD GLN A 42 -9.074 0.089 -3.363 1.00 0.00 C ATOM 561 OE1 GLN A 42 -9.881 -0.789 -3.645 1.00 0.00 O ATOM 562 NE2 GLN A 42 -9.377 1.368 -3.407 1.00 0.00 N ATOM 0 H GLN A 42 -7.367 -0.024 -0.332 1.00 0.00 H new ATOM 0 HA GLN A 42 -9.488 -1.530 -1.262 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -6.533 -1.776 -1.951 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -7.855 -2.383 -2.930 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -7.284 0.527 -2.281 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.018 -0.268 -3.820 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -8.675 2.067 -3.164 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -10.314 1.661 -3.684 1.00 0.00 H new ATOM 571 N ILE A 43 -7.227 -3.346 0.286 1.00 0.00 N ATOM 572 CA ILE A 43 -6.981 -4.648 0.870 1.00 0.00 C ATOM 573 C ILE A 43 -7.639 -4.793 2.248 1.00 0.00 C ATOM 574 O ILE A 43 -8.132 -5.858 2.597 1.00 0.00 O ATOM 575 CB ILE A 43 -5.457 -4.948 0.959 1.00 0.00 C ATOM 576 CG1 ILE A 43 -4.745 -3.968 1.892 1.00 0.00 C ATOM 577 CG2 ILE A 43 -4.825 -4.892 -0.420 1.00 0.00 C ATOM 578 CD1 ILE A 43 -4.537 -4.495 3.298 1.00 0.00 C ATOM 0 H ILE A 43 -6.484 -2.664 0.441 1.00 0.00 H new ATOM 0 HA ILE A 43 -7.438 -5.383 0.207 1.00 0.00 H new ATOM 0 HB ILE A 43 -5.345 -5.952 1.369 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -3.776 -3.713 1.463 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -5.323 -3.045 1.943 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -3.759 -5.104 -0.340 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -5.295 -5.633 -1.066 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -4.967 -3.898 -0.845 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -4.026 -3.741 3.897 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -5.503 -4.722 3.748 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.932 -5.401 3.261 1.00 0.00 H new ATOM 590 N ALA A 44 -7.657 -3.709 3.014 1.00 0.00 N ATOM 591 CA ALA A 44 -8.186 -3.743 4.371 1.00 0.00 C ATOM 592 C ALA A 44 -9.707 -3.725 4.379 1.00 0.00 C ATOM 593 O ALA A 44 -10.338 -4.642 4.898 1.00 0.00 O ATOM 594 CB ALA A 44 -7.627 -2.587 5.178 1.00 0.00 C ATOM 0 H ALA A 44 -7.311 -2.796 2.718 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.871 -4.679 4.833 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.029 -2.622 6.191 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -6.540 -2.662 5.216 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -7.909 -1.645 4.708 1.00 0.00 H new ATOM 600 N SER A 45 -10.283 -2.655 3.826 1.00 0.00 N ATOM 601 CA SER A 45 -11.741 -2.490 3.694 1.00 0.00 C ATOM 602 C SER A 45 -12.443 -2.238 5.050 1.00 0.00 C ATOM 603 O SER A 45 -13.552 -1.711 5.085 1.00 0.00 O ATOM 604 CB SER A 45 -12.349 -3.716 2.988 1.00 0.00 C ATOM 605 OG SER A 45 -13.695 -3.497 2.595 1.00 0.00 O ATOM 0 H SER A 45 -9.750 -1.870 3.453 1.00 0.00 H new ATOM 0 HA SER A 45 -11.910 -1.600 3.088 1.00 0.00 H new ATOM 0 HB2 SER A 45 -11.751 -3.961 2.110 1.00 0.00 H new ATOM 0 HB3 SER A 45 -12.303 -4.577 3.655 1.00 0.00 H new ATOM 0 HG SER A 45 -14.040 -4.299 2.150 1.00 0.00 H new ATOM 611 N SER A 46 -11.796 -2.616 6.144 1.00 0.00 N ATOM 612 CA SER A 46 -12.372 -2.466 7.474 1.00 0.00 C ATOM 613 C SER A 46 -12.470 -0.992 7.894 1.00 0.00 C ATOM 614 O SER A 46 -13.538 -0.382 7.807 1.00 0.00 O ATOM 615 CB SER A 46 -11.551 -3.265 8.499 1.00 0.00 C ATOM 616 OG SER A 46 -12.134 -3.206 9.789 1.00 0.00 O ATOM 0 H SER A 46 -10.865 -3.032 6.136 1.00 0.00 H new ATOM 0 HA SER A 46 -13.387 -2.861 7.442 1.00 0.00 H new ATOM 0 HB2 SER A 46 -11.478 -4.304 8.178 1.00 0.00 H new ATOM 0 HB3 SER A 46 -10.535 -2.872 8.539 1.00 0.00 H new ATOM 0 HG SER A 46 -11.590 -3.725 10.418 1.00 0.00 H new ATOM 622 N VAL A 47 -11.356 -0.426 8.338 1.00 0.00 N ATOM 623 CA VAL A 47 -11.339 0.954 8.813 1.00 0.00 C ATOM 624 C VAL A 47 -10.026 1.650 8.449 1.00 0.00 C ATOM 625 O VAL A 47 -10.008 2.835 8.119 1.00 0.00 O ATOM 626 CB VAL A 47 -11.578 1.021 10.353 1.00 0.00 C ATOM 627 CG1 VAL A 47 -10.543 0.194 11.112 1.00 0.00 C ATOM 628 CG2 VAL A 47 -11.585 2.466 10.846 1.00 0.00 C ATOM 0 H VAL A 47 -10.453 -0.899 8.380 1.00 0.00 H new ATOM 0 HA VAL A 47 -12.154 1.480 8.315 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.560 0.591 10.552 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.737 0.262 12.182 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -10.607 -0.847 10.797 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.545 0.577 10.900 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.754 2.482 11.923 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -10.625 2.932 10.622 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.381 3.017 10.346 1.00 0.00 H new ATOM 638 N VAL A 48 -8.933 0.907 8.509 1.00 0.00 N ATOM 639 CA VAL A 48 -7.632 1.440 8.160 1.00 0.00 C ATOM 640 C VAL A 48 -7.528 1.668 6.653 1.00 0.00 C ATOM 641 O VAL A 48 -7.331 0.735 5.874 1.00 0.00 O ATOM 642 CB VAL A 48 -6.486 0.518 8.658 1.00 0.00 C ATOM 643 CG1 VAL A 48 -6.748 -0.928 8.283 1.00 0.00 C ATOM 644 CG2 VAL A 48 -5.137 0.980 8.121 1.00 0.00 C ATOM 0 H VAL A 48 -8.924 -0.071 8.798 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.523 2.401 8.663 1.00 0.00 H new ATOM 0 HB VAL A 48 -6.456 0.585 9.746 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -5.930 -1.551 8.644 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -7.683 -1.258 8.736 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.820 -1.015 7.199 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.353 0.316 8.486 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.152 0.959 7.031 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.939 1.996 8.461 1.00 0.00 H new ATOM 654 N GLN A 49 -7.719 2.902 6.249 1.00 0.00 N ATOM 655 CA GLN A 49 -7.642 3.250 4.849 1.00 0.00 C ATOM 656 C GLN A 49 -6.208 3.474 4.425 1.00 0.00 C ATOM 657 O GLN A 49 -5.820 3.142 3.312 1.00 0.00 O ATOM 658 CB GLN A 49 -8.459 4.496 4.555 1.00 0.00 C ATOM 659 CG GLN A 49 -9.892 4.432 5.048 1.00 0.00 C ATOM 660 CD GLN A 49 -10.649 5.714 4.780 1.00 0.00 C ATOM 661 OE1 GLN A 49 -10.651 6.629 5.596 1.00 0.00 O ATOM 662 NE2 GLN A 49 -11.295 5.787 3.638 1.00 0.00 N ATOM 0 H GLN A 49 -7.929 3.683 6.871 1.00 0.00 H new ATOM 0 HA GLN A 49 -8.052 2.415 4.281 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -7.968 5.355 5.012 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -8.464 4.667 3.479 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -10.404 3.602 4.562 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -9.897 4.227 6.118 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -11.268 5.003 2.986 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -11.823 6.628 3.404 1.00 0.00 H new ATOM 671 N ARG A 50 -5.435 4.077 5.302 1.00 0.00 N ATOM 672 CA ARG A 50 -4.057 4.361 5.011 1.00 0.00 C ATOM 673 C ARG A 50 -3.187 4.312 6.273 1.00 0.00 C ATOM 674 O ARG A 50 -1.972 4.497 6.199 1.00 0.00 O ATOM 675 CB ARG A 50 -3.969 5.737 4.365 1.00 0.00 C ATOM 676 CG ARG A 50 -2.603 6.078 3.854 1.00 0.00 C ATOM 677 CD ARG A 50 -2.645 7.245 2.894 1.00 0.00 C ATOM 678 NE ARG A 50 -3.566 7.017 1.761 1.00 0.00 N ATOM 679 CZ ARG A 50 -3.540 5.970 0.894 1.00 0.00 C ATOM 680 NH1 ARG A 50 -2.640 4.989 1.013 1.00 0.00 N ATOM 681 NH2 ARG A 50 -4.434 5.918 -0.088 1.00 0.00 N ATOM 0 H ARG A 50 -5.745 4.379 6.226 1.00 0.00 H new ATOM 0 HA ARG A 50 -3.679 3.598 4.331 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.679 5.787 3.539 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -4.273 6.490 5.092 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -1.950 6.319 4.693 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -2.173 5.210 3.354 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -2.952 8.142 3.432 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -1.642 7.431 2.510 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.295 7.716 1.615 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -1.953 5.016 1.767 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -2.640 4.214 0.350 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.129 6.658 -0.185 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.425 5.138 -0.745 1.00 0.00 H new ATOM 695 N ALA A 51 -3.819 4.055 7.428 1.00 0.00 N ATOM 696 CA ALA A 51 -3.140 4.056 8.741 1.00 0.00 C ATOM 697 C ALA A 51 -2.760 5.478 9.165 1.00 0.00 C ATOM 698 O ALA A 51 -2.993 5.875 10.300 1.00 0.00 O ATOM 699 CB ALA A 51 -1.921 3.130 8.755 1.00 0.00 C ATOM 0 H ALA A 51 -4.815 3.840 7.483 1.00 0.00 H new ATOM 0 HA ALA A 51 -3.849 3.665 9.471 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.452 3.161 9.738 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -2.236 2.110 8.535 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.206 3.459 8.001 1.00 0.00 H new ATOM 705 N ALA A 52 -2.173 6.230 8.240 1.00 0.00 N ATOM 706 CA ALA A 52 -1.826 7.615 8.487 1.00 0.00 C ATOM 707 C ALA A 52 -3.084 8.430 8.688 1.00 0.00 C ATOM 708 O ALA A 52 -4.084 8.232 7.992 1.00 0.00 O ATOM 709 CB ALA A 52 -1.013 8.176 7.341 1.00 0.00 C ATOM 0 H ALA A 52 -1.928 5.896 7.308 1.00 0.00 H new ATOM 0 HA ALA A 52 -1.219 7.667 9.391 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.763 9.217 7.547 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -0.096 7.598 7.229 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -1.594 8.118 6.420 1.00 0.00 H new ATOM 715 N GLN A 53 -3.015 9.366 9.599 1.00 0.00 N ATOM 716 CA GLN A 53 -4.168 10.164 10.003 1.00 0.00 C ATOM 717 C GLN A 53 -4.693 11.033 8.863 1.00 0.00 C ATOM 718 O GLN A 53 -5.801 11.545 8.927 1.00 0.00 O ATOM 719 CB GLN A 53 -3.816 11.031 11.212 1.00 0.00 C ATOM 720 CG GLN A 53 -2.841 10.372 12.185 1.00 0.00 C ATOM 721 CD GLN A 53 -3.252 8.970 12.603 1.00 0.00 C ATOM 722 OE1 GLN A 53 -4.427 8.653 12.690 1.00 0.00 O ATOM 723 NE2 GLN A 53 -2.272 8.123 12.854 1.00 0.00 N ATOM 0 H GLN A 53 -2.155 9.606 10.092 1.00 0.00 H new ATOM 0 HA GLN A 53 -4.963 9.471 10.277 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -3.385 11.969 10.861 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -4.733 11.282 11.746 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -1.854 10.330 11.724 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -2.751 10.996 13.074 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -1.302 8.426 12.770 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -2.485 7.165 13.132 1.00 0.00 H new ATOM 732 N SER A 54 -3.887 11.208 7.841 1.00 0.00 N ATOM 733 CA SER A 54 -4.253 12.031 6.706 1.00 0.00 C ATOM 734 C SER A 54 -5.471 11.477 5.955 1.00 0.00 C ATOM 735 O SER A 54 -6.591 11.973 6.102 1.00 0.00 O ATOM 736 CB SER A 54 -3.060 12.148 5.760 1.00 0.00 C ATOM 737 OG SER A 54 -2.409 10.891 5.624 1.00 0.00 O ATOM 0 H SER A 54 -2.961 10.786 7.771 1.00 0.00 H new ATOM 0 HA SER A 54 -4.530 13.016 7.082 1.00 0.00 H new ATOM 0 HB2 SER A 54 -3.395 12.498 4.784 1.00 0.00 H new ATOM 0 HB3 SER A 54 -2.357 12.889 6.141 1.00 0.00 H new ATOM 0 HG SER A 54 -1.648 10.981 5.014 1.00 0.00 H new ATOM 743 N LEU A 55 -5.245 10.444 5.175 1.00 0.00 N ATOM 744 CA LEU A 55 -6.284 9.872 4.338 1.00 0.00 C ATOM 745 C LEU A 55 -7.133 8.849 5.105 1.00 0.00 C ATOM 746 O LEU A 55 -8.280 8.604 4.751 1.00 0.00 O ATOM 747 CB LEU A 55 -5.645 9.250 3.069 1.00 0.00 C ATOM 748 CG LEU A 55 -6.603 8.837 1.933 1.00 0.00 C ATOM 749 CD1 LEU A 55 -5.960 9.111 0.572 1.00 0.00 C ATOM 750 CD2 LEU A 55 -6.970 7.358 2.045 1.00 0.00 C ATOM 0 H LEU A 55 -4.342 9.976 5.100 1.00 0.00 H new ATOM 0 HA LEU A 55 -6.963 10.668 4.033 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.929 9.966 2.665 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.079 8.369 3.372 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.514 9.429 2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.647 8.815 -0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.738 10.174 0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.036 8.539 0.484 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.646 7.089 1.234 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.066 6.753 1.980 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.460 7.176 3.002 1.00 0.00 H new ATOM 762 N ALA A 56 -6.572 8.271 6.166 1.00 0.00 N ATOM 763 CA ALA A 56 -7.279 7.242 6.926 1.00 0.00 C ATOM 764 C ALA A 56 -8.275 7.800 7.920 1.00 0.00 C ATOM 765 O ALA A 56 -9.164 7.077 8.362 1.00 0.00 O ATOM 766 CB ALA A 56 -6.323 6.312 7.629 1.00 0.00 C ATOM 0 H ALA A 56 -5.640 8.494 6.516 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.846 6.680 6.183 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.887 5.561 8.183 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -5.688 5.819 6.893 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.702 6.882 8.320 1.00 0.00 H new ATOM 772 N SER A 57 -8.113 9.059 8.311 1.00 0.00 N ATOM 773 CA SER A 57 -9.030 9.654 9.269 1.00 0.00 C ATOM 774 C SER A 57 -10.451 9.710 8.698 1.00 0.00 C ATOM 775 O SER A 57 -10.803 10.626 7.952 1.00 0.00 O ATOM 776 CB SER A 57 -8.569 11.047 9.697 1.00 0.00 C ATOM 777 OG SER A 57 -9.276 11.479 10.849 1.00 0.00 O ATOM 0 H SER A 57 -7.369 9.676 7.985 1.00 0.00 H new ATOM 0 HA SER A 57 -9.036 9.019 10.155 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.499 11.033 9.905 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.726 11.754 8.882 1.00 0.00 H new ATOM 0 HG SER A 57 -8.965 12.372 11.108 1.00 0.00 H new ATOM 783 N THR A 58 -11.235 8.699 9.026 1.00 0.00 N ATOM 784 CA THR A 58 -12.603 8.603 8.567 1.00 0.00 C ATOM 785 C THR A 58 -13.571 8.570 9.756 1.00 0.00 C ATOM 786 O THR A 58 -14.667 9.116 9.696 1.00 0.00 O ATOM 787 CB THR A 58 -12.797 7.342 7.675 1.00 0.00 C ATOM 788 OG1 THR A 58 -14.154 7.256 7.212 1.00 0.00 O ATOM 789 CG2 THR A 58 -12.428 6.067 8.430 1.00 0.00 C ATOM 0 H THR A 58 -10.939 7.923 9.618 1.00 0.00 H new ATOM 0 HA THR A 58 -12.822 9.486 7.967 1.00 0.00 H new ATOM 0 HB THR A 58 -12.131 7.440 6.817 1.00 0.00 H new ATOM 0 HG1 THR A 58 -14.259 6.459 6.652 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.574 5.204 7.780 1.00 0.00 H new ATOM 0 HG22 THR A 58 -11.384 6.116 8.738 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.062 5.969 9.311 1.00 0.00 H new ATOM 797 N LEU A 59 -13.142 7.943 10.841 1.00 0.00 N ATOM 798 CA LEU A 59 -13.951 7.839 12.050 1.00 0.00 C ATOM 799 C LEU A 59 -13.250 8.532 13.204 1.00 0.00 C ATOM 800 O LEU A 59 -13.553 8.284 14.373 1.00 0.00 O ATOM 801 CB LEU A 59 -14.192 6.365 12.406 1.00 0.00 C ATOM 802 CG LEU A 59 -15.010 5.550 11.402 1.00 0.00 C ATOM 803 CD1 LEU A 59 -15.088 4.094 11.836 1.00 0.00 C ATOM 804 CD2 LEU A 59 -16.405 6.133 11.249 1.00 0.00 C ATOM 0 H LEU A 59 -12.229 7.494 10.910 1.00 0.00 H new ATOM 0 HA LEU A 59 -14.911 8.322 11.868 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -13.224 5.881 12.532 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -14.696 6.324 13.371 1.00 0.00 H new ATOM 0 HG LEU A 59 -14.510 5.597 10.435 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -15.673 3.529 11.111 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -14.082 3.677 11.894 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -15.564 4.031 12.814 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -16.971 5.539 10.531 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -16.913 6.118 12.213 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -16.333 7.161 10.893 1.00 0.00 H new ATOM 816 N GLY A 60 -12.317 9.406 12.874 1.00 0.00 N ATOM 817 CA GLY A 60 -11.538 10.054 13.899 1.00 0.00 C ATOM 818 C GLY A 60 -10.395 9.175 14.323 1.00 0.00 C ATOM 819 O GLY A 60 -10.364 8.677 15.449 1.00 0.00 O ATOM 0 H GLY A 60 -12.086 9.677 11.918 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -11.156 11.005 13.528 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -12.170 10.279 14.758 1.00 0.00 H new ATOM 823 N VAL A 61 -9.455 8.979 13.422 1.00 0.00 N ATOM 824 CA VAL A 61 -8.345 8.088 13.669 1.00 0.00 C ATOM 825 C VAL A 61 -7.213 8.834 14.334 1.00 0.00 C ATOM 826 O VAL A 61 -6.777 9.881 13.851 1.00 0.00 O ATOM 827 CB VAL A 61 -7.834 7.439 12.357 1.00 0.00 C ATOM 828 CG1 VAL A 61 -6.724 6.437 12.640 1.00 0.00 C ATOM 829 CG2 VAL A 61 -8.975 6.769 11.608 1.00 0.00 C ATOM 0 H VAL A 61 -9.440 9.429 12.507 1.00 0.00 H new ATOM 0 HA VAL A 61 -8.701 7.296 14.329 1.00 0.00 H new ATOM 0 HB VAL A 61 -7.426 8.231 11.729 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -6.384 5.997 11.703 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.891 6.945 13.126 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -7.101 5.651 13.294 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -8.594 6.320 10.691 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -9.416 5.994 12.235 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -9.734 7.512 11.361 1.00 0.00 H new ATOM 839 N ASP A 62 -6.777 8.295 15.462 1.00 0.00 N ATOM 840 CA ASP A 62 -5.691 8.855 16.252 1.00 0.00 C ATOM 841 C ASP A 62 -5.502 8.032 17.511 1.00 0.00 C ATOM 842 O ASP A 62 -6.149 8.274 18.527 1.00 0.00 O ATOM 843 CB ASP A 62 -5.958 10.320 16.626 1.00 0.00 C ATOM 844 CG ASP A 62 -4.838 10.925 17.444 1.00 0.00 C ATOM 845 OD1 ASP A 62 -3.731 11.117 16.898 1.00 0.00 O ATOM 846 OD2 ASP A 62 -5.064 11.227 18.638 1.00 0.00 O ATOM 0 H ASP A 62 -7.173 7.444 15.860 1.00 0.00 H new ATOM 0 HA ASP A 62 -4.785 8.825 15.647 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -6.095 10.904 15.716 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -6.889 10.384 17.189 1.00 0.00 H new ATOM 851 N GLY A 63 -4.670 7.013 17.416 1.00 0.00 N ATOM 852 CA GLY A 63 -4.387 6.166 18.560 1.00 0.00 C ATOM 853 C GLY A 63 -5.468 5.127 18.816 1.00 0.00 C ATOM 854 O GLY A 63 -5.198 3.928 18.753 1.00 0.00 O ATOM 0 H GLY A 63 -4.179 6.751 16.561 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.435 5.659 18.403 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -4.274 6.790 19.447 1.00 0.00 H new ATOM 858 N ASN A 64 -6.695 5.601 19.066 1.00 0.00 N ATOM 859 CA ASN A 64 -7.847 4.735 19.401 1.00 0.00 C ATOM 860 C ASN A 64 -8.010 3.588 18.411 1.00 0.00 C ATOM 861 O ASN A 64 -7.605 2.455 18.673 1.00 0.00 O ATOM 862 CB ASN A 64 -9.152 5.553 19.443 1.00 0.00 C ATOM 863 CG ASN A 64 -9.172 6.610 20.530 1.00 0.00 C ATOM 864 OD1 ASN A 64 -8.560 6.451 21.583 1.00 0.00 O ATOM 865 ND2 ASN A 64 -9.882 7.698 20.279 1.00 0.00 N ATOM 0 H ASN A 64 -6.924 6.595 19.043 1.00 0.00 H new ATOM 0 HA ASN A 64 -7.644 4.313 20.385 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -9.300 6.035 18.477 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -9.992 4.874 19.593 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -9.935 8.444 20.973 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -10.376 7.791 19.391 1.00 0.00 H new ATOM 872 N ASN A 65 -8.593 3.894 17.269 1.00 0.00 N ATOM 873 CA ASN A 65 -8.828 2.905 16.234 1.00 0.00 C ATOM 874 C ASN A 65 -7.610 2.753 15.340 1.00 0.00 C ATOM 875 O ASN A 65 -7.686 2.176 14.260 1.00 0.00 O ATOM 876 CB ASN A 65 -10.082 3.254 15.413 1.00 0.00 C ATOM 877 CG ASN A 65 -10.025 4.623 14.755 1.00 0.00 C ATOM 878 OD1 ASN A 65 -9.354 5.541 15.236 1.00 0.00 O ATOM 879 ND2 ASN A 65 -10.752 4.776 13.666 1.00 0.00 N ATOM 0 H ASN A 65 -8.917 4.832 17.032 1.00 0.00 H new ATOM 0 HA ASN A 65 -9.005 1.945 16.719 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -10.222 2.496 14.642 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -10.955 3.211 16.065 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -10.774 5.678 13.190 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -11.293 3.993 13.300 1.00 0.00 H new ATOM 886 N LEU A 66 -6.494 3.289 15.799 1.00 0.00 N ATOM 887 CA LEU A 66 -5.238 3.166 15.095 1.00 0.00 C ATOM 888 C LEU A 66 -4.528 1.889 15.528 1.00 0.00 C ATOM 889 O LEU A 66 -4.236 1.018 14.709 1.00 0.00 O ATOM 890 CB LEU A 66 -4.356 4.383 15.369 1.00 0.00 C ATOM 891 CG LEU A 66 -2.960 4.352 14.747 1.00 0.00 C ATOM 892 CD1 LEU A 66 -3.046 4.278 13.230 1.00 0.00 C ATOM 893 CD2 LEU A 66 -2.160 5.566 15.182 1.00 0.00 C ATOM 0 H LEU A 66 -6.436 3.820 16.668 1.00 0.00 H new ATOM 0 HA LEU A 66 -5.434 3.117 14.024 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.874 5.271 15.007 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -4.249 4.494 16.448 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.447 3.457 15.099 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.041 4.257 12.809 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.580 3.373 12.940 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.579 5.151 12.853 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.168 5.529 14.731 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.672 6.473 14.860 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.065 5.569 16.268 1.00 0.00 H new ATOM 905 N ALA A 67 -4.263 1.784 16.829 1.00 0.00 N ATOM 906 CA ALA A 67 -3.604 0.614 17.378 1.00 0.00 C ATOM 907 C ALA A 67 -4.586 -0.539 17.456 1.00 0.00 C ATOM 908 O ALA A 67 -4.265 -1.682 17.120 1.00 0.00 O ATOM 909 CB ALA A 67 -3.036 0.921 18.757 1.00 0.00 C ATOM 0 H ALA A 67 -4.497 2.499 17.518 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.779 0.333 16.723 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -2.545 0.033 19.154 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.312 1.732 18.680 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.844 1.219 19.425 1.00 0.00 H new ATOM 915 N ARG A 68 -5.787 -0.229 17.891 1.00 0.00 N ATOM 916 CA ARG A 68 -6.839 -1.211 17.999 1.00 0.00 C ATOM 917 C ARG A 68 -7.739 -1.098 16.794 1.00 0.00 C ATOM 918 O ARG A 68 -7.698 -0.095 16.099 1.00 0.00 O ATOM 919 CB ARG A 68 -7.637 -0.995 19.283 1.00 0.00 C ATOM 920 CG ARG A 68 -6.788 -1.067 20.537 1.00 0.00 C ATOM 921 CD ARG A 68 -7.608 -0.816 21.784 1.00 0.00 C ATOM 922 NE ARG A 68 -6.780 -0.841 22.990 1.00 0.00 N ATOM 923 CZ ARG A 68 -7.264 -0.868 24.235 1.00 0.00 C ATOM 924 NH1 ARG A 68 -8.577 -0.872 24.439 1.00 0.00 N ATOM 925 NH2 ARG A 68 -6.435 -0.883 25.276 1.00 0.00 N ATOM 0 H ARG A 68 -6.060 0.710 18.179 1.00 0.00 H new ATOM 0 HA ARG A 68 -6.404 -2.210 18.036 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -8.126 -0.022 19.239 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -8.425 -1.745 19.343 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -6.318 -2.048 20.602 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -5.985 -0.332 20.475 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -8.105 0.151 21.704 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -8.390 -1.571 21.864 1.00 0.00 H new ATOM 0 HE ARG A 68 -5.767 -0.838 22.873 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -9.217 -0.854 23.645 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -8.945 -0.893 25.390 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -5.426 -0.874 25.125 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -6.808 -0.904 26.225 1.00 0.00 H new ATOM 939 N PHE A 69 -8.541 -2.131 16.544 1.00 0.00 N ATOM 940 CA PHE A 69 -9.471 -2.159 15.398 1.00 0.00 C ATOM 941 C PHE A 69 -8.722 -2.286 14.060 1.00 0.00 C ATOM 942 O PHE A 69 -8.882 -3.271 13.349 1.00 0.00 O ATOM 943 CB PHE A 69 -10.395 -0.915 15.385 1.00 0.00 C ATOM 944 CG PHE A 69 -11.307 -0.807 16.582 1.00 0.00 C ATOM 945 CD1 PHE A 69 -10.856 -0.251 17.771 1.00 0.00 C ATOM 946 CD2 PHE A 69 -12.615 -1.254 16.514 1.00 0.00 C ATOM 947 CE1 PHE A 69 -11.690 -0.147 18.866 1.00 0.00 C ATOM 948 CE2 PHE A 69 -13.454 -1.151 17.608 1.00 0.00 C ATOM 949 CZ PHE A 69 -12.991 -0.598 18.784 1.00 0.00 C ATOM 0 H PHE A 69 -8.571 -2.971 17.121 1.00 0.00 H new ATOM 0 HA PHE A 69 -10.095 -3.045 15.520 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -9.777 -0.019 15.331 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -11.003 -0.938 14.481 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -9.839 0.105 17.840 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -12.984 -1.688 15.597 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -11.325 0.287 19.785 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -14.473 -1.504 17.542 1.00 0.00 H new ATOM 0 HZ PHE A 69 -13.646 -0.518 19.639 1.00 0.00 H new ATOM 959 N ALA A 70 -7.890 -1.298 13.745 1.00 0.00 N ATOM 960 CA ALA A 70 -7.145 -1.274 12.487 1.00 0.00 C ATOM 961 C ALA A 70 -6.151 -2.426 12.402 1.00 0.00 C ATOM 962 O ALA A 70 -6.265 -3.292 11.528 1.00 0.00 O ATOM 963 CB ALA A 70 -6.421 0.051 12.336 1.00 0.00 C ATOM 0 H ALA A 70 -7.713 -0.495 14.349 1.00 0.00 H new ATOM 0 HA ALA A 70 -7.861 -1.390 11.673 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -5.869 0.059 11.396 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -7.147 0.864 12.338 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.726 0.183 13.166 1.00 0.00 H new ATOM 969 N VAL A 71 -5.182 -2.440 13.313 1.00 0.00 N ATOM 970 CA VAL A 71 -4.168 -3.490 13.333 1.00 0.00 C ATOM 971 C VAL A 71 -4.804 -4.852 13.538 1.00 0.00 C ATOM 972 O VAL A 71 -4.447 -5.806 12.870 1.00 0.00 O ATOM 973 CB VAL A 71 -3.100 -3.238 14.428 1.00 0.00 C ATOM 974 CG1 VAL A 71 -2.057 -4.350 14.429 1.00 0.00 C ATOM 975 CG2 VAL A 71 -2.433 -1.884 14.216 1.00 0.00 C ATOM 0 H VAL A 71 -5.078 -1.738 14.045 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.670 -3.471 12.363 1.00 0.00 H new ATOM 0 HB VAL A 71 -3.597 -3.234 15.398 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -1.317 -4.154 15.205 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.544 -5.305 14.625 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -1.564 -4.387 13.458 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -1.686 -1.721 14.992 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.951 -1.865 13.239 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.185 -1.096 14.265 1.00 0.00 H new ATOM 985 N GLN A 72 -5.775 -4.923 14.433 1.00 0.00 N ATOM 986 CA GLN A 72 -6.461 -6.181 14.733 1.00 0.00 C ATOM 987 C GLN A 72 -7.123 -6.777 13.491 1.00 0.00 C ATOM 988 O GLN A 72 -7.114 -7.986 13.301 1.00 0.00 O ATOM 989 CB GLN A 72 -7.494 -5.974 15.837 1.00 0.00 C ATOM 990 CG GLN A 72 -6.879 -5.677 17.192 1.00 0.00 C ATOM 991 CD GLN A 72 -7.908 -5.328 18.244 1.00 0.00 C ATOM 992 OE1 GLN A 72 -9.056 -5.775 18.189 1.00 0.00 O ATOM 993 NE2 GLN A 72 -7.505 -4.541 19.217 1.00 0.00 N ATOM 0 H GLN A 72 -6.111 -4.124 14.970 1.00 0.00 H new ATOM 0 HA GLN A 72 -5.709 -6.890 15.078 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -8.153 -5.152 15.558 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.114 -6.867 15.916 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -6.308 -6.544 17.524 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -6.175 -4.851 17.092 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -6.547 -4.192 19.227 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -8.151 -4.280 19.962 1.00 0.00 H new ATOM 1002 N ALA A 73 -7.668 -5.925 12.644 1.00 0.00 N ATOM 1003 CA ALA A 73 -8.342 -6.384 11.441 1.00 0.00 C ATOM 1004 C ALA A 73 -7.356 -6.876 10.391 1.00 0.00 C ATOM 1005 O ALA A 73 -7.585 -7.889 9.757 1.00 0.00 O ATOM 1006 CB ALA A 73 -9.213 -5.286 10.862 1.00 0.00 C ATOM 0 H ALA A 73 -7.658 -4.912 12.765 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.973 -7.226 11.727 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.708 -5.651 9.962 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.964 -4.992 11.596 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -8.594 -4.425 10.611 1.00 0.00 H new ATOM 1012 N VAL A 74 -6.252 -6.160 10.217 1.00 0.00 N ATOM 1013 CA VAL A 74 -5.285 -6.512 9.181 1.00 0.00 C ATOM 1014 C VAL A 74 -4.283 -7.569 9.658 1.00 0.00 C ATOM 1015 O VAL A 74 -3.605 -8.198 8.856 1.00 0.00 O ATOM 1016 CB VAL A 74 -4.527 -5.271 8.649 1.00 0.00 C ATOM 1017 CG1 VAL A 74 -3.719 -5.622 7.405 1.00 0.00 C ATOM 1018 CG2 VAL A 74 -5.498 -4.149 8.343 1.00 0.00 C ATOM 0 H VAL A 74 -6.004 -5.341 10.772 1.00 0.00 H new ATOM 0 HA VAL A 74 -5.866 -6.938 8.363 1.00 0.00 H new ATOM 0 HB VAL A 74 -3.837 -4.937 9.424 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -3.195 -4.735 7.049 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.994 -6.398 7.649 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -4.390 -5.984 6.626 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -4.949 -3.284 7.970 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -6.210 -4.480 7.587 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.034 -3.874 9.251 1.00 0.00 H new ATOM 1028 N SER A 75 -4.188 -7.761 10.951 1.00 0.00 N ATOM 1029 CA SER A 75 -3.292 -8.768 11.478 1.00 0.00 C ATOM 1030 C SER A 75 -4.023 -10.101 11.620 1.00 0.00 C ATOM 1031 O SER A 75 -3.411 -11.169 11.610 1.00 0.00 O ATOM 1032 CB SER A 75 -2.711 -8.319 12.824 1.00 0.00 C ATOM 1033 OG SER A 75 -3.735 -8.142 13.788 1.00 0.00 O ATOM 0 H SER A 75 -4.713 -7.241 11.654 1.00 0.00 H new ATOM 0 HA SER A 75 -2.465 -8.901 10.780 1.00 0.00 H new ATOM 0 HB2 SER A 75 -1.996 -9.060 13.180 1.00 0.00 H new ATOM 0 HB3 SER A 75 -2.164 -7.385 12.694 1.00 0.00 H new ATOM 0 HG SER A 75 -4.069 -7.221 13.746 1.00 0.00 H new ATOM 1039 N ARG A 76 -5.340 -10.023 11.737 1.00 0.00 N ATOM 1040 CA ARG A 76 -6.173 -11.196 11.901 1.00 0.00 C ATOM 1041 C ARG A 76 -7.143 -11.325 10.720 1.00 0.00 C ATOM 1042 O ARG A 76 -8.189 -11.973 10.819 1.00 0.00 O ATOM 1043 CB ARG A 76 -6.946 -11.078 13.203 1.00 0.00 C ATOM 1044 CG ARG A 76 -7.499 -12.383 13.718 1.00 0.00 C ATOM 1045 CD ARG A 76 -8.407 -12.144 14.896 1.00 0.00 C ATOM 1046 NE ARG A 76 -9.638 -11.452 14.500 1.00 0.00 N ATOM 1047 CZ ARG A 76 -10.123 -10.353 15.090 1.00 0.00 C ATOM 1048 NH1 ARG A 76 -9.466 -9.776 16.088 1.00 0.00 N ATOM 1049 NH2 ARG A 76 -11.270 -9.831 14.668 1.00 0.00 N ATOM 0 H ARG A 76 -5.857 -9.144 11.720 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.545 -12.087 11.930 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.292 -10.649 13.962 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -7.770 -10.379 13.060 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -8.049 -12.890 12.925 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -6.681 -13.041 14.010 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.659 -13.097 15.361 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.882 -11.552 15.646 1.00 0.00 H new ATOM 0 HE ARG A 76 -10.164 -11.837 13.716 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -8.583 -10.170 16.412 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -9.844 -8.939 16.531 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -11.776 -10.268 13.898 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -11.644 -8.994 15.114 1.00 0.00 H new ATOM 1063 N LEU A 77 -6.785 -10.708 9.613 1.00 0.00 N ATOM 1064 CA LEU A 77 -7.618 -10.724 8.416 1.00 0.00 C ATOM 1065 C LEU A 77 -7.758 -12.143 7.856 1.00 0.00 C ATOM 1066 O LEU A 77 -6.832 -12.955 7.955 1.00 0.00 O ATOM 1067 CB LEU A 77 -7.080 -9.721 7.339 1.00 0.00 C ATOM 1068 CG LEU A 77 -5.759 -10.059 6.586 1.00 0.00 C ATOM 1069 CD1 LEU A 77 -4.697 -10.651 7.500 1.00 0.00 C ATOM 1070 CD2 LEU A 77 -6.020 -10.954 5.388 1.00 0.00 C ATOM 0 H LEU A 77 -5.916 -10.183 9.512 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.617 -10.390 8.698 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.862 -9.591 6.590 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.943 -8.756 7.827 1.00 0.00 H new ATOM 0 HG LEU A 77 -5.360 -9.113 6.220 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -3.799 -10.867 6.922 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -4.458 -9.938 8.289 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -5.072 -11.573 7.945 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -5.078 -11.171 4.884 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.476 -11.886 5.722 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.693 -10.448 4.696 1.00 0.00 H new ATOM 1171 N TYR A 86 -3.194 -9.451 -1.516 1.00 0.00 N ATOM 1172 CA TYR A 86 -3.087 -8.212 -0.773 1.00 0.00 C ATOM 1173 C TYR A 86 -1.866 -7.415 -1.210 1.00 0.00 C ATOM 1174 O TYR A 86 -1.204 -7.743 -2.199 1.00 0.00 O ATOM 1175 CB TYR A 86 -3.016 -8.495 0.740 1.00 0.00 C ATOM 1176 CG TYR A 86 -4.364 -8.560 1.417 1.00 0.00 C ATOM 1177 CD1 TYR A 86 -5.422 -9.234 0.829 1.00 0.00 C ATOM 1178 CD2 TYR A 86 -4.582 -7.940 2.648 1.00 0.00 C ATOM 1179 CE1 TYR A 86 -6.653 -9.292 1.434 1.00 0.00 C ATOM 1180 CE2 TYR A 86 -5.816 -7.998 3.259 1.00 0.00 C ATOM 1181 CZ TYR A 86 -6.849 -8.677 2.647 1.00 0.00 C ATOM 1182 OH TYR A 86 -8.084 -8.733 3.247 1.00 0.00 O ATOM 0 HA TYR A 86 -3.978 -7.619 -0.982 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -2.496 -9.440 0.898 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -2.419 -7.718 1.217 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -5.276 -9.723 -0.123 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -3.774 -7.408 3.128 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -7.466 -9.820 0.957 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -5.973 -7.514 4.212 1.00 0.00 H new ATOM 0 HH TYR A 86 -8.494 -7.843 3.235 1.00 0.00 H new ATOM 1192 N ALA A 87 -1.558 -6.381 -0.448 1.00 0.00 N ATOM 1193 CA ALA A 87 -0.440 -5.498 -0.735 1.00 0.00 C ATOM 1194 C ALA A 87 0.907 -6.136 -0.374 1.00 0.00 C ATOM 1195 O ALA A 87 1.845 -5.439 -0.014 1.00 0.00 O ATOM 1196 CB ALA A 87 -0.623 -4.197 0.026 1.00 0.00 C ATOM 0 H ALA A 87 -2.079 -6.128 0.392 1.00 0.00 H new ATOM 0 HA ALA A 87 -0.427 -5.306 -1.808 1.00 0.00 H new ATOM 0 HB1 ALA A 87 0.213 -3.531 -0.186 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -1.553 -3.722 -0.285 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -0.661 -4.403 1.096 1.00 0.00 H new ATOM 1202 N GLN A 88 0.991 -7.454 -0.486 1.00 0.00 N ATOM 1203 CA GLN A 88 2.220 -8.167 -0.195 1.00 0.00 C ATOM 1204 C GLN A 88 3.069 -8.275 -1.445 1.00 0.00 C ATOM 1205 O GLN A 88 4.177 -7.763 -1.503 1.00 0.00 O ATOM 1206 CB GLN A 88 1.912 -9.564 0.351 1.00 0.00 C ATOM 1207 CG GLN A 88 1.215 -9.546 1.696 1.00 0.00 C ATOM 1208 CD GLN A 88 2.068 -8.919 2.770 1.00 0.00 C ATOM 1209 OE1 GLN A 88 3.285 -9.022 2.749 1.00 0.00 O ATOM 1210 NE2 GLN A 88 1.435 -8.263 3.711 1.00 0.00 N ATOM 0 H GLN A 88 0.217 -8.051 -0.778 1.00 0.00 H new ATOM 0 HA GLN A 88 2.772 -7.610 0.562 1.00 0.00 H new ATOM 0 HB2 GLN A 88 1.287 -10.096 -0.366 1.00 0.00 H new ATOM 0 HB3 GLN A 88 2.843 -10.124 0.440 1.00 0.00 H new ATOM 0 HG2 GLN A 88 0.278 -8.996 1.611 1.00 0.00 H new ATOM 0 HG3 GLN A 88 0.960 -10.566 1.985 1.00 0.00 H new ATOM 0 HE21 GLN A 88 0.417 -8.200 3.693 1.00 0.00 H new ATOM 0 HE22 GLN A 88 1.960 -7.815 4.462 1.00 0.00 H new ATOM 1219 N ALA A 89 2.522 -8.911 -2.463 1.00 0.00 N ATOM 1220 CA ALA A 89 3.227 -9.069 -3.717 1.00 0.00 C ATOM 1221 C ALA A 89 3.197 -7.770 -4.501 1.00 0.00 C ATOM 1222 O ALA A 89 4.168 -7.395 -5.149 1.00 0.00 O ATOM 1223 CB ALA A 89 2.617 -10.201 -4.530 1.00 0.00 C ATOM 0 H ALA A 89 1.591 -9.326 -2.445 1.00 0.00 H new ATOM 0 HA ALA A 89 4.266 -9.322 -3.506 1.00 0.00 H new ATOM 0 HB1 ALA A 89 3.159 -10.307 -5.470 1.00 0.00 H new ATOM 0 HB2 ALA A 89 2.684 -11.131 -3.966 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.571 -9.977 -4.737 1.00 0.00 H new ATOM 1229 N PHE A 90 2.075 -7.076 -4.418 1.00 0.00 N ATOM 1230 CA PHE A 90 1.897 -5.819 -5.126 1.00 0.00 C ATOM 1231 C PHE A 90 2.483 -4.649 -4.346 1.00 0.00 C ATOM 1232 O PHE A 90 2.351 -3.499 -4.760 1.00 0.00 O ATOM 1233 CB PHE A 90 0.416 -5.572 -5.412 1.00 0.00 C ATOM 1234 CG PHE A 90 -0.199 -6.597 -6.318 1.00 0.00 C ATOM 1235 CD1 PHE A 90 -0.063 -6.492 -7.691 1.00 0.00 C ATOM 1236 CD2 PHE A 90 -0.911 -7.667 -5.797 1.00 0.00 C ATOM 1237 CE1 PHE A 90 -0.622 -7.432 -8.530 1.00 0.00 C ATOM 1238 CE2 PHE A 90 -1.472 -8.612 -6.631 1.00 0.00 C ATOM 1239 CZ PHE A 90 -1.328 -8.494 -7.999 1.00 0.00 C ATOM 0 H PHE A 90 1.269 -7.364 -3.864 1.00 0.00 H new ATOM 0 HA PHE A 90 2.435 -5.895 -6.071 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.130 -5.558 -4.469 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.301 -4.586 -5.862 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.488 -5.663 -8.110 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.027 -7.761 -4.727 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.508 -7.338 -9.600 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.023 -9.442 -6.215 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.767 -9.232 -8.654 1.00 0.00 H new ATOM 1249 N SER A 91 3.147 -4.953 -3.230 1.00 0.00 N ATOM 1250 CA SER A 91 3.733 -3.932 -2.360 1.00 0.00 C ATOM 1251 C SER A 91 4.620 -2.978 -3.163 1.00 0.00 C ATOM 1252 O SER A 91 4.605 -1.767 -2.949 1.00 0.00 O ATOM 1253 CB SER A 91 4.554 -4.606 -1.248 1.00 0.00 C ATOM 1254 OG SER A 91 4.828 -3.710 -0.182 1.00 0.00 O ATOM 0 H SER A 91 3.293 -5.909 -2.905 1.00 0.00 H new ATOM 0 HA SER A 91 2.926 -3.352 -1.912 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.010 -5.470 -0.867 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.492 -4.977 -1.662 1.00 0.00 H new ATOM 0 HG SER A 91 5.350 -4.172 0.507 1.00 0.00 H new ATOM 1260 N SER A 92 5.356 -3.537 -4.106 1.00 0.00 N ATOM 1261 CA SER A 92 6.271 -2.784 -4.939 1.00 0.00 C ATOM 1262 C SER A 92 5.567 -1.667 -5.721 1.00 0.00 C ATOM 1263 O SER A 92 5.972 -0.497 -5.659 1.00 0.00 O ATOM 1264 CB SER A 92 6.943 -3.732 -5.908 1.00 0.00 C ATOM 1265 OG SER A 92 7.315 -4.928 -5.257 1.00 0.00 O ATOM 0 H SER A 92 5.334 -4.535 -4.316 1.00 0.00 H new ATOM 0 HA SER A 92 7.004 -2.309 -4.287 1.00 0.00 H new ATOM 0 HB2 SER A 92 6.267 -3.956 -6.733 1.00 0.00 H new ATOM 0 HB3 SER A 92 7.825 -3.256 -6.338 1.00 0.00 H new ATOM 0 HG SER A 92 7.901 -5.451 -5.843 1.00 0.00 H new ATOM 1271 N ALA A 93 4.517 -2.031 -6.446 1.00 0.00 N ATOM 1272 CA ALA A 93 3.802 -1.082 -7.290 1.00 0.00 C ATOM 1273 C ALA A 93 2.898 -0.178 -6.481 1.00 0.00 C ATOM 1274 O ALA A 93 2.538 0.903 -6.926 1.00 0.00 O ATOM 1275 CB ALA A 93 3.001 -1.810 -8.353 1.00 0.00 C ATOM 0 H ALA A 93 4.141 -2.979 -6.466 1.00 0.00 H new ATOM 0 HA ALA A 93 4.549 -0.454 -7.776 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.475 -1.084 -8.973 1.00 0.00 H new ATOM 0 HB2 ALA A 93 3.674 -2.399 -8.976 1.00 0.00 H new ATOM 0 HB3 ALA A 93 2.278 -2.471 -7.875 1.00 0.00 H new ATOM 1281 N LEU A 94 2.522 -0.624 -5.303 1.00 0.00 N ATOM 1282 CA LEU A 94 1.653 0.160 -4.456 1.00 0.00 C ATOM 1283 C LEU A 94 2.436 1.195 -3.668 1.00 0.00 C ATOM 1284 O LEU A 94 2.040 2.345 -3.587 1.00 0.00 O ATOM 1285 CB LEU A 94 0.881 -0.735 -3.494 1.00 0.00 C ATOM 1286 CG LEU A 94 -0.002 -1.805 -4.126 1.00 0.00 C ATOM 1287 CD1 LEU A 94 -0.746 -2.568 -3.052 1.00 0.00 C ATOM 1288 CD2 LEU A 94 -0.970 -1.189 -5.119 1.00 0.00 C ATOM 0 H LEU A 94 2.804 -1.523 -4.911 1.00 0.00 H new ATOM 0 HA LEU A 94 0.948 0.677 -5.107 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.597 -1.227 -2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.254 -0.102 -2.866 1.00 0.00 H new ATOM 0 HG LEU A 94 0.635 -2.503 -4.670 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -1.373 -3.330 -3.515 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.030 -3.045 -2.383 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.371 -1.880 -2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.589 -1.972 -5.557 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.606 -0.467 -4.607 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.411 -0.685 -5.907 1.00 0.00 H new ATOM 1300 N PHE A 95 3.545 0.777 -3.085 1.00 0.00 N ATOM 1301 CA PHE A 95 4.343 1.652 -2.240 1.00 0.00 C ATOM 1302 C PHE A 95 5.062 2.729 -3.045 1.00 0.00 C ATOM 1303 O PHE A 95 5.074 3.892 -2.646 1.00 0.00 O ATOM 1304 CB PHE A 95 5.355 0.831 -1.427 1.00 0.00 C ATOM 1305 CG PHE A 95 6.221 1.654 -0.511 1.00 0.00 C ATOM 1306 CD1 PHE A 95 5.716 2.155 0.678 1.00 0.00 C ATOM 1307 CD2 PHE A 95 7.541 1.923 -0.839 1.00 0.00 C ATOM 1308 CE1 PHE A 95 6.509 2.908 1.521 1.00 0.00 C ATOM 1309 CE2 PHE A 95 8.339 2.677 -0.001 1.00 0.00 C ATOM 1310 CZ PHE A 95 7.822 3.170 1.181 1.00 0.00 C ATOM 0 H PHE A 95 3.916 -0.168 -3.181 1.00 0.00 H new ATOM 0 HA PHE A 95 3.659 2.157 -1.558 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.815 0.094 -0.833 1.00 0.00 H new ATOM 0 HB3 PHE A 95 5.995 0.279 -2.115 1.00 0.00 H new ATOM 0 HD1 PHE A 95 4.690 1.954 0.949 1.00 0.00 H new ATOM 0 HD2 PHE A 95 7.950 1.538 -1.761 1.00 0.00 H new ATOM 0 HE1 PHE A 95 6.103 3.292 2.445 1.00 0.00 H new ATOM 0 HE2 PHE A 95 9.365 2.881 -0.269 1.00 0.00 H new ATOM 0 HZ PHE A 95 8.443 3.760 1.839 1.00 0.00 H new ATOM 1320 N ASN A 96 5.641 2.332 -4.183 1.00 0.00 N ATOM 1321 CA ASN A 96 6.442 3.240 -5.017 1.00 0.00 C ATOM 1322 C ASN A 96 7.698 3.672 -4.275 1.00 0.00 C ATOM 1323 O ASN A 96 7.709 4.678 -3.578 1.00 0.00 O ATOM 1324 CB ASN A 96 5.653 4.491 -5.479 1.00 0.00 C ATOM 1325 CG ASN A 96 4.771 4.263 -6.693 1.00 0.00 C ATOM 1326 OD1 ASN A 96 4.593 5.162 -7.514 1.00 0.00 O ATOM 1327 ND2 ASN A 96 4.200 3.093 -6.806 1.00 0.00 N ATOM 0 H ASN A 96 5.570 1.383 -4.551 1.00 0.00 H new ATOM 0 HA ASN A 96 6.712 2.680 -5.912 1.00 0.00 H new ATOM 0 HB2 ASN A 96 5.032 4.839 -4.654 1.00 0.00 H new ATOM 0 HB3 ASN A 96 6.360 5.289 -5.704 1.00 0.00 H new ATOM 0 HD21 ASN A 96 3.583 2.901 -7.595 1.00 0.00 H new ATOM 0 HD22 ASN A 96 4.372 2.372 -6.105 1.00 0.00 H new ATOM 1334 N ALA A 97 8.752 2.889 -4.416 1.00 0.00 N ATOM 1335 CA ALA A 97 10.017 3.194 -3.765 1.00 0.00 C ATOM 1336 C ALA A 97 10.830 4.184 -4.597 1.00 0.00 C ATOM 1337 O ALA A 97 11.945 4.544 -4.239 1.00 0.00 O ATOM 1338 CB ALA A 97 10.811 1.915 -3.539 1.00 0.00 C ATOM 0 H ALA A 97 8.759 2.036 -4.975 1.00 0.00 H new ATOM 0 HA ALA A 97 9.806 3.654 -2.799 1.00 0.00 H new ATOM 0 HB1 ALA A 97 11.756 2.155 -3.051 1.00 0.00 H new ATOM 0 HB2 ALA A 97 10.238 1.238 -2.906 1.00 0.00 H new ATOM 0 HB3 ALA A 97 11.009 1.435 -4.498 1.00 0.00 H new ATOM 1344 N GLY A 98 10.262 4.598 -5.725 1.00 0.00 N ATOM 1345 CA GLY A 98 10.937 5.529 -6.623 1.00 0.00 C ATOM 1346 C GLY A 98 11.936 4.828 -7.521 1.00 0.00 C ATOM 1347 O GLY A 98 12.396 5.383 -8.514 1.00 0.00 O ATOM 0 H GLY A 98 9.337 4.304 -6.039 1.00 0.00 H new ATOM 0 HA2 GLY A 98 10.196 6.043 -7.236 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.449 6.291 -6.036 1.00 0.00 H new ATOM 1351 N VAL A 99 12.245 3.596 -7.174 1.00 0.00 N ATOM 1352 CA VAL A 99 13.213 2.795 -7.902 1.00 0.00 C ATOM 1353 C VAL A 99 12.488 1.803 -8.820 1.00 0.00 C ATOM 1354 O VAL A 99 12.992 0.727 -9.125 1.00 0.00 O ATOM 1355 CB VAL A 99 14.115 2.016 -6.914 1.00 0.00 C ATOM 1356 CG1 VAL A 99 15.375 1.499 -7.597 1.00 0.00 C ATOM 1357 CG2 VAL A 99 14.466 2.875 -5.707 1.00 0.00 C ATOM 0 H VAL A 99 11.830 3.117 -6.374 1.00 0.00 H new ATOM 0 HA VAL A 99 13.832 3.460 -8.504 1.00 0.00 H new ATOM 0 HB VAL A 99 13.551 1.151 -6.565 1.00 0.00 H new ATOM 0 HG11 VAL A 99 15.985 0.957 -6.874 1.00 0.00 H new ATOM 0 HG12 VAL A 99 15.099 0.830 -8.412 1.00 0.00 H new ATOM 0 HG13 VAL A 99 15.944 2.339 -7.994 1.00 0.00 H new ATOM 0 HG21 VAL A 99 15.100 2.306 -5.027 1.00 0.00 H new ATOM 0 HG22 VAL A 99 14.998 3.767 -6.038 1.00 0.00 H new ATOM 0 HG23 VAL A 99 13.552 3.168 -5.191 1.00 0.00 H new ATOM 1367 N LEU A 100 11.309 2.178 -9.258 1.00 0.00 N ATOM 1368 CA LEU A 100 10.518 1.324 -10.125 1.00 0.00 C ATOM 1369 C LEU A 100 10.190 2.045 -11.410 1.00 0.00 C ATOM 1370 O LEU A 100 10.457 3.238 -11.545 1.00 0.00 O ATOM 1371 CB LEU A 100 9.215 0.880 -9.441 1.00 0.00 C ATOM 1372 CG LEU A 100 8.195 1.987 -9.132 1.00 0.00 C ATOM 1373 CD1 LEU A 100 6.794 1.405 -9.043 1.00 0.00 C ATOM 1374 CD2 LEU A 100 8.545 2.691 -7.835 1.00 0.00 C ATOM 0 H LEU A 100 10.872 3.071 -9.030 1.00 0.00 H new ATOM 0 HA LEU A 100 11.112 0.436 -10.343 1.00 0.00 H new ATOM 0 HB2 LEU A 100 8.732 0.137 -10.076 1.00 0.00 H new ATOM 0 HB3 LEU A 100 9.472 0.382 -8.506 1.00 0.00 H new ATOM 0 HG LEU A 100 8.226 2.715 -9.943 1.00 0.00 H new ATOM 0 HD11 LEU A 100 6.083 2.201 -8.824 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.533 0.937 -9.992 1.00 0.00 H new ATOM 0 HD13 LEU A 100 6.760 0.659 -8.249 1.00 0.00 H new ATOM 0 HD21 LEU A 100 7.810 3.471 -7.635 1.00 0.00 H new ATOM 0 HD22 LEU A 100 8.541 1.970 -7.017 1.00 0.00 H new ATOM 0 HD23 LEU A 100 9.535 3.138 -7.920 1.00 0.00 H new ATOM 1386 N ASN A 101 9.604 1.325 -12.348 1.00 0.00 N ATOM 1387 CA ASN A 101 9.213 1.902 -13.609 1.00 0.00 C ATOM 1388 C ASN A 101 7.987 2.775 -13.414 1.00 0.00 C ATOM 1389 O ASN A 101 6.857 2.275 -13.324 1.00 0.00 O ATOM 1390 CB ASN A 101 8.938 0.800 -14.643 1.00 0.00 C ATOM 1391 CG ASN A 101 8.477 1.347 -15.980 1.00 0.00 C ATOM 1392 OD1 ASN A 101 8.795 2.474 -16.346 1.00 0.00 O ATOM 1393 ND2 ASN A 101 7.731 0.546 -16.720 1.00 0.00 N ATOM 0 H ASN A 101 9.389 0.332 -12.254 1.00 0.00 H new ATOM 0 HA ASN A 101 10.028 2.520 -13.985 1.00 0.00 H new ATOM 0 HB2 ASN A 101 9.844 0.212 -14.790 1.00 0.00 H new ATOM 0 HB3 ASN A 101 8.179 0.123 -14.252 1.00 0.00 H new ATOM 0 HD21 ASN A 101 7.398 0.858 -17.632 1.00 0.00 H new ATOM 0 HD22 ASN A 101 7.489 -0.384 -16.379 1.00 0.00 H new ATOM 1400 N ALA A 102 8.215 4.078 -13.325 1.00 0.00 N ATOM 1401 CA ALA A 102 7.143 5.037 -13.117 1.00 0.00 C ATOM 1402 C ALA A 102 6.255 5.123 -14.342 1.00 0.00 C ATOM 1403 O ALA A 102 5.116 5.580 -14.268 1.00 0.00 O ATOM 1404 CB ALA A 102 7.711 6.405 -12.771 1.00 0.00 C ATOM 0 H ALA A 102 9.143 4.496 -13.395 1.00 0.00 H new ATOM 0 HA ALA A 102 6.536 4.694 -12.279 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.894 7.110 -12.619 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.303 6.333 -11.859 1.00 0.00 H new ATOM 0 HB3 ALA A 102 8.344 6.753 -13.587 1.00 0.00 H new ATOM 1410 N SER A 103 6.766 4.645 -15.466 1.00 0.00 N ATOM 1411 CA SER A 103 6.016 4.658 -16.690 1.00 0.00 C ATOM 1412 C SER A 103 4.900 3.640 -16.592 1.00 0.00 C ATOM 1413 O SER A 103 3.830 3.822 -17.154 1.00 0.00 O ATOM 1414 CB SER A 103 6.930 4.361 -17.888 1.00 0.00 C ATOM 1415 OG SER A 103 6.210 4.374 -19.110 1.00 0.00 O ATOM 0 H SER A 103 7.701 4.244 -15.545 1.00 0.00 H new ATOM 0 HA SER A 103 5.586 5.647 -16.845 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.730 5.101 -17.928 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.402 3.388 -17.754 1.00 0.00 H new ATOM 0 HG SER A 103 6.821 4.183 -19.852 1.00 0.00 H new ATOM 1421 N ASN A 104 5.149 2.576 -15.833 1.00 0.00 N ATOM 1422 CA ASN A 104 4.158 1.539 -15.629 1.00 0.00 C ATOM 1423 C ASN A 104 3.008 2.084 -14.784 1.00 0.00 C ATOM 1424 O ASN A 104 1.840 1.759 -15.009 1.00 0.00 O ATOM 1425 CB ASN A 104 4.819 0.295 -14.993 1.00 0.00 C ATOM 1426 CG ASN A 104 4.204 -0.146 -13.671 1.00 0.00 C ATOM 1427 OD1 ASN A 104 3.238 -0.904 -13.639 1.00 0.00 O ATOM 1428 ND2 ASN A 104 4.788 0.300 -12.577 1.00 0.00 N ATOM 0 H ASN A 104 6.033 2.415 -15.351 1.00 0.00 H new ATOM 0 HA ASN A 104 3.741 1.228 -16.587 1.00 0.00 H new ATOM 0 HB2 ASN A 104 4.760 -0.533 -15.700 1.00 0.00 H new ATOM 0 HB3 ASN A 104 5.877 0.504 -14.834 1.00 0.00 H new ATOM 0 HD21 ASN A 104 4.440 0.017 -11.661 1.00 0.00 H new ATOM 0 HD22 ASN A 104 5.588 0.928 -12.646 1.00 0.00 H new ATOM 1435 N ILE A 105 3.346 2.956 -13.841 1.00 0.00 N ATOM 1436 CA ILE A 105 2.347 3.604 -13.009 1.00 0.00 C ATOM 1437 C ILE A 105 1.511 4.552 -13.854 1.00 0.00 C ATOM 1438 O ILE A 105 0.311 4.694 -13.649 1.00 0.00 O ATOM 1439 CB ILE A 105 2.998 4.383 -11.833 1.00 0.00 C ATOM 1440 CG1 ILE A 105 3.914 3.461 -11.015 1.00 0.00 C ATOM 1441 CG2 ILE A 105 1.933 5.012 -10.940 1.00 0.00 C ATOM 1442 CD1 ILE A 105 3.226 2.220 -10.487 1.00 0.00 C ATOM 0 H ILE A 105 4.307 3.229 -13.636 1.00 0.00 H new ATOM 0 HA ILE A 105 1.710 2.828 -12.584 1.00 0.00 H new ATOM 0 HB ILE A 105 3.604 5.186 -12.253 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.757 3.160 -11.636 1.00 0.00 H new ATOM 0 HG13 ILE A 105 4.322 4.023 -10.175 1.00 0.00 H new ATOM 0 HG21 ILE A 105 2.414 5.552 -10.124 1.00 0.00 H new ATOM 0 HG22 ILE A 105 1.329 5.704 -11.526 1.00 0.00 H new ATOM 0 HG23 ILE A 105 1.294 4.230 -10.530 1.00 0.00 H new ATOM 0 HD11 ILE A 105 3.940 1.622 -9.921 1.00 0.00 H new ATOM 0 HD12 ILE A 105 2.400 2.510 -9.838 1.00 0.00 H new ATOM 0 HD13 ILE A 105 2.843 1.633 -11.322 1.00 0.00 H new ATOM 1454 N ASP A 106 2.141 5.181 -14.819 1.00 0.00 N ATOM 1455 CA ASP A 106 1.433 6.079 -15.708 1.00 0.00 C ATOM 1456 C ASP A 106 0.662 5.290 -16.770 1.00 0.00 C ATOM 1457 O ASP A 106 -0.326 5.763 -17.308 1.00 0.00 O ATOM 1458 CB ASP A 106 2.401 7.064 -16.365 1.00 0.00 C ATOM 1459 CG ASP A 106 1.684 8.133 -17.165 1.00 0.00 C ATOM 1460 OD1 ASP A 106 1.059 9.023 -16.545 1.00 0.00 O ATOM 1461 OD2 ASP A 106 1.749 8.097 -18.412 1.00 0.00 O ATOM 0 H ASP A 106 3.139 5.090 -15.010 1.00 0.00 H new ATOM 0 HA ASP A 106 0.716 6.649 -15.117 1.00 0.00 H new ATOM 0 HB2 ASP A 106 3.011 7.538 -15.596 1.00 0.00 H new ATOM 0 HB3 ASP A 106 3.081 6.519 -17.020 1.00 0.00 H new ATOM 1466 N THR A 107 1.107 4.076 -17.046 1.00 0.00 N ATOM 1467 CA THR A 107 0.455 3.239 -18.043 1.00 0.00 C ATOM 1468 C THR A 107 -0.861 2.660 -17.509 1.00 0.00 C ATOM 1469 O THR A 107 -1.931 2.927 -18.058 1.00 0.00 O ATOM 1470 CB THR A 107 1.382 2.095 -18.524 1.00 0.00 C ATOM 1471 OG1 THR A 107 2.569 2.649 -19.111 1.00 0.00 O ATOM 1472 CG2 THR A 107 0.680 1.214 -19.551 1.00 0.00 C ATOM 0 H THR A 107 1.915 3.647 -16.596 1.00 0.00 H new ATOM 0 HA THR A 107 0.232 3.879 -18.897 1.00 0.00 H new ATOM 0 HB THR A 107 1.642 1.483 -17.660 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.982 3.277 -18.482 1.00 0.00 H new ATOM 0 HG21 THR A 107 1.354 0.420 -19.871 1.00 0.00 H new ATOM 0 HG22 THR A 107 -0.212 0.775 -19.104 1.00 0.00 H new ATOM 0 HG23 THR A 107 0.395 1.817 -20.413 1.00 0.00 H new ATOM 1480 N LEU A 108 -0.788 1.881 -16.437 1.00 0.00 N ATOM 1481 CA LEU A 108 -1.996 1.278 -15.882 1.00 0.00 C ATOM 1482 C LEU A 108 -2.214 1.683 -14.438 1.00 0.00 C ATOM 1483 O LEU A 108 -3.330 1.615 -13.939 1.00 0.00 O ATOM 1484 CB LEU A 108 -1.956 -0.251 -15.970 1.00 0.00 C ATOM 1485 CG LEU A 108 -1.017 -0.962 -14.981 1.00 0.00 C ATOM 1486 CD1 LEU A 108 -1.506 -2.375 -14.699 1.00 0.00 C ATOM 1487 CD2 LEU A 108 0.407 -0.994 -15.516 1.00 0.00 C ATOM 0 H LEU A 108 0.075 1.654 -15.942 1.00 0.00 H new ATOM 0 HA LEU A 108 -2.825 1.649 -16.484 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.966 -0.630 -15.816 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.662 -0.529 -16.982 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.022 -0.400 -14.047 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.828 -2.861 -13.997 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -2.507 -2.335 -14.268 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.534 -2.943 -15.629 1.00 0.00 H new ATOM 0 HD21 LEU A 108 1.053 -1.502 -14.800 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.427 -1.529 -16.466 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.762 0.025 -15.666 1.00 0.00 H new ATOM 1499 N GLY A 109 -1.153 2.111 -13.779 1.00 0.00 N ATOM 1500 CA GLY A 109 -1.235 2.462 -12.371 1.00 0.00 C ATOM 1501 C GLY A 109 -2.334 3.463 -12.052 1.00 0.00 C ATOM 1502 O GLY A 109 -3.261 3.168 -11.295 1.00 0.00 O ATOM 0 H GLY A 109 -0.228 2.224 -14.193 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.402 1.556 -11.789 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.277 2.874 -12.052 1.00 0.00 H new ATOM 1506 N SER A 110 -2.237 4.630 -12.634 1.00 0.00 N ATOM 1507 CA SER A 110 -3.199 5.683 -12.394 1.00 0.00 C ATOM 1508 C SER A 110 -4.453 5.521 -13.256 1.00 0.00 C ATOM 1509 O SER A 110 -5.478 6.149 -12.995 1.00 0.00 O ATOM 1510 CB SER A 110 -2.541 7.040 -12.638 1.00 0.00 C ATOM 1511 OG SER A 110 -1.739 7.009 -13.812 1.00 0.00 O ATOM 0 H SER A 110 -1.493 4.880 -13.286 1.00 0.00 H new ATOM 0 HA SER A 110 -3.522 5.619 -11.355 1.00 0.00 H new ATOM 0 HB2 SER A 110 -3.308 7.808 -12.736 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.926 7.311 -11.779 1.00 0.00 H new ATOM 0 HG SER A 110 -1.205 7.829 -13.865 1.00 0.00 H new ATOM 1517 N ARG A 111 -4.365 4.681 -14.273 1.00 0.00 N ATOM 1518 CA ARG A 111 -5.488 4.454 -15.180 1.00 0.00 C ATOM 1519 C ARG A 111 -6.415 3.347 -14.683 1.00 0.00 C ATOM 1520 O ARG A 111 -7.596 3.579 -14.428 1.00 0.00 O ATOM 1521 CB ARG A 111 -4.994 4.128 -16.592 1.00 0.00 C ATOM 1522 CG ARG A 111 -4.663 5.346 -17.442 1.00 0.00 C ATOM 1523 CD ARG A 111 -3.484 6.135 -16.894 1.00 0.00 C ATOM 1524 NE ARG A 111 -3.262 7.361 -17.671 1.00 0.00 N ATOM 1525 CZ ARG A 111 -2.315 8.269 -17.419 1.00 0.00 C ATOM 1526 NH1 ARG A 111 -1.529 8.146 -16.362 1.00 0.00 N ATOM 1527 NH2 ARG A 111 -2.182 9.323 -18.216 1.00 0.00 N ATOM 0 H ARG A 111 -3.528 4.142 -14.495 1.00 0.00 H new ATOM 0 HA ARG A 111 -6.061 5.381 -15.208 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -4.106 3.501 -16.517 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -5.756 3.540 -17.103 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -4.440 5.025 -18.460 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -5.537 5.995 -17.497 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -3.667 6.390 -15.850 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -2.586 5.517 -16.919 1.00 0.00 H new ATOM 0 HE ARG A 111 -3.879 7.533 -18.465 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.643 7.353 -15.731 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -0.809 8.844 -16.178 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -2.802 9.438 -19.018 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -1.460 10.018 -18.026 1.00 0.00 H new ATOM 1541 N VAL A 112 -5.869 2.155 -14.532 1.00 0.00 N ATOM 1542 CA VAL A 112 -6.653 0.995 -14.146 1.00 0.00 C ATOM 1543 C VAL A 112 -6.951 1.000 -12.655 1.00 0.00 C ATOM 1544 O VAL A 112 -8.113 1.007 -12.249 1.00 0.00 O ATOM 1545 CB VAL A 112 -5.935 -0.324 -14.529 1.00 0.00 C ATOM 1546 CG1 VAL A 112 -6.760 -1.531 -14.108 1.00 0.00 C ATOM 1547 CG2 VAL A 112 -5.661 -0.365 -16.027 1.00 0.00 C ATOM 0 H VAL A 112 -4.877 1.963 -14.672 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.595 1.052 -14.692 1.00 0.00 H new ATOM 0 HB VAL A 112 -4.983 -0.360 -13.999 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -6.236 -2.445 -14.387 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -6.907 -1.512 -13.028 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -7.729 -1.501 -14.607 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -5.156 -1.298 -16.279 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -6.604 -0.304 -16.571 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -5.027 0.477 -16.304 1.00 0.00 H new ATOM 1557 N LEU A 113 -5.903 1.022 -11.838 1.00 0.00 N ATOM 1558 CA LEU A 113 -6.083 1.010 -10.390 1.00 0.00 C ATOM 1559 C LEU A 113 -6.684 2.337 -9.926 1.00 0.00 C ATOM 1560 O LEU A 113 -7.355 2.404 -8.894 1.00 0.00 O ATOM 1561 CB LEU A 113 -4.758 0.721 -9.649 1.00 0.00 C ATOM 1562 CG LEU A 113 -4.016 -0.591 -10.019 1.00 0.00 C ATOM 1563 CD1 LEU A 113 -4.977 -1.693 -10.438 1.00 0.00 C ATOM 1564 CD2 LEU A 113 -2.966 -0.350 -11.089 1.00 0.00 C ATOM 0 H LEU A 113 -4.932 1.048 -12.148 1.00 0.00 H new ATOM 0 HA LEU A 113 -6.772 0.202 -10.145 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -4.080 1.556 -9.829 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -4.965 0.703 -8.579 1.00 0.00 H new ATOM 0 HG LEU A 113 -3.507 -0.931 -9.117 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -4.413 -2.592 -10.688 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -5.661 -1.910 -9.618 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -5.546 -1.368 -11.309 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.465 -1.289 -11.325 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -3.444 0.042 -11.987 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.234 0.370 -10.724 1.00 0.00 H new ATOM 1576 N SER A 114 -6.417 3.381 -10.713 1.00 0.00 N ATOM 1577 CA SER A 114 -6.957 4.725 -10.509 1.00 0.00 C ATOM 1578 C SER A 114 -6.882 5.201 -9.045 1.00 0.00 C ATOM 1579 O SER A 114 -5.799 5.538 -8.558 1.00 0.00 O ATOM 1580 CB SER A 114 -8.389 4.824 -11.057 1.00 0.00 C ATOM 1581 OG SER A 114 -8.897 6.138 -10.927 1.00 0.00 O ATOM 0 H SER A 114 -5.806 3.313 -11.527 1.00 0.00 H new ATOM 0 HA SER A 114 -6.317 5.404 -11.073 1.00 0.00 H new ATOM 0 HB2 SER A 114 -8.401 4.529 -12.106 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.035 4.127 -10.523 1.00 0.00 H new ATOM 0 HG SER A 114 -9.809 6.173 -11.285 1.00 0.00 H new ATOM 1587 N ALA A 115 -8.036 5.203 -8.357 1.00 0.00 N ATOM 1588 CA ALA A 115 -8.162 5.697 -6.975 1.00 0.00 C ATOM 1589 C ALA A 115 -7.082 5.147 -6.056 1.00 0.00 C ATOM 1590 O ALA A 115 -6.584 5.852 -5.172 1.00 0.00 O ATOM 1591 CB ALA A 115 -9.537 5.351 -6.423 1.00 0.00 C ATOM 0 H ALA A 115 -8.914 4.860 -8.747 1.00 0.00 H new ATOM 0 HA ALA A 115 -8.035 6.779 -7.009 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -9.622 5.720 -5.401 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -10.305 5.816 -7.041 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -9.671 4.269 -6.431 1.00 0.00 H new ATOM 1597 N LEU A 116 -6.712 3.902 -6.280 1.00 0.00 N ATOM 1598 CA LEU A 116 -5.714 3.248 -5.472 1.00 0.00 C ATOM 1599 C LEU A 116 -4.386 3.995 -5.521 1.00 0.00 C ATOM 1600 O LEU A 116 -3.923 4.512 -4.505 1.00 0.00 O ATOM 1601 CB LEU A 116 -5.534 1.798 -5.924 1.00 0.00 C ATOM 1602 CG LEU A 116 -4.368 1.033 -5.291 1.00 0.00 C ATOM 1603 CD1 LEU A 116 -4.438 1.093 -3.775 1.00 0.00 C ATOM 1604 CD2 LEU A 116 -4.370 -0.408 -5.766 1.00 0.00 C ATOM 0 H LEU A 116 -7.096 3.321 -7.025 1.00 0.00 H new ATOM 0 HA LEU A 116 -6.059 3.253 -4.438 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -6.455 1.256 -5.711 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.402 1.790 -7.006 1.00 0.00 H new ATOM 0 HG LEU A 116 -3.437 1.506 -5.604 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -3.599 0.542 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -4.392 2.132 -3.449 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -5.373 0.648 -3.436 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -3.537 -0.943 -5.310 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -5.307 -0.884 -5.479 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -4.267 -0.434 -6.851 1.00 0.00 H new ATOM 1616 N LEU A 117 -3.801 4.083 -6.697 1.00 0.00 N ATOM 1617 CA LEU A 117 -2.504 4.713 -6.837 1.00 0.00 C ATOM 1618 C LEU A 117 -2.597 6.230 -6.868 1.00 0.00 C ATOM 1619 O LEU A 117 -1.631 6.908 -6.561 1.00 0.00 O ATOM 1620 CB LEU A 117 -1.749 4.171 -8.046 1.00 0.00 C ATOM 1621 CG LEU A 117 -1.365 2.687 -7.958 1.00 0.00 C ATOM 1622 CD1 LEU A 117 -0.481 2.296 -9.120 1.00 0.00 C ATOM 1623 CD2 LEU A 117 -0.670 2.385 -6.638 1.00 0.00 C ATOM 0 H LEU A 117 -4.200 3.728 -7.566 1.00 0.00 H new ATOM 0 HA LEU A 117 -1.931 4.455 -5.947 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -2.362 4.320 -8.935 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -0.841 4.759 -8.182 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.281 2.098 -8.006 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.220 1.241 -9.039 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.013 2.468 -10.056 1.00 0.00 H new ATOM 0 HD13 LEU A 117 0.428 2.897 -9.104 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.407 1.328 -6.599 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.235 2.987 -6.557 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.339 2.624 -5.811 1.00 0.00 H new ATOM 1635 N ASN A 118 -3.756 6.762 -7.232 1.00 0.00 N ATOM 1636 CA ASN A 118 -3.956 8.217 -7.221 1.00 0.00 C ATOM 1637 C ASN A 118 -3.826 8.747 -5.805 1.00 0.00 C ATOM 1638 O ASN A 118 -3.166 9.762 -5.564 1.00 0.00 O ATOM 1639 CB ASN A 118 -5.320 8.600 -7.808 1.00 0.00 C ATOM 1640 CG ASN A 118 -5.266 8.855 -9.306 1.00 0.00 C ATOM 1641 OD1 ASN A 118 -5.086 9.986 -9.748 1.00 0.00 O ATOM 1642 ND2 ASN A 118 -5.415 7.809 -10.091 1.00 0.00 N ATOM 0 H ASN A 118 -4.566 6.222 -7.536 1.00 0.00 H new ATOM 0 HA ASN A 118 -3.186 8.669 -7.847 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -6.035 7.802 -7.605 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -5.689 9.494 -7.305 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -5.383 7.923 -11.104 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -5.563 6.884 -9.686 1.00 0.00 H new ATOM 1649 N GLY A 119 -4.442 8.043 -4.862 1.00 0.00 N ATOM 1650 CA GLY A 119 -4.333 8.425 -3.475 1.00 0.00 C ATOM 1651 C GLY A 119 -2.935 8.179 -2.944 1.00 0.00 C ATOM 1652 O GLY A 119 -2.426 8.935 -2.120 1.00 0.00 O ATOM 0 H GLY A 119 -5.013 7.216 -5.037 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -4.586 9.480 -3.365 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -5.054 7.861 -2.883 1.00 0.00 H new ATOM 1656 N VAL A 120 -2.308 7.120 -3.431 1.00 0.00 N ATOM 1657 CA VAL A 120 -0.952 6.780 -3.020 1.00 0.00 C ATOM 1658 C VAL A 120 0.060 7.799 -3.552 1.00 0.00 C ATOM 1659 O VAL A 120 0.999 8.179 -2.851 1.00 0.00 O ATOM 1660 CB VAL A 120 -0.552 5.367 -3.501 1.00 0.00 C ATOM 1661 CG1 VAL A 120 0.928 5.119 -3.273 1.00 0.00 C ATOM 1662 CG2 VAL A 120 -1.382 4.310 -2.790 1.00 0.00 C ATOM 0 H VAL A 120 -2.716 6.479 -4.112 1.00 0.00 H new ATOM 0 HA VAL A 120 -0.939 6.798 -1.930 1.00 0.00 H new ATOM 0 HB VAL A 120 -0.748 5.303 -4.571 1.00 0.00 H new ATOM 0 HG11 VAL A 120 1.187 4.118 -3.619 1.00 0.00 H new ATOM 0 HG12 VAL A 120 1.510 5.856 -3.826 1.00 0.00 H new ATOM 0 HG13 VAL A 120 1.152 5.204 -2.210 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -1.088 3.320 -3.140 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -1.215 4.379 -1.715 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -2.438 4.472 -3.005 1.00 0.00 H new ATOM 1672 N SER A 121 -0.147 8.235 -4.785 1.00 0.00 N ATOM 1673 CA SER A 121 0.730 9.196 -5.435 1.00 0.00 C ATOM 1674 C SER A 121 0.836 10.478 -4.612 1.00 0.00 C ATOM 1675 O SER A 121 1.895 11.098 -4.538 1.00 0.00 O ATOM 1676 CB SER A 121 0.210 9.508 -6.846 1.00 0.00 C ATOM 1677 OG SER A 121 1.080 10.387 -7.545 1.00 0.00 O ATOM 0 H SER A 121 -0.930 7.932 -5.364 1.00 0.00 H new ATOM 0 HA SER A 121 1.726 8.760 -5.512 1.00 0.00 H new ATOM 0 HB2 SER A 121 0.103 8.580 -7.408 1.00 0.00 H new ATOM 0 HB3 SER A 121 -0.781 9.956 -6.778 1.00 0.00 H new ATOM 0 HG SER A 121 2.011 10.141 -7.361 1.00 0.00 H new ATOM 1683 N SER A 122 -0.255 10.858 -3.988 1.00 0.00 N ATOM 1684 CA SER A 122 -0.282 12.048 -3.176 1.00 0.00 C ATOM 1685 C SER A 122 0.242 11.760 -1.762 1.00 0.00 C ATOM 1686 O SER A 122 0.972 12.560 -1.183 1.00 0.00 O ATOM 1687 CB SER A 122 -1.707 12.588 -3.114 1.00 0.00 C ATOM 1688 OG SER A 122 -2.276 12.654 -4.417 1.00 0.00 O ATOM 0 H SER A 122 -1.141 10.354 -4.029 1.00 0.00 H new ATOM 0 HA SER A 122 0.370 12.796 -3.628 1.00 0.00 H new ATOM 0 HB2 SER A 122 -2.317 11.947 -2.477 1.00 0.00 H new ATOM 0 HB3 SER A 122 -1.706 13.579 -2.661 1.00 0.00 H new ATOM 0 HG SER A 122 -2.538 11.755 -4.705 1.00 0.00 H new ATOM 1694 N ALA A 123 -0.119 10.600 -1.228 1.00 0.00 N ATOM 1695 CA ALA A 123 0.249 10.236 0.132 1.00 0.00 C ATOM 1696 C ALA A 123 1.663 9.623 0.236 1.00 0.00 C ATOM 1697 O ALA A 123 2.589 10.270 0.714 1.00 0.00 O ATOM 1698 CB ALA A 123 -0.794 9.300 0.722 1.00 0.00 C ATOM 0 H ALA A 123 -0.668 9.894 -1.719 1.00 0.00 H new ATOM 0 HA ALA A 123 0.277 11.158 0.712 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -0.509 9.033 1.740 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -1.764 9.798 0.735 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.858 8.397 0.115 1.00 0.00 H new ATOM 1704 N ALA A 124 1.822 8.382 -0.227 1.00 0.00 N ATOM 1705 CA ALA A 124 3.107 7.664 -0.104 1.00 0.00 C ATOM 1706 C ALA A 124 4.163 8.245 -1.009 1.00 0.00 C ATOM 1707 O ALA A 124 5.290 8.500 -0.584 1.00 0.00 O ATOM 1708 CB ALA A 124 2.932 6.186 -0.408 1.00 0.00 C ATOM 0 H ALA A 124 1.085 7.849 -0.690 1.00 0.00 H new ATOM 0 HA ALA A 124 3.439 7.782 0.927 1.00 0.00 H new ATOM 0 HB1 ALA A 124 3.892 5.678 -0.311 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.219 5.752 0.294 1.00 0.00 H new ATOM 0 HB3 ALA A 124 2.559 6.065 -1.425 1.00 0.00 H new ATOM 1714 N GLN A 125 3.798 8.454 -2.250 1.00 0.00 N ATOM 1715 CA GLN A 125 4.712 8.987 -3.228 1.00 0.00 C ATOM 1716 C GLN A 125 4.990 10.461 -2.928 1.00 0.00 C ATOM 1717 O GLN A 125 6.029 10.999 -3.295 1.00 0.00 O ATOM 1718 CB GLN A 125 4.120 8.825 -4.626 1.00 0.00 C ATOM 1719 CG GLN A 125 5.121 8.988 -5.756 1.00 0.00 C ATOM 1720 CD GLN A 125 4.448 9.108 -7.108 1.00 0.00 C ATOM 1721 OE1 GLN A 125 4.121 10.208 -7.552 1.00 0.00 O ATOM 1722 NE2 GLN A 125 4.227 7.987 -7.768 1.00 0.00 N ATOM 0 H GLN A 125 2.863 8.260 -2.609 1.00 0.00 H new ATOM 0 HA GLN A 125 5.654 8.440 -3.182 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.663 7.838 -4.701 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.322 9.556 -4.756 1.00 0.00 H new ATOM 0 HG2 GLN A 125 5.728 9.875 -5.575 1.00 0.00 H new ATOM 0 HG3 GLN A 125 5.798 8.134 -5.764 1.00 0.00 H new ATOM 0 HE21 GLN A 125 4.513 7.094 -7.367 1.00 0.00 H new ATOM 0 HE22 GLN A 125 3.770 8.013 -8.680 1.00 0.00 H new ATOM 1731 N GLY A 126 4.049 11.098 -2.240 1.00 0.00 N ATOM 1732 CA GLY A 126 4.183 12.497 -1.910 1.00 0.00 C ATOM 1733 C GLY A 126 4.961 12.753 -0.626 1.00 0.00 C ATOM 1734 O GLY A 126 6.064 13.300 -0.662 1.00 0.00 O ATOM 0 H GLY A 126 3.190 10.662 -1.904 1.00 0.00 H new ATOM 0 HA2 GLY A 126 4.680 13.009 -2.734 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.190 12.935 -1.816 1.00 0.00 H new ATOM 1738 N LEU A 127 4.402 12.339 0.509 1.00 0.00 N ATOM 1739 CA LEU A 127 5.008 12.647 1.804 1.00 0.00 C ATOM 1740 C LEU A 127 5.605 11.410 2.460 1.00 0.00 C ATOM 1741 O LEU A 127 6.519 11.513 3.274 1.00 0.00 O ATOM 1742 CB LEU A 127 3.959 13.259 2.739 1.00 0.00 C ATOM 1743 CG LEU A 127 3.168 14.450 2.180 1.00 0.00 C ATOM 1744 CD1 LEU A 127 2.139 14.931 3.196 1.00 0.00 C ATOM 1745 CD2 LEU A 127 4.104 15.588 1.792 1.00 0.00 C ATOM 0 H LEU A 127 3.540 11.796 0.560 1.00 0.00 H new ATOM 0 HA LEU A 127 5.814 13.359 1.626 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.252 12.478 3.019 1.00 0.00 H new ATOM 0 HB3 LEU A 127 4.459 13.578 3.653 1.00 0.00 H new ATOM 0 HG LEU A 127 2.643 14.119 1.284 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.587 15.776 2.783 1.00 0.00 H new ATOM 0 HD12 LEU A 127 1.446 14.121 3.423 1.00 0.00 H new ATOM 0 HD13 LEU A 127 2.647 15.241 4.109 1.00 0.00 H new ATOM 0 HD21 LEU A 127 3.521 16.421 1.399 1.00 0.00 H new ATOM 0 HD22 LEU A 127 4.660 15.917 2.670 1.00 0.00 H new ATOM 0 HD23 LEU A 127 4.802 15.241 1.030 1.00 0.00 H new ATOM 1757 N GLY A 128 5.098 10.251 2.098 1.00 0.00 N ATOM 1758 CA GLY A 128 5.583 9.025 2.693 1.00 0.00 C ATOM 1759 C GLY A 128 4.740 8.610 3.882 1.00 0.00 C ATOM 1760 O GLY A 128 4.838 9.195 4.958 1.00 0.00 O ATOM 0 H GLY A 128 4.360 10.132 1.404 1.00 0.00 H new ATOM 0 HA2 GLY A 128 5.577 8.230 1.947 1.00 0.00 H new ATOM 0 HA3 GLY A 128 6.618 9.158 3.009 1.00 0.00 H new ATOM 1764 N ILE A 129 3.904 7.614 3.679 1.00 0.00 N ATOM 1765 CA ILE A 129 3.007 7.123 4.727 1.00 0.00 C ATOM 1766 C ILE A 129 3.739 6.203 5.705 1.00 0.00 C ATOM 1767 O ILE A 129 4.510 5.335 5.292 1.00 0.00 O ATOM 1768 CB ILE A 129 1.843 6.314 4.128 1.00 0.00 C ATOM 1769 CG1 ILE A 129 1.206 7.040 2.956 1.00 0.00 C ATOM 1770 CG2 ILE A 129 0.796 6.037 5.194 1.00 0.00 C ATOM 1771 CD1 ILE A 129 0.417 6.121 2.058 1.00 0.00 C ATOM 0 H ILE A 129 3.820 7.118 2.792 1.00 0.00 H new ATOM 0 HA ILE A 129 2.634 8.006 5.246 1.00 0.00 H new ATOM 0 HB ILE A 129 2.247 5.370 3.762 1.00 0.00 H new ATOM 0 HG12 ILE A 129 0.549 7.824 3.334 1.00 0.00 H new ATOM 0 HG13 ILE A 129 1.985 7.531 2.372 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -0.023 5.464 4.759 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.246 5.467 6.007 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.413 6.981 5.582 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -0.015 6.696 1.239 1.00 0.00 H new ATOM 0 HD12 ILE A 129 1.076 5.352 1.654 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -0.382 5.650 2.631 1.00 0.00 H new ATOM 1783 N ASN A 130 3.481 6.392 6.988 1.00 0.00 N ATOM 1784 CA ASN A 130 4.025 5.524 8.024 1.00 0.00 C ATOM 1785 C ASN A 130 2.888 4.900 8.829 1.00 0.00 C ATOM 1786 O ASN A 130 1.979 5.599 9.279 1.00 0.00 O ATOM 1787 CB ASN A 130 4.969 6.294 8.964 1.00 0.00 C ATOM 1788 CG ASN A 130 6.333 6.578 8.348 1.00 0.00 C ATOM 1789 OD1 ASN A 130 6.839 5.806 7.529 1.00 0.00 O ATOM 1790 ND2 ASN A 130 6.941 7.679 8.747 1.00 0.00 N ATOM 0 H ASN A 130 2.892 7.146 7.342 1.00 0.00 H new ATOM 0 HA ASN A 130 4.602 4.738 7.536 1.00 0.00 H new ATOM 0 HB2 ASN A 130 4.501 7.238 9.244 1.00 0.00 H new ATOM 0 HB3 ASN A 130 5.104 5.721 9.881 1.00 0.00 H new ATOM 0 HD21 ASN A 130 7.861 7.916 8.377 1.00 0.00 H new ATOM 0 HD22 ASN A 130 6.491 8.293 9.426 1.00 0.00 H new ATOM 1797 N VAL A 131 2.925 3.586 8.979 1.00 0.00 N ATOM 1798 CA VAL A 131 1.910 2.870 9.744 1.00 0.00 C ATOM 1799 C VAL A 131 2.253 2.950 11.239 1.00 0.00 C ATOM 1800 O VAL A 131 3.356 3.370 11.597 1.00 0.00 O ATOM 1801 CB VAL A 131 1.807 1.376 9.281 1.00 0.00 C ATOM 1802 CG1 VAL A 131 0.642 0.644 9.941 1.00 0.00 C ATOM 1803 CG2 VAL A 131 1.681 1.298 7.774 1.00 0.00 C ATOM 0 H VAL A 131 3.649 2.989 8.580 1.00 0.00 H new ATOM 0 HA VAL A 131 0.940 3.336 9.569 1.00 0.00 H new ATOM 0 HB VAL A 131 2.725 0.880 9.595 1.00 0.00 H new ATOM 0 HG11 VAL A 131 0.613 -0.387 9.588 1.00 0.00 H new ATOM 0 HG12 VAL A 131 0.773 0.653 11.023 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -0.293 1.142 9.684 1.00 0.00 H new ATOM 0 HG21 VAL A 131 1.611 0.254 7.468 1.00 0.00 H new ATOM 0 HG22 VAL A 131 0.785 1.831 7.456 1.00 0.00 H new ATOM 0 HG23 VAL A 131 2.557 1.753 7.312 1.00 0.00 H new ATOM 1813 N ASP A 132 1.320 2.552 12.097 1.00 0.00 N ATOM 1814 CA ASP A 132 1.531 2.606 13.537 1.00 0.00 C ATOM 1815 C ASP A 132 2.737 1.763 13.952 1.00 0.00 C ATOM 1816 O ASP A 132 2.929 0.633 13.475 1.00 0.00 O ATOM 1817 CB ASP A 132 0.281 2.144 14.287 1.00 0.00 C ATOM 1818 CG ASP A 132 0.447 2.245 15.787 1.00 0.00 C ATOM 1819 OD1 ASP A 132 0.226 3.340 16.341 1.00 0.00 O ATOM 1820 OD2 ASP A 132 0.818 1.235 16.416 1.00 0.00 O ATOM 0 H ASP A 132 0.409 2.188 11.818 1.00 0.00 H new ATOM 0 HA ASP A 132 1.733 3.644 13.801 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -0.572 2.747 13.976 1.00 0.00 H new ATOM 0 HB3 ASP A 132 0.057 1.112 14.016 1.00 0.00 H new ATOM 1825 N SER A 133 3.534 2.325 14.851 1.00 0.00 N ATOM 1826 CA SER A 133 4.772 1.713 15.324 1.00 0.00 C ATOM 1827 C SER A 133 4.550 0.331 15.955 1.00 0.00 C ATOM 1828 O SER A 133 5.476 -0.489 16.005 1.00 0.00 O ATOM 1829 CB SER A 133 5.431 2.641 16.339 1.00 0.00 C ATOM 1830 OG SER A 133 5.525 3.964 15.832 1.00 0.00 O ATOM 0 H SER A 133 3.338 3.230 15.279 1.00 0.00 H new ATOM 0 HA SER A 133 5.417 1.566 14.458 1.00 0.00 H new ATOM 0 HB2 SER A 133 4.855 2.642 17.264 1.00 0.00 H new ATOM 0 HB3 SER A 133 6.426 2.270 16.584 1.00 0.00 H new ATOM 0 HG SER A 133 6.411 4.101 15.437 1.00 0.00 H new ATOM 1836 N GLY A 134 3.332 0.079 16.420 1.00 0.00 N ATOM 1837 CA GLY A 134 3.026 -1.168 17.087 1.00 0.00 C ATOM 1838 C GLY A 134 3.199 -2.391 16.205 1.00 0.00 C ATOM 1839 O GLY A 134 3.714 -3.416 16.654 1.00 0.00 O ATOM 0 H GLY A 134 2.546 0.724 16.345 1.00 0.00 H new ATOM 0 HA2 GLY A 134 3.668 -1.269 17.962 1.00 0.00 H new ATOM 0 HA3 GLY A 134 1.998 -1.134 17.448 1.00 0.00 H new ATOM 1843 N SER A 135 2.781 -2.294 14.960 1.00 0.00 N ATOM 1844 CA SER A 135 2.829 -3.440 14.069 1.00 0.00 C ATOM 1845 C SER A 135 3.930 -3.357 13.009 1.00 0.00 C ATOM 1846 O SER A 135 4.648 -4.337 12.779 1.00 0.00 O ATOM 1847 CB SER A 135 1.479 -3.638 13.407 1.00 0.00 C ATOM 1848 OG SER A 135 0.936 -2.392 12.983 1.00 0.00 O ATOM 0 H SER A 135 2.407 -1.442 14.542 1.00 0.00 H new ATOM 0 HA SER A 135 3.075 -4.300 14.691 1.00 0.00 H new ATOM 0 HB2 SER A 135 1.583 -4.305 12.551 1.00 0.00 H new ATOM 0 HB3 SER A 135 0.794 -4.120 14.105 1.00 0.00 H new ATOM 0 HG SER A 135 0.066 -2.542 12.557 1.00 0.00 H new ATOM 1854 N VAL A 136 4.069 -2.205 12.362 1.00 0.00 N ATOM 1855 CA VAL A 136 5.003 -2.095 11.255 1.00 0.00 C ATOM 1856 C VAL A 136 6.455 -1.940 11.717 1.00 0.00 C ATOM 1857 O VAL A 136 7.308 -2.745 11.355 1.00 0.00 O ATOM 1858 CB VAL A 136 4.613 -0.963 10.254 1.00 0.00 C ATOM 1859 CG1 VAL A 136 4.742 0.424 10.871 1.00 0.00 C ATOM 1860 CG2 VAL A 136 5.436 -1.072 8.983 1.00 0.00 C ATOM 0 H VAL A 136 3.556 -1.351 12.581 1.00 0.00 H new ATOM 0 HA VAL A 136 4.933 -3.043 10.722 1.00 0.00 H new ATOM 0 HB VAL A 136 3.561 -1.099 10.003 1.00 0.00 H new ATOM 0 HG11 VAL A 136 4.460 1.177 10.135 1.00 0.00 H new ATOM 0 HG12 VAL A 136 4.085 0.499 11.738 1.00 0.00 H new ATOM 0 HG13 VAL A 136 5.774 0.589 11.182 1.00 0.00 H new ATOM 0 HG21 VAL A 136 5.151 -0.275 8.296 1.00 0.00 H new ATOM 0 HG22 VAL A 136 6.495 -0.981 9.226 1.00 0.00 H new ATOM 0 HG23 VAL A 136 5.254 -2.039 8.513 1.00 0.00 H new ATOM 1870 N GLN A 137 6.717 -0.936 12.547 1.00 0.00 N ATOM 1871 CA GLN A 137 8.072 -0.625 12.982 1.00 0.00 C ATOM 1872 C GLN A 137 8.722 -1.792 13.709 1.00 0.00 C ATOM 1873 O GLN A 137 9.873 -2.126 13.446 1.00 0.00 O ATOM 1874 CB GLN A 137 8.067 0.614 13.867 1.00 0.00 C ATOM 1875 CG GLN A 137 9.439 1.014 14.379 1.00 0.00 C ATOM 1876 CD GLN A 137 9.392 2.221 15.292 1.00 0.00 C ATOM 1877 OE1 GLN A 137 8.470 3.129 15.033 1.00 0.00 O flip ATOM 1878 NE2 GLN A 137 10.187 2.337 16.221 1.00 0.00 N flip ATOM 0 H GLN A 137 6.002 -0.320 12.934 1.00 0.00 H new ATOM 0 HA GLN A 137 8.666 -0.429 12.089 1.00 0.00 H new ATOM 0 HB2 GLN A 137 7.643 1.447 13.306 1.00 0.00 H new ATOM 0 HB3 GLN A 137 7.410 0.437 14.719 1.00 0.00 H new ATOM 0 HG2 GLN A 137 9.881 0.175 14.916 1.00 0.00 H new ATOM 0 HG3 GLN A 137 10.090 1.229 13.532 1.00 0.00 H new ATOM 0 HE21 GLN A 137 10.885 1.612 16.388 1.00 0.00 H new ATOM 0 HE22 GLN A 137 10.149 3.158 16.825 1.00 0.00 H new ATOM 1887 N SER A 138 7.975 -2.417 14.596 1.00 0.00 N ATOM 1888 CA SER A 138 8.481 -3.526 15.387 1.00 0.00 C ATOM 1889 C SER A 138 9.025 -4.655 14.509 1.00 0.00 C ATOM 1890 O SER A 138 10.083 -5.225 14.796 1.00 0.00 O ATOM 1891 CB SER A 138 7.371 -4.045 16.293 1.00 0.00 C ATOM 1892 OG SER A 138 6.143 -4.103 15.584 1.00 0.00 O ATOM 0 H SER A 138 7.004 -2.174 14.790 1.00 0.00 H new ATOM 0 HA SER A 138 9.313 -3.163 15.991 1.00 0.00 H new ATOM 0 HB2 SER A 138 7.630 -5.036 16.666 1.00 0.00 H new ATOM 0 HB3 SER A 138 7.267 -3.394 17.161 1.00 0.00 H new ATOM 0 HG SER A 138 5.413 -3.812 16.170 1.00 0.00 H new ATOM 1898 N ASP A 139 8.314 -4.963 13.435 1.00 0.00 N ATOM 1899 CA ASP A 139 8.711 -6.050 12.558 1.00 0.00 C ATOM 1900 C ASP A 139 9.738 -5.605 11.518 1.00 0.00 C ATOM 1901 O ASP A 139 10.790 -6.237 11.358 1.00 0.00 O ATOM 1902 CB ASP A 139 7.491 -6.638 11.861 1.00 0.00 C ATOM 1903 CG ASP A 139 7.721 -8.061 11.398 1.00 0.00 C ATOM 1904 OD1 ASP A 139 8.578 -8.280 10.523 1.00 0.00 O ATOM 1905 OD2 ASP A 139 7.045 -8.972 11.924 1.00 0.00 O ATOM 0 H ASP A 139 7.463 -4.477 13.152 1.00 0.00 H new ATOM 0 HA ASP A 139 9.180 -6.812 13.181 1.00 0.00 H new ATOM 0 HB2 ASP A 139 6.640 -6.613 12.542 1.00 0.00 H new ATOM 0 HB3 ASP A 139 7.231 -6.017 11.003 1.00 0.00 H new ATOM 1910 N ILE A 140 9.451 -4.501 10.825 1.00 0.00 N ATOM 1911 CA ILE A 140 10.319 -4.045 9.740 1.00 0.00 C ATOM 1912 C ILE A 140 11.722 -3.696 10.214 1.00 0.00 C ATOM 1913 O ILE A 140 12.673 -3.912 9.494 1.00 0.00 O ATOM 1914 CB ILE A 140 9.735 -2.852 8.935 1.00 0.00 C ATOM 1915 CG1 ILE A 140 9.620 -1.595 9.806 1.00 0.00 C ATOM 1916 CG2 ILE A 140 8.384 -3.226 8.338 1.00 0.00 C ATOM 1917 CD1 ILE A 140 9.246 -0.346 9.033 1.00 0.00 C ATOM 0 H ILE A 140 8.635 -3.913 10.993 1.00 0.00 H new ATOM 0 HA ILE A 140 10.378 -4.903 9.070 1.00 0.00 H new ATOM 0 HB ILE A 140 10.422 -2.624 8.120 1.00 0.00 H new ATOM 0 HG12 ILE A 140 8.873 -1.769 10.581 1.00 0.00 H new ATOM 0 HG13 ILE A 140 10.571 -1.427 10.312 1.00 0.00 H new ATOM 0 HG21 ILE A 140 7.987 -2.380 7.777 1.00 0.00 H new ATOM 0 HG22 ILE A 140 8.505 -4.079 7.671 1.00 0.00 H new ATOM 0 HG23 ILE A 140 7.692 -3.487 9.139 1.00 0.00 H new ATOM 0 HD11 ILE A 140 9.184 0.500 9.717 1.00 0.00 H new ATOM 0 HD12 ILE A 140 10.004 -0.146 8.276 1.00 0.00 H new ATOM 0 HD13 ILE A 140 8.280 -0.493 8.549 1.00 0.00 H new ATOM 1929 N SER A 141 11.854 -3.183 11.429 1.00 0.00 N ATOM 1930 CA SER A 141 13.171 -2.797 11.944 1.00 0.00 C ATOM 1931 C SER A 141 14.135 -3.991 12.014 1.00 0.00 C ATOM 1932 O SER A 141 15.345 -3.828 11.867 1.00 0.00 O ATOM 1933 CB SER A 141 13.041 -2.129 13.309 1.00 0.00 C ATOM 1934 OG SER A 141 12.221 -0.977 13.222 1.00 0.00 O ATOM 0 H SER A 141 11.080 -3.024 12.074 1.00 0.00 H new ATOM 0 HA SER A 141 13.595 -2.079 11.242 1.00 0.00 H new ATOM 0 HB2 SER A 141 12.616 -2.832 14.025 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.028 -1.853 13.681 1.00 0.00 H new ATOM 0 HG SER A 141 11.304 -1.244 13.001 1.00 0.00 H new ATOM 1940 N SER A 142 13.598 -5.183 12.214 1.00 0.00 N ATOM 1941 CA SER A 142 14.423 -6.377 12.293 1.00 0.00 C ATOM 1942 C SER A 142 14.732 -6.922 10.896 1.00 0.00 C ATOM 1943 O SER A 142 15.808 -7.465 10.649 1.00 0.00 O ATOM 1944 CB SER A 142 13.714 -7.446 13.123 1.00 0.00 C ATOM 1945 OG SER A 142 13.297 -6.923 14.374 1.00 0.00 O ATOM 0 H SER A 142 12.598 -5.350 12.324 1.00 0.00 H new ATOM 0 HA SER A 142 15.365 -6.111 12.774 1.00 0.00 H new ATOM 0 HB2 SER A 142 12.850 -7.823 12.576 1.00 0.00 H new ATOM 0 HB3 SER A 142 14.384 -8.291 13.283 1.00 0.00 H new ATOM 0 HG SER A 142 12.844 -7.624 14.887 1.00 0.00 H new ATOM 1951 N SER A 143 13.789 -6.754 9.988 1.00 0.00 N ATOM 1952 CA SER A 143 13.908 -7.280 8.636 1.00 0.00 C ATOM 1953 C SER A 143 14.623 -6.296 7.689 1.00 0.00 C ATOM 1954 O SER A 143 15.261 -6.702 6.719 1.00 0.00 O ATOM 1955 CB SER A 143 12.518 -7.610 8.109 1.00 0.00 C ATOM 1956 OG SER A 143 12.572 -8.123 6.799 1.00 0.00 O ATOM 0 H SER A 143 12.920 -6.250 10.164 1.00 0.00 H new ATOM 0 HA SER A 143 14.519 -8.182 8.672 1.00 0.00 H new ATOM 0 HB2 SER A 143 12.042 -8.337 8.766 1.00 0.00 H new ATOM 0 HB3 SER A 143 11.899 -6.713 8.124 1.00 0.00 H new ATOM 0 HG SER A 143 13.466 -8.485 6.626 1.00 0.00 H new ATOM 1962 N SER A 144 14.512 -5.017 7.990 1.00 0.00 N ATOM 1963 CA SER A 144 15.095 -3.954 7.188 1.00 0.00 C ATOM 1964 C SER A 144 16.619 -4.054 7.138 1.00 0.00 C ATOM 1965 O SER A 144 17.247 -3.441 6.291 1.00 0.00 O ATOM 1966 CB SER A 144 14.636 -2.591 7.712 1.00 0.00 C ATOM 1967 OG SER A 144 15.122 -1.526 6.923 1.00 0.00 O ATOM 0 H SER A 144 14.007 -4.680 8.810 1.00 0.00 H new ATOM 0 HA SER A 144 14.742 -4.066 6.163 1.00 0.00 H new ATOM 0 HB2 SER A 144 13.547 -2.559 7.731 1.00 0.00 H new ATOM 0 HB3 SER A 144 14.977 -2.465 8.740 1.00 0.00 H new ATOM 0 HG SER A 144 14.805 -0.675 7.291 1.00 0.00 H new