USER MOD reduce.3.24.130724 H: found=0, std=0, add=867, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 868 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 115 GLN : amide:sc= -6.08! C(o=-7.7!,f=-13!) USER MOD Set 1.2: A 119 ASN : amide:sc= -1.63! C(o=-7.7!,f=-13!) USER MOD Set 2.1: A 45 THR OG1 : rot 180:sc= 0.0209 USER MOD Set 2.2: A 56 GLN : amide:sc= -1.03 K(o=-1,f=0.42) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 17 ASN : amide:sc= -1.38 X(o=-1.4,f=-0.9) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 128:sc= 0.0036 USER MOD Single : A 29 SER OG : rot -116:sc= 0.26 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0958 K(o=-0.096,f=-1.6!) USER MOD Single : A 39 SER OG : rot 80:sc= -1.01 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -14:sc= -0.53 USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot -160:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 165:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0.13 USER MOD Single : A 66 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0161) USER MOD Single : A 67 TYR OH : rot -3:sc= -0.418 USER MOD Single : A 74 TYR OH : rot 180:sc=-0.00441 USER MOD Single : A 78 SER OG : rot -78:sc= 0.0543 USER MOD Single : A 79 GLN : amide:sc= -0.256 X(o=-0.26,f=-0.12) USER MOD Single : A 81 ASN : amide:sc= 0.00054 K(o=0.00054,f=-0.96) USER MOD Single : A 85 ASN : amide:sc= -0.0699 K(o=-0.07,f=-1.9) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ -158:sc= -0.0605 (180deg=-0.341) USER MOD Single : A 97 GLN : amide:sc= -0.0849 X(o=-0.085,f=-0.27) USER MOD Single : A 101 ASN : amide:sc= -0.599 X(o=-0.6,f=-0.44) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 MET CE :methyl -104:sc= -1.14 (180deg=-4.43!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 64:sc= 1.16 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= -0.337 K(o=-0.34,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 97 N ASP A 10 2.207 21.308 -7.401 1.00 0.00 N ATOM 98 CA ASP A 10 2.979 20.413 -8.256 1.00 0.00 C ATOM 99 C ASP A 10 2.718 18.955 -7.891 1.00 0.00 C ATOM 100 O ASP A 10 3.129 18.487 -6.828 1.00 0.00 O ATOM 101 CB ASP A 10 4.472 20.722 -8.138 1.00 0.00 C ATOM 102 CG ASP A 10 4.874 21.945 -8.939 1.00 0.00 C ATOM 103 OD1 ASP A 10 4.994 21.831 -10.176 1.00 0.00 O ATOM 104 OD2 ASP A 10 5.071 23.017 -8.327 1.00 0.00 O ATOM 0 HA ASP A 10 2.664 20.573 -9.287 1.00 0.00 H new ATOM 0 HB2 ASP A 10 4.726 20.878 -7.090 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.047 19.862 -8.481 1.00 0.00 H new ATOM 109 N TYR A 11 2.032 18.242 -8.777 1.00 0.00 N ATOM 110 CA TYR A 11 1.714 16.838 -8.547 1.00 0.00 C ATOM 111 C TYR A 11 2.927 15.953 -8.817 1.00 0.00 C ATOM 112 O TYR A 11 3.420 15.266 -7.923 1.00 0.00 O ATOM 113 CB TYR A 11 0.546 16.406 -9.435 1.00 0.00 C ATOM 114 CG TYR A 11 -0.730 17.175 -9.174 1.00 0.00 C ATOM 115 CD1 TYR A 11 -1.113 17.505 -7.880 1.00 0.00 C ATOM 116 CD2 TYR A 11 -1.552 17.571 -10.222 1.00 0.00 C ATOM 117 CE1 TYR A 11 -2.277 18.207 -7.637 1.00 0.00 C ATOM 118 CE2 TYR A 11 -2.718 18.274 -9.988 1.00 0.00 C ATOM 119 CZ TYR A 11 -3.076 18.590 -8.694 1.00 0.00 C ATOM 120 OH TYR A 11 -4.237 19.289 -8.457 1.00 0.00 O ATOM 0 H TYR A 11 1.685 18.613 -9.661 1.00 0.00 H new ATOM 0 HA TYR A 11 1.429 16.723 -7.501 1.00 0.00 H new ATOM 0 HB2 TYR A 11 0.829 16.532 -10.480 1.00 0.00 H new ATOM 0 HB3 TYR A 11 0.358 15.343 -9.282 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -0.490 17.207 -7.050 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -1.275 17.325 -11.236 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -2.560 18.455 -6.625 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -3.346 18.575 -10.814 1.00 0.00 H new ATOM 0 HH TYR A 11 -4.682 19.482 -9.308 1.00 0.00 H new ATOM 130 N GLY A 12 3.403 15.975 -10.058 1.00 0.00 N ATOM 131 CA GLY A 12 4.555 15.171 -10.425 1.00 0.00 C ATOM 132 C GLY A 12 5.597 15.116 -9.326 1.00 0.00 C ATOM 133 O GLY A 12 6.221 14.078 -9.106 1.00 0.00 O ATOM 0 H GLY A 12 3.012 16.535 -10.816 1.00 0.00 H new ATOM 0 HA2 GLY A 12 4.227 14.159 -10.662 1.00 0.00 H new ATOM 0 HA3 GLY A 12 5.006 15.580 -11.329 1.00 0.00 H new ATOM 137 N GLU A 13 5.787 16.235 -8.635 1.00 0.00 N ATOM 138 CA GLU A 13 6.763 16.309 -7.554 1.00 0.00 C ATOM 139 C GLU A 13 6.344 15.428 -6.381 1.00 0.00 C ATOM 140 O GLU A 13 7.060 14.502 -6.001 1.00 0.00 O ATOM 141 CB GLU A 13 6.930 17.756 -7.086 1.00 0.00 C ATOM 142 CG GLU A 13 7.689 18.631 -8.069 1.00 0.00 C ATOM 143 CD GLU A 13 9.024 18.034 -8.470 1.00 0.00 C ATOM 144 OE1 GLU A 13 10.027 18.302 -7.776 1.00 0.00 O ATOM 145 OE2 GLU A 13 9.065 17.299 -9.479 1.00 0.00 O ATOM 0 H GLU A 13 5.278 17.103 -8.804 1.00 0.00 H new ATOM 0 HA GLU A 13 7.717 15.946 -7.935 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.945 18.189 -6.913 1.00 0.00 H new ATOM 0 HB3 GLU A 13 7.453 17.761 -6.129 1.00 0.00 H new ATOM 0 HG2 GLU A 13 7.080 18.782 -8.960 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.853 19.613 -7.625 1.00 0.00 H new ATOM 152 N GLU A 14 5.180 15.725 -5.812 1.00 0.00 N ATOM 153 CA GLU A 14 4.666 14.960 -4.682 1.00 0.00 C ATOM 154 C GLU A 14 4.997 13.478 -4.831 1.00 0.00 C ATOM 155 O GLU A 14 5.491 12.845 -3.899 1.00 0.00 O ATOM 156 CB GLU A 14 3.153 15.146 -4.557 1.00 0.00 C ATOM 157 CG GLU A 14 2.754 16.371 -3.751 1.00 0.00 C ATOM 158 CD GLU A 14 2.872 16.149 -2.256 1.00 0.00 C ATOM 159 OE1 GLU A 14 1.912 15.622 -1.657 1.00 0.00 O ATOM 160 OE2 GLU A 14 3.925 16.502 -1.684 1.00 0.00 O ATOM 0 H GLU A 14 4.576 16.489 -6.115 1.00 0.00 H new ATOM 0 HA GLU A 14 5.146 15.332 -3.777 1.00 0.00 H new ATOM 0 HB2 GLU A 14 2.721 15.222 -5.555 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.724 14.259 -4.091 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.383 17.213 -4.040 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.727 16.643 -3.994 1.00 0.00 H new ATOM 167 N GLN A 15 4.720 12.933 -6.011 1.00 0.00 N ATOM 168 CA GLN A 15 4.987 11.525 -6.283 1.00 0.00 C ATOM 169 C GLN A 15 6.457 11.194 -6.046 1.00 0.00 C ATOM 170 O GLN A 15 6.787 10.356 -5.206 1.00 0.00 O ATOM 171 CB GLN A 15 4.600 11.179 -7.722 1.00 0.00 C ATOM 172 CG GLN A 15 3.130 11.415 -8.030 1.00 0.00 C ATOM 173 CD GLN A 15 2.863 11.573 -9.513 1.00 0.00 C ATOM 174 OE1 GLN A 15 3.504 10.928 -10.344 1.00 0.00 O ATOM 175 NE2 GLN A 15 1.911 12.433 -9.855 1.00 0.00 N ATOM 0 H GLN A 15 4.311 13.444 -6.793 1.00 0.00 H new ATOM 0 HA GLN A 15 4.384 10.928 -5.599 1.00 0.00 H new ATOM 0 HB2 GLN A 15 5.206 11.774 -8.405 1.00 0.00 H new ATOM 0 HB3 GLN A 15 4.839 10.133 -7.912 1.00 0.00 H new ATOM 0 HG2 GLN A 15 2.544 10.580 -7.646 1.00 0.00 H new ATOM 0 HG3 GLN A 15 2.792 12.309 -7.507 1.00 0.00 H new ATOM 0 HE21 GLN A 15 1.405 12.947 -9.134 1.00 0.00 H new ATOM 0 HE22 GLN A 15 1.686 12.580 -10.839 1.00 0.00 H new ATOM 184 N ARG A 16 7.335 11.857 -6.790 1.00 0.00 N ATOM 185 CA ARG A 16 8.770 11.632 -6.662 1.00 0.00 C ATOM 186 C ARG A 16 9.241 11.925 -5.241 1.00 0.00 C ATOM 187 O ARG A 16 9.730 11.037 -4.543 1.00 0.00 O ATOM 188 CB ARG A 16 9.536 12.507 -7.655 1.00 0.00 C ATOM 189 CG ARG A 16 9.166 12.248 -9.107 1.00 0.00 C ATOM 190 CD ARG A 16 9.964 13.133 -10.051 1.00 0.00 C ATOM 191 NE ARG A 16 9.679 12.835 -11.452 1.00 0.00 N ATOM 192 CZ ARG A 16 8.548 13.173 -12.060 1.00 0.00 C ATOM 193 NH1 ARG A 16 7.601 13.819 -11.394 1.00 0.00 N ATOM 194 NH2 ARG A 16 8.363 12.867 -13.338 1.00 0.00 N ATOM 0 H ARG A 16 7.078 12.555 -7.488 1.00 0.00 H new ATOM 0 HA ARG A 16 8.969 10.584 -6.884 1.00 0.00 H new ATOM 0 HB2 ARG A 16 9.348 13.555 -7.423 1.00 0.00 H new ATOM 0 HB3 ARG A 16 10.605 12.338 -7.526 1.00 0.00 H new ATOM 0 HG2 ARG A 16 9.347 11.201 -9.348 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.101 12.429 -9.250 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.734 14.179 -9.849 1.00 0.00 H new ATOM 0 HD3 ARG A 16 11.029 12.998 -9.861 1.00 0.00 H new ATOM 0 HE ARG A 16 10.388 12.340 -11.993 1.00 0.00 H new ATOM 0 HH11 ARG A 16 7.740 14.058 -10.412 1.00 0.00 H new ATOM 0 HH12 ARG A 16 6.733 14.077 -11.864 1.00 0.00 H new ATOM 0 HH21 ARG A 16 9.090 12.372 -13.854 1.00 0.00 H new ATOM 0 HH22 ARG A 16 7.494 13.127 -13.804 1.00 0.00 H new ATOM 208 N ASN A 17 9.090 13.176 -4.819 1.00 0.00 N ATOM 209 CA ASN A 17 9.502 13.587 -3.481 1.00 0.00 C ATOM 210 C ASN A 17 9.201 12.494 -2.460 1.00 0.00 C ATOM 211 O ASN A 17 10.060 12.127 -1.659 1.00 0.00 O ATOM 212 CB ASN A 17 8.792 14.882 -3.082 1.00 0.00 C ATOM 213 CG ASN A 17 9.431 16.108 -3.706 1.00 0.00 C ATOM 214 OD1 ASN A 17 10.653 16.260 -3.692 1.00 0.00 O ATOM 215 ND2 ASN A 17 8.605 16.989 -4.258 1.00 0.00 N ATOM 0 H ASN A 17 8.686 13.923 -5.384 1.00 0.00 H new ATOM 0 HA ASN A 17 10.578 13.760 -3.496 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.746 14.827 -3.384 1.00 0.00 H new ATOM 0 HB3 ASN A 17 8.806 14.981 -1.997 1.00 0.00 H new ATOM 0 HD21 ASN A 17 8.977 17.833 -4.694 1.00 0.00 H new ATOM 0 HD22 ASN A 17 7.599 16.822 -4.246 1.00 0.00 H new ATOM 222 N GLU A 18 7.977 11.977 -2.497 1.00 0.00 N ATOM 223 CA GLU A 18 7.563 10.926 -1.575 1.00 0.00 C ATOM 224 C GLU A 18 8.339 9.638 -1.835 1.00 0.00 C ATOM 225 O GLU A 18 8.949 9.073 -0.926 1.00 0.00 O ATOM 226 CB GLU A 18 6.061 10.665 -1.705 1.00 0.00 C ATOM 227 CG GLU A 18 5.476 9.886 -0.539 1.00 0.00 C ATOM 228 CD GLU A 18 4.076 9.377 -0.821 1.00 0.00 C ATOM 229 OE1 GLU A 18 3.599 9.552 -1.962 1.00 0.00 O ATOM 230 OE2 GLU A 18 3.457 8.804 0.100 1.00 0.00 O ATOM 0 H GLU A 18 7.255 12.269 -3.156 1.00 0.00 H new ATOM 0 HA GLU A 18 7.779 11.262 -0.561 1.00 0.00 H new ATOM 0 HB2 GLU A 18 5.541 11.619 -1.791 1.00 0.00 H new ATOM 0 HB3 GLU A 18 5.875 10.116 -2.628 1.00 0.00 H new ATOM 0 HG2 GLU A 18 6.126 9.042 -0.308 1.00 0.00 H new ATOM 0 HG3 GLU A 18 5.456 10.523 0.345 1.00 0.00 H new ATOM 237 N LEU A 19 8.312 9.179 -3.081 1.00 0.00 N ATOM 238 CA LEU A 19 9.012 7.957 -3.462 1.00 0.00 C ATOM 239 C LEU A 19 10.364 7.865 -2.764 1.00 0.00 C ATOM 240 O LEU A 19 10.777 6.789 -2.331 1.00 0.00 O ATOM 241 CB LEU A 19 9.203 7.908 -4.979 1.00 0.00 C ATOM 242 CG LEU A 19 7.990 7.458 -5.794 1.00 0.00 C ATOM 243 CD1 LEU A 19 8.260 7.615 -7.283 1.00 0.00 C ATOM 244 CD2 LEU A 19 7.631 6.017 -5.464 1.00 0.00 C ATOM 0 H LEU A 19 7.813 9.634 -3.845 1.00 0.00 H new ATOM 0 HA LEU A 19 8.405 7.107 -3.151 1.00 0.00 H new ATOM 0 HB2 LEU A 19 9.497 8.901 -5.320 1.00 0.00 H new ATOM 0 HB3 LEU A 19 10.033 7.236 -5.199 1.00 0.00 H new ATOM 0 HG LEU A 19 7.143 8.092 -5.530 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.386 7.290 -7.848 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.468 8.661 -7.507 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.120 7.006 -7.563 1.00 0.00 H new ATOM 0 HD21 LEU A 19 6.766 5.714 -6.053 1.00 0.00 H new ATOM 0 HD22 LEU A 19 8.475 5.369 -5.699 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.395 5.935 -4.403 1.00 0.00 H new ATOM 256 N GLU A 20 11.049 8.999 -2.657 1.00 0.00 N ATOM 257 CA GLU A 20 12.355 9.045 -2.010 1.00 0.00 C ATOM 258 C GLU A 20 12.225 8.818 -0.507 1.00 0.00 C ATOM 259 O GLU A 20 12.991 8.058 0.085 1.00 0.00 O ATOM 260 CB GLU A 20 13.034 10.390 -2.277 1.00 0.00 C ATOM 261 CG GLU A 20 13.348 10.633 -3.743 1.00 0.00 C ATOM 262 CD GLU A 20 14.305 11.791 -3.951 1.00 0.00 C ATOM 263 OE1 GLU A 20 15.483 11.665 -3.559 1.00 0.00 O ATOM 264 OE2 GLU A 20 13.874 12.823 -4.507 1.00 0.00 O ATOM 0 H GLU A 20 10.721 9.898 -3.010 1.00 0.00 H new ATOM 0 HA GLU A 20 12.968 8.247 -2.429 1.00 0.00 H new ATOM 0 HB2 GLU A 20 12.390 11.191 -1.915 1.00 0.00 H new ATOM 0 HB3 GLU A 20 13.959 10.441 -1.703 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.779 9.729 -4.173 1.00 0.00 H new ATOM 0 HG3 GLU A 20 12.421 10.831 -4.281 1.00 0.00 H new ATOM 271 N ALA A 21 11.250 9.483 0.105 1.00 0.00 N ATOM 272 CA ALA A 21 11.018 9.353 1.538 1.00 0.00 C ATOM 273 C ALA A 21 10.683 7.914 1.911 1.00 0.00 C ATOM 274 O ALA A 21 11.260 7.352 2.843 1.00 0.00 O ATOM 275 CB ALA A 21 9.903 10.289 1.979 1.00 0.00 C ATOM 0 H ALA A 21 10.608 10.117 -0.370 1.00 0.00 H new ATOM 0 HA ALA A 21 11.936 9.630 2.057 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.740 10.181 3.051 1.00 0.00 H new ATOM 0 HB2 ALA A 21 10.183 11.319 1.756 1.00 0.00 H new ATOM 0 HB3 ALA A 21 8.986 10.039 1.446 1.00 0.00 H new ATOM 281 N LEU A 22 9.746 7.321 1.180 1.00 0.00 N ATOM 282 CA LEU A 22 9.332 5.945 1.435 1.00 0.00 C ATOM 283 C LEU A 22 10.538 5.013 1.477 1.00 0.00 C ATOM 284 O LEU A 22 10.634 4.146 2.345 1.00 0.00 O ATOM 285 CB LEU A 22 8.350 5.479 0.359 1.00 0.00 C ATOM 286 CG LEU A 22 6.943 6.072 0.432 1.00 0.00 C ATOM 287 CD1 LEU A 22 6.145 5.707 -0.810 1.00 0.00 C ATOM 288 CD2 LEU A 22 6.227 5.594 1.687 1.00 0.00 C ATOM 0 H LEU A 22 9.258 7.771 0.406 1.00 0.00 H new ATOM 0 HA LEU A 22 8.838 5.914 2.406 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.772 5.717 -0.617 1.00 0.00 H new ATOM 0 HB3 LEU A 22 8.268 4.394 0.416 1.00 0.00 H new ATOM 0 HG LEU A 22 7.029 7.158 0.478 1.00 0.00 H new ATOM 0 HD11 LEU A 22 5.146 6.138 -0.740 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.648 6.099 -1.694 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.068 4.622 -0.887 1.00 0.00 H new ATOM 0 HD21 LEU A 22 5.227 6.026 1.722 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.152 4.507 1.671 1.00 0.00 H new ATOM 0 HD23 LEU A 22 6.788 5.906 2.568 1.00 0.00 H new ATOM 300 N GLU A 23 11.458 5.200 0.535 1.00 0.00 N ATOM 301 CA GLU A 23 12.659 4.376 0.467 1.00 0.00 C ATOM 302 C GLU A 23 13.265 4.182 1.853 1.00 0.00 C ATOM 303 O GLU A 23 13.585 3.062 2.252 1.00 0.00 O ATOM 304 CB GLU A 23 13.689 5.013 -0.469 1.00 0.00 C ATOM 305 CG GLU A 23 14.904 4.137 -0.722 1.00 0.00 C ATOM 306 CD GLU A 23 14.559 2.863 -1.470 1.00 0.00 C ATOM 307 OE1 GLU A 23 14.224 1.859 -0.808 1.00 0.00 O ATOM 308 OE2 GLU A 23 14.625 2.872 -2.717 1.00 0.00 O ATOM 0 H GLU A 23 11.394 5.914 -0.191 1.00 0.00 H new ATOM 0 HA GLU A 23 12.377 3.399 0.074 1.00 0.00 H new ATOM 0 HB2 GLU A 23 13.210 5.240 -1.422 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.017 5.961 -0.043 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.641 4.701 -1.293 1.00 0.00 H new ATOM 0 HG3 GLU A 23 15.367 3.880 0.231 1.00 0.00 H new ATOM 315 N SER A 24 13.422 5.282 2.583 1.00 0.00 N ATOM 316 CA SER A 24 13.994 5.235 3.923 1.00 0.00 C ATOM 317 C SER A 24 13.220 4.265 4.811 1.00 0.00 C ATOM 318 O SER A 24 13.802 3.377 5.434 1.00 0.00 O ATOM 319 CB SER A 24 13.993 6.630 4.551 1.00 0.00 C ATOM 320 OG SER A 24 14.722 7.548 3.754 1.00 0.00 O ATOM 0 H SER A 24 13.161 6.217 2.269 1.00 0.00 H new ATOM 0 HA SER A 24 15.022 4.883 3.839 1.00 0.00 H new ATOM 0 HB2 SER A 24 12.967 6.979 4.667 1.00 0.00 H new ATOM 0 HB3 SER A 24 14.429 6.583 5.549 1.00 0.00 H new ATOM 0 HG SER A 24 14.705 8.433 4.176 1.00 0.00 H new ATOM 326 N ILE A 25 11.904 4.443 4.863 1.00 0.00 N ATOM 327 CA ILE A 25 11.049 3.584 5.673 1.00 0.00 C ATOM 328 C ILE A 25 11.170 2.126 5.244 1.00 0.00 C ATOM 329 O ILE A 25 11.306 1.231 6.079 1.00 0.00 O ATOM 330 CB ILE A 25 9.573 4.013 5.583 1.00 0.00 C ATOM 331 CG1 ILE A 25 9.353 5.324 6.341 1.00 0.00 C ATOM 332 CG2 ILE A 25 8.669 2.919 6.133 1.00 0.00 C ATOM 333 CD1 ILE A 25 9.504 6.555 5.475 1.00 0.00 C ATOM 0 H ILE A 25 11.407 5.174 4.354 1.00 0.00 H new ATOM 0 HA ILE A 25 11.386 3.686 6.705 1.00 0.00 H new ATOM 0 HB ILE A 25 9.320 4.174 4.535 1.00 0.00 H new ATOM 0 HG12 ILE A 25 8.355 5.318 6.779 1.00 0.00 H new ATOM 0 HG13 ILE A 25 10.063 5.381 7.166 1.00 0.00 H new ATOM 0 HG21 ILE A 25 7.629 3.237 6.063 1.00 0.00 H new ATOM 0 HG22 ILE A 25 8.809 2.006 5.554 1.00 0.00 H new ATOM 0 HG23 ILE A 25 8.921 2.729 7.176 1.00 0.00 H new ATOM 0 HD11 ILE A 25 9.335 7.447 6.078 1.00 0.00 H new ATOM 0 HD12 ILE A 25 10.510 6.585 5.058 1.00 0.00 H new ATOM 0 HD13 ILE A 25 8.776 6.521 4.665 1.00 0.00 H new ATOM 345 N TYR A 26 11.123 1.894 3.937 1.00 0.00 N ATOM 346 CA TYR A 26 11.226 0.544 3.396 1.00 0.00 C ATOM 347 C TYR A 26 12.379 0.442 2.401 1.00 0.00 C ATOM 348 O TYR A 26 12.189 0.482 1.185 1.00 0.00 O ATOM 349 CB TYR A 26 9.916 0.142 2.717 1.00 0.00 C ATOM 350 CG TYR A 26 8.683 0.599 3.463 1.00 0.00 C ATOM 351 CD1 TYR A 26 8.238 -0.078 4.592 1.00 0.00 C ATOM 352 CD2 TYR A 26 7.963 1.709 3.039 1.00 0.00 C ATOM 353 CE1 TYR A 26 7.111 0.336 5.276 1.00 0.00 C ATOM 354 CE2 TYR A 26 6.836 2.131 3.718 1.00 0.00 C ATOM 355 CZ TYR A 26 6.414 1.441 4.835 1.00 0.00 C ATOM 356 OH TYR A 26 5.292 1.858 5.514 1.00 0.00 O ATOM 0 H TYR A 26 11.014 2.623 3.232 1.00 0.00 H new ATOM 0 HA TYR A 26 11.422 -0.137 4.224 1.00 0.00 H new ATOM 0 HB2 TYR A 26 9.896 0.558 1.710 1.00 0.00 H new ATOM 0 HB3 TYR A 26 9.887 -0.943 2.615 1.00 0.00 H new ATOM 0 HD1 TYR A 26 8.783 -0.943 4.941 1.00 0.00 H new ATOM 0 HD2 TYR A 26 8.290 2.251 2.164 1.00 0.00 H new ATOM 0 HE1 TYR A 26 6.778 -0.203 6.151 1.00 0.00 H new ATOM 0 HE2 TYR A 26 6.288 2.997 3.376 1.00 0.00 H new ATOM 0 HH TYR A 26 5.373 2.811 5.726 1.00 0.00 H new ATOM 366 N PRO A 27 13.604 0.307 2.929 1.00 0.00 N ATOM 367 CA PRO A 27 14.813 0.196 2.107 1.00 0.00 C ATOM 368 C PRO A 27 14.883 -1.129 1.357 1.00 0.00 C ATOM 369 O PRO A 27 15.527 -1.228 0.312 1.00 0.00 O ATOM 370 CB PRO A 27 15.948 0.293 3.130 1.00 0.00 C ATOM 371 CG PRO A 27 15.346 -0.176 4.409 1.00 0.00 C ATOM 372 CD PRO A 27 13.905 0.252 4.370 1.00 0.00 C ATOM 0 HA PRO A 27 14.852 0.963 1.333 1.00 0.00 H new ATOM 0 HB2 PRO A 27 16.796 -0.328 2.841 1.00 0.00 H new ATOM 0 HB3 PRO A 27 16.316 1.315 3.217 1.00 0.00 H new ATOM 0 HG2 PRO A 27 15.429 -1.259 4.506 1.00 0.00 H new ATOM 0 HG3 PRO A 27 15.860 0.261 5.265 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.261 -0.458 4.888 1.00 0.00 H new ATOM 0 HD3 PRO A 27 13.761 1.221 4.848 1.00 0.00 H new ATOM 380 N ASP A 28 14.218 -2.145 1.896 1.00 0.00 N ATOM 381 CA ASP A 28 14.204 -3.465 1.276 1.00 0.00 C ATOM 382 C ASP A 28 12.819 -3.793 0.727 1.00 0.00 C ATOM 383 O ASP A 28 12.630 -3.901 -0.484 1.00 0.00 O ATOM 384 CB ASP A 28 14.632 -4.531 2.285 1.00 0.00 C ATOM 385 CG ASP A 28 16.024 -4.283 2.833 1.00 0.00 C ATOM 386 OD1 ASP A 28 16.918 -3.919 2.041 1.00 0.00 O ATOM 387 OD2 ASP A 28 16.220 -4.454 4.055 1.00 0.00 O ATOM 0 H ASP A 28 13.681 -2.080 2.761 1.00 0.00 H new ATOM 0 HA ASP A 28 14.911 -3.457 0.447 1.00 0.00 H new ATOM 0 HB2 ASP A 28 13.919 -4.554 3.109 1.00 0.00 H new ATOM 0 HB3 ASP A 28 14.601 -5.511 1.809 1.00 0.00 H new ATOM 392 N SER A 29 11.854 -3.952 1.628 1.00 0.00 N ATOM 393 CA SER A 29 10.487 -4.273 1.235 1.00 0.00 C ATOM 394 C SER A 29 10.092 -3.512 -0.027 1.00 0.00 C ATOM 395 O SER A 29 9.285 -3.988 -0.826 1.00 0.00 O ATOM 396 CB SER A 29 9.516 -3.940 2.369 1.00 0.00 C ATOM 397 OG SER A 29 9.438 -5.004 3.302 1.00 0.00 O ATOM 0 H SER A 29 11.994 -3.864 2.635 1.00 0.00 H new ATOM 0 HA SER A 29 10.437 -5.341 1.025 1.00 0.00 H new ATOM 0 HB2 SER A 29 9.841 -3.031 2.875 1.00 0.00 H new ATOM 0 HB3 SER A 29 8.527 -3.739 1.958 1.00 0.00 H new ATOM 0 HG SER A 29 8.530 -5.373 3.303 1.00 0.00 H new ATOM 403 N PHE A 30 10.666 -2.326 -0.200 1.00 0.00 N ATOM 404 CA PHE A 30 10.374 -1.497 -1.364 1.00 0.00 C ATOM 405 C PHE A 30 11.022 -2.075 -2.619 1.00 0.00 C ATOM 406 O PHE A 30 12.211 -2.396 -2.627 1.00 0.00 O ATOM 407 CB PHE A 30 10.866 -0.067 -1.134 1.00 0.00 C ATOM 408 CG PHE A 30 10.529 0.871 -2.258 1.00 0.00 C ATOM 409 CD1 PHE A 30 9.209 1.130 -2.590 1.00 0.00 C ATOM 410 CD2 PHE A 30 11.533 1.493 -2.983 1.00 0.00 C ATOM 411 CE1 PHE A 30 8.897 1.991 -3.625 1.00 0.00 C ATOM 412 CE2 PHE A 30 11.227 2.356 -4.018 1.00 0.00 C ATOM 413 CZ PHE A 30 9.907 2.606 -4.339 1.00 0.00 C ATOM 0 H PHE A 30 11.336 -1.917 0.451 1.00 0.00 H new ATOM 0 HA PHE A 30 9.294 -1.483 -1.508 1.00 0.00 H new ATOM 0 HB2 PHE A 30 10.431 0.314 -0.210 1.00 0.00 H new ATOM 0 HB3 PHE A 30 11.947 -0.081 -0.995 1.00 0.00 H new ATOM 0 HD1 PHE A 30 8.415 0.654 -2.034 1.00 0.00 H new ATOM 0 HD2 PHE A 30 12.567 1.301 -2.736 1.00 0.00 H new ATOM 0 HE1 PHE A 30 7.864 2.183 -3.875 1.00 0.00 H new ATOM 0 HE2 PHE A 30 12.019 2.834 -4.575 1.00 0.00 H new ATOM 0 HZ PHE A 30 9.665 3.281 -5.147 1.00 0.00 H new ATOM 423 N THR A 31 10.232 -2.204 -3.680 1.00 0.00 N ATOM 424 CA THR A 31 10.727 -2.743 -4.940 1.00 0.00 C ATOM 425 C THR A 31 10.095 -2.029 -6.130 1.00 0.00 C ATOM 426 O THR A 31 8.890 -2.129 -6.358 1.00 0.00 O ATOM 427 CB THR A 31 10.445 -4.253 -5.054 1.00 0.00 C ATOM 428 OG1 THR A 31 10.956 -4.935 -3.903 1.00 0.00 O ATOM 429 CG2 THR A 31 11.077 -4.829 -6.313 1.00 0.00 C ATOM 0 H THR A 31 9.246 -1.942 -3.692 1.00 0.00 H new ATOM 0 HA THR A 31 11.805 -2.580 -4.952 1.00 0.00 H new ATOM 0 HB THR A 31 9.366 -4.395 -5.111 1.00 0.00 H new ATOM 0 HG1 THR A 31 10.771 -5.894 -3.982 1.00 0.00 H new ATOM 0 HG21 THR A 31 10.864 -5.896 -6.371 1.00 0.00 H new ATOM 0 HG22 THR A 31 10.665 -4.328 -7.189 1.00 0.00 H new ATOM 0 HG23 THR A 31 12.156 -4.675 -6.282 1.00 0.00 H new ATOM 437 N VAL A 32 10.917 -1.309 -6.886 1.00 0.00 N ATOM 438 CA VAL A 32 10.439 -0.579 -8.054 1.00 0.00 C ATOM 439 C VAL A 32 10.239 -1.513 -9.242 1.00 0.00 C ATOM 440 O VAL A 32 11.184 -2.144 -9.716 1.00 0.00 O ATOM 441 CB VAL A 32 11.417 0.541 -8.455 1.00 0.00 C ATOM 442 CG1 VAL A 32 10.936 1.246 -9.715 1.00 0.00 C ATOM 443 CG2 VAL A 32 11.590 1.532 -7.314 1.00 0.00 C ATOM 0 H VAL A 32 11.917 -1.215 -6.711 1.00 0.00 H new ATOM 0 HA VAL A 32 9.482 -0.135 -7.780 1.00 0.00 H new ATOM 0 HB VAL A 32 12.387 0.092 -8.667 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.640 2.034 -9.982 1.00 0.00 H new ATOM 0 HG12 VAL A 32 10.869 0.527 -10.531 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.954 1.683 -9.535 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.284 2.316 -7.615 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.625 1.976 -7.068 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.984 1.015 -6.439 1.00 0.00 H new ATOM 453 N LEU A 33 9.002 -1.597 -9.719 1.00 0.00 N ATOM 454 CA LEU A 33 8.676 -2.455 -10.854 1.00 0.00 C ATOM 455 C LEU A 33 9.215 -1.866 -12.154 1.00 0.00 C ATOM 456 O LEU A 33 10.069 -2.463 -12.810 1.00 0.00 O ATOM 457 CB LEU A 33 7.162 -2.645 -10.956 1.00 0.00 C ATOM 458 CG LEU A 33 6.531 -3.578 -9.921 1.00 0.00 C ATOM 459 CD1 LEU A 33 5.014 -3.480 -9.969 1.00 0.00 C ATOM 460 CD2 LEU A 33 6.982 -5.013 -10.152 1.00 0.00 C ATOM 0 H LEU A 33 8.208 -1.082 -9.338 1.00 0.00 H new ATOM 0 HA LEU A 33 9.148 -3.424 -10.693 1.00 0.00 H new ATOM 0 HB2 LEU A 33 6.687 -1.668 -10.872 1.00 0.00 H new ATOM 0 HB3 LEU A 33 6.930 -3.028 -11.950 1.00 0.00 H new ATOM 0 HG LEU A 33 6.863 -3.269 -8.930 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.582 -4.151 -9.226 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.709 -2.456 -9.754 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.662 -3.763 -10.961 1.00 0.00 H new ATOM 0 HD21 LEU A 33 6.524 -5.663 -9.407 1.00 0.00 H new ATOM 0 HD22 LEU A 33 6.679 -5.334 -11.149 1.00 0.00 H new ATOM 0 HD23 LEU A 33 8.067 -5.072 -10.066 1.00 0.00 H new ATOM 472 N SER A 34 8.712 -0.691 -12.519 1.00 0.00 N ATOM 473 CA SER A 34 9.142 -0.023 -13.741 1.00 0.00 C ATOM 474 C SER A 34 9.238 1.485 -13.530 1.00 0.00 C ATOM 475 O SER A 34 8.394 2.084 -12.865 1.00 0.00 O ATOM 476 CB SER A 34 8.171 -0.329 -14.883 1.00 0.00 C ATOM 477 OG SER A 34 8.355 -1.647 -15.370 1.00 0.00 O ATOM 0 H SER A 34 8.007 -0.182 -11.986 1.00 0.00 H new ATOM 0 HA SER A 34 10.131 -0.399 -14.004 1.00 0.00 H new ATOM 0 HB2 SER A 34 7.145 -0.207 -14.535 1.00 0.00 H new ATOM 0 HB3 SER A 34 8.320 0.385 -15.693 1.00 0.00 H new ATOM 0 HG SER A 34 7.722 -1.818 -16.098 1.00 0.00 H new ATOM 483 N GLU A 35 10.273 2.092 -14.103 1.00 0.00 N ATOM 484 CA GLU A 35 10.480 3.530 -13.977 1.00 0.00 C ATOM 485 C GLU A 35 9.232 4.298 -14.400 1.00 0.00 C ATOM 486 O GLU A 35 8.684 5.085 -13.630 1.00 0.00 O ATOM 487 CB GLU A 35 11.676 3.971 -14.823 1.00 0.00 C ATOM 488 CG GLU A 35 13.021 3.654 -14.190 1.00 0.00 C ATOM 489 CD GLU A 35 13.203 2.173 -13.920 1.00 0.00 C ATOM 490 OE1 GLU A 35 13.596 1.444 -14.855 1.00 0.00 O ATOM 491 OE2 GLU A 35 12.953 1.743 -12.774 1.00 0.00 O ATOM 0 H GLU A 35 10.980 1.611 -14.658 1.00 0.00 H new ATOM 0 HA GLU A 35 10.684 3.752 -12.930 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.619 3.486 -15.797 1.00 0.00 H new ATOM 0 HB3 GLU A 35 11.610 5.045 -14.997 1.00 0.00 H new ATOM 0 HG2 GLU A 35 13.819 4.001 -14.847 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.117 4.205 -13.254 1.00 0.00 H new ATOM 498 N ASN A 36 8.789 4.064 -15.631 1.00 0.00 N ATOM 499 CA ASN A 36 7.606 4.735 -16.159 1.00 0.00 C ATOM 500 C ASN A 36 6.614 3.723 -16.723 1.00 0.00 C ATOM 501 O ASN A 36 6.942 2.910 -17.588 1.00 0.00 O ATOM 502 CB ASN A 36 8.004 5.736 -17.245 1.00 0.00 C ATOM 503 CG ASN A 36 8.450 7.066 -16.669 1.00 0.00 C ATOM 504 OD1 ASN A 36 8.348 7.300 -15.465 1.00 0.00 O ATOM 505 ND2 ASN A 36 8.949 7.946 -17.530 1.00 0.00 N ATOM 0 H ASN A 36 9.231 3.415 -16.282 1.00 0.00 H new ATOM 0 HA ASN A 36 7.126 5.270 -15.340 1.00 0.00 H new ATOM 0 HB2 ASN A 36 8.810 5.315 -17.846 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.159 5.898 -17.914 1.00 0.00 H new ATOM 0 HD21 ASN A 36 9.266 8.858 -17.201 1.00 0.00 H new ATOM 0 HD22 ASN A 36 9.015 7.710 -18.520 1.00 0.00 H new ATOM 512 N PRO A 37 5.370 3.773 -16.224 1.00 0.00 N ATOM 513 CA PRO A 37 4.968 4.736 -15.194 1.00 0.00 C ATOM 514 C PRO A 37 5.604 4.436 -13.841 1.00 0.00 C ATOM 515 O PRO A 37 6.177 3.369 -13.620 1.00 0.00 O ATOM 516 CB PRO A 37 3.449 4.563 -15.121 1.00 0.00 C ATOM 517 CG PRO A 37 3.202 3.172 -15.595 1.00 0.00 C ATOM 518 CD PRO A 37 4.260 2.893 -16.626 1.00 0.00 C ATOM 0 HA PRO A 37 5.284 5.750 -15.438 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.083 4.705 -14.104 1.00 0.00 H new ATOM 0 HB3 PRO A 37 2.937 5.292 -15.749 1.00 0.00 H new ATOM 0 HG2 PRO A 37 3.264 2.462 -14.770 1.00 0.00 H new ATOM 0 HG3 PRO A 37 2.204 3.077 -16.024 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.557 1.844 -16.623 1.00 0.00 H new ATOM 0 HD3 PRO A 37 3.910 3.122 -17.633 1.00 0.00 H new ATOM 526 N PRO A 38 5.503 5.399 -12.913 1.00 0.00 N ATOM 527 CA PRO A 38 6.062 5.261 -11.565 1.00 0.00 C ATOM 528 C PRO A 38 5.306 4.237 -10.726 1.00 0.00 C ATOM 529 O PRO A 38 4.465 4.595 -9.901 1.00 0.00 O ATOM 530 CB PRO A 38 5.903 6.662 -10.969 1.00 0.00 C ATOM 531 CG PRO A 38 4.763 7.264 -11.717 1.00 0.00 C ATOM 532 CD PRO A 38 4.835 6.697 -13.108 1.00 0.00 C ATOM 0 HA PRO A 38 7.092 4.906 -11.586 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.695 6.616 -9.900 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.812 7.250 -11.092 1.00 0.00 H new ATOM 0 HG2 PRO A 38 3.812 7.018 -11.244 1.00 0.00 H new ATOM 0 HG3 PRO A 38 4.838 8.351 -11.734 1.00 0.00 H new ATOM 0 HD2 PRO A 38 3.844 6.577 -13.545 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.402 7.344 -13.777 1.00 0.00 H new ATOM 540 N SER A 39 5.611 2.961 -10.941 1.00 0.00 N ATOM 541 CA SER A 39 4.957 1.884 -10.207 1.00 0.00 C ATOM 542 C SER A 39 5.934 1.206 -9.252 1.00 0.00 C ATOM 543 O SER A 39 7.124 1.085 -9.545 1.00 0.00 O ATOM 544 CB SER A 39 4.378 0.854 -11.178 1.00 0.00 C ATOM 545 OG SER A 39 4.021 -0.340 -10.503 1.00 0.00 O ATOM 0 H SER A 39 6.307 2.648 -11.618 1.00 0.00 H new ATOM 0 HA SER A 39 4.146 2.317 -9.622 1.00 0.00 H new ATOM 0 HB2 SER A 39 3.502 1.270 -11.675 1.00 0.00 H new ATOM 0 HB3 SER A 39 5.109 0.631 -11.955 1.00 0.00 H new ATOM 0 HG SER A 39 3.154 -0.220 -10.061 1.00 0.00 H new ATOM 551 N PHE A 40 5.424 0.765 -8.107 1.00 0.00 N ATOM 552 CA PHE A 40 6.251 0.100 -7.107 1.00 0.00 C ATOM 553 C PHE A 40 5.414 -0.849 -6.253 1.00 0.00 C ATOM 554 O PHE A 40 4.201 -0.681 -6.124 1.00 0.00 O ATOM 555 CB PHE A 40 6.940 1.134 -6.214 1.00 0.00 C ATOM 556 CG PHE A 40 5.983 1.941 -5.384 1.00 0.00 C ATOM 557 CD1 PHE A 40 5.445 1.419 -4.219 1.00 0.00 C ATOM 558 CD2 PHE A 40 5.623 3.223 -5.768 1.00 0.00 C ATOM 559 CE1 PHE A 40 4.565 2.159 -3.453 1.00 0.00 C ATOM 560 CE2 PHE A 40 4.743 3.968 -5.006 1.00 0.00 C ATOM 561 CZ PHE A 40 4.214 3.436 -3.847 1.00 0.00 C ATOM 0 H PHE A 40 4.442 0.856 -7.848 1.00 0.00 H new ATOM 0 HA PHE A 40 7.010 -0.482 -7.629 1.00 0.00 H new ATOM 0 HB2 PHE A 40 7.640 0.623 -5.553 1.00 0.00 H new ATOM 0 HB3 PHE A 40 7.526 1.809 -6.838 1.00 0.00 H new ATOM 0 HD1 PHE A 40 5.717 0.422 -3.906 1.00 0.00 H new ATOM 0 HD2 PHE A 40 6.035 3.645 -6.673 1.00 0.00 H new ATOM 0 HE1 PHE A 40 4.152 1.740 -2.547 1.00 0.00 H new ATOM 0 HE2 PHE A 40 4.469 4.965 -5.317 1.00 0.00 H new ATOM 0 HZ PHE A 40 3.527 4.017 -3.249 1.00 0.00 H new ATOM 571 N THR A 41 6.072 -1.848 -5.672 1.00 0.00 N ATOM 572 CA THR A 41 5.390 -2.825 -4.833 1.00 0.00 C ATOM 573 C THR A 41 5.990 -2.859 -3.432 1.00 0.00 C ATOM 574 O THR A 41 7.189 -2.643 -3.254 1.00 0.00 O ATOM 575 CB THR A 41 5.461 -4.237 -5.444 1.00 0.00 C ATOM 576 OG1 THR A 41 6.819 -4.570 -5.752 1.00 0.00 O ATOM 577 CG2 THR A 41 4.614 -4.324 -6.704 1.00 0.00 C ATOM 0 H THR A 41 7.076 -2.001 -5.767 1.00 0.00 H new ATOM 0 HA THR A 41 4.346 -2.516 -4.772 1.00 0.00 H new ATOM 0 HB THR A 41 5.071 -4.945 -4.713 1.00 0.00 H new ATOM 0 HG1 THR A 41 6.856 -5.470 -6.139 1.00 0.00 H new ATOM 0 HG21 THR A 41 4.680 -5.330 -7.118 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.576 -4.099 -6.461 1.00 0.00 H new ATOM 0 HG23 THR A 41 4.979 -3.605 -7.438 1.00 0.00 H new ATOM 585 N ILE A 42 5.149 -3.133 -2.440 1.00 0.00 N ATOM 586 CA ILE A 42 5.598 -3.197 -1.055 1.00 0.00 C ATOM 587 C ILE A 42 5.208 -4.524 -0.412 1.00 0.00 C ATOM 588 O ILE A 42 4.031 -4.883 -0.364 1.00 0.00 O ATOM 589 CB ILE A 42 5.012 -2.044 -0.219 1.00 0.00 C ATOM 590 CG1 ILE A 42 5.344 -0.697 -0.866 1.00 0.00 C ATOM 591 CG2 ILE A 42 5.544 -2.099 1.205 1.00 0.00 C ATOM 592 CD1 ILE A 42 4.988 0.492 -0.002 1.00 0.00 C ATOM 0 H ILE A 42 4.154 -3.314 -2.570 1.00 0.00 H new ATOM 0 HA ILE A 42 6.684 -3.108 -1.071 1.00 0.00 H new ATOM 0 HB ILE A 42 3.928 -2.153 -0.185 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.410 -0.665 -1.093 1.00 0.00 H new ATOM 0 HG13 ILE A 42 4.813 -0.618 -1.815 1.00 0.00 H new ATOM 0 HG21 ILE A 42 5.121 -1.278 1.783 1.00 0.00 H new ATOM 0 HG22 ILE A 42 5.263 -3.048 1.662 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.630 -2.011 1.191 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.251 1.412 -0.523 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.918 0.485 0.204 1.00 0.00 H new ATOM 0 HD13 ILE A 42 5.539 0.437 0.937 1.00 0.00 H new ATOM 604 N THR A 43 6.205 -5.250 0.085 1.00 0.00 N ATOM 605 CA THR A 43 5.968 -6.537 0.726 1.00 0.00 C ATOM 606 C THR A 43 5.667 -6.365 2.210 1.00 0.00 C ATOM 607 O THR A 43 6.483 -5.833 2.962 1.00 0.00 O ATOM 608 CB THR A 43 7.178 -7.477 0.565 1.00 0.00 C ATOM 609 OG1 THR A 43 7.287 -7.906 -0.797 1.00 0.00 O ATOM 610 CG2 THR A 43 7.047 -8.689 1.475 1.00 0.00 C ATOM 0 H THR A 43 7.185 -4.968 0.056 1.00 0.00 H new ATOM 0 HA THR A 43 5.104 -6.981 0.232 1.00 0.00 H new ATOM 0 HB THR A 43 8.077 -6.928 0.846 1.00 0.00 H new ATOM 0 HG1 THR A 43 8.059 -8.502 -0.892 1.00 0.00 H new ATOM 0 HG21 THR A 43 7.913 -9.338 1.344 1.00 0.00 H new ATOM 0 HG22 THR A 43 6.994 -8.361 2.513 1.00 0.00 H new ATOM 0 HG23 THR A 43 6.140 -9.238 1.221 1.00 0.00 H new ATOM 618 N VAL A 44 4.489 -6.819 2.627 1.00 0.00 N ATOM 619 CA VAL A 44 4.080 -6.716 4.023 1.00 0.00 C ATOM 620 C VAL A 44 3.757 -8.088 4.603 1.00 0.00 C ATOM 621 O VAL A 44 2.765 -8.715 4.229 1.00 0.00 O ATOM 622 CB VAL A 44 2.852 -5.801 4.182 1.00 0.00 C ATOM 623 CG1 VAL A 44 2.444 -5.704 5.644 1.00 0.00 C ATOM 624 CG2 VAL A 44 3.137 -4.421 3.608 1.00 0.00 C ATOM 0 H VAL A 44 3.801 -7.262 2.018 1.00 0.00 H new ATOM 0 HA VAL A 44 4.919 -6.283 4.568 1.00 0.00 H new ATOM 0 HB VAL A 44 2.022 -6.237 3.625 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.575 -5.053 5.737 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.196 -6.697 6.019 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.269 -5.292 6.225 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.258 -3.788 3.729 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.981 -3.975 4.135 1.00 0.00 H new ATOM 0 HG23 VAL A 44 3.377 -4.510 2.548 1.00 0.00 H new ATOM 634 N THR A 45 4.600 -8.551 5.521 1.00 0.00 N ATOM 635 CA THR A 45 4.406 -9.849 6.153 1.00 0.00 C ATOM 636 C THR A 45 3.888 -9.694 7.578 1.00 0.00 C ATOM 637 O THR A 45 4.246 -8.748 8.280 1.00 0.00 O ATOM 638 CB THR A 45 5.713 -10.663 6.179 1.00 0.00 C ATOM 639 OG1 THR A 45 6.313 -10.669 4.879 1.00 0.00 O ATOM 640 CG2 THR A 45 5.451 -12.093 6.629 1.00 0.00 C ATOM 0 H THR A 45 5.425 -8.045 5.843 1.00 0.00 H new ATOM 0 HA THR A 45 3.667 -10.384 5.557 1.00 0.00 H new ATOM 0 HB THR A 45 6.393 -10.194 6.890 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.144 -11.188 4.905 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.389 -12.649 6.640 1.00 0.00 H new ATOM 0 HG22 THR A 45 5.022 -12.086 7.631 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.755 -12.570 5.939 1.00 0.00 H new ATOM 648 N SER A 46 3.043 -10.629 8.001 1.00 0.00 N ATOM 649 CA SER A 46 2.474 -10.595 9.343 1.00 0.00 C ATOM 650 C SER A 46 3.308 -11.430 10.309 1.00 0.00 C ATOM 651 O SER A 46 3.994 -12.368 9.902 1.00 0.00 O ATOM 652 CB SER A 46 1.032 -11.107 9.322 1.00 0.00 C ATOM 653 OG SER A 46 0.995 -12.519 9.210 1.00 0.00 O ATOM 0 H SER A 46 2.737 -11.419 7.433 1.00 0.00 H new ATOM 0 HA SER A 46 2.480 -9.561 9.687 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.519 -10.798 10.233 1.00 0.00 H new ATOM 0 HB3 SER A 46 0.495 -10.658 8.486 1.00 0.00 H new ATOM 0 HG SER A 46 1.879 -12.849 8.946 1.00 0.00 H new ATOM 659 N GLU A 47 3.244 -11.082 11.591 1.00 0.00 N ATOM 660 CA GLU A 47 3.994 -11.799 12.615 1.00 0.00 C ATOM 661 C GLU A 47 3.593 -13.271 12.652 1.00 0.00 C ATOM 662 O GLU A 47 2.770 -13.722 11.856 1.00 0.00 O ATOM 663 CB GLU A 47 3.764 -11.162 13.987 1.00 0.00 C ATOM 664 CG GLU A 47 2.366 -10.597 14.169 1.00 0.00 C ATOM 665 CD GLU A 47 2.008 -10.385 15.627 1.00 0.00 C ATOM 666 OE1 GLU A 47 2.226 -11.313 16.434 1.00 0.00 O ATOM 667 OE2 GLU A 47 1.509 -9.290 15.962 1.00 0.00 O ATOM 0 H GLU A 47 2.681 -10.308 11.944 1.00 0.00 H new ATOM 0 HA GLU A 47 5.053 -11.735 12.365 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.949 -11.908 14.760 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.491 -10.364 14.134 1.00 0.00 H new ATOM 0 HG2 GLU A 47 2.290 -9.648 13.638 1.00 0.00 H new ATOM 0 HG3 GLU A 47 1.642 -11.275 13.716 1.00 0.00 H new ATOM 674 N ALA A 48 4.183 -14.016 13.582 1.00 0.00 N ATOM 675 CA ALA A 48 3.887 -15.436 13.725 1.00 0.00 C ATOM 676 C ALA A 48 2.860 -15.674 14.826 1.00 0.00 C ATOM 677 O ALA A 48 3.086 -15.330 15.985 1.00 0.00 O ATOM 678 CB ALA A 48 5.163 -16.214 14.013 1.00 0.00 C ATOM 0 H ALA A 48 4.869 -13.659 14.247 1.00 0.00 H new ATOM 0 HA ALA A 48 3.462 -15.790 12.786 1.00 0.00 H new ATOM 0 HB1 ALA A 48 4.928 -17.273 14.118 1.00 0.00 H new ATOM 0 HB2 ALA A 48 5.866 -16.078 13.191 1.00 0.00 H new ATOM 0 HB3 ALA A 48 5.611 -15.849 14.937 1.00 0.00 H new ATOM 684 N GLY A 49 1.728 -16.266 14.456 1.00 0.00 N ATOM 685 CA GLY A 49 0.682 -16.540 15.424 1.00 0.00 C ATOM 686 C GLY A 49 0.994 -17.745 16.289 1.00 0.00 C ATOM 687 O GLY A 49 1.908 -17.705 17.113 1.00 0.00 O ATOM 0 H GLY A 49 1.517 -16.561 13.503 1.00 0.00 H new ATOM 0 HA2 GLY A 49 0.542 -15.666 16.060 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.259 -16.707 14.900 1.00 0.00 H new ATOM 691 N GLU A 50 0.233 -18.818 16.103 1.00 0.00 N ATOM 692 CA GLU A 50 0.432 -20.039 16.877 1.00 0.00 C ATOM 693 C GLU A 50 1.231 -21.064 16.077 1.00 0.00 C ATOM 694 O GLU A 50 2.257 -21.562 16.538 1.00 0.00 O ATOM 695 CB GLU A 50 -0.916 -20.634 17.288 1.00 0.00 C ATOM 696 CG GLU A 50 -0.794 -21.871 18.162 1.00 0.00 C ATOM 697 CD GLU A 50 -0.628 -21.533 19.631 1.00 0.00 C ATOM 698 OE1 GLU A 50 0.066 -20.540 19.936 1.00 0.00 O ATOM 699 OE2 GLU A 50 -1.192 -22.260 20.475 1.00 0.00 O ATOM 0 H GLU A 50 -0.527 -18.868 15.424 1.00 0.00 H new ATOM 0 HA GLU A 50 0.996 -19.783 17.774 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -1.490 -19.877 17.822 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -1.480 -20.888 16.391 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -1.681 -22.491 18.034 1.00 0.00 H new ATOM 0 HG3 GLU A 50 0.059 -22.463 17.830 1.00 0.00 H new ATOM 706 N ASN A 51 0.751 -21.375 14.878 1.00 0.00 N ATOM 707 CA ASN A 51 1.419 -22.342 14.014 1.00 0.00 C ATOM 708 C ASN A 51 2.284 -21.636 12.974 1.00 0.00 C ATOM 709 O ASN A 51 2.261 -21.986 11.793 1.00 0.00 O ATOM 710 CB ASN A 51 0.389 -23.233 13.318 1.00 0.00 C ATOM 711 CG ASN A 51 -0.031 -24.411 14.176 1.00 0.00 C ATOM 712 OD1 ASN A 51 0.794 -25.242 14.556 1.00 0.00 O ATOM 713 ND2 ASN A 51 -1.320 -24.488 14.487 1.00 0.00 N ATOM 0 H ASN A 51 -0.098 -20.972 14.482 1.00 0.00 H new ATOM 0 HA ASN A 51 2.064 -22.963 14.636 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -0.490 -22.639 13.066 1.00 0.00 H new ATOM 0 HB3 ASN A 51 0.805 -23.600 12.380 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -1.661 -25.258 15.062 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -1.969 -23.777 14.150 1.00 0.00 H new ATOM 720 N ASP A 52 3.044 -20.643 13.420 1.00 0.00 N ATOM 721 CA ASP A 52 3.917 -19.889 12.528 1.00 0.00 C ATOM 722 C ASP A 52 3.175 -19.476 11.261 1.00 0.00 C ATOM 723 O ASP A 52 3.782 -19.294 10.206 1.00 0.00 O ATOM 724 CB ASP A 52 5.150 -20.718 12.165 1.00 0.00 C ATOM 725 CG ASP A 52 6.287 -20.527 13.148 1.00 0.00 C ATOM 726 OD1 ASP A 52 6.715 -19.369 13.343 1.00 0.00 O ATOM 727 OD2 ASP A 52 6.750 -21.534 13.724 1.00 0.00 O ATOM 0 H ASP A 52 3.074 -20.341 14.394 1.00 0.00 H new ATOM 0 HA ASP A 52 4.236 -18.987 13.050 1.00 0.00 H new ATOM 0 HB2 ASP A 52 4.877 -21.773 12.130 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.488 -20.443 11.166 1.00 0.00 H new ATOM 732 N GLU A 53 1.858 -19.332 11.373 1.00 0.00 N ATOM 733 CA GLU A 53 1.033 -18.943 10.235 1.00 0.00 C ATOM 734 C GLU A 53 1.319 -17.502 9.823 1.00 0.00 C ATOM 735 O GLU A 53 0.987 -16.560 10.543 1.00 0.00 O ATOM 736 CB GLU A 53 -0.450 -19.103 10.574 1.00 0.00 C ATOM 737 CG GLU A 53 -0.883 -18.318 11.801 1.00 0.00 C ATOM 738 CD GLU A 53 -2.033 -18.975 12.538 1.00 0.00 C ATOM 739 OE1 GLU A 53 -1.982 -20.207 12.739 1.00 0.00 O ATOM 740 OE2 GLU A 53 -2.984 -18.258 12.914 1.00 0.00 O ATOM 0 H GLU A 53 1.340 -19.479 12.239 1.00 0.00 H new ATOM 0 HA GLU A 53 1.280 -19.598 9.399 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -1.046 -18.783 9.719 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.665 -20.159 10.735 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -0.035 -18.213 12.478 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.177 -17.313 11.499 1.00 0.00 H new ATOM 747 N THR A 54 1.939 -17.338 8.658 1.00 0.00 N ATOM 748 CA THR A 54 2.272 -16.013 8.150 1.00 0.00 C ATOM 749 C THR A 54 1.531 -15.720 6.851 1.00 0.00 C ATOM 750 O THR A 54 1.360 -16.603 6.009 1.00 0.00 O ATOM 751 CB THR A 54 3.786 -15.869 7.908 1.00 0.00 C ATOM 752 OG1 THR A 54 4.224 -16.839 6.950 1.00 0.00 O ATOM 753 CG2 THR A 54 4.561 -16.044 9.205 1.00 0.00 C ATOM 0 H THR A 54 2.220 -18.106 8.049 1.00 0.00 H new ATOM 0 HA THR A 54 1.963 -15.296 8.911 1.00 0.00 H new ATOM 0 HB THR A 54 3.976 -14.867 7.523 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.187 -16.739 6.801 1.00 0.00 H new ATOM 0 HG21 THR A 54 5.628 -15.938 9.008 1.00 0.00 H new ATOM 0 HG22 THR A 54 4.247 -15.285 9.922 1.00 0.00 H new ATOM 0 HG23 THR A 54 4.364 -17.034 9.616 1.00 0.00 H new ATOM 761 N VAL A 55 1.093 -14.475 6.692 1.00 0.00 N ATOM 762 CA VAL A 55 0.372 -14.066 5.493 1.00 0.00 C ATOM 763 C VAL A 55 1.064 -12.893 4.808 1.00 0.00 C ATOM 764 O VAL A 55 1.637 -12.027 5.469 1.00 0.00 O ATOM 765 CB VAL A 55 -1.081 -13.671 5.819 1.00 0.00 C ATOM 766 CG1 VAL A 55 -1.733 -14.720 6.706 1.00 0.00 C ATOM 767 CG2 VAL A 55 -1.124 -12.301 6.480 1.00 0.00 C ATOM 0 H VAL A 55 1.225 -13.732 7.379 1.00 0.00 H new ATOM 0 HA VAL A 55 0.366 -14.923 4.820 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.643 -13.618 4.887 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.759 -14.424 6.926 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.735 -15.681 6.192 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.173 -14.808 7.637 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.158 -12.037 6.704 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -0.547 -12.325 7.405 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -0.698 -11.558 5.806 1.00 0.00 H new ATOM 777 N GLN A 56 1.007 -12.872 3.481 1.00 0.00 N ATOM 778 CA GLN A 56 1.630 -11.804 2.706 1.00 0.00 C ATOM 779 C GLN A 56 0.725 -11.365 1.560 1.00 0.00 C ATOM 780 O GLN A 56 -0.026 -12.167 1.004 1.00 0.00 O ATOM 781 CB GLN A 56 2.981 -12.265 2.157 1.00 0.00 C ATOM 782 CG GLN A 56 3.896 -11.121 1.754 1.00 0.00 C ATOM 783 CD GLN A 56 5.316 -11.577 1.481 1.00 0.00 C ATOM 784 OE1 GLN A 56 5.737 -11.676 0.328 1.00 0.00 O ATOM 785 NE2 GLN A 56 6.062 -11.858 2.542 1.00 0.00 N ATOM 0 H GLN A 56 0.536 -13.582 2.919 1.00 0.00 H new ATOM 0 HA GLN A 56 1.787 -10.952 3.368 1.00 0.00 H new ATOM 0 HB2 GLN A 56 3.482 -12.872 2.911 1.00 0.00 H new ATOM 0 HB3 GLN A 56 2.813 -12.906 1.292 1.00 0.00 H new ATOM 0 HG2 GLN A 56 3.496 -10.638 0.863 1.00 0.00 H new ATOM 0 HG3 GLN A 56 3.905 -10.372 2.546 1.00 0.00 H new ATOM 0 HE21 GLN A 56 5.672 -11.762 3.480 1.00 0.00 H new ATOM 0 HE22 GLN A 56 7.025 -12.170 2.420 1.00 0.00 H new ATOM 794 N THR A 57 0.801 -10.084 1.210 1.00 0.00 N ATOM 795 CA THR A 57 -0.012 -9.537 0.132 1.00 0.00 C ATOM 796 C THR A 57 0.751 -8.469 -0.644 1.00 0.00 C ATOM 797 O THR A 57 1.112 -7.427 -0.096 1.00 0.00 O ATOM 798 CB THR A 57 -1.321 -8.929 0.668 1.00 0.00 C ATOM 799 OG1 THR A 57 -2.112 -8.433 -0.418 1.00 0.00 O ATOM 800 CG2 THR A 57 -1.033 -7.802 1.648 1.00 0.00 C ATOM 0 H THR A 57 1.418 -9.407 1.658 1.00 0.00 H new ATOM 0 HA THR A 57 -0.252 -10.365 -0.535 1.00 0.00 H new ATOM 0 HB THR A 57 -1.872 -9.711 1.190 1.00 0.00 H new ATOM 0 HG1 THR A 57 -2.763 -7.784 -0.079 1.00 0.00 H new ATOM 0 HG21 THR A 57 -1.973 -7.388 2.013 1.00 0.00 H new ATOM 0 HG22 THR A 57 -0.456 -8.189 2.488 1.00 0.00 H new ATOM 0 HG23 THR A 57 -0.463 -7.020 1.146 1.00 0.00 H new ATOM 808 N THR A 58 0.994 -8.734 -1.924 1.00 0.00 N ATOM 809 CA THR A 58 1.714 -7.796 -2.775 1.00 0.00 C ATOM 810 C THR A 58 0.830 -6.616 -3.165 1.00 0.00 C ATOM 811 O THR A 58 -0.170 -6.782 -3.864 1.00 0.00 O ATOM 812 CB THR A 58 2.231 -8.480 -4.055 1.00 0.00 C ATOM 813 OG1 THR A 58 3.071 -9.588 -3.712 1.00 0.00 O ATOM 814 CG2 THR A 58 3.006 -7.497 -4.919 1.00 0.00 C ATOM 0 H THR A 58 0.702 -9.591 -2.394 1.00 0.00 H new ATOM 0 HA THR A 58 2.564 -7.434 -2.196 1.00 0.00 H new ATOM 0 HB THR A 58 1.372 -8.838 -4.622 1.00 0.00 H new ATOM 0 HG1 THR A 58 3.395 -10.019 -4.531 1.00 0.00 H new ATOM 0 HG21 THR A 58 3.361 -8.003 -5.817 1.00 0.00 H new ATOM 0 HG22 THR A 58 2.355 -6.670 -5.202 1.00 0.00 H new ATOM 0 HG23 THR A 58 3.858 -7.113 -4.358 1.00 0.00 H new ATOM 822 N LEU A 59 1.206 -5.426 -2.710 1.00 0.00 N ATOM 823 CA LEU A 59 0.447 -4.218 -3.012 1.00 0.00 C ATOM 824 C LEU A 59 1.145 -3.390 -4.086 1.00 0.00 C ATOM 825 O LEU A 59 2.233 -2.857 -3.865 1.00 0.00 O ATOM 826 CB LEU A 59 0.260 -3.379 -1.746 1.00 0.00 C ATOM 827 CG LEU A 59 -0.226 -4.132 -0.508 1.00 0.00 C ATOM 828 CD1 LEU A 59 0.256 -3.443 0.760 1.00 0.00 C ATOM 829 CD2 LEU A 59 -1.744 -4.243 -0.513 1.00 0.00 C ATOM 0 H LEU A 59 2.031 -5.272 -2.131 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.531 -4.518 -3.389 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.210 -2.902 -1.507 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.451 -2.582 -1.964 1.00 0.00 H new ATOM 0 HG LEU A 59 0.192 -5.138 -0.531 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -0.100 -3.993 1.631 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.346 -3.416 0.768 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.132 -2.425 0.791 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.072 -4.782 0.376 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -2.182 -3.245 -0.514 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.066 -4.782 -1.404 1.00 0.00 H new ATOM 841 N LYS A 60 0.512 -3.284 -5.249 1.00 0.00 N ATOM 842 CA LYS A 60 1.070 -2.519 -6.358 1.00 0.00 C ATOM 843 C LYS A 60 0.441 -1.131 -6.432 1.00 0.00 C ATOM 844 O LYS A 60 -0.672 -0.969 -6.933 1.00 0.00 O ATOM 845 CB LYS A 60 0.852 -3.261 -7.678 1.00 0.00 C ATOM 846 CG LYS A 60 1.513 -2.590 -8.870 1.00 0.00 C ATOM 847 CD LYS A 60 1.093 -3.238 -10.178 1.00 0.00 C ATOM 848 CE LYS A 60 1.771 -2.578 -11.369 1.00 0.00 C ATOM 849 NZ LYS A 60 1.934 -3.523 -12.509 1.00 0.00 N ATOM 0 H LYS A 60 -0.389 -3.719 -5.448 1.00 0.00 H new ATOM 0 HA LYS A 60 2.140 -2.405 -6.186 1.00 0.00 H new ATOM 0 HB2 LYS A 60 1.238 -4.276 -7.583 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -0.218 -3.344 -7.866 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.249 -1.532 -8.886 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.597 -2.647 -8.766 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.344 -4.299 -10.157 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.011 -3.168 -10.289 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.183 -1.719 -11.691 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.748 -2.201 -11.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.400 -3.035 -13.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.516 -4.331 -12.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 1.000 -3.864 -12.814 1.00 0.00 H new ATOM 863 N PHE A 61 1.161 -0.133 -5.931 1.00 0.00 N ATOM 864 CA PHE A 61 0.673 1.241 -5.941 1.00 0.00 C ATOM 865 C PHE A 61 1.126 1.970 -7.203 1.00 0.00 C ATOM 866 O PHE A 61 2.301 1.934 -7.568 1.00 0.00 O ATOM 867 CB PHE A 61 1.168 1.990 -4.702 1.00 0.00 C ATOM 868 CG PHE A 61 0.629 1.437 -3.413 1.00 0.00 C ATOM 869 CD1 PHE A 61 -0.696 1.634 -3.059 1.00 0.00 C ATOM 870 CD2 PHE A 61 1.448 0.721 -2.555 1.00 0.00 C ATOM 871 CE1 PHE A 61 -1.195 1.126 -1.874 1.00 0.00 C ATOM 872 CE2 PHE A 61 0.955 0.210 -1.369 1.00 0.00 C ATOM 873 CZ PHE A 61 -0.368 0.414 -1.028 1.00 0.00 C ATOM 0 H PHE A 61 2.084 -0.250 -5.513 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.417 1.213 -5.929 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.257 1.954 -4.676 1.00 0.00 H new ATOM 0 HB3 PHE A 61 0.885 3.039 -4.784 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -1.347 2.191 -3.717 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.484 0.560 -2.816 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.230 1.286 -1.610 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.603 -0.348 -0.710 1.00 0.00 H new ATOM 0 HZ PHE A 61 -0.755 0.017 -0.101 1.00 0.00 H new ATOM 883 N THR A 62 0.183 2.631 -7.868 1.00 0.00 N ATOM 884 CA THR A 62 0.483 3.367 -9.090 1.00 0.00 C ATOM 885 C THR A 62 -0.081 4.782 -9.031 1.00 0.00 C ATOM 886 O THR A 62 -1.161 5.009 -8.486 1.00 0.00 O ATOM 887 CB THR A 62 -0.085 2.651 -10.330 1.00 0.00 C ATOM 888 OG1 THR A 62 0.326 1.280 -10.335 1.00 0.00 O ATOM 889 CG2 THR A 62 0.383 3.331 -11.608 1.00 0.00 C ATOM 0 H THR A 62 -0.795 2.672 -7.581 1.00 0.00 H new ATOM 0 HA THR A 62 1.569 3.415 -9.173 1.00 0.00 H new ATOM 0 HB THR A 62 -1.173 2.703 -10.287 1.00 0.00 H new ATOM 0 HG1 THR A 62 -0.041 0.831 -11.125 1.00 0.00 H new ATOM 0 HG21 THR A 62 -0.030 2.808 -12.471 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.044 4.367 -11.614 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.472 3.306 -11.656 1.00 0.00 H new ATOM 897 N TYR A 63 0.656 5.731 -9.598 1.00 0.00 N ATOM 898 CA TYR A 63 0.230 7.126 -9.608 1.00 0.00 C ATOM 899 C TYR A 63 -0.581 7.438 -10.862 1.00 0.00 C ATOM 900 O TYR A 63 -0.056 7.421 -11.975 1.00 0.00 O ATOM 901 CB TYR A 63 1.445 8.052 -9.529 1.00 0.00 C ATOM 902 CG TYR A 63 2.212 7.936 -8.232 1.00 0.00 C ATOM 903 CD1 TYR A 63 1.558 7.999 -7.007 1.00 0.00 C ATOM 904 CD2 TYR A 63 3.591 7.763 -8.230 1.00 0.00 C ATOM 905 CE1 TYR A 63 2.255 7.894 -5.819 1.00 0.00 C ATOM 906 CE2 TYR A 63 4.296 7.655 -7.047 1.00 0.00 C ATOM 907 CZ TYR A 63 3.624 7.722 -5.844 1.00 0.00 C ATOM 908 OH TYR A 63 4.321 7.616 -4.663 1.00 0.00 O ATOM 0 H TYR A 63 1.551 5.560 -10.057 1.00 0.00 H new ATOM 0 HA TYR A 63 -0.403 7.293 -8.737 1.00 0.00 H new ATOM 0 HB2 TYR A 63 2.116 7.829 -10.359 1.00 0.00 H new ATOM 0 HB3 TYR A 63 1.114 9.083 -9.655 1.00 0.00 H new ATOM 0 HD1 TYR A 63 0.487 8.132 -6.984 1.00 0.00 H new ATOM 0 HD2 TYR A 63 4.121 7.712 -9.170 1.00 0.00 H new ATOM 0 HE1 TYR A 63 1.731 7.946 -4.876 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.367 7.519 -7.064 1.00 0.00 H new ATOM 0 HH TYR A 63 5.218 7.264 -4.843 1.00 0.00 H new ATOM 918 N SER A 64 -1.865 7.723 -10.672 1.00 0.00 N ATOM 919 CA SER A 64 -2.752 8.036 -11.787 1.00 0.00 C ATOM 920 C SER A 64 -2.487 9.444 -12.312 1.00 0.00 C ATOM 921 O SER A 64 -1.616 10.152 -11.808 1.00 0.00 O ATOM 922 CB SER A 64 -4.214 7.907 -11.355 1.00 0.00 C ATOM 923 OG SER A 64 -4.612 9.013 -10.564 1.00 0.00 O ATOM 0 H SER A 64 -2.315 7.744 -9.757 1.00 0.00 H new ATOM 0 HA SER A 64 -2.554 7.324 -12.588 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.852 7.838 -12.236 1.00 0.00 H new ATOM 0 HB3 SER A 64 -4.349 6.985 -10.790 1.00 0.00 H new ATOM 0 HG SER A 64 -5.550 8.907 -10.302 1.00 0.00 H new ATOM 929 N GLU A 65 -3.247 9.842 -13.328 1.00 0.00 N ATOM 930 CA GLU A 65 -3.094 11.165 -13.922 1.00 0.00 C ATOM 931 C GLU A 65 -3.423 12.258 -12.910 1.00 0.00 C ATOM 932 O GLU A 65 -3.079 13.424 -13.103 1.00 0.00 O ATOM 933 CB GLU A 65 -3.996 11.304 -15.151 1.00 0.00 C ATOM 934 CG GLU A 65 -5.445 10.931 -14.886 1.00 0.00 C ATOM 935 CD GLU A 65 -6.333 11.147 -16.097 1.00 0.00 C ATOM 936 OE1 GLU A 65 -5.992 12.004 -16.939 1.00 0.00 O ATOM 937 OE2 GLU A 65 -7.370 10.459 -16.202 1.00 0.00 O ATOM 0 H GLU A 65 -3.974 9.268 -13.756 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.054 11.279 -14.228 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.954 12.333 -15.508 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.607 10.673 -15.950 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -5.498 9.885 -14.583 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -5.822 11.524 -14.053 1.00 0.00 H new ATOM 944 N LYS A 66 -4.093 11.872 -11.829 1.00 0.00 N ATOM 945 CA LYS A 66 -4.470 12.817 -10.784 1.00 0.00 C ATOM 946 C LYS A 66 -4.088 12.285 -9.406 1.00 0.00 C ATOM 947 O LYS A 66 -4.750 11.398 -8.867 1.00 0.00 O ATOM 948 CB LYS A 66 -5.974 13.094 -10.837 1.00 0.00 C ATOM 949 CG LYS A 66 -6.408 13.863 -12.072 1.00 0.00 C ATOM 950 CD LYS A 66 -7.838 14.363 -11.945 1.00 0.00 C ATOM 951 CE LYS A 66 -8.049 15.653 -12.722 1.00 0.00 C ATOM 952 NZ LYS A 66 -7.817 15.466 -14.181 1.00 0.00 N ATOM 0 H LYS A 66 -4.386 10.911 -11.654 1.00 0.00 H new ATOM 0 HA LYS A 66 -3.929 13.747 -10.957 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -6.511 12.146 -10.802 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -6.263 13.656 -9.949 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -5.739 14.709 -12.229 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -6.322 13.222 -12.949 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -8.525 13.600 -12.311 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -8.075 14.527 -10.894 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -9.065 16.013 -12.559 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -7.374 16.420 -12.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -8.069 16.339 -14.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -6.814 15.246 -14.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -8.406 14.682 -14.529 1.00 0.00 H new ATOM 966 N TYR A 67 -3.018 12.833 -8.842 1.00 0.00 N ATOM 967 CA TYR A 67 -2.548 12.413 -7.527 1.00 0.00 C ATOM 968 C TYR A 67 -1.430 13.325 -7.031 1.00 0.00 C ATOM 969 O TYR A 67 -0.560 13.754 -7.789 1.00 0.00 O ATOM 970 CB TYR A 67 -2.055 10.965 -7.577 1.00 0.00 C ATOM 971 CG TYR A 67 -1.387 10.509 -6.300 1.00 0.00 C ATOM 972 CD1 TYR A 67 -0.045 10.779 -6.060 1.00 0.00 C ATOM 973 CD2 TYR A 67 -2.096 9.807 -5.334 1.00 0.00 C ATOM 974 CE1 TYR A 67 0.571 10.364 -4.895 1.00 0.00 C ATOM 975 CE2 TYR A 67 -1.489 9.389 -4.165 1.00 0.00 C ATOM 976 CZ TYR A 67 -0.156 9.669 -3.951 1.00 0.00 C ATOM 977 OH TYR A 67 0.452 9.253 -2.789 1.00 0.00 O ATOM 0 H TYR A 67 -2.460 13.569 -9.274 1.00 0.00 H new ATOM 0 HA TYR A 67 -3.384 12.482 -6.831 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -2.900 10.310 -7.790 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -1.352 10.858 -8.403 1.00 0.00 H new ATOM 0 HD1 TYR A 67 0.527 11.323 -6.797 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -3.140 9.584 -5.499 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.615 10.582 -4.725 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.056 8.846 -3.423 1.00 0.00 H new ATOM 0 HH TYR A 67 1.403 9.487 -2.815 1.00 0.00 H new ATOM 987 N PRO A 68 -1.453 13.630 -5.725 1.00 0.00 N ATOM 988 CA PRO A 68 -2.484 13.127 -4.812 1.00 0.00 C ATOM 989 C PRO A 68 -3.850 13.748 -5.081 1.00 0.00 C ATOM 990 O PRO A 68 -4.840 13.396 -4.440 1.00 0.00 O ATOM 991 CB PRO A 68 -1.970 13.543 -3.432 1.00 0.00 C ATOM 992 CG PRO A 68 -1.101 14.725 -3.692 1.00 0.00 C ATOM 993 CD PRO A 68 -0.475 14.490 -5.038 1.00 0.00 C ATOM 0 HA PRO A 68 -2.634 12.053 -4.920 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -2.792 13.796 -2.763 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -1.410 12.737 -2.958 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -1.684 15.646 -3.688 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.339 14.827 -2.919 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -0.315 15.425 -5.575 1.00 0.00 H new ATOM 0 HD3 PRO A 68 0.496 14.003 -4.950 1.00 0.00 H new ATOM 1001 N ASP A 69 -3.897 14.673 -6.034 1.00 0.00 N ATOM 1002 CA ASP A 69 -5.143 15.343 -6.389 1.00 0.00 C ATOM 1003 C ASP A 69 -6.326 14.387 -6.273 1.00 0.00 C ATOM 1004 O ASP A 69 -7.379 14.749 -5.752 1.00 0.00 O ATOM 1005 CB ASP A 69 -5.059 15.901 -7.810 1.00 0.00 C ATOM 1006 CG ASP A 69 -6.410 16.338 -8.341 1.00 0.00 C ATOM 1007 OD1 ASP A 69 -7.173 16.968 -7.578 1.00 0.00 O ATOM 1008 OD2 ASP A 69 -6.705 16.050 -9.520 1.00 0.00 O ATOM 0 H ASP A 69 -3.087 14.976 -6.574 1.00 0.00 H new ATOM 0 HA ASP A 69 -5.296 16.167 -5.692 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -4.375 16.749 -7.824 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -4.640 15.142 -8.471 1.00 0.00 H new ATOM 1013 N GLU A 70 -6.143 13.165 -6.765 1.00 0.00 N ATOM 1014 CA GLU A 70 -7.196 12.158 -6.718 1.00 0.00 C ATOM 1015 C GLU A 70 -6.688 10.868 -6.081 1.00 0.00 C ATOM 1016 O GLU A 70 -5.500 10.734 -5.789 1.00 0.00 O ATOM 1017 CB GLU A 70 -7.722 11.872 -8.126 1.00 0.00 C ATOM 1018 CG GLU A 70 -8.767 12.869 -8.600 1.00 0.00 C ATOM 1019 CD GLU A 70 -9.670 12.299 -9.677 1.00 0.00 C ATOM 1020 OE1 GLU A 70 -10.077 11.125 -9.549 1.00 0.00 O ATOM 1021 OE2 GLU A 70 -9.970 13.027 -10.646 1.00 0.00 O ATOM 0 H GLU A 70 -5.276 12.849 -7.200 1.00 0.00 H new ATOM 0 HA GLU A 70 -8.009 12.549 -6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -6.886 11.875 -8.825 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -8.151 10.870 -8.148 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -9.374 13.185 -7.751 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.268 13.759 -8.983 1.00 0.00 H new ATOM 1028 N ALA A 71 -7.597 9.922 -5.869 1.00 0.00 N ATOM 1029 CA ALA A 71 -7.241 8.642 -5.269 1.00 0.00 C ATOM 1030 C ALA A 71 -6.301 7.853 -6.174 1.00 0.00 C ATOM 1031 O ALA A 71 -6.512 7.741 -7.382 1.00 0.00 O ATOM 1032 CB ALA A 71 -8.494 7.832 -4.972 1.00 0.00 C ATOM 0 H ALA A 71 -8.585 10.018 -6.104 1.00 0.00 H new ATOM 0 HA ALA A 71 -6.719 8.841 -4.333 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -8.213 6.879 -4.524 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -9.129 8.385 -4.280 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -9.039 7.651 -5.899 1.00 0.00 H new ATOM 1038 N PRO A 72 -5.236 7.294 -5.579 1.00 0.00 N ATOM 1039 CA PRO A 72 -4.242 6.507 -6.314 1.00 0.00 C ATOM 1040 C PRO A 72 -4.800 5.170 -6.792 1.00 0.00 C ATOM 1041 O PRO A 72 -5.981 4.877 -6.607 1.00 0.00 O ATOM 1042 CB PRO A 72 -3.133 6.285 -5.283 1.00 0.00 C ATOM 1043 CG PRO A 72 -3.817 6.384 -3.963 1.00 0.00 C ATOM 1044 CD PRO A 72 -4.922 7.388 -4.144 1.00 0.00 C ATOM 0 HA PRO A 72 -3.907 7.015 -7.218 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -2.662 5.311 -5.412 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.347 7.035 -5.379 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -4.215 5.417 -3.656 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -3.122 6.704 -3.186 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -5.788 7.148 -3.527 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -4.602 8.393 -3.868 1.00 0.00 H new ATOM 1052 N LEU A 73 -3.943 4.363 -7.408 1.00 0.00 N ATOM 1053 CA LEU A 73 -4.350 3.057 -7.913 1.00 0.00 C ATOM 1054 C LEU A 73 -3.744 1.936 -7.074 1.00 0.00 C ATOM 1055 O LEU A 73 -2.526 1.854 -6.916 1.00 0.00 O ATOM 1056 CB LEU A 73 -3.928 2.899 -9.375 1.00 0.00 C ATOM 1057 CG LEU A 73 -4.757 3.674 -10.400 1.00 0.00 C ATOM 1058 CD1 LEU A 73 -4.106 3.609 -11.773 1.00 0.00 C ATOM 1059 CD2 LEU A 73 -6.178 3.133 -10.455 1.00 0.00 C ATOM 0 H LEU A 73 -2.962 4.590 -7.570 1.00 0.00 H new ATOM 0 HA LEU A 73 -5.436 2.991 -7.845 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -2.888 3.211 -9.468 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -3.967 1.840 -9.631 1.00 0.00 H new ATOM 0 HG LEU A 73 -4.799 4.718 -10.090 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -4.710 4.166 -12.489 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.108 4.045 -11.724 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -4.032 2.569 -12.092 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -6.754 3.696 -11.190 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.156 2.081 -10.740 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -6.644 3.233 -9.475 1.00 0.00 H new ATOM 1071 N TYR A 74 -4.603 1.074 -6.540 1.00 0.00 N ATOM 1072 CA TYR A 74 -4.153 -0.042 -5.717 1.00 0.00 C ATOM 1073 C TYR A 74 -4.679 -1.367 -6.261 1.00 0.00 C ATOM 1074 O TYR A 74 -5.792 -1.438 -6.782 1.00 0.00 O ATOM 1075 CB TYR A 74 -4.612 0.146 -4.270 1.00 0.00 C ATOM 1076 CG TYR A 74 -6.085 0.463 -4.139 1.00 0.00 C ATOM 1077 CD1 TYR A 74 -6.556 1.757 -4.320 1.00 0.00 C ATOM 1078 CD2 TYR A 74 -7.005 -0.532 -3.832 1.00 0.00 C ATOM 1079 CE1 TYR A 74 -7.901 2.051 -4.200 1.00 0.00 C ATOM 1080 CE2 TYR A 74 -8.351 -0.248 -3.712 1.00 0.00 C ATOM 1081 CZ TYR A 74 -8.794 1.045 -3.897 1.00 0.00 C ATOM 1082 OH TYR A 74 -10.135 1.333 -3.776 1.00 0.00 O ATOM 0 H TYR A 74 -5.614 1.127 -6.663 1.00 0.00 H new ATOM 0 HA TYR A 74 -3.064 -0.065 -5.745 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -4.393 -0.761 -3.707 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.034 0.951 -3.816 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.859 2.547 -4.559 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -6.661 -1.545 -3.685 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -8.251 3.063 -4.343 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -9.053 -1.034 -3.475 1.00 0.00 H new ATOM 0 HH TYR A 74 -10.627 0.514 -3.561 1.00 0.00 H new ATOM 1092 N GLU A 75 -3.870 -2.414 -6.135 1.00 0.00 N ATOM 1093 CA GLU A 75 -4.253 -3.737 -6.614 1.00 0.00 C ATOM 1094 C GLU A 75 -3.357 -4.815 -6.011 1.00 0.00 C ATOM 1095 O GLU A 75 -2.152 -4.618 -5.853 1.00 0.00 O ATOM 1096 CB GLU A 75 -4.179 -3.792 -8.141 1.00 0.00 C ATOM 1097 CG GLU A 75 -2.759 -3.789 -8.682 1.00 0.00 C ATOM 1098 CD GLU A 75 -2.681 -4.267 -10.119 1.00 0.00 C ATOM 1099 OE1 GLU A 75 -3.166 -5.382 -10.401 1.00 0.00 O ATOM 1100 OE2 GLU A 75 -2.134 -3.525 -10.961 1.00 0.00 O ATOM 0 H GLU A 75 -2.946 -2.372 -5.706 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.280 -3.925 -6.300 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.690 -4.690 -8.489 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.718 -2.939 -8.553 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.351 -2.780 -8.616 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.135 -4.427 -8.056 1.00 0.00 H new ATOM 1107 N ILE A 76 -3.955 -5.953 -5.675 1.00 0.00 N ATOM 1108 CA ILE A 76 -3.212 -7.062 -5.090 1.00 0.00 C ATOM 1109 C ILE A 76 -2.777 -8.058 -6.160 1.00 0.00 C ATOM 1110 O ILE A 76 -3.522 -8.974 -6.509 1.00 0.00 O ATOM 1111 CB ILE A 76 -4.046 -7.799 -4.026 1.00 0.00 C ATOM 1112 CG1 ILE A 76 -4.259 -6.905 -2.803 1.00 0.00 C ATOM 1113 CG2 ILE A 76 -3.363 -9.099 -3.626 1.00 0.00 C ATOM 1114 CD1 ILE A 76 -5.029 -7.578 -1.689 1.00 0.00 C ATOM 0 H ILE A 76 -4.952 -6.131 -5.798 1.00 0.00 H new ATOM 0 HA ILE A 76 -2.329 -6.635 -4.615 1.00 0.00 H new ATOM 0 HB ILE A 76 -5.021 -8.038 -4.451 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -3.288 -6.587 -2.422 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -4.792 -6.005 -3.110 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -3.964 -9.609 -2.873 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -3.258 -9.739 -4.502 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -2.377 -8.881 -3.216 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -5.142 -6.885 -0.855 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -6.014 -7.872 -2.053 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -4.487 -8.463 -1.355 1.00 0.00 H new ATOM 1126 N PHE A 77 -1.567 -7.873 -6.676 1.00 0.00 N ATOM 1127 CA PHE A 77 -1.032 -8.756 -7.706 1.00 0.00 C ATOM 1128 C PHE A 77 -1.104 -10.214 -7.263 1.00 0.00 C ATOM 1129 O PHE A 77 -1.587 -11.075 -7.999 1.00 0.00 O ATOM 1130 CB PHE A 77 0.415 -8.380 -8.030 1.00 0.00 C ATOM 1131 CG PHE A 77 0.913 -8.964 -9.320 1.00 0.00 C ATOM 1132 CD1 PHE A 77 1.052 -10.335 -9.467 1.00 0.00 C ATOM 1133 CD2 PHE A 77 1.242 -8.143 -10.387 1.00 0.00 C ATOM 1134 CE1 PHE A 77 1.509 -10.877 -10.654 1.00 0.00 C ATOM 1135 CE2 PHE A 77 1.699 -8.679 -11.576 1.00 0.00 C ATOM 1136 CZ PHE A 77 1.834 -10.047 -11.709 1.00 0.00 C ATOM 0 H PHE A 77 -0.938 -7.120 -6.398 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.640 -8.637 -8.603 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.498 -7.294 -8.077 1.00 0.00 H new ATOM 0 HB3 PHE A 77 1.059 -8.714 -7.217 1.00 0.00 H new ATOM 0 HD1 PHE A 77 0.800 -10.988 -8.644 1.00 0.00 H new ATOM 0 HD2 PHE A 77 1.140 -7.072 -10.288 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.612 -11.947 -10.756 1.00 0.00 H new ATOM 0 HE2 PHE A 77 1.950 -8.029 -12.401 1.00 0.00 H new ATOM 0 HZ PHE A 77 2.193 -10.467 -12.637 1.00 0.00 H new ATOM 1146 N SER A 78 -0.618 -10.484 -6.056 1.00 0.00 N ATOM 1147 CA SER A 78 -0.622 -11.839 -5.516 1.00 0.00 C ATOM 1148 C SER A 78 -0.850 -11.821 -4.007 1.00 0.00 C ATOM 1149 O SER A 78 -0.491 -10.861 -3.326 1.00 0.00 O ATOM 1150 CB SER A 78 0.699 -12.542 -5.835 1.00 0.00 C ATOM 1151 OG SER A 78 0.684 -13.885 -5.383 1.00 0.00 O ATOM 0 H SER A 78 -0.217 -9.783 -5.433 1.00 0.00 H new ATOM 0 HA SER A 78 -1.439 -12.388 -5.984 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.877 -12.519 -6.910 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.523 -12.006 -5.364 1.00 0.00 H new ATOM 0 HG SER A 78 0.830 -13.906 -4.414 1.00 0.00 H new ATOM 1157 N GLN A 79 -1.449 -12.890 -3.493 1.00 0.00 N ATOM 1158 CA GLN A 79 -1.726 -12.998 -2.066 1.00 0.00 C ATOM 1159 C GLN A 79 -1.714 -14.455 -1.617 1.00 0.00 C ATOM 1160 O GLN A 79 -1.708 -15.368 -2.442 1.00 0.00 O ATOM 1161 CB GLN A 79 -3.079 -12.362 -1.738 1.00 0.00 C ATOM 1162 CG GLN A 79 -4.267 -13.222 -2.137 1.00 0.00 C ATOM 1163 CD GLN A 79 -4.577 -13.139 -3.619 1.00 0.00 C ATOM 1164 OE1 GLN A 79 -4.421 -14.115 -4.353 1.00 0.00 O ATOM 1165 NE2 GLN A 79 -5.019 -11.969 -4.067 1.00 0.00 N ATOM 0 H GLN A 79 -1.752 -13.694 -4.044 1.00 0.00 H new ATOM 0 HA GLN A 79 -0.942 -12.465 -1.528 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -3.128 -12.163 -0.667 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -3.151 -11.399 -2.244 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -4.066 -14.259 -1.869 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.143 -12.910 -1.569 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -5.133 -11.186 -3.423 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -5.244 -11.853 -5.055 1.00 0.00 H new ATOM 1174 N GLU A 80 -1.709 -14.665 -0.304 1.00 0.00 N ATOM 1175 CA GLU A 80 -1.696 -16.013 0.253 1.00 0.00 C ATOM 1176 C GLU A 80 -2.403 -16.049 1.605 1.00 0.00 C ATOM 1177 O GLU A 80 -2.231 -15.155 2.431 1.00 0.00 O ATOM 1178 CB GLU A 80 -0.258 -16.512 0.404 1.00 0.00 C ATOM 1179 CG GLU A 80 0.424 -16.813 -0.920 1.00 0.00 C ATOM 1180 CD GLU A 80 1.035 -15.580 -1.556 1.00 0.00 C ATOM 1181 OE1 GLU A 80 1.506 -14.699 -0.806 1.00 0.00 O ATOM 1182 OE2 GLU A 80 1.042 -15.495 -2.801 1.00 0.00 O ATOM 0 H GLU A 80 -1.714 -13.920 0.393 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.230 -16.668 -0.435 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.323 -15.762 0.940 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.258 -17.414 1.017 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.203 -17.559 -0.762 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -0.301 -17.250 -1.607 1.00 0.00 H new ATOM 1189 N ASN A 81 -3.201 -17.090 1.821 1.00 0.00 N ATOM 1190 CA ASN A 81 -3.936 -17.244 3.071 1.00 0.00 C ATOM 1191 C ASN A 81 -4.909 -16.087 3.275 1.00 0.00 C ATOM 1192 O ASN A 81 -5.013 -15.535 4.372 1.00 0.00 O ATOM 1193 CB ASN A 81 -2.965 -17.323 4.251 1.00 0.00 C ATOM 1194 CG ASN A 81 -2.123 -18.584 4.223 1.00 0.00 C ATOM 1195 OD1 ASN A 81 -2.539 -19.610 3.685 1.00 0.00 O ATOM 1196 ND2 ASN A 81 -0.932 -18.513 4.806 1.00 0.00 N ATOM 0 H ASN A 81 -3.355 -17.839 1.146 1.00 0.00 H new ATOM 0 HA ASN A 81 -4.507 -18.171 3.017 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.310 -16.452 4.238 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -3.527 -17.285 5.184 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -0.321 -19.330 4.820 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -0.628 -17.641 5.240 1.00 0.00 H new ATOM 1203 N LEU A 82 -5.620 -15.724 2.213 1.00 0.00 N ATOM 1204 CA LEU A 82 -6.586 -14.633 2.276 1.00 0.00 C ATOM 1205 C LEU A 82 -7.743 -14.875 1.312 1.00 0.00 C ATOM 1206 O LEU A 82 -7.594 -14.726 0.099 1.00 0.00 O ATOM 1207 CB LEU A 82 -5.905 -13.303 1.949 1.00 0.00 C ATOM 1208 CG LEU A 82 -4.694 -12.941 2.809 1.00 0.00 C ATOM 1209 CD1 LEU A 82 -4.034 -11.670 2.295 1.00 0.00 C ATOM 1210 CD2 LEU A 82 -5.103 -12.779 4.266 1.00 0.00 C ATOM 0 H LEU A 82 -5.546 -16.169 1.298 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.984 -14.591 3.290 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -5.591 -13.325 0.905 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.643 -12.507 2.043 1.00 0.00 H new ATOM 0 HG LEU A 82 -3.971 -13.754 2.743 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -3.174 -11.428 2.920 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.705 -11.821 1.267 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -4.750 -10.849 2.330 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -4.228 -12.521 4.863 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -5.846 -11.985 4.349 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.529 -13.714 4.631 1.00 0.00 H new ATOM 1222 N GLU A 83 -8.896 -15.246 1.860 1.00 0.00 N ATOM 1223 CA GLU A 83 -10.079 -15.507 1.048 1.00 0.00 C ATOM 1224 C GLU A 83 -10.691 -14.203 0.545 1.00 0.00 C ATOM 1225 O GLU A 83 -10.209 -13.115 0.861 1.00 0.00 O ATOM 1226 CB GLU A 83 -11.115 -16.293 1.854 1.00 0.00 C ATOM 1227 CG GLU A 83 -11.702 -15.511 3.016 1.00 0.00 C ATOM 1228 CD GLU A 83 -12.787 -16.279 3.746 1.00 0.00 C ATOM 1229 OE1 GLU A 83 -13.821 -16.586 3.117 1.00 0.00 O ATOM 1230 OE2 GLU A 83 -12.603 -16.572 4.946 1.00 0.00 O ATOM 0 H GLU A 83 -9.036 -15.373 2.862 1.00 0.00 H new ATOM 0 HA GLU A 83 -9.774 -16.101 0.187 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.922 -16.601 1.190 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -10.652 -17.203 2.236 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -10.907 -15.257 3.717 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -12.113 -14.571 2.646 1.00 0.00 H new ATOM 1237 N ASP A 84 -11.757 -14.321 -0.239 1.00 0.00 N ATOM 1238 CA ASP A 84 -12.437 -13.153 -0.786 1.00 0.00 C ATOM 1239 C ASP A 84 -12.804 -12.170 0.321 1.00 0.00 C ATOM 1240 O ASP A 84 -12.643 -10.960 0.170 1.00 0.00 O ATOM 1241 CB ASP A 84 -13.694 -13.577 -1.546 1.00 0.00 C ATOM 1242 CG ASP A 84 -14.160 -12.522 -2.530 1.00 0.00 C ATOM 1243 OD1 ASP A 84 -13.318 -12.015 -3.301 1.00 0.00 O ATOM 1244 OD2 ASP A 84 -15.368 -12.203 -2.529 1.00 0.00 O ATOM 0 H ASP A 84 -12.169 -15.214 -0.510 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.755 -12.657 -1.476 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -13.496 -14.506 -2.081 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -14.493 -13.784 -0.834 1.00 0.00 H new ATOM 1249 N ASN A 85 -13.301 -12.700 1.435 1.00 0.00 N ATOM 1250 CA ASN A 85 -13.693 -11.869 2.567 1.00 0.00 C ATOM 1251 C ASN A 85 -12.487 -11.139 3.150 1.00 0.00 C ATOM 1252 O ASN A 85 -12.571 -9.963 3.504 1.00 0.00 O ATOM 1253 CB ASN A 85 -14.357 -12.725 3.648 1.00 0.00 C ATOM 1254 CG ASN A 85 -14.958 -11.887 4.761 1.00 0.00 C ATOM 1255 OD1 ASN A 85 -15.063 -10.666 4.646 1.00 0.00 O ATOM 1256 ND2 ASN A 85 -15.355 -12.542 5.846 1.00 0.00 N ATOM 0 H ASN A 85 -13.441 -13.700 1.577 1.00 0.00 H new ATOM 0 HA ASN A 85 -14.407 -11.126 2.211 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -15.138 -13.336 3.195 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -13.620 -13.409 4.069 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -15.766 -12.032 6.628 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -15.249 -13.555 5.898 1.00 0.00 H new ATOM 1263 N ASP A 86 -11.366 -11.845 3.247 1.00 0.00 N ATOM 1264 CA ASP A 86 -10.141 -11.265 3.786 1.00 0.00 C ATOM 1265 C ASP A 86 -9.628 -10.146 2.884 1.00 0.00 C ATOM 1266 O ASP A 86 -9.338 -9.044 3.349 1.00 0.00 O ATOM 1267 CB ASP A 86 -9.067 -12.342 3.944 1.00 0.00 C ATOM 1268 CG ASP A 86 -9.446 -13.391 4.971 1.00 0.00 C ATOM 1269 OD1 ASP A 86 -10.099 -13.031 5.973 1.00 0.00 O ATOM 1270 OD2 ASP A 86 -9.090 -14.572 4.774 1.00 0.00 O ATOM 0 H ASP A 86 -11.280 -12.820 2.959 1.00 0.00 H new ATOM 0 HA ASP A 86 -10.368 -10.844 4.765 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.896 -12.825 2.982 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.127 -11.874 4.237 1.00 0.00 H new ATOM 1275 N VAL A 87 -9.516 -10.439 1.592 1.00 0.00 N ATOM 1276 CA VAL A 87 -9.038 -9.458 0.625 1.00 0.00 C ATOM 1277 C VAL A 87 -9.974 -8.257 0.551 1.00 0.00 C ATOM 1278 O VAL A 87 -9.577 -7.129 0.843 1.00 0.00 O ATOM 1279 CB VAL A 87 -8.901 -10.075 -0.779 1.00 0.00 C ATOM 1280 CG1 VAL A 87 -8.062 -9.179 -1.678 1.00 0.00 C ATOM 1281 CG2 VAL A 87 -8.299 -11.470 -0.692 1.00 0.00 C ATOM 0 H VAL A 87 -9.750 -11.347 1.191 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.057 -9.129 0.967 1.00 0.00 H new ATOM 0 HB VAL A 87 -9.895 -10.160 -1.217 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -7.977 -9.632 -2.666 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -8.539 -8.203 -1.766 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -7.068 -9.059 -1.247 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.210 -11.891 -1.694 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -7.312 -11.412 -0.233 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -8.944 -12.107 -0.087 1.00 0.00 H new ATOM 1291 N SER A 88 -11.219 -8.507 0.160 1.00 0.00 N ATOM 1292 CA SER A 88 -12.212 -7.446 0.045 1.00 0.00 C ATOM 1293 C SER A 88 -12.162 -6.521 1.257 1.00 0.00 C ATOM 1294 O SER A 88 -12.271 -5.301 1.126 1.00 0.00 O ATOM 1295 CB SER A 88 -13.613 -8.042 -0.098 1.00 0.00 C ATOM 1296 OG SER A 88 -14.610 -7.087 0.224 1.00 0.00 O ATOM 0 H SER A 88 -11.564 -9.436 -0.083 1.00 0.00 H new ATOM 0 HA SER A 88 -11.981 -6.862 -0.846 1.00 0.00 H new ATOM 0 HB2 SER A 88 -13.759 -8.394 -1.119 1.00 0.00 H new ATOM 0 HB3 SER A 88 -13.711 -8.909 0.555 1.00 0.00 H new ATOM 0 HG SER A 88 -15.496 -7.493 0.123 1.00 0.00 H new ATOM 1302 N ASP A 89 -11.996 -7.110 2.436 1.00 0.00 N ATOM 1303 CA ASP A 89 -11.930 -6.340 3.673 1.00 0.00 C ATOM 1304 C ASP A 89 -10.728 -5.401 3.665 1.00 0.00 C ATOM 1305 O ASP A 89 -10.806 -4.272 4.152 1.00 0.00 O ATOM 1306 CB ASP A 89 -11.852 -7.277 4.879 1.00 0.00 C ATOM 1307 CG ASP A 89 -13.178 -7.949 5.176 1.00 0.00 C ATOM 1308 OD1 ASP A 89 -14.228 -7.375 4.818 1.00 0.00 O ATOM 1309 OD2 ASP A 89 -13.166 -9.050 5.766 1.00 0.00 O ATOM 0 H ASP A 89 -11.905 -8.118 2.561 1.00 0.00 H new ATOM 0 HA ASP A 89 -12.837 -5.740 3.747 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -11.095 -8.039 4.695 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -11.530 -6.712 5.754 1.00 0.00 H new ATOM 1314 N ILE A 90 -9.617 -5.874 3.110 1.00 0.00 N ATOM 1315 CA ILE A 90 -8.399 -5.077 3.039 1.00 0.00 C ATOM 1316 C ILE A 90 -8.476 -4.055 1.911 1.00 0.00 C ATOM 1317 O ILE A 90 -7.931 -2.955 2.016 1.00 0.00 O ATOM 1318 CB ILE A 90 -7.157 -5.963 2.830 1.00 0.00 C ATOM 1319 CG1 ILE A 90 -7.011 -6.956 3.985 1.00 0.00 C ATOM 1320 CG2 ILE A 90 -5.908 -5.104 2.701 1.00 0.00 C ATOM 1321 CD1 ILE A 90 -6.041 -8.080 3.697 1.00 0.00 C ATOM 0 H ILE A 90 -9.536 -6.806 2.703 1.00 0.00 H new ATOM 0 HA ILE A 90 -8.307 -4.556 3.992 1.00 0.00 H new ATOM 0 HB ILE A 90 -7.283 -6.526 1.905 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -6.680 -6.420 4.874 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -7.988 -7.380 4.214 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -5.039 -5.745 2.554 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -6.014 -4.434 1.847 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.775 -4.516 3.609 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -5.988 -8.745 4.559 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -6.382 -8.641 2.827 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.053 -7.666 3.497 1.00 0.00 H new ATOM 1333 N LEU A 91 -9.158 -4.423 0.832 1.00 0.00 N ATOM 1334 CA LEU A 91 -9.309 -3.538 -0.318 1.00 0.00 C ATOM 1335 C LEU A 91 -10.225 -2.364 0.016 1.00 0.00 C ATOM 1336 O LEU A 91 -9.854 -1.203 -0.157 1.00 0.00 O ATOM 1337 CB LEU A 91 -9.868 -4.312 -1.513 1.00 0.00 C ATOM 1338 CG LEU A 91 -8.854 -5.126 -2.318 1.00 0.00 C ATOM 1339 CD1 LEU A 91 -7.815 -4.211 -2.949 1.00 0.00 C ATOM 1340 CD2 LEU A 91 -8.184 -6.167 -1.434 1.00 0.00 C ATOM 0 H LEU A 91 -9.616 -5.329 0.729 1.00 0.00 H new ATOM 0 HA LEU A 91 -8.325 -3.146 -0.576 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -10.643 -4.988 -1.152 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -10.351 -3.603 -2.186 1.00 0.00 H new ATOM 0 HG LEU A 91 -9.385 -5.644 -3.117 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -7.102 -4.808 -3.518 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.309 -3.504 -3.615 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.288 -3.665 -2.167 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.466 -6.737 -2.023 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -7.667 -5.669 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -8.939 -6.842 -1.031 1.00 0.00 H new ATOM 1352 N LYS A 92 -11.424 -2.675 0.497 1.00 0.00 N ATOM 1353 CA LYS A 92 -12.393 -1.648 0.859 1.00 0.00 C ATOM 1354 C LYS A 92 -11.786 -0.647 1.837 1.00 0.00 C ATOM 1355 O LYS A 92 -12.037 0.556 1.746 1.00 0.00 O ATOM 1356 CB LYS A 92 -13.639 -2.287 1.476 1.00 0.00 C ATOM 1357 CG LYS A 92 -13.411 -2.840 2.873 1.00 0.00 C ATOM 1358 CD LYS A 92 -14.694 -3.395 3.469 1.00 0.00 C ATOM 1359 CE LYS A 92 -15.495 -2.311 4.174 1.00 0.00 C ATOM 1360 NZ LYS A 92 -14.822 -1.844 5.418 1.00 0.00 N ATOM 0 H LYS A 92 -11.748 -3.631 0.645 1.00 0.00 H new ATOM 0 HA LYS A 92 -12.676 -1.116 -0.049 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -14.437 -1.545 1.514 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -13.983 -3.092 0.827 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -12.656 -3.626 2.836 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -13.020 -2.053 3.518 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -15.299 -3.842 2.680 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -14.454 -4.190 4.176 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -15.636 -1.467 3.499 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -16.486 -2.693 4.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -15.524 -1.409 6.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -14.379 -2.653 5.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -14.092 -1.143 5.176 1.00 0.00 H new ATOM 1374 N LEU A 93 -10.985 -1.149 2.770 1.00 0.00 N ATOM 1375 CA LEU A 93 -10.339 -0.299 3.764 1.00 0.00 C ATOM 1376 C LEU A 93 -9.536 0.811 3.092 1.00 0.00 C ATOM 1377 O LEU A 93 -9.631 1.978 3.473 1.00 0.00 O ATOM 1378 CB LEU A 93 -9.425 -1.134 4.662 1.00 0.00 C ATOM 1379 CG LEU A 93 -8.278 -0.381 5.337 1.00 0.00 C ATOM 1380 CD1 LEU A 93 -7.916 -1.036 6.661 1.00 0.00 C ATOM 1381 CD2 LEU A 93 -7.066 -0.321 4.420 1.00 0.00 C ATOM 0 H LEU A 93 -10.767 -2.141 2.859 1.00 0.00 H new ATOM 0 HA LEU A 93 -11.117 0.159 4.375 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -10.035 -1.597 5.437 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.001 -1.942 4.065 1.00 0.00 H new ATOM 0 HG LEU A 93 -8.607 0.639 5.538 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.098 -0.487 7.127 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.783 -1.025 7.321 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -7.607 -2.066 6.485 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.260 0.219 4.917 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -6.736 -1.333 4.187 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -7.333 0.195 3.498 1.00 0.00 H new ATOM 1393 N LEU A 94 -8.747 0.439 2.090 1.00 0.00 N ATOM 1394 CA LEU A 94 -7.929 1.403 1.363 1.00 0.00 C ATOM 1395 C LEU A 94 -8.789 2.523 0.787 1.00 0.00 C ATOM 1396 O LEU A 94 -8.564 3.700 1.070 1.00 0.00 O ATOM 1397 CB LEU A 94 -7.161 0.705 0.239 1.00 0.00 C ATOM 1398 CG LEU A 94 -6.261 -0.457 0.661 1.00 0.00 C ATOM 1399 CD1 LEU A 94 -5.907 -1.322 -0.539 1.00 0.00 C ATOM 1400 CD2 LEU A 94 -5.001 0.063 1.337 1.00 0.00 C ATOM 0 H LEU A 94 -8.657 -0.523 1.763 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.218 1.840 2.064 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.881 0.334 -0.490 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.547 1.448 -0.270 1.00 0.00 H new ATOM 0 HG LEU A 94 -6.806 -1.072 1.377 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -5.266 -2.144 -0.219 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.819 -1.724 -0.980 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.381 -0.719 -1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.372 -0.778 1.631 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.453 0.701 0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.274 0.638 2.222 1.00 0.00 H new ATOM 1412 N ALA A 95 -9.776 2.149 -0.020 1.00 0.00 N ATOM 1413 CA ALA A 95 -10.673 3.122 -0.632 1.00 0.00 C ATOM 1414 C ALA A 95 -10.983 4.263 0.330 1.00 0.00 C ATOM 1415 O ALA A 95 -10.668 5.422 0.057 1.00 0.00 O ATOM 1416 CB ALA A 95 -11.958 2.444 -1.083 1.00 0.00 C ATOM 0 H ALA A 95 -9.975 1.179 -0.265 1.00 0.00 H new ATOM 0 HA ALA A 95 -10.173 3.543 -1.504 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -12.618 3.182 -1.538 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -11.724 1.668 -1.812 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.454 1.995 -0.222 1.00 0.00 H new ATOM 1422 N LEU A 96 -11.603 3.929 1.456 1.00 0.00 N ATOM 1423 CA LEU A 96 -11.958 4.927 2.459 1.00 0.00 C ATOM 1424 C LEU A 96 -10.734 5.735 2.880 1.00 0.00 C ATOM 1425 O LEU A 96 -10.676 6.946 2.670 1.00 0.00 O ATOM 1426 CB LEU A 96 -12.581 4.251 3.682 1.00 0.00 C ATOM 1427 CG LEU A 96 -14.100 4.078 3.651 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -14.528 2.946 4.572 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -14.793 5.375 4.041 1.00 0.00 C ATOM 0 H LEU A 96 -11.870 2.975 1.698 1.00 0.00 H new ATOM 0 HA LEU A 96 -12.686 5.607 2.017 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -12.126 3.268 3.800 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -12.319 4.832 4.566 1.00 0.00 H new ATOM 0 HG LEU A 96 -14.396 3.823 2.633 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.612 2.838 4.536 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -14.060 2.016 4.248 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -14.219 3.171 5.593 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -15.873 5.233 4.013 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -14.490 5.661 5.048 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -14.513 6.162 3.341 1.00 0.00 H new ATOM 1441 N GLN A 97 -9.758 5.055 3.473 1.00 0.00 N ATOM 1442 CA GLN A 97 -8.535 5.709 3.922 1.00 0.00 C ATOM 1443 C GLN A 97 -8.103 6.791 2.936 1.00 0.00 C ATOM 1444 O GLN A 97 -7.891 7.941 3.316 1.00 0.00 O ATOM 1445 CB GLN A 97 -7.414 4.682 4.092 1.00 0.00 C ATOM 1446 CG GLN A 97 -7.671 3.681 5.207 1.00 0.00 C ATOM 1447 CD GLN A 97 -7.691 4.328 6.579 1.00 0.00 C ATOM 1448 OE1 GLN A 97 -8.726 4.815 7.034 1.00 0.00 O ATOM 1449 NE2 GLN A 97 -6.543 4.335 7.246 1.00 0.00 N ATOM 0 H GLN A 97 -9.791 4.052 3.654 1.00 0.00 H new ATOM 0 HA GLN A 97 -8.737 6.179 4.885 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.281 4.143 3.154 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -6.480 5.206 4.293 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -8.624 3.183 5.030 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -6.900 2.911 5.184 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -5.709 3.920 6.830 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -6.495 4.756 8.174 1.00 0.00 H new ATOM 1458 N ALA A 98 -7.975 6.412 1.669 1.00 0.00 N ATOM 1459 CA ALA A 98 -7.571 7.350 0.629 1.00 0.00 C ATOM 1460 C ALA A 98 -8.603 8.459 0.457 1.00 0.00 C ATOM 1461 O ALA A 98 -8.305 9.634 0.667 1.00 0.00 O ATOM 1462 CB ALA A 98 -7.357 6.617 -0.688 1.00 0.00 C ATOM 0 H ALA A 98 -8.145 5.462 1.338 1.00 0.00 H new ATOM 0 HA ALA A 98 -6.631 7.809 0.935 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -7.056 7.329 -1.456 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.577 5.866 -0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -8.285 6.130 -0.989 1.00 0.00 H new ATOM 1468 N GLU A 99 -9.818 8.076 0.074 1.00 0.00 N ATOM 1469 CA GLU A 99 -10.893 9.040 -0.126 1.00 0.00 C ATOM 1470 C GLU A 99 -10.914 10.074 0.996 1.00 0.00 C ATOM 1471 O GLU A 99 -11.347 11.209 0.800 1.00 0.00 O ATOM 1472 CB GLU A 99 -12.243 8.324 -0.199 1.00 0.00 C ATOM 1473 CG GLU A 99 -13.435 9.267 -0.183 1.00 0.00 C ATOM 1474 CD GLU A 99 -14.642 8.693 -0.898 1.00 0.00 C ATOM 1475 OE1 GLU A 99 -14.740 8.870 -2.131 1.00 0.00 O ATOM 1476 OE2 GLU A 99 -15.489 8.069 -0.226 1.00 0.00 O ATOM 0 H GLU A 99 -10.081 7.107 -0.103 1.00 0.00 H new ATOM 0 HA GLU A 99 -10.712 9.556 -1.069 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -12.278 7.724 -1.108 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.325 7.635 0.641 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -13.702 9.492 0.850 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -13.154 10.210 -0.652 1.00 0.00 H new ATOM 1483 N GLU A 100 -10.442 9.672 2.172 1.00 0.00 N ATOM 1484 CA GLU A 100 -10.408 10.563 3.326 1.00 0.00 C ATOM 1485 C GLU A 100 -9.114 11.370 3.351 1.00 0.00 C ATOM 1486 O GLU A 100 -9.088 12.506 3.823 1.00 0.00 O ATOM 1487 CB GLU A 100 -10.547 9.761 4.622 1.00 0.00 C ATOM 1488 CG GLU A 100 -11.012 10.592 5.805 1.00 0.00 C ATOM 1489 CD GLU A 100 -11.698 9.759 6.870 1.00 0.00 C ATOM 1490 OE1 GLU A 100 -12.888 9.427 6.687 1.00 0.00 O ATOM 1491 OE2 GLU A 100 -11.046 9.440 7.886 1.00 0.00 O ATOM 0 H GLU A 100 -10.078 8.736 2.351 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.246 11.255 3.244 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.253 8.946 4.461 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.586 9.307 4.863 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.155 11.103 6.245 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -11.698 11.364 5.455 1.00 0.00 H new ATOM 1498 N ASN A 101 -8.041 10.774 2.841 1.00 0.00 N ATOM 1499 CA ASN A 101 -6.742 11.437 2.806 1.00 0.00 C ATOM 1500 C ASN A 101 -6.437 11.961 1.406 1.00 0.00 C ATOM 1501 O ASN A 101 -5.277 12.035 0.998 1.00 0.00 O ATOM 1502 CB ASN A 101 -5.642 10.473 3.253 1.00 0.00 C ATOM 1503 CG ASN A 101 -5.807 10.037 4.696 1.00 0.00 C ATOM 1504 OD1 ASN A 101 -5.755 10.857 5.613 1.00 0.00 O ATOM 1505 ND2 ASN A 101 -6.006 8.741 4.904 1.00 0.00 N ATOM 0 H ASN A 101 -8.045 9.833 2.446 1.00 0.00 H new ATOM 0 HA ASN A 101 -6.775 12.283 3.492 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -5.648 9.594 2.608 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -4.671 10.952 3.130 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -6.123 8.389 5.854 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -6.042 8.097 4.114 1.00 0.00 H new ATOM 1512 N LEU A 102 -7.485 12.323 0.674 1.00 0.00 N ATOM 1513 CA LEU A 102 -7.329 12.842 -0.681 1.00 0.00 C ATOM 1514 C LEU A 102 -6.693 14.228 -0.664 1.00 0.00 C ATOM 1515 O LEU A 102 -6.731 14.927 0.347 1.00 0.00 O ATOM 1516 CB LEU A 102 -8.686 12.899 -1.385 1.00 0.00 C ATOM 1517 CG LEU A 102 -9.139 11.612 -2.075 1.00 0.00 C ATOM 1518 CD1 LEU A 102 -10.638 11.643 -2.332 1.00 0.00 C ATOM 1519 CD2 LEU A 102 -8.378 11.409 -3.377 1.00 0.00 C ATOM 0 H LEU A 102 -8.451 12.267 0.995 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.670 12.168 -1.228 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.442 13.180 -0.651 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.653 13.695 -2.129 1.00 0.00 H new ATOM 0 HG LEU A 102 -8.921 10.773 -1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -10.942 10.719 -2.824 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.168 11.741 -1.384 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -10.880 12.491 -2.972 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -8.713 10.488 -3.855 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -8.564 12.252 -4.043 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.310 11.341 -3.168 1.00 0.00 H new ATOM 1531 N GLY A 103 -6.110 14.619 -1.793 1.00 0.00 N ATOM 1532 CA GLY A 103 -5.475 15.921 -1.887 1.00 0.00 C ATOM 1533 C GLY A 103 -3.994 15.869 -1.569 1.00 0.00 C ATOM 1534 O GLY A 103 -3.248 16.789 -1.904 1.00 0.00 O ATOM 0 H GLY A 103 -6.066 14.058 -2.644 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -5.614 16.317 -2.893 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.966 16.612 -1.202 1.00 0.00 H new ATOM 1538 N MET A 104 -3.568 14.791 -0.918 1.00 0.00 N ATOM 1539 CA MET A 104 -2.166 14.624 -0.554 1.00 0.00 C ATOM 1540 C MET A 104 -1.780 13.148 -0.541 1.00 0.00 C ATOM 1541 O MET A 104 -2.644 12.271 -0.504 1.00 0.00 O ATOM 1542 CB MET A 104 -1.895 15.246 0.817 1.00 0.00 C ATOM 1543 CG MET A 104 -2.518 14.473 1.969 1.00 0.00 C ATOM 1544 SD MET A 104 -4.198 15.013 2.339 1.00 0.00 S ATOM 1545 CE MET A 104 -3.942 15.878 3.887 1.00 0.00 C ATOM 0 H MET A 104 -4.173 14.021 -0.632 1.00 0.00 H new ATOM 0 HA MET A 104 -1.559 15.134 -1.302 1.00 0.00 H new ATOM 0 HB2 MET A 104 -0.818 15.308 0.972 1.00 0.00 H new ATOM 0 HB3 MET A 104 -2.278 16.267 0.826 1.00 0.00 H new ATOM 0 HG2 MET A 104 -2.527 13.411 1.726 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.898 14.591 2.858 1.00 0.00 H new ATOM 0 HE1 MET A 104 -4.893 16.272 4.245 1.00 0.00 H new ATOM 0 HE2 MET A 104 -3.533 15.189 4.626 1.00 0.00 H new ATOM 0 HE3 MET A 104 -3.244 16.701 3.733 1.00 0.00 H new ATOM 1555 N VAL A 105 -0.479 12.880 -0.572 1.00 0.00 N ATOM 1556 CA VAL A 105 0.021 11.511 -0.562 1.00 0.00 C ATOM 1557 C VAL A 105 -0.496 10.745 0.650 1.00 0.00 C ATOM 1558 O VAL A 105 -0.448 11.240 1.776 1.00 0.00 O ATOM 1559 CB VAL A 105 1.561 11.475 -0.560 1.00 0.00 C ATOM 1560 CG1 VAL A 105 2.114 12.196 -1.779 1.00 0.00 C ATOM 1561 CG2 VAL A 105 2.105 12.085 0.723 1.00 0.00 C ATOM 0 H VAL A 105 0.249 13.594 -0.604 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.345 11.035 -1.472 1.00 0.00 H new ATOM 0 HB VAL A 105 1.883 10.435 -0.607 1.00 0.00 H new ATOM 0 HG11 VAL A 105 3.203 12.160 -1.760 1.00 0.00 H new ATOM 0 HG12 VAL A 105 1.751 11.711 -2.685 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.785 13.235 -1.767 1.00 0.00 H new ATOM 0 HG21 VAL A 105 3.194 12.052 0.708 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.775 13.121 0.802 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.736 11.520 1.579 1.00 0.00 H new ATOM 1571 N MET A 106 -0.991 9.535 0.413 1.00 0.00 N ATOM 1572 CA MET A 106 -1.516 8.700 1.487 1.00 0.00 C ATOM 1573 C MET A 106 -0.955 7.284 1.398 1.00 0.00 C ATOM 1574 O MET A 106 -1.665 6.309 1.645 1.00 0.00 O ATOM 1575 CB MET A 106 -3.045 8.660 1.430 1.00 0.00 C ATOM 1576 CG MET A 106 -3.589 7.969 0.189 1.00 0.00 C ATOM 1577 SD MET A 106 -3.621 9.053 -1.251 1.00 0.00 S ATOM 1578 CE MET A 106 -5.215 9.843 -1.045 1.00 0.00 C ATOM 0 H MET A 106 -1.040 9.111 -0.513 1.00 0.00 H new ATOM 0 HA MET A 106 -1.206 9.136 2.437 1.00 0.00 H new ATOM 0 HB2 MET A 106 -3.420 8.147 2.316 1.00 0.00 H new ATOM 0 HB3 MET A 106 -3.429 9.680 1.466 1.00 0.00 H new ATOM 0 HG2 MET A 106 -2.977 7.094 -0.033 1.00 0.00 H new ATOM 0 HG3 MET A 106 -4.598 7.609 0.391 1.00 0.00 H new ATOM 0 HE1 MET A 106 -5.929 9.411 -1.746 1.00 0.00 H new ATOM 0 HE2 MET A 106 -5.569 9.688 -0.026 1.00 0.00 H new ATOM 0 HE3 MET A 106 -5.119 10.912 -1.238 1.00 0.00 H new ATOM 1588 N ILE A 107 0.321 7.180 1.045 1.00 0.00 N ATOM 1589 CA ILE A 107 0.977 5.883 0.925 1.00 0.00 C ATOM 1590 C ILE A 107 1.295 5.299 2.297 1.00 0.00 C ATOM 1591 O ILE A 107 0.648 4.352 2.746 1.00 0.00 O ATOM 1592 CB ILE A 107 2.278 5.984 0.108 1.00 0.00 C ATOM 1593 CG1 ILE A 107 2.008 6.648 -1.243 1.00 0.00 C ATOM 1594 CG2 ILE A 107 2.889 4.604 -0.087 1.00 0.00 C ATOM 1595 CD1 ILE A 107 1.192 5.791 -2.186 1.00 0.00 C ATOM 0 H ILE A 107 0.922 7.978 0.837 1.00 0.00 H new ATOM 0 HA ILE A 107 0.282 5.224 0.405 1.00 0.00 H new ATOM 0 HB ILE A 107 2.988 6.601 0.659 1.00 0.00 H new ATOM 0 HG12 ILE A 107 1.486 7.590 -1.078 1.00 0.00 H new ATOM 0 HG13 ILE A 107 2.960 6.890 -1.716 1.00 0.00 H new ATOM 0 HG21 ILE A 107 3.808 4.692 -0.666 1.00 0.00 H new ATOM 0 HG22 ILE A 107 3.113 4.165 0.885 1.00 0.00 H new ATOM 0 HG23 ILE A 107 2.184 3.966 -0.620 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.040 6.325 -3.124 1.00 0.00 H new ATOM 0 HD12 ILE A 107 1.722 4.859 -2.382 1.00 0.00 H new ATOM 0 HD13 ILE A 107 0.225 5.570 -1.733 1.00 0.00 H new ATOM 1607 N PHE A 108 2.294 5.871 2.960 1.00 0.00 N ATOM 1608 CA PHE A 108 2.698 5.408 4.283 1.00 0.00 C ATOM 1609 C PHE A 108 1.479 5.143 5.162 1.00 0.00 C ATOM 1610 O PHE A 108 1.397 4.117 5.839 1.00 0.00 O ATOM 1611 CB PHE A 108 3.608 6.440 4.952 1.00 0.00 C ATOM 1612 CG PHE A 108 4.045 6.047 6.334 1.00 0.00 C ATOM 1613 CD1 PHE A 108 3.245 6.320 7.432 1.00 0.00 C ATOM 1614 CD2 PHE A 108 5.256 5.405 6.536 1.00 0.00 C ATOM 1615 CE1 PHE A 108 3.643 5.960 8.705 1.00 0.00 C ATOM 1616 CE2 PHE A 108 5.660 5.042 7.807 1.00 0.00 C ATOM 1617 CZ PHE A 108 4.853 5.321 8.893 1.00 0.00 C ATOM 0 H PHE A 108 2.839 6.656 2.603 1.00 0.00 H new ATOM 0 HA PHE A 108 3.247 4.474 4.162 1.00 0.00 H new ATOM 0 HB2 PHE A 108 4.490 6.592 4.330 1.00 0.00 H new ATOM 0 HB3 PHE A 108 3.085 7.395 5.003 1.00 0.00 H new ATOM 0 HD1 PHE A 108 2.298 6.821 7.291 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.892 5.186 5.691 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.009 6.178 9.552 1.00 0.00 H new ATOM 0 HE2 PHE A 108 6.606 4.541 7.951 1.00 0.00 H new ATOM 0 HZ PHE A 108 5.168 5.040 9.887 1.00 0.00 H new ATOM 1627 N THR A 109 0.532 6.076 5.147 1.00 0.00 N ATOM 1628 CA THR A 109 -0.682 5.946 5.943 1.00 0.00 C ATOM 1629 C THR A 109 -1.484 4.719 5.526 1.00 0.00 C ATOM 1630 O THR A 109 -1.931 3.939 6.368 1.00 0.00 O ATOM 1631 CB THR A 109 -1.573 7.195 5.817 1.00 0.00 C ATOM 1632 OG1 THR A 109 -2.303 7.402 7.032 1.00 0.00 O ATOM 1633 CG2 THR A 109 -2.544 7.053 4.655 1.00 0.00 C ATOM 0 H THR A 109 0.583 6.930 4.592 1.00 0.00 H new ATOM 0 HA THR A 109 -0.369 5.836 6.981 1.00 0.00 H new ATOM 0 HB THR A 109 -0.929 8.054 5.629 1.00 0.00 H new ATOM 0 HG1 THR A 109 -2.866 8.199 6.944 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.163 7.948 4.586 1.00 0.00 H new ATOM 0 HG22 THR A 109 -1.986 6.926 3.728 1.00 0.00 H new ATOM 0 HG23 THR A 109 -3.181 6.183 4.817 1.00 0.00 H new ATOM 1641 N LEU A 110 -1.664 4.552 4.220 1.00 0.00 N ATOM 1642 CA LEU A 110 -2.413 3.418 3.689 1.00 0.00 C ATOM 1643 C LEU A 110 -1.746 2.100 4.068 1.00 0.00 C ATOM 1644 O LEU A 110 -2.402 1.174 4.546 1.00 0.00 O ATOM 1645 CB LEU A 110 -2.529 3.525 2.168 1.00 0.00 C ATOM 1646 CG LEU A 110 -3.774 4.238 1.638 1.00 0.00 C ATOM 1647 CD1 LEU A 110 -3.888 4.064 0.132 1.00 0.00 C ATOM 1648 CD2 LEU A 110 -5.023 3.717 2.334 1.00 0.00 C ATOM 0 H LEU A 110 -1.301 5.188 3.509 1.00 0.00 H new ATOM 0 HA LEU A 110 -3.412 3.438 4.125 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -1.649 4.046 1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -2.506 2.519 1.750 1.00 0.00 H new ATOM 0 HG LEU A 110 -3.680 5.302 1.853 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -4.780 4.578 -0.227 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -3.007 4.486 -0.351 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -3.960 3.003 -0.107 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -5.899 4.235 1.945 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -5.123 2.647 2.150 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -4.943 3.895 3.406 1.00 0.00 H new ATOM 1660 N VAL A 111 -0.436 2.022 3.854 1.00 0.00 N ATOM 1661 CA VAL A 111 0.321 0.818 4.177 1.00 0.00 C ATOM 1662 C VAL A 111 0.178 0.457 5.651 1.00 0.00 C ATOM 1663 O VAL A 111 0.386 -0.691 6.044 1.00 0.00 O ATOM 1664 CB VAL A 111 1.815 0.989 3.844 1.00 0.00 C ATOM 1665 CG1 VAL A 111 2.607 -0.227 4.300 1.00 0.00 C ATOM 1666 CG2 VAL A 111 2.005 1.231 2.354 1.00 0.00 C ATOM 0 H VAL A 111 0.123 2.778 3.458 1.00 0.00 H new ATOM 0 HA VAL A 111 -0.090 0.013 3.568 1.00 0.00 H new ATOM 0 HB VAL A 111 2.191 1.860 4.381 1.00 0.00 H new ATOM 0 HG11 VAL A 111 3.660 -0.088 4.056 1.00 0.00 H new ATOM 0 HG12 VAL A 111 2.497 -0.350 5.377 1.00 0.00 H new ATOM 0 HG13 VAL A 111 2.232 -1.116 3.794 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.067 1.350 2.137 1.00 0.00 H new ATOM 0 HG22 VAL A 111 1.613 0.382 1.795 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.472 2.135 2.061 1.00 0.00 H new ATOM 1676 N THR A 112 -0.179 1.446 6.465 1.00 0.00 N ATOM 1677 CA THR A 112 -0.350 1.233 7.896 1.00 0.00 C ATOM 1678 C THR A 112 -1.616 0.436 8.187 1.00 0.00 C ATOM 1679 O THR A 112 -1.576 -0.582 8.877 1.00 0.00 O ATOM 1680 CB THR A 112 -0.412 2.570 8.659 1.00 0.00 C ATOM 1681 OG1 THR A 112 0.744 3.360 8.358 1.00 0.00 O ATOM 1682 CG2 THR A 112 -0.493 2.333 10.160 1.00 0.00 C ATOM 0 H THR A 112 -0.355 2.402 6.157 1.00 0.00 H new ATOM 0 HA THR A 112 0.517 0.668 8.237 1.00 0.00 H new ATOM 0 HB THR A 112 -1.309 3.103 8.342 1.00 0.00 H new ATOM 0 HG1 THR A 112 0.740 3.597 7.407 1.00 0.00 H new ATOM 0 HG21 THR A 112 -0.536 3.291 10.678 1.00 0.00 H new ATOM 0 HG22 THR A 112 -1.389 1.756 10.389 1.00 0.00 H new ATOM 0 HG23 THR A 112 0.388 1.782 10.489 1.00 0.00 H new ATOM 1690 N ALA A 113 -2.740 0.906 7.655 1.00 0.00 N ATOM 1691 CA ALA A 113 -4.019 0.235 7.855 1.00 0.00 C ATOM 1692 C ALA A 113 -3.966 -1.206 7.358 1.00 0.00 C ATOM 1693 O ALA A 113 -4.585 -2.097 7.939 1.00 0.00 O ATOM 1694 CB ALA A 113 -5.131 0.998 7.152 1.00 0.00 C ATOM 0 H ALA A 113 -2.791 1.749 7.082 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.228 0.215 8.925 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -6.080 0.486 7.310 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.192 2.008 7.558 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -4.919 1.048 6.084 1.00 0.00 H new ATOM 1700 N VAL A 114 -3.225 -1.427 6.277 1.00 0.00 N ATOM 1701 CA VAL A 114 -3.091 -2.760 5.701 1.00 0.00 C ATOM 1702 C VAL A 114 -2.391 -3.709 6.667 1.00 0.00 C ATOM 1703 O VAL A 114 -2.979 -4.689 7.124 1.00 0.00 O ATOM 1704 CB VAL A 114 -2.307 -2.723 4.376 1.00 0.00 C ATOM 1705 CG1 VAL A 114 -1.957 -4.132 3.923 1.00 0.00 C ATOM 1706 CG2 VAL A 114 -3.103 -1.992 3.306 1.00 0.00 C ATOM 0 H VAL A 114 -2.708 -0.700 5.782 1.00 0.00 H new ATOM 0 HA VAL A 114 -4.100 -3.123 5.507 1.00 0.00 H new ATOM 0 HB VAL A 114 -1.377 -2.178 4.539 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -1.403 -4.086 2.985 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -1.344 -4.617 4.683 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -2.873 -4.705 3.776 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -2.534 -1.976 2.377 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.050 -2.506 3.142 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -3.296 -0.970 3.631 1.00 0.00 H new ATOM 1716 N GLN A 115 -1.133 -3.410 6.974 1.00 0.00 N ATOM 1717 CA GLN A 115 -0.353 -4.237 7.886 1.00 0.00 C ATOM 1718 C GLN A 115 -1.187 -4.652 9.094 1.00 0.00 C ATOM 1719 O GLN A 115 -1.326 -5.839 9.385 1.00 0.00 O ATOM 1720 CB GLN A 115 0.896 -3.485 8.349 1.00 0.00 C ATOM 1721 CG GLN A 115 1.948 -4.383 8.980 1.00 0.00 C ATOM 1722 CD GLN A 115 1.350 -5.405 9.928 1.00 0.00 C ATOM 1723 OE1 GLN A 115 0.632 -5.054 10.864 1.00 0.00 O ATOM 1724 NE2 GLN A 115 1.645 -6.677 9.688 1.00 0.00 N ATOM 0 H GLN A 115 -0.633 -2.602 6.605 1.00 0.00 H new ATOM 0 HA GLN A 115 -0.050 -5.136 7.350 1.00 0.00 H new ATOM 0 HB2 GLN A 115 1.336 -2.968 7.496 1.00 0.00 H new ATOM 0 HB3 GLN A 115 0.604 -2.721 9.069 1.00 0.00 H new ATOM 0 HG2 GLN A 115 2.498 -4.900 8.194 1.00 0.00 H new ATOM 0 HG3 GLN A 115 2.668 -3.769 9.521 1.00 0.00 H new ATOM 0 HE21 GLN A 115 2.245 -6.922 8.900 1.00 0.00 H new ATOM 0 HE22 GLN A 115 1.272 -7.410 10.292 1.00 0.00 H new ATOM 1733 N GLU A 116 -1.740 -3.665 9.792 1.00 0.00 N ATOM 1734 CA GLU A 116 -2.559 -3.928 10.969 1.00 0.00 C ATOM 1735 C GLU A 116 -3.614 -4.990 10.671 1.00 0.00 C ATOM 1736 O GLU A 116 -3.840 -5.899 11.470 1.00 0.00 O ATOM 1737 CB GLU A 116 -3.236 -2.641 11.446 1.00 0.00 C ATOM 1738 CG GLU A 116 -2.364 -1.799 12.362 1.00 0.00 C ATOM 1739 CD GLU A 116 -2.217 -2.402 13.745 1.00 0.00 C ATOM 1740 OE1 GLU A 116 -3.251 -2.609 14.414 1.00 0.00 O ATOM 1741 OE2 GLU A 116 -1.069 -2.667 14.159 1.00 0.00 O ATOM 0 H GLU A 116 -1.636 -2.677 9.563 1.00 0.00 H new ATOM 0 HA GLU A 116 -1.906 -4.300 11.758 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -3.518 -2.045 10.578 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.157 -2.897 11.969 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -1.377 -1.684 11.913 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -2.793 -0.801 12.449 1.00 0.00 H new ATOM 1748 N LYS A 117 -4.259 -4.867 9.515 1.00 0.00 N ATOM 1749 CA LYS A 117 -5.289 -5.815 9.109 1.00 0.00 C ATOM 1750 C LYS A 117 -4.737 -7.236 9.071 1.00 0.00 C ATOM 1751 O LYS A 117 -5.339 -8.161 9.618 1.00 0.00 O ATOM 1752 CB LYS A 117 -5.846 -5.435 7.735 1.00 0.00 C ATOM 1753 CG LYS A 117 -7.271 -5.910 7.504 1.00 0.00 C ATOM 1754 CD LYS A 117 -8.245 -5.230 8.451 1.00 0.00 C ATOM 1755 CE LYS A 117 -9.683 -5.390 7.980 1.00 0.00 C ATOM 1756 NZ LYS A 117 -10.658 -4.993 9.033 1.00 0.00 N ATOM 0 H LYS A 117 -4.086 -4.119 8.843 1.00 0.00 H new ATOM 0 HA LYS A 117 -6.093 -5.777 9.844 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -5.811 -4.351 7.625 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -5.202 -5.855 6.962 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.561 -5.706 6.473 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.322 -6.990 7.641 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.139 -5.653 9.450 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -8.001 -4.170 8.526 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -9.843 -4.783 7.089 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.859 -6.427 7.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -11.626 -5.116 8.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -10.522 -5.589 9.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -10.507 -3.996 9.287 1.00 0.00 H new ATOM 1770 N LEU A 118 -3.590 -7.403 8.423 1.00 0.00 N ATOM 1771 CA LEU A 118 -2.956 -8.712 8.315 1.00 0.00 C ATOM 1772 C LEU A 118 -2.703 -9.310 9.695 1.00 0.00 C ATOM 1773 O LEU A 118 -3.063 -10.456 9.961 1.00 0.00 O ATOM 1774 CB LEU A 118 -1.638 -8.600 7.546 1.00 0.00 C ATOM 1775 CG LEU A 118 -1.735 -8.046 6.124 1.00 0.00 C ATOM 1776 CD1 LEU A 118 -0.348 -7.848 5.533 1.00 0.00 C ATOM 1777 CD2 LEU A 118 -2.563 -8.973 5.246 1.00 0.00 C ATOM 0 H LEU A 118 -3.080 -6.648 7.964 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.632 -9.372 7.772 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.961 -7.965 8.117 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.183 -9.589 7.499 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.232 -7.077 6.165 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -0.437 -7.453 4.521 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.213 -7.145 6.149 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.175 -8.804 5.505 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.621 -8.563 4.238 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -2.094 -9.956 5.211 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.567 -9.064 5.659 1.00 0.00 H new ATOM 1789 N ASN A 119 -2.084 -8.525 10.570 1.00 0.00 N ATOM 1790 CA ASN A 119 -1.785 -8.977 11.925 1.00 0.00 C ATOM 1791 C ASN A 119 -3.058 -9.407 12.648 1.00 0.00 C ATOM 1792 O ASN A 119 -3.006 -10.155 13.623 1.00 0.00 O ATOM 1793 CB ASN A 119 -1.088 -7.867 12.713 1.00 0.00 C ATOM 1794 CG ASN A 119 0.380 -7.738 12.354 1.00 0.00 C ATOM 1795 OD1 ASN A 119 0.939 -8.589 11.662 1.00 0.00 O ATOM 1796 ND2 ASN A 119 1.013 -6.670 12.826 1.00 0.00 N ATOM 0 H ASN A 119 -1.779 -7.573 10.366 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.119 -9.837 11.856 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -1.591 -6.919 12.522 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.182 -8.068 13.780 1.00 0.00 H new ATOM 0 HD21 ASN A 119 2.002 -6.530 12.619 1.00 0.00 H new ATOM 0 HD22 ASN A 119 0.510 -5.990 13.396 1.00 0.00 H new ATOM 1803 N GLU A 120 -4.199 -8.929 12.161 1.00 0.00 N ATOM 1804 CA GLU A 120 -5.485 -9.264 12.762 1.00 0.00 C ATOM 1805 C GLU A 120 -6.025 -10.574 12.196 1.00 0.00 C ATOM 1806 O GLU A 120 -6.669 -11.349 12.903 1.00 0.00 O ATOM 1807 CB GLU A 120 -6.493 -8.138 12.523 1.00 0.00 C ATOM 1808 CG GLU A 120 -6.399 -7.011 13.538 1.00 0.00 C ATOM 1809 CD GLU A 120 -7.067 -7.354 14.855 1.00 0.00 C ATOM 1810 OE1 GLU A 120 -8.310 -7.255 14.933 1.00 0.00 O ATOM 1811 OE2 GLU A 120 -6.348 -7.722 15.808 1.00 0.00 O ATOM 0 H GLU A 120 -4.259 -8.309 11.353 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.335 -9.386 13.835 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -6.339 -7.730 11.524 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -7.501 -8.553 12.546 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -5.350 -6.776 13.718 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.860 -6.115 13.124 1.00 0.00 H new ATOM 1818 N ILE A 121 -5.757 -10.813 10.917 1.00 0.00 N ATOM 1819 CA ILE A 121 -6.216 -12.029 10.256 1.00 0.00 C ATOM 1820 C ILE A 121 -5.331 -13.218 10.615 1.00 0.00 C ATOM 1821 O ILE A 121 -5.814 -14.337 10.782 1.00 0.00 O ATOM 1822 CB ILE A 121 -6.236 -11.864 8.725 1.00 0.00 C ATOM 1823 CG1 ILE A 121 -7.239 -10.781 8.320 1.00 0.00 C ATOM 1824 CG2 ILE A 121 -6.577 -13.186 8.054 1.00 0.00 C ATOM 1825 CD1 ILE A 121 -6.995 -10.217 6.938 1.00 0.00 C ATOM 0 H ILE A 121 -5.225 -10.182 10.318 1.00 0.00 H new ATOM 0 HA ILE A 121 -7.231 -12.215 10.607 1.00 0.00 H new ATOM 0 HB ILE A 121 -5.244 -11.556 8.395 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -8.246 -11.196 8.361 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -7.199 -9.970 9.047 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -6.587 -13.053 6.972 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -5.829 -13.933 8.321 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -7.559 -13.521 8.388 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -7.743 -9.455 6.719 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -6.001 -9.772 6.897 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -7.065 -11.017 6.201 1.00 0.00 H new ATOM 1837 N VAL A 122 -4.031 -12.965 10.736 1.00 0.00 N ATOM 1838 CA VAL A 122 -3.078 -14.014 11.080 1.00 0.00 C ATOM 1839 C VAL A 122 -3.441 -14.674 12.405 1.00 0.00 C ATOM 1840 O VAL A 122 -2.904 -15.726 12.754 1.00 0.00 O ATOM 1841 CB VAL A 122 -1.643 -13.460 11.170 1.00 0.00 C ATOM 1842 CG1 VAL A 122 -1.484 -12.589 12.407 1.00 0.00 C ATOM 1843 CG2 VAL A 122 -0.633 -14.598 11.175 1.00 0.00 C ATOM 0 H VAL A 122 -3.614 -12.044 10.601 1.00 0.00 H new ATOM 0 HA VAL A 122 -3.124 -14.757 10.284 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.454 -12.841 10.293 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.464 -12.207 12.454 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.183 -11.754 12.356 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.691 -13.182 13.298 1.00 0.00 H new ATOM 0 HG21 VAL A 122 0.375 -14.189 11.239 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -0.818 -15.245 12.033 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -0.732 -15.177 10.257 1.00 0.00 H new ATOM 1853 N ASP A 123 -4.355 -14.049 13.140 1.00 0.00 N ATOM 1854 CA ASP A 123 -4.791 -14.577 14.428 1.00 0.00 C ATOM 1855 C ASP A 123 -6.106 -15.338 14.286 1.00 0.00 C ATOM 1856 O ASP A 123 -6.455 -16.155 15.137 1.00 0.00 O ATOM 1857 CB ASP A 123 -4.951 -13.442 15.440 1.00 0.00 C ATOM 1858 CG ASP A 123 -4.752 -13.908 16.869 1.00 0.00 C ATOM 1859 OD1 ASP A 123 -5.494 -14.812 17.306 1.00 0.00 O ATOM 1860 OD2 ASP A 123 -3.855 -13.368 17.550 1.00 0.00 O ATOM 0 H ASP A 123 -4.808 -13.177 12.866 1.00 0.00 H new ATOM 0 HA ASP A 123 -4.029 -15.269 14.787 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -4.232 -12.654 15.214 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -5.945 -13.006 15.338 1.00 0.00 H new ATOM 1865 N GLN A 124 -6.830 -15.062 13.206 1.00 0.00 N ATOM 1866 CA GLN A 124 -8.107 -15.719 12.954 1.00 0.00 C ATOM 1867 C GLN A 124 -7.917 -16.968 12.100 1.00 0.00 C ATOM 1868 O GLN A 124 -8.819 -17.800 11.990 1.00 0.00 O ATOM 1869 CB GLN A 124 -9.073 -14.756 12.263 1.00 0.00 C ATOM 1870 CG GLN A 124 -8.994 -14.800 10.745 1.00 0.00 C ATOM 1871 CD GLN A 124 -9.782 -13.685 10.087 1.00 0.00 C ATOM 1872 OE1 GLN A 124 -9.594 -12.509 10.399 1.00 0.00 O ATOM 1873 NE2 GLN A 124 -10.672 -14.049 9.171 1.00 0.00 N ATOM 0 H GLN A 124 -6.554 -14.388 12.492 1.00 0.00 H new ATOM 0 HA GLN A 124 -8.529 -16.018 13.914 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -10.091 -14.992 12.573 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -8.864 -13.741 12.600 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -7.951 -14.733 10.437 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -9.369 -15.761 10.393 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -10.795 -15.036 8.943 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -11.232 -13.342 8.695 1.00 0.00 H new