USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 971 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 40 TYR OH : rot -178:sc= 0.897 USER MOD Set 1.2: A 104 CYS SG : rot 138:sc= -1.33 USER MOD Set 1.3: A 107 HIS : no HD1:sc= 0.759 K(o=0.33,f=-1.6) USER MOD Set 2.1: A 11 ASN : amide:sc= -0.0369 K(o=-0.025,f=-1.4) USER MOD Set 2.2: A 13 SER OG : rot 171:sc= 0.0116 USER MOD Single : A 15 ASN : amide:sc= -0.0183 X(o=-0.018,f=0) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 23 TYR OH : rot 157:sc= 1.21 USER MOD Single : A 28 THR OG1 : rot 87:sc= 1.17 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc=-0.00625 USER MOD Single : A 33 THR OG1 : rot -12:sc= 0.18 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.151 USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.191 X(o=-0.19,f=-0.58) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 151:sc= -0.0997 (180deg=-0.592) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 66 SER OG : rot 180:sc= 0.0585 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl -167:sc= -4.62! (180deg=-5.62!) USER MOD Single : A 71 TYR OH : rot 80:sc= -0.232 USER MOD Single : A 74 CYS SG : rot -3:sc= 0.613 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -1.67 X(o=-1.7,f=-2.1) USER MOD Single : A 81 SER OG : rot 158:sc= -0.363 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.226 K(o=-0.23,f=-2.3!) USER MOD Single : A 92 THR OG1 : rot 61:sc= 0.567 USER MOD Single : A 97 ASN : amide:sc= -1.42 K(o=-1.4,f=-3.4!) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 MET CE :methyl 153:sc= -1.6 (180deg=-2.9!) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 HIS : no HD1:sc= -0.744 X(o=-0.74,f=-0.65) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -0.662 K(o=-0.66,f=-2.6!) USER MOD Single : A 134 CYS SG : rot 153:sc= 0.167 USER MOD Single : A 136 MET CE :methyl -112:sc= -0.496 (180deg=-3.79!) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= -0.0341 (180deg=-0.0341) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 93 N ALA A 10 11.253 -15.034 0.931 1.00 0.00 N ATOM 94 CA ALA A 10 10.684 -16.002 0.002 1.00 0.00 C ATOM 95 C ALA A 10 9.477 -15.419 -0.727 1.00 0.00 C ATOM 96 O ALA A 10 8.720 -14.631 -0.162 1.00 0.00 O ATOM 97 CB ALA A 10 10.293 -17.275 0.738 1.00 0.00 C ATOM 0 HA ALA A 10 11.444 -16.244 -0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 10 9.870 -17.989 0.031 1.00 0.00 H new ATOM 0 HB2 ALA A 10 11.176 -17.710 1.207 1.00 0.00 H new ATOM 0 HB3 ALA A 10 9.553 -17.040 1.503 1.00 0.00 H new ATOM 103 N ASN A 11 9.306 -15.812 -1.985 1.00 0.00 N ATOM 104 CA ASN A 11 8.192 -15.327 -2.792 1.00 0.00 C ATOM 105 C ASN A 11 7.075 -16.364 -2.857 1.00 0.00 C ATOM 106 O ASN A 11 5.991 -16.161 -2.307 1.00 0.00 O ATOM 107 CB ASN A 11 8.669 -14.986 -4.205 1.00 0.00 C ATOM 108 CG ASN A 11 7.706 -14.069 -4.935 1.00 0.00 C ATOM 109 OD1 ASN A 11 7.116 -13.168 -4.338 1.00 0.00 O ATOM 110 ND2 ASN A 11 7.543 -14.295 -6.233 1.00 0.00 N ATOM 0 H ASN A 11 9.924 -16.464 -2.467 1.00 0.00 H new ATOM 0 HA ASN A 11 7.800 -14.426 -2.321 1.00 0.00 H new ATOM 0 HB2 ASN A 11 9.648 -14.510 -4.150 1.00 0.00 H new ATOM 0 HB3 ASN A 11 8.793 -15.906 -4.776 1.00 0.00 H new ATOM 0 HD21 ASN A 11 6.908 -13.710 -6.777 1.00 0.00 H new ATOM 0 HD22 ASN A 11 8.053 -15.053 -6.687 1.00 0.00 H new ATOM 117 N LEU A 12 7.346 -17.476 -3.530 1.00 0.00 N ATOM 118 CA LEU A 12 6.365 -18.547 -3.667 1.00 0.00 C ATOM 119 C LEU A 12 5.113 -18.051 -4.383 1.00 0.00 C ATOM 120 O LEU A 12 4.022 -18.587 -4.191 1.00 0.00 O ATOM 121 CB LEU A 12 5.993 -19.103 -2.291 1.00 0.00 C ATOM 122 CG LEU A 12 7.159 -19.566 -1.416 1.00 0.00 C ATOM 123 CD1 LEU A 12 7.257 -18.711 -0.162 1.00 0.00 C ATOM 124 CD2 LEU A 12 7.001 -21.035 -1.052 1.00 0.00 C ATOM 0 H LEU A 12 8.238 -17.660 -3.990 1.00 0.00 H new ATOM 0 HA LEU A 12 6.812 -19.341 -4.265 1.00 0.00 H new ATOM 0 HB2 LEU A 12 5.440 -18.336 -1.749 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.315 -19.944 -2.433 1.00 0.00 H new ATOM 0 HG LEU A 12 8.083 -19.450 -1.983 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.092 -19.055 0.448 1.00 0.00 H new ATOM 0 HD12 LEU A 12 7.417 -17.670 -0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.332 -18.794 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 12 7.839 -21.348 -0.429 1.00 0.00 H new ATOM 0 HD22 LEU A 12 6.069 -21.176 -0.504 1.00 0.00 H new ATOM 0 HD23 LEU A 12 6.981 -21.635 -1.962 1.00 0.00 H new ATOM 136 N SER A 13 5.279 -17.023 -5.210 1.00 0.00 N ATOM 137 CA SER A 13 4.162 -16.453 -5.954 1.00 0.00 C ATOM 138 C SER A 13 4.082 -17.050 -7.356 1.00 0.00 C ATOM 139 O SER A 13 3.016 -17.478 -7.800 1.00 0.00 O ATOM 140 CB SER A 13 4.304 -14.932 -6.043 1.00 0.00 C ATOM 141 OG SER A 13 4.629 -14.376 -4.780 1.00 0.00 O ATOM 0 H SER A 13 6.176 -16.568 -5.381 1.00 0.00 H new ATOM 0 HA SER A 13 3.242 -16.695 -5.422 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.079 -14.677 -6.766 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.373 -14.497 -6.407 1.00 0.00 H new ATOM 0 HG SER A 13 4.857 -13.429 -4.888 1.00 0.00 H new ATOM 147 N ARG A 14 5.217 -17.076 -8.047 1.00 0.00 N ATOM 148 CA ARG A 14 5.276 -17.619 -9.399 1.00 0.00 C ATOM 149 C ARG A 14 4.674 -19.020 -9.449 1.00 0.00 C ATOM 150 O ARG A 14 3.848 -19.321 -10.309 1.00 0.00 O ATOM 151 CB ARG A 14 6.723 -17.656 -9.894 1.00 0.00 C ATOM 152 CG ARG A 14 7.411 -16.300 -9.867 1.00 0.00 C ATOM 153 CD ARG A 14 8.800 -16.369 -10.481 1.00 0.00 C ATOM 154 NE ARG A 14 8.755 -16.348 -11.940 1.00 0.00 N ATOM 155 CZ ARG A 14 8.596 -15.240 -12.655 1.00 0.00 C ATOM 156 NH1 ARG A 14 8.468 -14.068 -12.048 1.00 0.00 N ATOM 157 NH2 ARG A 14 8.566 -15.302 -13.980 1.00 0.00 N ATOM 0 H ARG A 14 6.108 -16.728 -7.693 1.00 0.00 H new ATOM 0 HA ARG A 14 4.693 -16.968 -10.051 1.00 0.00 H new ATOM 0 HB2 ARG A 14 7.291 -18.354 -9.279 1.00 0.00 H new ATOM 0 HB3 ARG A 14 6.740 -18.042 -10.913 1.00 0.00 H new ATOM 0 HG2 ARG A 14 6.807 -15.573 -10.411 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.484 -15.948 -8.838 1.00 0.00 H new ATOM 0 HD2 ARG A 14 9.396 -15.529 -10.125 1.00 0.00 H new ATOM 0 HD3 ARG A 14 9.299 -17.278 -10.147 1.00 0.00 H new ATOM 0 HE ARG A 14 8.851 -17.233 -12.438 1.00 0.00 H new ATOM 0 HH11 ARG A 14 8.492 -14.016 -11.030 1.00 0.00 H new ATOM 0 HH12 ARG A 14 8.346 -13.219 -12.599 1.00 0.00 H new ATOM 0 HH21 ARG A 14 8.665 -16.201 -14.451 1.00 0.00 H new ATOM 0 HH22 ARG A 14 8.444 -14.450 -14.528 1.00 0.00 H new ATOM 171 N ASN A 15 5.095 -19.872 -8.520 1.00 0.00 N ATOM 172 CA ASN A 15 4.598 -21.242 -8.459 1.00 0.00 C ATOM 173 C ASN A 15 3.686 -21.437 -7.251 1.00 0.00 C ATOM 174 O ASN A 15 3.826 -22.404 -6.503 1.00 0.00 O ATOM 175 CB ASN A 15 5.766 -22.228 -8.394 1.00 0.00 C ATOM 176 CG ASN A 15 6.953 -21.774 -9.222 1.00 0.00 C ATOM 177 OD1 ASN A 15 7.013 -22.020 -10.427 1.00 0.00 O ATOM 178 ND2 ASN A 15 7.903 -21.108 -8.578 1.00 0.00 N ATOM 0 H ASN A 15 5.778 -19.638 -7.800 1.00 0.00 H new ATOM 0 HA ASN A 15 4.020 -21.433 -9.363 1.00 0.00 H new ATOM 0 HB2 ASN A 15 6.076 -22.352 -7.356 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.433 -23.205 -8.746 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.725 -20.777 -9.083 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.811 -20.927 -7.578 1.00 0.00 H new ATOM 185 N GLY A 16 2.750 -20.510 -7.067 1.00 0.00 N ATOM 186 CA GLY A 16 1.829 -20.598 -5.950 1.00 0.00 C ATOM 187 C GLY A 16 1.137 -21.945 -5.873 1.00 0.00 C ATOM 188 O GLY A 16 1.389 -22.745 -4.972 1.00 0.00 O ATOM 0 H GLY A 16 2.614 -19.700 -7.672 1.00 0.00 H new ATOM 0 HA2 GLY A 16 2.371 -20.418 -5.021 1.00 0.00 H new ATOM 0 HA3 GLY A 16 1.079 -19.812 -6.039 1.00 0.00 H new ATOM 192 N PRO A 17 0.241 -22.210 -6.834 1.00 0.00 N ATOM 193 CA PRO A 17 -0.509 -23.468 -6.893 1.00 0.00 C ATOM 194 C PRO A 17 0.402 -24.689 -6.822 1.00 0.00 C ATOM 195 O PRO A 17 0.155 -25.616 -6.052 1.00 0.00 O ATOM 196 CB PRO A 17 -1.209 -23.401 -8.253 1.00 0.00 C ATOM 197 CG PRO A 17 -1.307 -21.946 -8.557 1.00 0.00 C ATOM 198 CD PRO A 17 -0.110 -21.301 -7.939 1.00 0.00 C ATOM 0 HA PRO A 17 -1.193 -23.574 -6.051 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -0.639 -23.928 -9.018 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -2.195 -23.865 -8.214 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -1.327 -21.775 -9.633 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -2.227 -21.526 -8.150 1.00 0.00 H new ATOM 0 HD2 PRO A 17 0.707 -21.204 -8.654 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -0.337 -20.298 -7.577 1.00 0.00 H new ATOM 206 N ALA A 18 1.457 -24.682 -7.631 1.00 0.00 N ATOM 207 CA ALA A 18 2.406 -25.788 -7.658 1.00 0.00 C ATOM 208 C ALA A 18 2.976 -26.057 -6.269 1.00 0.00 C ATOM 209 O ALA A 18 3.035 -27.203 -5.822 1.00 0.00 O ATOM 210 CB ALA A 18 3.528 -25.497 -8.643 1.00 0.00 C ATOM 0 H ALA A 18 1.676 -23.923 -8.276 1.00 0.00 H new ATOM 0 HA ALA A 18 1.874 -26.682 -7.983 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.229 -26.331 -8.653 1.00 0.00 H new ATOM 0 HB2 ALA A 18 3.110 -25.362 -9.641 1.00 0.00 H new ATOM 0 HB3 ALA A 18 4.050 -24.588 -8.342 1.00 0.00 H new ATOM 216 N LEU A 19 3.394 -24.994 -5.591 1.00 0.00 N ATOM 217 CA LEU A 19 3.961 -25.115 -4.252 1.00 0.00 C ATOM 218 C LEU A 19 2.920 -25.636 -3.266 1.00 0.00 C ATOM 219 O LEU A 19 3.204 -26.522 -2.460 1.00 0.00 O ATOM 220 CB LEU A 19 4.496 -23.762 -3.779 1.00 0.00 C ATOM 221 CG LEU A 19 5.743 -23.246 -4.497 1.00 0.00 C ATOM 222 CD1 LEU A 19 5.813 -21.728 -4.420 1.00 0.00 C ATOM 223 CD2 LEU A 19 6.997 -23.870 -3.903 1.00 0.00 C ATOM 0 H LEU A 19 3.351 -24.039 -5.946 1.00 0.00 H new ATOM 0 HA LEU A 19 4.784 -25.829 -4.295 1.00 0.00 H new ATOM 0 HB2 LEU A 19 3.704 -23.021 -3.891 1.00 0.00 H new ATOM 0 HB3 LEU A 19 4.718 -23.833 -2.714 1.00 0.00 H new ATOM 0 HG LEU A 19 5.680 -23.534 -5.546 1.00 0.00 H new ATOM 0 HD11 LEU A 19 6.707 -21.378 -4.936 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.930 -21.299 -4.893 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.853 -21.418 -3.376 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.875 -23.491 -4.426 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.066 -23.613 -2.846 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.950 -24.954 -4.010 1.00 0.00 H new ATOM 235 N GLN A 20 1.714 -25.082 -3.338 1.00 0.00 N ATOM 236 CA GLN A 20 0.631 -25.493 -2.453 1.00 0.00 C ATOM 237 C GLN A 20 0.257 -26.952 -2.690 1.00 0.00 C ATOM 238 O GLN A 20 -0.209 -27.639 -1.782 1.00 0.00 O ATOM 239 CB GLN A 20 -0.593 -24.600 -2.661 1.00 0.00 C ATOM 240 CG GLN A 20 -1.839 -25.099 -1.948 1.00 0.00 C ATOM 241 CD GLN A 20 -2.941 -24.058 -1.901 1.00 0.00 C ATOM 242 OE1 GLN A 20 -2.723 -22.925 -1.471 1.00 0.00 O ATOM 243 NE2 GLN A 20 -4.134 -24.439 -2.344 1.00 0.00 N ATOM 0 H GLN A 20 1.463 -24.348 -4.000 1.00 0.00 H new ATOM 0 HA GLN A 20 0.977 -25.389 -1.425 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -0.362 -23.594 -2.310 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -0.801 -24.525 -3.728 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -2.209 -25.992 -2.453 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -1.578 -25.393 -0.931 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -4.270 -25.388 -2.692 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -4.914 -23.782 -2.336 1.00 0.00 H new ATOM 252 N GLU A 21 0.464 -27.418 -3.918 1.00 0.00 N ATOM 253 CA GLU A 21 0.146 -28.796 -4.275 1.00 0.00 C ATOM 254 C GLU A 21 1.045 -29.774 -3.523 1.00 0.00 C ATOM 255 O GLU A 21 0.568 -30.737 -2.923 1.00 0.00 O ATOM 256 CB GLU A 21 0.298 -29.004 -5.783 1.00 0.00 C ATOM 257 CG GLU A 21 -0.153 -30.375 -6.257 1.00 0.00 C ATOM 258 CD GLU A 21 -0.688 -30.356 -7.676 1.00 0.00 C ATOM 259 OE1 GLU A 21 -0.021 -29.766 -8.552 1.00 0.00 O ATOM 260 OE2 GLU A 21 -1.772 -30.929 -7.910 1.00 0.00 O ATOM 0 H GLU A 21 0.850 -26.862 -4.681 1.00 0.00 H new ATOM 0 HA GLU A 21 -0.889 -28.988 -3.991 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.278 -28.241 -6.306 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.343 -28.860 -6.058 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.685 -31.069 -6.198 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.926 -30.751 -5.587 1.00 0.00 H new ATOM 267 N ALA A 22 2.349 -29.518 -3.560 1.00 0.00 N ATOM 268 CA ALA A 22 3.315 -30.373 -2.882 1.00 0.00 C ATOM 269 C ALA A 22 3.032 -30.442 -1.385 1.00 0.00 C ATOM 270 O ALA A 22 3.459 -31.374 -0.704 1.00 0.00 O ATOM 271 CB ALA A 22 4.730 -29.873 -3.131 1.00 0.00 C ATOM 0 H ALA A 22 2.760 -28.725 -4.053 1.00 0.00 H new ATOM 0 HA ALA A 22 3.220 -31.379 -3.290 1.00 0.00 H new ATOM 0 HB1 ALA A 22 5.441 -30.521 -2.618 1.00 0.00 H new ATOM 0 HB2 ALA A 22 4.936 -29.883 -4.201 1.00 0.00 H new ATOM 0 HB3 ALA A 22 4.828 -28.856 -2.752 1.00 0.00 H new ATOM 277 N TYR A 23 2.310 -29.448 -0.878 1.00 0.00 N ATOM 278 CA TYR A 23 1.972 -29.394 0.539 1.00 0.00 C ATOM 279 C TYR A 23 0.642 -30.091 0.809 1.00 0.00 C ATOM 280 O TYR A 23 0.553 -30.975 1.661 1.00 0.00 O ATOM 281 CB TYR A 23 1.906 -27.942 1.014 1.00 0.00 C ATOM 282 CG TYR A 23 1.278 -27.779 2.380 1.00 0.00 C ATOM 283 CD1 TYR A 23 -0.095 -27.614 2.520 1.00 0.00 C ATOM 284 CD2 TYR A 23 2.057 -27.790 3.530 1.00 0.00 C ATOM 285 CE1 TYR A 23 -0.673 -27.464 3.766 1.00 0.00 C ATOM 286 CE2 TYR A 23 1.488 -27.643 4.780 1.00 0.00 C ATOM 287 CZ TYR A 23 0.123 -27.480 4.892 1.00 0.00 C ATOM 288 OH TYR A 23 -0.448 -27.332 6.136 1.00 0.00 O ATOM 0 H TYR A 23 1.948 -28.669 -1.428 1.00 0.00 H new ATOM 0 HA TYR A 23 2.753 -29.915 1.093 1.00 0.00 H new ATOM 0 HB2 TYR A 23 2.915 -27.530 1.036 1.00 0.00 H new ATOM 0 HB3 TYR A 23 1.338 -27.357 0.290 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -0.721 -27.603 1.640 1.00 0.00 H new ATOM 0 HD2 TYR A 23 3.126 -27.916 3.445 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -1.741 -27.335 3.858 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.108 -27.656 5.664 1.00 0.00 H new ATOM 0 HH TYR A 23 0.143 -27.718 6.815 1.00 0.00 H new ATOM 298 N VAL A 24 -0.390 -29.686 0.077 1.00 0.00 N ATOM 299 CA VAL A 24 -1.716 -30.271 0.235 1.00 0.00 C ATOM 300 C VAL A 24 -1.715 -31.747 -0.148 1.00 0.00 C ATOM 301 O VAL A 24 -2.585 -32.509 0.275 1.00 0.00 O ATOM 302 CB VAL A 24 -2.762 -29.531 -0.621 1.00 0.00 C ATOM 303 CG1 VAL A 24 -2.497 -29.758 -2.102 1.00 0.00 C ATOM 304 CG2 VAL A 24 -4.167 -29.977 -0.248 1.00 0.00 C ATOM 0 H VAL A 24 -0.334 -28.955 -0.632 1.00 0.00 H new ATOM 0 HA VAL A 24 -1.982 -30.172 1.287 1.00 0.00 H new ATOM 0 HB VAL A 24 -2.680 -28.463 -0.421 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -3.246 -29.228 -2.691 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -1.505 -29.385 -2.355 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -2.551 -30.824 -2.322 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -4.893 -29.444 -0.862 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -4.265 -31.049 -0.418 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -4.351 -29.758 0.804 1.00 0.00 H new ATOM 314 N ARG A 25 -0.732 -32.143 -0.949 1.00 0.00 N ATOM 315 CA ARG A 25 -0.617 -33.529 -1.390 1.00 0.00 C ATOM 316 C ARG A 25 -0.126 -34.421 -0.254 1.00 0.00 C ATOM 317 O ARG A 25 -0.711 -35.468 0.025 1.00 0.00 O ATOM 318 CB ARG A 25 0.336 -33.630 -2.582 1.00 0.00 C ATOM 319 CG ARG A 25 -0.331 -33.363 -3.921 1.00 0.00 C ATOM 320 CD ARG A 25 0.649 -33.515 -5.072 1.00 0.00 C ATOM 321 NE ARG A 25 -0.012 -33.420 -6.371 1.00 0.00 N ATOM 322 CZ ARG A 25 0.633 -33.476 -7.531 1.00 0.00 C ATOM 323 NH1 ARG A 25 1.950 -33.626 -7.553 1.00 0.00 N ATOM 324 NH2 ARG A 25 -0.039 -33.382 -8.671 1.00 0.00 N ATOM 0 H ARG A 25 -0.004 -31.525 -1.306 1.00 0.00 H new ATOM 0 HA ARG A 25 -1.606 -33.871 -1.696 1.00 0.00 H new ATOM 0 HB2 ARG A 25 1.152 -32.921 -2.445 1.00 0.00 H new ATOM 0 HB3 ARG A 25 0.779 -34.626 -2.599 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -1.164 -34.053 -4.058 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -0.747 -32.356 -3.927 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.416 -32.744 -4.999 1.00 0.00 H new ATOM 0 HD3 ARG A 25 1.155 -34.477 -4.992 1.00 0.00 H new ATOM 0 HE ARG A 25 -1.025 -33.304 -6.388 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.470 -33.699 -6.678 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.444 -33.669 -8.445 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -1.052 -33.267 -8.658 1.00 0.00 H new ATOM 0 HH22 ARG A 25 0.458 -33.425 -9.561 1.00 0.00 H new ATOM 338 N VAL A 26 0.953 -34.000 0.398 1.00 0.00 N ATOM 339 CA VAL A 26 1.524 -34.761 1.504 1.00 0.00 C ATOM 340 C VAL A 26 0.487 -35.006 2.594 1.00 0.00 C ATOM 341 O VAL A 26 0.387 -36.108 3.134 1.00 0.00 O ATOM 342 CB VAL A 26 2.736 -34.035 2.117 1.00 0.00 C ATOM 343 CG1 VAL A 26 3.295 -34.827 3.290 1.00 0.00 C ATOM 344 CG2 VAL A 26 3.807 -33.803 1.062 1.00 0.00 C ATOM 0 H VAL A 26 1.450 -33.136 0.180 1.00 0.00 H new ATOM 0 HA VAL A 26 1.851 -35.717 1.096 1.00 0.00 H new ATOM 0 HB VAL A 26 2.407 -33.064 2.488 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.151 -34.299 3.711 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.526 -34.938 4.054 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.610 -35.812 2.947 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.656 -33.289 1.512 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.135 -34.761 0.659 1.00 0.00 H new ATOM 0 HG23 VAL A 26 3.398 -33.192 0.257 1.00 0.00 H new ATOM 354 N VAL A 27 -0.284 -33.971 2.914 1.00 0.00 N ATOM 355 CA VAL A 27 -1.316 -34.075 3.939 1.00 0.00 C ATOM 356 C VAL A 27 -2.469 -34.955 3.472 1.00 0.00 C ATOM 357 O VAL A 27 -3.191 -35.535 4.283 1.00 0.00 O ATOM 358 CB VAL A 27 -1.866 -32.688 4.323 1.00 0.00 C ATOM 359 CG1 VAL A 27 -0.748 -31.793 4.836 1.00 0.00 C ATOM 360 CG2 VAL A 27 -2.571 -32.048 3.137 1.00 0.00 C ATOM 0 H VAL A 27 -0.213 -33.051 2.478 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.849 -34.528 4.813 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.594 -32.814 5.124 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.156 -30.818 5.102 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -0.292 -32.248 5.715 1.00 0.00 H new ATOM 0 HG13 VAL A 27 0.006 -31.671 4.059 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -2.953 -31.069 3.426 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.866 -31.934 2.313 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.399 -32.682 2.821 1.00 0.00 H new ATOM 370 N THR A 28 -2.638 -35.052 2.156 1.00 0.00 N ATOM 371 CA THR A 28 -3.704 -35.861 1.580 1.00 0.00 C ATOM 372 C THR A 28 -3.233 -37.287 1.321 1.00 0.00 C ATOM 373 O THR A 28 -2.256 -37.507 0.605 1.00 0.00 O ATOM 374 CB THR A 28 -4.219 -35.254 0.261 1.00 0.00 C ATOM 375 OG1 THR A 28 -4.741 -33.942 0.496 1.00 0.00 O ATOM 376 CG2 THR A 28 -5.298 -36.133 -0.354 1.00 0.00 C ATOM 0 H THR A 28 -2.049 -34.580 1.470 1.00 0.00 H new ATOM 0 HA THR A 28 -4.517 -35.877 2.306 1.00 0.00 H new ATOM 0 HB THR A 28 -3.383 -35.192 -0.436 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.015 -33.286 0.442 1.00 0.00 H new ATOM 0 HG21 THR A 28 -5.646 -35.684 -1.284 1.00 0.00 H new ATOM 0 HG22 THR A 28 -4.888 -37.122 -0.559 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.133 -36.223 0.340 1.00 0.00 H new ATOM 384 N GLU A 29 -3.933 -38.253 1.907 1.00 0.00 N ATOM 385 CA GLU A 29 -3.585 -39.659 1.738 1.00 0.00 C ATOM 386 C GLU A 29 -4.179 -40.215 0.447 1.00 0.00 C ATOM 387 O GLU A 29 -3.692 -41.207 -0.097 1.00 0.00 O ATOM 388 CB GLU A 29 -4.078 -40.476 2.934 1.00 0.00 C ATOM 389 CG GLU A 29 -5.578 -40.385 3.156 1.00 0.00 C ATOM 390 CD GLU A 29 -6.140 -41.609 3.853 1.00 0.00 C ATOM 391 OE1 GLU A 29 -5.354 -42.524 4.173 1.00 0.00 O ATOM 392 OE2 GLU A 29 -7.368 -41.650 4.079 1.00 0.00 O ATOM 0 H GLU A 29 -4.744 -38.088 2.503 1.00 0.00 H new ATOM 0 HA GLU A 29 -2.499 -39.734 1.679 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -3.804 -41.521 2.788 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -3.565 -40.135 3.833 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -5.800 -39.499 3.750 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.077 -40.258 2.195 1.00 0.00 H new ATOM 399 N LYS A 30 -5.234 -39.570 -0.037 1.00 0.00 N ATOM 400 CA LYS A 30 -5.896 -39.998 -1.264 1.00 0.00 C ATOM 401 C LYS A 30 -4.889 -40.160 -2.398 1.00 0.00 C ATOM 402 O LYS A 30 -4.781 -41.230 -2.998 1.00 0.00 O ATOM 403 CB LYS A 30 -6.974 -38.989 -1.666 1.00 0.00 C ATOM 404 CG LYS A 30 -8.242 -39.633 -2.200 1.00 0.00 C ATOM 405 CD LYS A 30 -9.360 -38.616 -2.358 1.00 0.00 C ATOM 406 CE LYS A 30 -9.998 -38.699 -3.736 1.00 0.00 C ATOM 407 NZ LYS A 30 -10.508 -37.376 -4.192 1.00 0.00 N ATOM 0 H LYS A 30 -5.650 -38.748 0.402 1.00 0.00 H new ATOM 0 HA LYS A 30 -6.364 -40.964 -1.076 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -7.225 -38.375 -0.801 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -6.569 -38.320 -2.425 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -8.036 -40.101 -3.163 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -8.562 -40.425 -1.523 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.119 -38.786 -1.594 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -8.966 -37.612 -2.198 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -9.267 -39.073 -4.453 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -10.818 -39.416 -3.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -10.935 -37.475 -5.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -11.224 -37.030 -3.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -9.721 -36.698 -4.238 1.00 0.00 H new ATOM 421 N SER A 31 -4.152 -39.092 -2.686 1.00 0.00 N ATOM 422 CA SER A 31 -3.154 -39.115 -3.749 1.00 0.00 C ATOM 423 C SER A 31 -1.829 -39.671 -3.238 1.00 0.00 C ATOM 424 O SER A 31 -1.576 -39.737 -2.035 1.00 0.00 O ATOM 425 CB SER A 31 -2.947 -37.708 -4.313 1.00 0.00 C ATOM 426 OG SER A 31 -3.422 -37.617 -5.645 1.00 0.00 O ATOM 0 H SER A 31 -4.227 -38.200 -2.198 1.00 0.00 H new ATOM 0 HA SER A 31 -3.519 -39.767 -4.543 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.467 -36.982 -3.688 1.00 0.00 H new ATOM 0 HB3 SER A 31 -1.888 -37.453 -4.283 1.00 0.00 H new ATOM 0 HG SER A 31 -3.280 -36.708 -5.982 1.00 0.00 H new ATOM 432 N PRO A 32 -0.961 -40.082 -4.175 1.00 0.00 N ATOM 433 CA PRO A 32 0.354 -40.640 -3.845 1.00 0.00 C ATOM 434 C PRO A 32 1.377 -39.558 -3.516 1.00 0.00 C ATOM 435 O PRO A 32 1.964 -38.950 -4.412 1.00 0.00 O ATOM 436 CB PRO A 32 0.755 -41.383 -5.122 1.00 0.00 C ATOM 437 CG PRO A 32 0.027 -40.679 -6.214 1.00 0.00 C ATOM 438 CD PRO A 32 -1.196 -40.033 -5.628 1.00 0.00 C ATOM 0 HA PRO A 32 0.316 -41.275 -2.960 1.00 0.00 H new ATOM 0 HB2 PRO A 32 1.833 -41.348 -5.278 1.00 0.00 H new ATOM 0 HB3 PRO A 32 0.474 -42.435 -5.073 1.00 0.00 H new ATOM 0 HG2 PRO A 32 0.669 -39.928 -6.675 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -0.254 -41.383 -6.998 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -1.313 -39.008 -5.979 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -2.103 -40.571 -5.904 1.00 0.00 H new ATOM 446 N THR A 33 1.587 -39.321 -2.224 1.00 0.00 N ATOM 447 CA THR A 33 2.538 -38.312 -1.777 1.00 0.00 C ATOM 448 C THR A 33 2.938 -38.539 -0.324 1.00 0.00 C ATOM 449 O THR A 33 2.196 -38.194 0.596 1.00 0.00 O ATOM 450 CB THR A 33 1.960 -36.891 -1.922 1.00 0.00 C ATOM 451 OG1 THR A 33 1.653 -36.625 -3.295 1.00 0.00 O ATOM 452 CG2 THR A 33 2.943 -35.852 -1.406 1.00 0.00 C ATOM 0 H THR A 33 1.111 -39.815 -1.469 1.00 0.00 H new ATOM 0 HA THR A 33 3.419 -38.405 -2.413 1.00 0.00 H new ATOM 0 HB THR A 33 1.048 -36.831 -1.328 1.00 0.00 H new ATOM 0 HG1 THR A 33 2.050 -37.321 -3.860 1.00 0.00 H new ATOM 0 HG21 THR A 33 2.513 -34.857 -1.519 1.00 0.00 H new ATOM 0 HG22 THR A 33 3.152 -36.040 -0.353 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.870 -35.913 -1.976 1.00 0.00 H new ATOM 460 N ASP A 34 4.116 -39.121 -0.124 1.00 0.00 N ATOM 461 CA ASP A 34 4.616 -39.393 1.219 1.00 0.00 C ATOM 462 C ASP A 34 5.575 -38.298 1.674 1.00 0.00 C ATOM 463 O ASP A 34 5.734 -38.056 2.870 1.00 0.00 O ATOM 464 CB ASP A 34 5.317 -40.752 1.259 1.00 0.00 C ATOM 465 CG ASP A 34 5.292 -41.375 2.641 1.00 0.00 C ATOM 466 OD1 ASP A 34 5.761 -40.721 3.595 1.00 0.00 O ATOM 467 OD2 ASP A 34 4.804 -42.518 2.768 1.00 0.00 O ATOM 0 H ASP A 34 4.742 -39.413 -0.874 1.00 0.00 H new ATOM 0 HA ASP A 34 3.765 -39.411 1.900 1.00 0.00 H new ATOM 0 HB2 ASP A 34 4.836 -41.427 0.551 1.00 0.00 H new ATOM 0 HB3 ASP A 34 6.351 -40.634 0.935 1.00 0.00 H new ATOM 472 N TRP A 35 6.212 -37.640 0.712 1.00 0.00 N ATOM 473 CA TRP A 35 7.157 -36.571 1.014 1.00 0.00 C ATOM 474 C TRP A 35 7.026 -35.429 0.013 1.00 0.00 C ATOM 475 O TRP A 35 6.230 -35.500 -0.923 1.00 0.00 O ATOM 476 CB TRP A 35 8.589 -37.110 1.007 1.00 0.00 C ATOM 477 CG TRP A 35 8.968 -37.770 -0.284 1.00 0.00 C ATOM 478 CD1 TRP A 35 8.708 -39.059 -0.653 1.00 0.00 C ATOM 479 CD2 TRP A 35 9.676 -37.174 -1.376 1.00 0.00 C ATOM 480 NE1 TRP A 35 9.212 -39.301 -1.908 1.00 0.00 N ATOM 481 CE2 TRP A 35 9.811 -38.160 -2.374 1.00 0.00 C ATOM 482 CE3 TRP A 35 10.209 -35.903 -1.609 1.00 0.00 C ATOM 483 CZ2 TRP A 35 10.456 -37.912 -3.582 1.00 0.00 C ATOM 484 CZ3 TRP A 35 10.849 -35.659 -2.809 1.00 0.00 C ATOM 485 CH2 TRP A 35 10.968 -36.659 -3.784 1.00 0.00 C ATOM 0 H TRP A 35 6.091 -37.828 -0.283 1.00 0.00 H new ATOM 0 HA TRP A 35 6.926 -36.187 2.007 1.00 0.00 H new ATOM 0 HB2 TRP A 35 9.279 -36.290 1.204 1.00 0.00 H new ATOM 0 HB3 TRP A 35 8.704 -37.826 1.821 1.00 0.00 H new ATOM 0 HD1 TRP A 35 8.183 -39.782 -0.047 1.00 0.00 H new ATOM 0 HE1 TRP A 35 9.150 -40.186 -2.411 1.00 0.00 H new ATOM 0 HE3 TRP A 35 10.122 -35.126 -0.864 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 10.549 -38.682 -4.334 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 11.265 -34.681 -2.999 1.00 0.00 H new ATOM 0 HH2 TRP A 35 11.473 -36.436 -4.712 1.00 0.00 H new ATOM 496 N ALA A 36 7.811 -34.376 0.216 1.00 0.00 N ATOM 497 CA ALA A 36 7.783 -33.220 -0.672 1.00 0.00 C ATOM 498 C ALA A 36 8.950 -32.281 -0.387 1.00 0.00 C ATOM 499 O ALA A 36 9.074 -31.744 0.714 1.00 0.00 O ATOM 500 CB ALA A 36 6.461 -32.479 -0.532 1.00 0.00 C ATOM 0 H ALA A 36 8.474 -34.300 0.987 1.00 0.00 H new ATOM 0 HA ALA A 36 7.880 -33.578 -1.697 1.00 0.00 H new ATOM 0 HB1 ALA A 36 6.454 -31.618 -1.201 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.640 -33.147 -0.792 1.00 0.00 H new ATOM 0 HB3 ALA A 36 6.341 -32.140 0.497 1.00 0.00 H new ATOM 506 N LEU A 37 9.805 -32.088 -1.386 1.00 0.00 N ATOM 507 CA LEU A 37 10.964 -31.214 -1.243 1.00 0.00 C ATOM 508 C LEU A 37 10.707 -29.857 -1.891 1.00 0.00 C ATOM 509 O LEU A 37 9.914 -29.745 -2.826 1.00 0.00 O ATOM 510 CB LEU A 37 12.199 -31.865 -1.868 1.00 0.00 C ATOM 511 CG LEU A 37 13.443 -31.934 -0.982 1.00 0.00 C ATOM 512 CD1 LEU A 37 13.179 -32.796 0.243 1.00 0.00 C ATOM 513 CD2 LEU A 37 14.629 -32.472 -1.769 1.00 0.00 C ATOM 0 H LEU A 37 9.717 -32.525 -2.303 1.00 0.00 H new ATOM 0 HA LEU A 37 11.142 -31.059 -0.179 1.00 0.00 H new ATOM 0 HB2 LEU A 37 11.937 -32.879 -2.171 1.00 0.00 H new ATOM 0 HB3 LEU A 37 12.454 -31.317 -2.775 1.00 0.00 H new ATOM 0 HG LEU A 37 13.683 -30.925 -0.646 1.00 0.00 H new ATOM 0 HD11 LEU A 37 14.076 -32.833 0.862 1.00 0.00 H new ATOM 0 HD12 LEU A 37 12.358 -32.368 0.819 1.00 0.00 H new ATOM 0 HD13 LEU A 37 12.914 -33.805 -0.072 1.00 0.00 H new ATOM 0 HD21 LEU A 37 15.506 -32.514 -1.123 1.00 0.00 H new ATOM 0 HD22 LEU A 37 14.399 -33.473 -2.135 1.00 0.00 H new ATOM 0 HD23 LEU A 37 14.833 -31.815 -2.614 1.00 0.00 H new ATOM 525 N PHE A 38 11.383 -28.830 -1.390 1.00 0.00 N ATOM 526 CA PHE A 38 11.229 -27.480 -1.921 1.00 0.00 C ATOM 527 C PHE A 38 12.570 -26.753 -1.955 1.00 0.00 C ATOM 528 O PHE A 38 13.226 -26.585 -0.926 1.00 0.00 O ATOM 529 CB PHE A 38 10.228 -26.689 -1.077 1.00 0.00 C ATOM 530 CG PHE A 38 8.888 -27.356 -0.954 1.00 0.00 C ATOM 531 CD1 PHE A 38 8.688 -28.375 -0.037 1.00 0.00 C ATOM 532 CD2 PHE A 38 7.827 -26.964 -1.755 1.00 0.00 C ATOM 533 CE1 PHE A 38 7.456 -28.991 0.077 1.00 0.00 C ATOM 534 CE2 PHE A 38 6.593 -27.576 -1.645 1.00 0.00 C ATOM 535 CZ PHE A 38 6.407 -28.590 -0.727 1.00 0.00 C ATOM 0 H PHE A 38 12.043 -28.906 -0.616 1.00 0.00 H new ATOM 0 HA PHE A 38 10.852 -27.558 -2.941 1.00 0.00 H new ATOM 0 HB2 PHE A 38 10.643 -26.540 -0.080 1.00 0.00 H new ATOM 0 HB3 PHE A 38 10.094 -25.701 -1.518 1.00 0.00 H new ATOM 0 HD1 PHE A 38 9.504 -28.692 0.596 1.00 0.00 H new ATOM 0 HD2 PHE A 38 7.966 -26.170 -2.474 1.00 0.00 H new ATOM 0 HE1 PHE A 38 7.314 -29.786 0.794 1.00 0.00 H new ATOM 0 HE2 PHE A 38 5.775 -27.261 -2.276 1.00 0.00 H new ATOM 0 HZ PHE A 38 5.443 -29.069 -0.638 1.00 0.00 H new ATOM 545 N THR A 39 12.972 -26.321 -3.147 1.00 0.00 N ATOM 546 CA THR A 39 14.234 -25.614 -3.317 1.00 0.00 C ATOM 547 C THR A 39 14.055 -24.370 -4.180 1.00 0.00 C ATOM 548 O THR A 39 13.025 -24.199 -4.833 1.00 0.00 O ATOM 549 CB THR A 39 15.304 -26.519 -3.957 1.00 0.00 C ATOM 550 OG1 THR A 39 16.582 -25.873 -3.913 1.00 0.00 O ATOM 551 CG2 THR A 39 14.945 -26.846 -5.398 1.00 0.00 C ATOM 0 H THR A 39 12.441 -26.449 -4.008 1.00 0.00 H new ATOM 0 HA THR A 39 14.567 -25.318 -2.322 1.00 0.00 H new ATOM 0 HB THR A 39 15.348 -27.449 -3.390 1.00 0.00 H new ATOM 0 HG1 THR A 39 17.257 -26.455 -4.320 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.715 -27.486 -5.829 1.00 0.00 H new ATOM 0 HG22 THR A 39 13.986 -27.363 -5.426 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.876 -25.923 -5.974 1.00 0.00 H new ATOM 559 N TYR A 40 15.063 -23.505 -4.180 1.00 0.00 N ATOM 560 CA TYR A 40 15.016 -22.276 -4.962 1.00 0.00 C ATOM 561 C TYR A 40 15.070 -22.578 -6.456 1.00 0.00 C ATOM 562 O TYR A 40 15.358 -23.703 -6.862 1.00 0.00 O ATOM 563 CB TYR A 40 16.175 -21.355 -4.575 1.00 0.00 C ATOM 564 CG TYR A 40 16.122 -20.886 -3.139 1.00 0.00 C ATOM 565 CD1 TYR A 40 16.682 -21.644 -2.118 1.00 0.00 C ATOM 566 CD2 TYR A 40 15.511 -19.684 -2.802 1.00 0.00 C ATOM 567 CE1 TYR A 40 16.635 -21.220 -0.804 1.00 0.00 C ATOM 568 CE2 TYR A 40 15.461 -19.251 -1.491 1.00 0.00 C ATOM 569 CZ TYR A 40 16.023 -20.022 -0.496 1.00 0.00 C ATOM 570 OH TYR A 40 15.976 -19.595 0.811 1.00 0.00 O ATOM 0 H TYR A 40 15.923 -23.633 -3.647 1.00 0.00 H new ATOM 0 HA TYR A 40 14.073 -21.774 -4.745 1.00 0.00 H new ATOM 0 HB2 TYR A 40 17.116 -21.879 -4.743 1.00 0.00 H new ATOM 0 HB3 TYR A 40 16.172 -20.486 -5.233 1.00 0.00 H new ATOM 0 HD1 TYR A 40 17.163 -22.581 -2.356 1.00 0.00 H new ATOM 0 HD2 TYR A 40 15.068 -19.078 -3.578 1.00 0.00 H new ATOM 0 HE1 TYR A 40 17.074 -21.822 -0.023 1.00 0.00 H new ATOM 0 HE2 TYR A 40 14.984 -18.313 -1.247 1.00 0.00 H new ATOM 0 HH TYR A 40 15.484 -18.749 0.861 1.00 0.00 H new ATOM 580 N GLU A 41 14.790 -21.564 -7.269 1.00 0.00 N ATOM 581 CA GLU A 41 14.806 -21.721 -8.719 1.00 0.00 C ATOM 582 C GLU A 41 16.198 -21.445 -9.281 1.00 0.00 C ATOM 583 O GLU A 41 16.818 -22.317 -9.888 1.00 0.00 O ATOM 584 CB GLU A 41 13.787 -20.782 -9.367 1.00 0.00 C ATOM 585 CG GLU A 41 12.876 -21.471 -10.370 1.00 0.00 C ATOM 586 CD GLU A 41 12.700 -20.670 -11.645 1.00 0.00 C ATOM 587 OE1 GLU A 41 13.702 -20.476 -12.366 1.00 0.00 O ATOM 588 OE2 GLU A 41 11.563 -20.237 -11.923 1.00 0.00 O ATOM 0 H GLU A 41 14.550 -20.626 -6.949 1.00 0.00 H new ATOM 0 HA GLU A 41 14.538 -22.752 -8.950 1.00 0.00 H new ATOM 0 HB2 GLU A 41 13.176 -20.328 -8.587 1.00 0.00 H new ATOM 0 HB3 GLU A 41 14.318 -19.973 -9.868 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.286 -22.451 -10.615 1.00 0.00 H new ATOM 0 HG3 GLU A 41 11.901 -21.639 -9.913 1.00 0.00 H new ATOM 595 N GLY A 42 16.682 -20.224 -9.074 1.00 0.00 N ATOM 596 CA GLY A 42 17.995 -19.853 -9.566 1.00 0.00 C ATOM 597 C GLY A 42 18.844 -19.181 -8.505 1.00 0.00 C ATOM 598 O GLY A 42 19.140 -19.775 -7.469 1.00 0.00 O ATOM 0 H GLY A 42 16.187 -19.485 -8.574 1.00 0.00 H new ATOM 0 HA2 GLY A 42 18.509 -20.744 -9.928 1.00 0.00 H new ATOM 0 HA3 GLY A 42 17.884 -19.181 -10.417 1.00 0.00 H new ATOM 602 N ASN A 43 19.237 -17.938 -8.763 1.00 0.00 N ATOM 603 CA ASN A 43 20.058 -17.185 -7.823 1.00 0.00 C ATOM 604 C ASN A 43 19.271 -16.025 -7.220 1.00 0.00 C ATOM 605 O ASN A 43 19.835 -14.979 -6.898 1.00 0.00 O ATOM 606 CB ASN A 43 21.314 -16.656 -8.520 1.00 0.00 C ATOM 607 CG ASN A 43 22.019 -17.726 -9.329 1.00 0.00 C ATOM 608 OD1 ASN A 43 21.786 -17.868 -10.530 1.00 0.00 O ATOM 609 ND2 ASN A 43 22.889 -18.487 -8.674 1.00 0.00 N ATOM 0 H ASN A 43 19.000 -17.431 -9.616 1.00 0.00 H new ATOM 0 HA ASN A 43 20.353 -17.858 -7.018 1.00 0.00 H new ATOM 0 HB2 ASN A 43 21.041 -15.829 -9.176 1.00 0.00 H new ATOM 0 HB3 ASN A 43 22.000 -16.258 -7.773 1.00 0.00 H new ATOM 0 HD21 ASN A 43 23.394 -19.223 -9.167 1.00 0.00 H new ATOM 0 HD22 ASN A 43 23.052 -18.335 -7.679 1.00 0.00 H new ATOM 616 N SER A 44 17.965 -16.219 -7.070 1.00 0.00 N ATOM 617 CA SER A 44 17.099 -15.188 -6.509 1.00 0.00 C ATOM 618 C SER A 44 16.059 -15.801 -5.575 1.00 0.00 C ATOM 619 O SER A 44 15.905 -17.020 -5.516 1.00 0.00 O ATOM 620 CB SER A 44 16.401 -14.413 -7.629 1.00 0.00 C ATOM 621 OG SER A 44 16.327 -15.186 -8.814 1.00 0.00 O ATOM 0 H SER A 44 17.483 -17.080 -7.329 1.00 0.00 H new ATOM 0 HA SER A 44 17.719 -14.501 -5.933 1.00 0.00 H new ATOM 0 HB2 SER A 44 15.397 -14.133 -7.311 1.00 0.00 H new ATOM 0 HB3 SER A 44 16.942 -13.488 -7.828 1.00 0.00 H new ATOM 0 HG SER A 44 15.875 -14.670 -9.514 1.00 0.00 H new ATOM 627 N ASN A 45 15.350 -14.945 -4.847 1.00 0.00 N ATOM 628 CA ASN A 45 14.325 -15.401 -3.915 1.00 0.00 C ATOM 629 C ASN A 45 13.081 -15.874 -4.662 1.00 0.00 C ATOM 630 O ASN A 45 12.336 -15.069 -5.220 1.00 0.00 O ATOM 631 CB ASN A 45 13.954 -14.279 -2.944 1.00 0.00 C ATOM 632 CG ASN A 45 15.155 -13.449 -2.533 1.00 0.00 C ATOM 633 OD1 ASN A 45 16.258 -13.971 -2.373 1.00 0.00 O ATOM 634 ND2 ASN A 45 14.944 -12.149 -2.360 1.00 0.00 N ATOM 0 H ASN A 45 15.466 -13.932 -4.884 1.00 0.00 H new ATOM 0 HA ASN A 45 14.730 -16.242 -3.352 1.00 0.00 H new ATOM 0 HB2 ASN A 45 13.210 -13.632 -3.408 1.00 0.00 H new ATOM 0 HB3 ASN A 45 13.492 -14.709 -2.055 1.00 0.00 H new ATOM 0 HD21 ASN A 45 15.714 -11.540 -2.083 1.00 0.00 H new ATOM 0 HD22 ASN A 45 14.012 -11.760 -2.504 1.00 0.00 H new ATOM 641 N ASP A 46 12.865 -17.185 -4.668 1.00 0.00 N ATOM 642 CA ASP A 46 11.711 -17.766 -5.345 1.00 0.00 C ATOM 643 C ASP A 46 11.676 -19.279 -5.157 1.00 0.00 C ATOM 644 O ASP A 46 12.109 -20.033 -6.029 1.00 0.00 O ATOM 645 CB ASP A 46 11.742 -17.425 -6.835 1.00 0.00 C ATOM 646 CG ASP A 46 10.783 -16.307 -7.194 1.00 0.00 C ATOM 647 OD1 ASP A 46 9.559 -16.499 -7.029 1.00 0.00 O ATOM 648 OD2 ASP A 46 11.255 -15.240 -7.639 1.00 0.00 O ATOM 0 H ASP A 46 13.473 -17.865 -4.212 1.00 0.00 H new ATOM 0 HA ASP A 46 10.810 -17.342 -4.902 1.00 0.00 H new ATOM 0 HB2 ASP A 46 12.754 -17.136 -7.117 1.00 0.00 H new ATOM 0 HB3 ASP A 46 11.491 -18.314 -7.413 1.00 0.00 H new ATOM 653 N ILE A 47 11.159 -19.717 -4.014 1.00 0.00 N ATOM 654 CA ILE A 47 11.068 -21.140 -3.712 1.00 0.00 C ATOM 655 C ILE A 47 10.159 -21.855 -4.706 1.00 0.00 C ATOM 656 O ILE A 47 9.155 -21.302 -5.154 1.00 0.00 O ATOM 657 CB ILE A 47 10.540 -21.380 -2.286 1.00 0.00 C ATOM 658 CG1 ILE A 47 11.451 -20.702 -1.260 1.00 0.00 C ATOM 659 CG2 ILE A 47 10.435 -22.872 -2.004 1.00 0.00 C ATOM 660 CD1 ILE A 47 12.866 -21.236 -1.263 1.00 0.00 C ATOM 0 H ILE A 47 10.797 -19.106 -3.282 1.00 0.00 H new ATOM 0 HA ILE A 47 12.077 -21.545 -3.789 1.00 0.00 H new ATOM 0 HB ILE A 47 9.545 -20.943 -2.205 1.00 0.00 H new ATOM 0 HG12 ILE A 47 11.475 -19.631 -1.459 1.00 0.00 H new ATOM 0 HG13 ILE A 47 11.024 -20.832 -0.265 1.00 0.00 H new ATOM 0 HG21 ILE A 47 10.060 -23.026 -0.992 1.00 0.00 H new ATOM 0 HG22 ILE A 47 9.750 -23.330 -2.718 1.00 0.00 H new ATOM 0 HG23 ILE A 47 11.419 -23.331 -2.100 1.00 0.00 H new ATOM 0 HD11 ILE A 47 13.455 -20.710 -0.512 1.00 0.00 H new ATOM 0 HD12 ILE A 47 12.853 -22.302 -1.034 1.00 0.00 H new ATOM 0 HD13 ILE A 47 13.311 -21.082 -2.246 1.00 0.00 H new ATOM 672 N ARG A 48 10.518 -23.089 -5.045 1.00 0.00 N ATOM 673 CA ARG A 48 9.735 -23.881 -5.986 1.00 0.00 C ATOM 674 C ARG A 48 9.904 -25.373 -5.713 1.00 0.00 C ATOM 675 O ARG A 48 10.883 -25.796 -5.098 1.00 0.00 O ATOM 676 CB ARG A 48 10.152 -23.565 -7.423 1.00 0.00 C ATOM 677 CG ARG A 48 11.610 -23.877 -7.717 1.00 0.00 C ATOM 678 CD ARG A 48 11.784 -24.469 -9.107 1.00 0.00 C ATOM 679 NE ARG A 48 11.018 -25.702 -9.277 1.00 0.00 N ATOM 680 CZ ARG A 48 11.080 -26.461 -10.365 1.00 0.00 C ATOM 681 NH1 ARG A 48 11.867 -26.117 -11.374 1.00 0.00 N ATOM 682 NH2 ARG A 48 10.353 -27.568 -10.445 1.00 0.00 N ATOM 0 H ARG A 48 11.346 -23.562 -4.682 1.00 0.00 H new ATOM 0 HA ARG A 48 8.685 -23.621 -5.854 1.00 0.00 H new ATOM 0 HB2 ARG A 48 9.523 -24.133 -8.108 1.00 0.00 H new ATOM 0 HB3 ARG A 48 9.968 -22.509 -7.622 1.00 0.00 H new ATOM 0 HG2 ARG A 48 12.202 -22.966 -7.632 1.00 0.00 H new ATOM 0 HG3 ARG A 48 11.991 -24.576 -6.972 1.00 0.00 H new ATOM 0 HD2 ARG A 48 11.468 -23.740 -9.854 1.00 0.00 H new ATOM 0 HD3 ARG A 48 12.840 -24.671 -9.285 1.00 0.00 H new ATOM 0 HE ARG A 48 10.402 -25.996 -8.519 1.00 0.00 H new ATOM 0 HH11 ARG A 48 12.428 -25.267 -11.317 1.00 0.00 H new ATOM 0 HH12 ARG A 48 11.912 -26.702 -12.208 1.00 0.00 H new ATOM 0 HH21 ARG A 48 9.746 -27.837 -9.671 1.00 0.00 H new ATOM 0 HH22 ARG A 48 10.401 -28.150 -11.281 1.00 0.00 H new ATOM 696 N VAL A 49 8.942 -26.166 -6.173 1.00 0.00 N ATOM 697 CA VAL A 49 8.984 -27.611 -5.980 1.00 0.00 C ATOM 698 C VAL A 49 10.318 -28.188 -6.438 1.00 0.00 C ATOM 699 O VAL A 49 10.903 -27.725 -7.416 1.00 0.00 O ATOM 700 CB VAL A 49 7.844 -28.313 -6.742 1.00 0.00 C ATOM 701 CG1 VAL A 49 7.924 -29.820 -6.553 1.00 0.00 C ATOM 702 CG2 VAL A 49 6.493 -27.781 -6.288 1.00 0.00 C ATOM 0 H VAL A 49 8.124 -25.832 -6.682 1.00 0.00 H new ATOM 0 HA VAL A 49 8.861 -27.791 -4.912 1.00 0.00 H new ATOM 0 HB VAL A 49 7.955 -28.098 -7.805 1.00 0.00 H new ATOM 0 HG11 VAL A 49 7.111 -30.299 -7.098 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.879 -30.184 -6.932 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.840 -30.059 -5.493 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.699 -28.288 -6.837 1.00 0.00 H new ATOM 0 HG22 VAL A 49 6.370 -27.964 -5.220 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.440 -26.710 -6.481 1.00 0.00 H new ATOM 712 N ALA A 50 10.794 -29.203 -5.724 1.00 0.00 N ATOM 713 CA ALA A 50 12.059 -29.846 -6.059 1.00 0.00 C ATOM 714 C ALA A 50 11.865 -31.336 -6.320 1.00 0.00 C ATOM 715 O ALA A 50 12.544 -31.923 -7.161 1.00 0.00 O ATOM 716 CB ALA A 50 13.072 -29.631 -4.945 1.00 0.00 C ATOM 0 H ALA A 50 10.323 -29.598 -4.910 1.00 0.00 H new ATOM 0 HA ALA A 50 12.439 -29.390 -6.973 1.00 0.00 H new ATOM 0 HB1 ALA A 50 14.012 -30.117 -5.209 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.241 -28.563 -4.808 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.690 -30.059 -4.018 1.00 0.00 H new ATOM 722 N GLY A 51 10.933 -31.944 -5.590 1.00 0.00 N ATOM 723 CA GLY A 51 10.668 -33.361 -5.757 1.00 0.00 C ATOM 724 C GLY A 51 9.496 -33.834 -4.920 1.00 0.00 C ATOM 725 O GLY A 51 9.290 -33.360 -3.802 1.00 0.00 O ATOM 0 H GLY A 51 10.358 -31.480 -4.887 1.00 0.00 H new ATOM 0 HA2 GLY A 51 10.467 -33.569 -6.808 1.00 0.00 H new ATOM 0 HA3 GLY A 51 11.558 -33.929 -5.484 1.00 0.00 H new ATOM 729 N THR A 52 8.723 -34.770 -5.462 1.00 0.00 N ATOM 730 CA THR A 52 7.564 -35.305 -4.759 1.00 0.00 C ATOM 731 C THR A 52 7.288 -36.747 -5.171 1.00 0.00 C ATOM 732 O THR A 52 7.385 -37.096 -6.347 1.00 0.00 O ATOM 733 CB THR A 52 6.305 -34.458 -5.025 1.00 0.00 C ATOM 734 OG1 THR A 52 5.993 -34.469 -6.422 1.00 0.00 O ATOM 735 CG2 THR A 52 6.509 -33.024 -4.558 1.00 0.00 C ATOM 0 H THR A 52 8.879 -35.173 -6.386 1.00 0.00 H new ATOM 0 HA THR A 52 7.797 -35.272 -3.695 1.00 0.00 H new ATOM 0 HB THR A 52 5.477 -34.892 -4.465 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.191 -33.930 -6.582 1.00 0.00 H new ATOM 0 HG21 THR A 52 5.607 -32.445 -4.756 1.00 0.00 H new ATOM 0 HG22 THR A 52 6.718 -33.016 -3.488 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.349 -32.583 -5.095 1.00 0.00 H new ATOM 743 N GLY A 53 6.944 -37.581 -4.195 1.00 0.00 N ATOM 744 CA GLY A 53 6.659 -38.976 -4.477 1.00 0.00 C ATOM 745 C GLY A 53 6.212 -39.737 -3.244 1.00 0.00 C ATOM 746 O GLY A 53 6.221 -39.198 -2.138 1.00 0.00 O ATOM 0 H GLY A 53 6.857 -37.316 -3.214 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.883 -39.038 -5.240 1.00 0.00 H new ATOM 0 HA3 GLY A 53 7.550 -39.450 -4.889 1.00 0.00 H new ATOM 750 N GLU A 54 5.819 -40.992 -3.436 1.00 0.00 N ATOM 751 CA GLU A 54 5.364 -41.827 -2.331 1.00 0.00 C ATOM 752 C GLU A 54 6.436 -42.839 -1.936 1.00 0.00 C ATOM 753 O GLU A 54 6.133 -43.903 -1.398 1.00 0.00 O ATOM 754 CB GLU A 54 4.074 -42.556 -2.710 1.00 0.00 C ATOM 755 CG GLU A 54 2.914 -42.271 -1.770 1.00 0.00 C ATOM 756 CD GLU A 54 2.352 -43.530 -1.139 1.00 0.00 C ATOM 757 OE1 GLU A 54 2.957 -44.028 -0.166 1.00 0.00 O ATOM 758 OE2 GLU A 54 1.307 -44.018 -1.618 1.00 0.00 O ATOM 0 H GLU A 54 5.807 -41.453 -4.346 1.00 0.00 H new ATOM 0 HA GLU A 54 5.168 -41.179 -1.477 1.00 0.00 H new ATOM 0 HB2 GLU A 54 3.789 -42.270 -3.722 1.00 0.00 H new ATOM 0 HB3 GLU A 54 4.264 -43.629 -2.724 1.00 0.00 H new ATOM 0 HG2 GLU A 54 3.246 -41.592 -0.984 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.123 -41.760 -2.319 1.00 0.00 H new ATOM 765 N GLY A 55 7.692 -42.498 -2.208 1.00 0.00 N ATOM 766 CA GLY A 55 8.791 -43.387 -1.876 1.00 0.00 C ATOM 767 C GLY A 55 9.056 -43.448 -0.385 1.00 0.00 C ATOM 768 O GLY A 55 9.684 -44.387 0.103 1.00 0.00 O ATOM 0 H GLY A 55 7.968 -41.622 -2.652 1.00 0.00 H new ATOM 0 HA2 GLY A 55 8.568 -44.389 -2.244 1.00 0.00 H new ATOM 0 HA3 GLY A 55 9.693 -43.053 -2.389 1.00 0.00 H new ATOM 772 N GLY A 56 8.577 -42.442 0.342 1.00 0.00 N ATOM 773 CA GLY A 56 8.778 -42.404 1.779 1.00 0.00 C ATOM 774 C GLY A 56 9.912 -41.482 2.181 1.00 0.00 C ATOM 775 O GLY A 56 10.103 -40.422 1.583 1.00 0.00 O ATOM 0 H GLY A 56 8.054 -41.653 -0.039 1.00 0.00 H new ATOM 0 HA2 GLY A 56 7.858 -42.076 2.263 1.00 0.00 H new ATOM 0 HA3 GLY A 56 8.987 -43.411 2.140 1.00 0.00 H new ATOM 779 N LEU A 57 10.666 -41.884 3.199 1.00 0.00 N ATOM 780 CA LEU A 57 11.787 -41.085 3.682 1.00 0.00 C ATOM 781 C LEU A 57 13.082 -41.483 2.982 1.00 0.00 C ATOM 782 O LEU A 57 14.007 -40.680 2.865 1.00 0.00 O ATOM 783 CB LEU A 57 11.941 -41.249 5.195 1.00 0.00 C ATOM 784 CG LEU A 57 10.704 -40.928 6.035 1.00 0.00 C ATOM 785 CD1 LEU A 57 10.459 -42.020 7.065 1.00 0.00 C ATOM 786 CD2 LEU A 57 10.857 -39.575 6.714 1.00 0.00 C ATOM 0 H LEU A 57 10.521 -42.758 3.705 1.00 0.00 H new ATOM 0 HA LEU A 57 11.580 -40.039 3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 57 12.238 -42.277 5.400 1.00 0.00 H new ATOM 0 HB3 LEU A 57 12.758 -40.609 5.528 1.00 0.00 H new ATOM 0 HG LEU A 57 9.840 -40.883 5.372 1.00 0.00 H new ATOM 0 HD11 LEU A 57 9.575 -41.774 7.653 1.00 0.00 H new ATOM 0 HD12 LEU A 57 10.303 -42.971 6.557 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.323 -42.098 7.725 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.968 -39.363 7.307 1.00 0.00 H new ATOM 0 HD22 LEU A 57 11.732 -39.591 7.364 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.982 -38.800 5.957 1.00 0.00 H new ATOM 798 N GLU A 58 13.139 -42.727 2.517 1.00 0.00 N ATOM 799 CA GLU A 58 14.320 -43.231 1.826 1.00 0.00 C ATOM 800 C GLU A 58 14.562 -42.463 0.530 1.00 0.00 C ATOM 801 O GLU A 58 15.700 -42.317 0.086 1.00 0.00 O ATOM 802 CB GLU A 58 14.166 -44.723 1.526 1.00 0.00 C ATOM 803 CG GLU A 58 13.887 -45.566 2.759 1.00 0.00 C ATOM 804 CD GLU A 58 12.527 -46.235 2.714 1.00 0.00 C ATOM 805 OE1 GLU A 58 12.429 -47.341 2.142 1.00 0.00 O ATOM 806 OE2 GLU A 58 11.561 -45.652 3.250 1.00 0.00 O ATOM 0 H GLU A 58 12.381 -43.404 2.606 1.00 0.00 H new ATOM 0 HA GLU A 58 15.180 -43.086 2.480 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.354 -44.859 0.812 1.00 0.00 H new ATOM 0 HB3 GLU A 58 15.076 -45.085 1.047 1.00 0.00 H new ATOM 0 HG2 GLU A 58 14.660 -46.329 2.855 1.00 0.00 H new ATOM 0 HG3 GLU A 58 13.949 -44.936 3.646 1.00 0.00 H new ATOM 813 N GLU A 59 13.482 -41.975 -0.072 1.00 0.00 N ATOM 814 CA GLU A 59 13.576 -41.223 -1.318 1.00 0.00 C ATOM 815 C GLU A 59 13.787 -39.737 -1.042 1.00 0.00 C ATOM 816 O GLU A 59 14.570 -39.074 -1.722 1.00 0.00 O ATOM 817 CB GLU A 59 12.312 -41.422 -2.157 1.00 0.00 C ATOM 818 CG GLU A 59 12.463 -40.974 -3.601 1.00 0.00 C ATOM 819 CD GLU A 59 12.424 -42.133 -4.578 1.00 0.00 C ATOM 820 OE1 GLU A 59 13.238 -43.067 -4.425 1.00 0.00 O ATOM 821 OE2 GLU A 59 11.578 -42.105 -5.497 1.00 0.00 O ATOM 0 H GLU A 59 12.532 -42.087 0.283 1.00 0.00 H new ATOM 0 HA GLU A 59 14.435 -41.598 -1.874 1.00 0.00 H new ATOM 0 HB2 GLU A 59 12.037 -42.477 -2.140 1.00 0.00 H new ATOM 0 HB3 GLU A 59 11.491 -40.871 -1.698 1.00 0.00 H new ATOM 0 HG2 GLU A 59 11.666 -40.271 -3.845 1.00 0.00 H new ATOM 0 HG3 GLU A 59 13.406 -40.439 -3.715 1.00 0.00 H new ATOM 828 N MET A 60 13.082 -39.221 -0.041 1.00 0.00 N ATOM 829 CA MET A 60 13.193 -37.814 0.326 1.00 0.00 C ATOM 830 C MET A 60 14.644 -37.437 0.606 1.00 0.00 C ATOM 831 O MET A 60 15.151 -36.446 0.081 1.00 0.00 O ATOM 832 CB MET A 60 12.331 -37.515 1.554 1.00 0.00 C ATOM 833 CG MET A 60 12.537 -36.118 2.116 1.00 0.00 C ATOM 834 SD MET A 60 13.557 -36.111 3.603 1.00 0.00 S ATOM 835 CE MET A 60 12.365 -36.632 4.834 1.00 0.00 C ATOM 0 H MET A 60 12.428 -39.756 0.530 1.00 0.00 H new ATOM 0 HA MET A 60 12.837 -37.217 -0.514 1.00 0.00 H new ATOM 0 HB2 MET A 60 11.281 -37.640 1.290 1.00 0.00 H new ATOM 0 HB3 MET A 60 12.554 -38.247 2.331 1.00 0.00 H new ATOM 0 HG2 MET A 60 13.004 -35.490 1.357 1.00 0.00 H new ATOM 0 HG3 MET A 60 11.567 -35.675 2.343 1.00 0.00 H new ATOM 0 HE1 MET A 60 12.879 -37.160 5.638 1.00 0.00 H new ATOM 0 HE2 MET A 60 11.856 -35.758 5.241 1.00 0.00 H new ATOM 0 HE3 MET A 60 11.633 -37.296 4.374 1.00 0.00 H new ATOM 845 N VAL A 61 15.309 -38.235 1.436 1.00 0.00 N ATOM 846 CA VAL A 61 16.702 -37.986 1.785 1.00 0.00 C ATOM 847 C VAL A 61 17.609 -38.138 0.569 1.00 0.00 C ATOM 848 O VAL A 61 18.678 -37.533 0.500 1.00 0.00 O ATOM 849 CB VAL A 61 17.183 -38.942 2.893 1.00 0.00 C ATOM 850 CG1 VAL A 61 16.427 -38.682 4.187 1.00 0.00 C ATOM 851 CG2 VAL A 61 17.024 -40.389 2.453 1.00 0.00 C ATOM 0 H VAL A 61 14.905 -39.060 1.879 1.00 0.00 H new ATOM 0 HA VAL A 61 16.758 -36.961 2.151 1.00 0.00 H new ATOM 0 HB VAL A 61 18.241 -38.757 3.076 1.00 0.00 H new ATOM 0 HG11 VAL A 61 16.780 -39.366 4.958 1.00 0.00 H new ATOM 0 HG12 VAL A 61 16.598 -37.654 4.508 1.00 0.00 H new ATOM 0 HG13 VAL A 61 15.361 -38.839 4.023 1.00 0.00 H new ATOM 0 HG21 VAL A 61 17.369 -41.051 3.248 1.00 0.00 H new ATOM 0 HG22 VAL A 61 15.974 -40.592 2.242 1.00 0.00 H new ATOM 0 HG23 VAL A 61 17.615 -40.563 1.554 1.00 0.00 H new ATOM 861 N GLU A 62 17.174 -38.950 -0.389 1.00 0.00 N ATOM 862 CA GLU A 62 17.947 -39.182 -1.604 1.00 0.00 C ATOM 863 C GLU A 62 17.943 -37.944 -2.496 1.00 0.00 C ATOM 864 O GLU A 62 18.864 -37.731 -3.283 1.00 0.00 O ATOM 865 CB GLU A 62 17.385 -40.380 -2.372 1.00 0.00 C ATOM 866 CG GLU A 62 18.142 -41.673 -2.121 1.00 0.00 C ATOM 867 CD GLU A 62 18.848 -42.186 -3.361 1.00 0.00 C ATOM 868 OE1 GLU A 62 18.266 -42.079 -4.461 1.00 0.00 O ATOM 869 OE2 GLU A 62 19.982 -42.693 -3.232 1.00 0.00 O ATOM 0 H GLU A 62 16.291 -39.458 -0.348 1.00 0.00 H new ATOM 0 HA GLU A 62 18.976 -39.396 -1.314 1.00 0.00 H new ATOM 0 HB2 GLU A 62 16.340 -40.521 -2.095 1.00 0.00 H new ATOM 0 HB3 GLU A 62 17.405 -40.159 -3.439 1.00 0.00 H new ATOM 0 HG2 GLU A 62 18.875 -41.513 -1.330 1.00 0.00 H new ATOM 0 HG3 GLU A 62 17.447 -42.433 -1.763 1.00 0.00 H new ATOM 876 N GLU A 63 16.899 -37.132 -2.366 1.00 0.00 N ATOM 877 CA GLU A 63 16.774 -35.916 -3.161 1.00 0.00 C ATOM 878 C GLU A 63 17.558 -34.769 -2.529 1.00 0.00 C ATOM 879 O GLU A 63 18.095 -33.909 -3.228 1.00 0.00 O ATOM 880 CB GLU A 63 15.302 -35.523 -3.306 1.00 0.00 C ATOM 881 CG GLU A 63 14.616 -36.165 -4.500 1.00 0.00 C ATOM 882 CD GLU A 63 14.384 -35.187 -5.635 1.00 0.00 C ATOM 883 OE1 GLU A 63 15.190 -34.243 -5.778 1.00 0.00 O ATOM 884 OE2 GLU A 63 13.398 -35.364 -6.381 1.00 0.00 O ATOM 0 H GLU A 63 16.128 -37.294 -1.718 1.00 0.00 H new ATOM 0 HA GLU A 63 17.188 -36.115 -4.149 1.00 0.00 H new ATOM 0 HB2 GLU A 63 14.769 -35.803 -2.397 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.231 -34.439 -3.396 1.00 0.00 H new ATOM 0 HG2 GLU A 63 15.223 -36.996 -4.860 1.00 0.00 H new ATOM 0 HG3 GLU A 63 13.660 -36.582 -4.184 1.00 0.00 H new ATOM 891 N LEU A 64 17.617 -34.763 -1.202 1.00 0.00 N ATOM 892 CA LEU A 64 18.334 -33.722 -0.473 1.00 0.00 C ATOM 893 C LEU A 64 19.763 -33.583 -0.988 1.00 0.00 C ATOM 894 O LEU A 64 20.554 -34.522 -0.915 1.00 0.00 O ATOM 895 CB LEU A 64 18.348 -34.037 1.024 1.00 0.00 C ATOM 896 CG LEU A 64 16.982 -34.096 1.710 1.00 0.00 C ATOM 897 CD1 LEU A 64 17.130 -34.544 3.155 1.00 0.00 C ATOM 898 CD2 LEU A 64 16.290 -32.742 1.637 1.00 0.00 C ATOM 0 H LEU A 64 17.177 -35.467 -0.609 1.00 0.00 H new ATOM 0 HA LEU A 64 17.815 -32.777 -0.634 1.00 0.00 H new ATOM 0 HB2 LEU A 64 18.847 -34.995 1.169 1.00 0.00 H new ATOM 0 HB3 LEU A 64 18.953 -33.283 1.528 1.00 0.00 H new ATOM 0 HG LEU A 64 16.364 -34.826 1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 64 16.148 -34.580 3.627 1.00 0.00 H new ATOM 0 HD12 LEU A 64 17.583 -35.535 3.184 1.00 0.00 H new ATOM 0 HD13 LEU A 64 17.765 -33.839 3.691 1.00 0.00 H new ATOM 0 HD21 LEU A 64 15.320 -32.802 2.130 1.00 0.00 H new ATOM 0 HD22 LEU A 64 16.904 -31.992 2.135 1.00 0.00 H new ATOM 0 HD23 LEU A 64 16.150 -32.461 0.593 1.00 0.00 H new ATOM 910 N ASN A 65 20.087 -32.403 -1.507 1.00 0.00 N ATOM 911 CA ASN A 65 21.422 -32.140 -2.033 1.00 0.00 C ATOM 912 C ASN A 65 22.257 -31.351 -1.028 1.00 0.00 C ATOM 913 O ASN A 65 21.910 -30.227 -0.665 1.00 0.00 O ATOM 914 CB ASN A 65 21.331 -31.371 -3.352 1.00 0.00 C ATOM 915 CG ASN A 65 22.063 -32.070 -4.481 1.00 0.00 C ATOM 916 OD1 ASN A 65 23.209 -32.493 -4.325 1.00 0.00 O ATOM 917 ND2 ASN A 65 21.403 -32.196 -5.626 1.00 0.00 N ATOM 0 H ASN A 65 19.444 -31.614 -1.575 1.00 0.00 H new ATOM 0 HA ASN A 65 21.910 -33.098 -2.212 1.00 0.00 H new ATOM 0 HB2 ASN A 65 20.283 -31.246 -3.625 1.00 0.00 H new ATOM 0 HB3 ASN A 65 21.747 -30.372 -3.217 1.00 0.00 H new ATOM 0 HD21 ASN A 65 21.844 -32.658 -6.421 1.00 0.00 H new ATOM 0 HD22 ASN A 65 20.455 -31.830 -5.711 1.00 0.00 H new ATOM 924 N SER A 66 23.358 -31.947 -0.584 1.00 0.00 N ATOM 925 CA SER A 66 24.241 -31.302 0.380 1.00 0.00 C ATOM 926 C SER A 66 24.968 -30.120 -0.254 1.00 0.00 C ATOM 927 O SER A 66 25.993 -30.288 -0.913 1.00 0.00 O ATOM 928 CB SER A 66 25.258 -32.307 0.925 1.00 0.00 C ATOM 929 OG SER A 66 25.576 -33.289 -0.046 1.00 0.00 O ATOM 0 H SER A 66 23.660 -32.876 -0.877 1.00 0.00 H new ATOM 0 HA SER A 66 23.630 -30.931 1.203 1.00 0.00 H new ATOM 0 HB2 SER A 66 26.165 -31.783 1.228 1.00 0.00 H new ATOM 0 HB3 SER A 66 24.856 -32.789 1.816 1.00 0.00 H new ATOM 0 HG SER A 66 26.229 -33.918 0.326 1.00 0.00 H new ATOM 935 N GLY A 67 24.428 -28.922 -0.049 1.00 0.00 N ATOM 936 CA GLY A 67 25.037 -27.729 -0.606 1.00 0.00 C ATOM 937 C GLY A 67 24.033 -26.616 -0.832 1.00 0.00 C ATOM 938 O GLY A 67 24.404 -25.448 -0.951 1.00 0.00 O ATOM 0 H GLY A 67 23.580 -28.757 0.493 1.00 0.00 H new ATOM 0 HA2 GLY A 67 25.820 -27.377 0.066 1.00 0.00 H new ATOM 0 HA3 GLY A 67 25.517 -27.978 -1.552 1.00 0.00 H new ATOM 942 N LYS A 68 22.755 -26.978 -0.892 1.00 0.00 N ATOM 943 CA LYS A 68 21.693 -26.003 -1.105 1.00 0.00 C ATOM 944 C LYS A 68 20.587 -26.168 -0.067 1.00 0.00 C ATOM 945 O LYS A 68 20.166 -27.285 0.234 1.00 0.00 O ATOM 946 CB LYS A 68 21.112 -26.150 -2.513 1.00 0.00 C ATOM 947 CG LYS A 68 22.163 -26.138 -3.609 1.00 0.00 C ATOM 948 CD LYS A 68 21.591 -26.606 -4.936 1.00 0.00 C ATOM 949 CE LYS A 68 20.617 -25.590 -5.513 1.00 0.00 C ATOM 950 NZ LYS A 68 21.304 -24.600 -6.389 1.00 0.00 N ATOM 0 H LYS A 68 22.431 -27.940 -0.796 1.00 0.00 H new ATOM 0 HA LYS A 68 22.122 -25.007 -0.998 1.00 0.00 H new ATOM 0 HB2 LYS A 68 20.551 -27.083 -2.570 1.00 0.00 H new ATOM 0 HB3 LYS A 68 20.404 -25.341 -2.691 1.00 0.00 H new ATOM 0 HG2 LYS A 68 22.563 -25.130 -3.720 1.00 0.00 H new ATOM 0 HG3 LYS A 68 22.995 -26.782 -3.323 1.00 0.00 H new ATOM 0 HD2 LYS A 68 22.403 -26.776 -5.643 1.00 0.00 H new ATOM 0 HD3 LYS A 68 21.083 -27.561 -4.798 1.00 0.00 H new ATOM 0 HE2 LYS A 68 19.847 -26.108 -6.085 1.00 0.00 H new ATOM 0 HE3 LYS A 68 20.113 -25.068 -4.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 20.607 -23.925 -6.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 22.021 -24.087 -5.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 21.764 -25.096 -7.179 1.00 0.00 H new ATOM 964 N VAL A 69 20.119 -25.048 0.476 1.00 0.00 N ATOM 965 CA VAL A 69 19.060 -25.069 1.478 1.00 0.00 C ATOM 966 C VAL A 69 17.735 -25.512 0.867 1.00 0.00 C ATOM 967 O VAL A 69 17.307 -24.988 -0.161 1.00 0.00 O ATOM 968 CB VAL A 69 18.876 -23.685 2.128 1.00 0.00 C ATOM 969 CG1 VAL A 69 17.762 -23.725 3.164 1.00 0.00 C ATOM 970 CG2 VAL A 69 20.180 -23.213 2.754 1.00 0.00 C ATOM 0 H VAL A 69 20.457 -24.115 0.239 1.00 0.00 H new ATOM 0 HA VAL A 69 19.361 -25.784 2.243 1.00 0.00 H new ATOM 0 HB VAL A 69 18.593 -22.973 1.352 1.00 0.00 H new ATOM 0 HG11 VAL A 69 17.647 -22.738 3.613 1.00 0.00 H new ATOM 0 HG12 VAL A 69 16.828 -24.016 2.683 1.00 0.00 H new ATOM 0 HG13 VAL A 69 18.012 -24.449 3.939 1.00 0.00 H new ATOM 0 HG21 VAL A 69 20.032 -22.234 3.209 1.00 0.00 H new ATOM 0 HG22 VAL A 69 20.495 -23.924 3.518 1.00 0.00 H new ATOM 0 HG23 VAL A 69 20.949 -23.143 1.984 1.00 0.00 H new ATOM 980 N MET A 70 17.089 -26.480 1.509 1.00 0.00 N ATOM 981 CA MET A 70 15.810 -26.993 1.029 1.00 0.00 C ATOM 982 C MET A 70 14.883 -27.317 2.196 1.00 0.00 C ATOM 983 O MET A 70 15.288 -27.260 3.358 1.00 0.00 O ATOM 984 CB MET A 70 16.026 -28.241 0.172 1.00 0.00 C ATOM 985 CG MET A 70 17.059 -28.052 -0.927 1.00 0.00 C ATOM 986 SD MET A 70 17.534 -29.607 -1.708 1.00 0.00 S ATOM 987 CE MET A 70 16.166 -29.850 -2.838 1.00 0.00 C ATOM 0 H MET A 70 17.429 -26.925 2.362 1.00 0.00 H new ATOM 0 HA MET A 70 15.342 -26.220 0.420 1.00 0.00 H new ATOM 0 HB2 MET A 70 16.338 -29.064 0.815 1.00 0.00 H new ATOM 0 HB3 MET A 70 15.077 -28.531 -0.279 1.00 0.00 H new ATOM 0 HG2 MET A 70 16.659 -27.377 -1.684 1.00 0.00 H new ATOM 0 HG3 MET A 70 17.945 -27.574 -0.509 1.00 0.00 H new ATOM 0 HE1 MET A 70 16.189 -30.869 -3.224 1.00 0.00 H new ATOM 0 HE2 MET A 70 15.226 -29.683 -2.312 1.00 0.00 H new ATOM 0 HE3 MET A 70 16.249 -29.146 -3.666 1.00 0.00 H new ATOM 997 N TYR A 71 13.638 -27.656 1.880 1.00 0.00 N ATOM 998 CA TYR A 71 12.653 -27.987 2.903 1.00 0.00 C ATOM 999 C TYR A 71 11.968 -29.314 2.590 1.00 0.00 C ATOM 1000 O TYR A 71 11.470 -29.523 1.485 1.00 0.00 O ATOM 1001 CB TYR A 71 11.609 -26.874 3.013 1.00 0.00 C ATOM 1002 CG TYR A 71 12.187 -25.539 3.423 1.00 0.00 C ATOM 1003 CD1 TYR A 71 12.893 -24.758 2.517 1.00 0.00 C ATOM 1004 CD2 TYR A 71 12.030 -25.059 4.718 1.00 0.00 C ATOM 1005 CE1 TYR A 71 13.425 -23.538 2.887 1.00 0.00 C ATOM 1006 CE2 TYR A 71 12.556 -23.840 5.096 1.00 0.00 C ATOM 1007 CZ TYR A 71 13.253 -23.083 4.178 1.00 0.00 C ATOM 1008 OH TYR A 71 13.780 -21.868 4.551 1.00 0.00 O ATOM 0 H TYR A 71 13.287 -27.709 0.924 1.00 0.00 H new ATOM 0 HA TYR A 71 13.173 -28.084 3.856 1.00 0.00 H new ATOM 0 HB2 TYR A 71 11.106 -26.763 2.052 1.00 0.00 H new ATOM 0 HB3 TYR A 71 10.850 -27.170 3.738 1.00 0.00 H new ATOM 0 HD1 TYR A 71 13.028 -25.111 1.505 1.00 0.00 H new ATOM 0 HD2 TYR A 71 11.487 -25.650 5.441 1.00 0.00 H new ATOM 0 HE1 TYR A 71 13.972 -22.944 2.170 1.00 0.00 H new ATOM 0 HE2 TYR A 71 12.422 -23.481 6.106 1.00 0.00 H new ATOM 0 HH TYR A 71 13.191 -21.148 4.243 1.00 0.00 H new ATOM 1018 N ALA A 72 11.946 -30.207 3.574 1.00 0.00 N ATOM 1019 CA ALA A 72 11.320 -31.513 3.407 1.00 0.00 C ATOM 1020 C ALA A 72 10.021 -31.604 4.199 1.00 0.00 C ATOM 1021 O ALA A 72 9.905 -31.042 5.289 1.00 0.00 O ATOM 1022 CB ALA A 72 12.279 -32.616 3.832 1.00 0.00 C ATOM 0 H ALA A 72 12.355 -30.050 4.495 1.00 0.00 H new ATOM 0 HA ALA A 72 11.081 -31.642 2.351 1.00 0.00 H new ATOM 0 HB1 ALA A 72 11.799 -33.586 3.702 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.179 -32.572 3.219 1.00 0.00 H new ATOM 0 HB3 ALA A 72 12.547 -32.481 4.880 1.00 0.00 H new ATOM 1028 N PHE A 73 9.044 -32.314 3.644 1.00 0.00 N ATOM 1029 CA PHE A 73 7.751 -32.478 4.299 1.00 0.00 C ATOM 1030 C PHE A 73 7.222 -33.897 4.112 1.00 0.00 C ATOM 1031 O PHE A 73 6.584 -34.206 3.105 1.00 0.00 O ATOM 1032 CB PHE A 73 6.743 -31.469 3.743 1.00 0.00 C ATOM 1033 CG PHE A 73 5.537 -31.283 4.618 1.00 0.00 C ATOM 1034 CD1 PHE A 73 5.677 -30.895 5.941 1.00 0.00 C ATOM 1035 CD2 PHE A 73 4.262 -31.496 4.118 1.00 0.00 C ATOM 1036 CE1 PHE A 73 4.568 -30.724 6.748 1.00 0.00 C ATOM 1037 CE2 PHE A 73 3.150 -31.326 4.920 1.00 0.00 C ATOM 1038 CZ PHE A 73 3.303 -30.939 6.237 1.00 0.00 C ATOM 0 H PHE A 73 9.123 -32.785 2.743 1.00 0.00 H new ATOM 0 HA PHE A 73 7.886 -32.297 5.365 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.239 -30.507 3.612 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.419 -31.798 2.756 1.00 0.00 H new ATOM 0 HD1 PHE A 73 6.664 -30.724 6.346 1.00 0.00 H new ATOM 0 HD2 PHE A 73 4.136 -31.799 3.089 1.00 0.00 H new ATOM 0 HE1 PHE A 73 4.691 -30.422 7.778 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.162 -31.496 4.518 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.435 -30.805 6.866 1.00 0.00 H new ATOM 1048 N CYS A 74 7.493 -34.755 5.089 1.00 0.00 N ATOM 1049 CA CYS A 74 7.046 -36.143 5.033 1.00 0.00 C ATOM 1050 C CYS A 74 5.785 -36.342 5.868 1.00 0.00 C ATOM 1051 O CYS A 74 5.372 -35.450 6.609 1.00 0.00 O ATOM 1052 CB CYS A 74 8.152 -37.076 5.527 1.00 0.00 C ATOM 1053 SG CYS A 74 8.250 -38.644 4.631 1.00 0.00 S ATOM 0 H CYS A 74 8.020 -34.515 5.929 1.00 0.00 H new ATOM 0 HA CYS A 74 6.814 -36.383 3.995 1.00 0.00 H new ATOM 0 HB2 CYS A 74 9.110 -36.562 5.445 1.00 0.00 H new ATOM 0 HB3 CYS A 74 7.992 -37.284 6.585 1.00 0.00 H new ATOM 0 HG CYS A 74 7.292 -38.704 3.755 1.00 0.00 H new ATOM 1059 N ARG A 75 5.177 -37.517 5.741 1.00 0.00 N ATOM 1060 CA ARG A 75 3.961 -37.832 6.481 1.00 0.00 C ATOM 1061 C ARG A 75 4.011 -39.256 7.027 1.00 0.00 C ATOM 1062 O ARG A 75 3.938 -40.225 6.271 1.00 0.00 O ATOM 1063 CB ARG A 75 2.734 -37.661 5.584 1.00 0.00 C ATOM 1064 CG ARG A 75 1.424 -38.006 6.272 1.00 0.00 C ATOM 1065 CD ARG A 75 0.290 -38.154 5.270 1.00 0.00 C ATOM 1066 NE ARG A 75 -0.400 -39.434 5.409 1.00 0.00 N ATOM 1067 CZ ARG A 75 0.048 -40.571 4.890 1.00 0.00 C ATOM 1068 NH1 ARG A 75 1.181 -40.588 4.202 1.00 0.00 N ATOM 1069 NH2 ARG A 75 -0.636 -41.695 5.060 1.00 0.00 N ATOM 0 H ARG A 75 5.507 -38.266 5.133 1.00 0.00 H new ATOM 0 HA ARG A 75 3.887 -37.141 7.321 1.00 0.00 H new ATOM 0 HB2 ARG A 75 2.691 -36.629 5.235 1.00 0.00 H new ATOM 0 HB3 ARG A 75 2.848 -38.291 4.702 1.00 0.00 H new ATOM 0 HG2 ARG A 75 1.539 -38.934 6.832 1.00 0.00 H new ATOM 0 HG3 ARG A 75 1.175 -37.228 6.993 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.423 -37.341 5.407 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.686 -38.064 4.258 1.00 0.00 H new ATOM 0 HE ARG A 75 -1.274 -39.455 5.934 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.711 -39.726 4.070 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.523 -41.463 3.804 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -1.507 -41.686 5.590 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -0.290 -42.568 4.661 1.00 0.00 H new ATOM 1083 N VAL A 76 4.136 -39.375 8.345 1.00 0.00 N ATOM 1084 CA VAL A 76 4.195 -40.680 8.993 1.00 0.00 C ATOM 1085 C VAL A 76 3.160 -40.787 10.107 1.00 0.00 C ATOM 1086 O VAL A 76 2.581 -39.787 10.531 1.00 0.00 O ATOM 1087 CB VAL A 76 5.594 -40.953 9.578 1.00 0.00 C ATOM 1088 CG1 VAL A 76 6.639 -40.981 8.474 1.00 0.00 C ATOM 1089 CG2 VAL A 76 5.944 -39.910 10.629 1.00 0.00 C ATOM 0 H VAL A 76 4.198 -38.583 8.985 1.00 0.00 H new ATOM 0 HA VAL A 76 3.978 -41.425 8.227 1.00 0.00 H new ATOM 0 HB VAL A 76 5.583 -41.931 10.059 1.00 0.00 H new ATOM 0 HG11 VAL A 76 7.620 -41.175 8.907 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.394 -41.769 7.761 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.652 -40.019 7.961 1.00 0.00 H new ATOM 0 HG21 VAL A 76 6.935 -40.118 11.032 1.00 0.00 H new ATOM 0 HG22 VAL A 76 5.937 -38.919 10.175 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.210 -39.945 11.434 1.00 0.00 H new ATOM 1099 N LYS A 77 2.931 -42.008 10.578 1.00 0.00 N ATOM 1100 CA LYS A 77 1.967 -42.249 11.645 1.00 0.00 C ATOM 1101 C LYS A 77 2.675 -42.589 12.952 1.00 0.00 C ATOM 1102 O LYS A 77 3.612 -43.388 12.972 1.00 0.00 O ATOM 1103 CB LYS A 77 1.018 -43.385 11.256 1.00 0.00 C ATOM 1104 CG LYS A 77 1.731 -44.682 10.913 1.00 0.00 C ATOM 1105 CD LYS A 77 0.755 -45.841 10.800 1.00 0.00 C ATOM 1106 CE LYS A 77 -0.186 -45.664 9.618 1.00 0.00 C ATOM 1107 NZ LYS A 77 -0.398 -46.942 8.882 1.00 0.00 N ATOM 0 H LYS A 77 3.400 -42.847 10.237 1.00 0.00 H new ATOM 0 HA LYS A 77 1.390 -41.336 11.792 1.00 0.00 H new ATOM 0 HB2 LYS A 77 0.326 -43.567 12.078 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.420 -43.071 10.400 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.269 -44.565 9.972 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.474 -44.904 11.679 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.308 -46.774 10.690 1.00 0.00 H new ATOM 0 HD3 LYS A 77 0.175 -45.921 11.719 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.145 -45.285 9.971 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.222 -44.916 8.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -1.045 -46.780 8.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.514 -47.291 8.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -0.811 -47.648 9.524 1.00 0.00 H new ATOM 1121 N ASP A 78 2.221 -41.979 14.042 1.00 0.00 N ATOM 1122 CA ASP A 78 2.810 -42.220 15.354 1.00 0.00 C ATOM 1123 C ASP A 78 2.837 -43.711 15.673 1.00 0.00 C ATOM 1124 O ASP A 78 2.139 -44.516 15.055 1.00 0.00 O ATOM 1125 CB ASP A 78 2.028 -41.469 16.433 1.00 0.00 C ATOM 1126 CG ASP A 78 2.833 -40.346 17.056 1.00 0.00 C ATOM 1127 OD1 ASP A 78 3.465 -39.579 16.300 1.00 0.00 O ATOM 1128 OD2 ASP A 78 2.832 -40.234 18.301 1.00 0.00 O ATOM 0 H ASP A 78 1.447 -41.314 14.043 1.00 0.00 H new ATOM 0 HA ASP A 78 3.836 -41.852 15.337 1.00 0.00 H new ATOM 0 HB2 ASP A 78 1.116 -41.060 15.998 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.724 -42.169 17.211 1.00 0.00 H new ATOM 1133 N PRO A 79 3.663 -44.091 16.659 1.00 0.00 N ATOM 1134 CA PRO A 79 3.801 -45.488 17.082 1.00 0.00 C ATOM 1135 C PRO A 79 2.597 -45.974 17.882 1.00 0.00 C ATOM 1136 O PRO A 79 2.052 -47.042 17.612 1.00 0.00 O ATOM 1137 CB PRO A 79 5.055 -45.471 17.959 1.00 0.00 C ATOM 1138 CG PRO A 79 5.139 -44.075 18.473 1.00 0.00 C ATOM 1139 CD PRO A 79 4.525 -43.186 17.438 1.00 0.00 C ATOM 0 HA PRO A 79 3.868 -46.166 16.231 1.00 0.00 H new ATOM 0 HB2 PRO A 79 4.977 -46.189 18.775 1.00 0.00 H new ATOM 0 HB3 PRO A 79 5.943 -45.736 17.385 1.00 0.00 H new ATOM 0 HG2 PRO A 79 4.611 -43.982 19.422 1.00 0.00 H new ATOM 0 HG3 PRO A 79 6.176 -43.794 18.656 1.00 0.00 H new ATOM 0 HD2 PRO A 79 3.949 -42.380 17.894 1.00 0.00 H new ATOM 0 HD3 PRO A 79 5.285 -42.720 16.811 1.00 0.00 H new ATOM 1147 N ASN A 80 2.189 -45.181 18.867 1.00 0.00 N ATOM 1148 CA ASN A 80 1.049 -45.530 19.707 1.00 0.00 C ATOM 1149 C ASN A 80 -0.204 -44.781 19.263 1.00 0.00 C ATOM 1150 O ASN A 80 -1.268 -45.376 19.091 1.00 0.00 O ATOM 1151 CB ASN A 80 1.353 -45.215 21.172 1.00 0.00 C ATOM 1152 CG ASN A 80 1.877 -43.805 21.364 1.00 0.00 C ATOM 1153 OD1 ASN A 80 1.104 -42.855 21.488 1.00 0.00 O ATOM 1154 ND2 ASN A 80 3.197 -43.664 21.389 1.00 0.00 N ATOM 0 H ASN A 80 2.631 -44.292 19.103 1.00 0.00 H new ATOM 0 HA ASN A 80 0.867 -46.600 19.603 1.00 0.00 H new ATOM 0 HB2 ASN A 80 0.448 -45.347 21.764 1.00 0.00 H new ATOM 0 HB3 ASN A 80 2.087 -45.927 21.549 1.00 0.00 H new ATOM 0 HD21 ASN A 80 3.609 -42.739 21.515 1.00 0.00 H new ATOM 0 HD22 ASN A 80 3.799 -44.480 21.282 1.00 0.00 H new ATOM 1161 N SER A 81 -0.070 -43.472 19.078 1.00 0.00 N ATOM 1162 CA SER A 81 -1.191 -42.640 18.658 1.00 0.00 C ATOM 1163 C SER A 81 -1.780 -43.146 17.344 1.00 0.00 C ATOM 1164 O SER A 81 -2.986 -43.058 17.118 1.00 0.00 O ATOM 1165 CB SER A 81 -0.744 -41.185 18.503 1.00 0.00 C ATOM 1166 OG SER A 81 -1.356 -40.580 17.377 1.00 0.00 O ATOM 0 H SER A 81 0.804 -42.964 19.212 1.00 0.00 H new ATOM 0 HA SER A 81 -1.961 -42.696 19.427 1.00 0.00 H new ATOM 0 HB2 SER A 81 -0.998 -40.625 19.403 1.00 0.00 H new ATOM 0 HB3 SER A 81 0.340 -41.144 18.397 1.00 0.00 H new ATOM 0 HG SER A 81 -1.352 -39.606 17.486 1.00 0.00 H new ATOM 1172 N GLY A 82 -0.918 -43.675 16.482 1.00 0.00 N ATOM 1173 CA GLY A 82 -1.370 -44.187 15.201 1.00 0.00 C ATOM 1174 C GLY A 82 -2.047 -43.125 14.358 1.00 0.00 C ATOM 1175 O GLY A 82 -2.828 -43.439 13.460 1.00 0.00 O ATOM 0 H GLY A 82 0.085 -43.758 16.647 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -0.518 -44.592 14.654 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.064 -45.011 15.367 1.00 0.00 H new ATOM 1179 N LEU A 83 -1.748 -41.863 14.648 1.00 0.00 N ATOM 1180 CA LEU A 83 -2.335 -40.749 13.910 1.00 0.00 C ATOM 1181 C LEU A 83 -1.320 -40.137 12.950 1.00 0.00 C ATOM 1182 O LEU A 83 -0.109 -40.201 13.164 1.00 0.00 O ATOM 1183 CB LEU A 83 -2.844 -39.682 14.880 1.00 0.00 C ATOM 1184 CG LEU A 83 -3.972 -40.112 15.819 1.00 0.00 C ATOM 1185 CD1 LEU A 83 -4.269 -39.017 16.832 1.00 0.00 C ATOM 1186 CD2 LEU A 83 -5.223 -40.460 15.026 1.00 0.00 C ATOM 0 H LEU A 83 -1.103 -41.586 15.388 1.00 0.00 H new ATOM 0 HA LEU A 83 -3.173 -41.132 13.328 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -2.005 -39.340 15.486 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.188 -38.826 14.299 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.649 -41.002 16.360 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.074 -39.340 17.492 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -3.375 -38.815 17.422 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -4.571 -38.110 16.309 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.015 -40.764 15.711 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -5.548 -39.588 14.459 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.003 -41.278 14.340 1.00 0.00 H new ATOM 1198 N PRO A 84 -1.823 -39.528 11.866 1.00 0.00 N ATOM 1199 CA PRO A 84 -0.977 -38.890 10.853 1.00 0.00 C ATOM 1200 C PRO A 84 -0.292 -37.633 11.377 1.00 0.00 C ATOM 1201 O PRO A 84 -0.940 -36.614 11.617 1.00 0.00 O ATOM 1202 CB PRO A 84 -1.965 -38.535 9.739 1.00 0.00 C ATOM 1203 CG PRO A 84 -3.285 -38.430 10.422 1.00 0.00 C ATOM 1204 CD PRO A 84 -3.256 -39.414 11.547 1.00 0.00 C ATOM 0 HA PRO A 84 -0.165 -39.542 10.531 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -1.695 -37.597 9.254 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -1.980 -39.302 8.964 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.451 -37.419 10.794 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -4.099 -38.653 9.732 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -3.831 -39.062 12.403 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -3.679 -40.374 11.252 1.00 0.00 H new ATOM 1212 N LYS A 85 1.023 -37.711 11.553 1.00 0.00 N ATOM 1213 CA LYS A 85 1.797 -36.579 12.048 1.00 0.00 C ATOM 1214 C LYS A 85 2.741 -36.053 10.971 1.00 0.00 C ATOM 1215 O LYS A 85 3.496 -36.815 10.368 1.00 0.00 O ATOM 1216 CB LYS A 85 2.597 -36.984 13.288 1.00 0.00 C ATOM 1217 CG LYS A 85 1.749 -37.616 14.379 1.00 0.00 C ATOM 1218 CD LYS A 85 1.644 -36.713 15.597 1.00 0.00 C ATOM 1219 CE LYS A 85 0.902 -37.397 16.735 1.00 0.00 C ATOM 1220 NZ LYS A 85 0.162 -36.419 17.581 1.00 0.00 N ATOM 0 H LYS A 85 1.575 -38.547 11.360 1.00 0.00 H new ATOM 0 HA LYS A 85 1.100 -35.785 12.316 1.00 0.00 H new ATOM 0 HB2 LYS A 85 3.377 -37.686 12.994 1.00 0.00 H new ATOM 0 HB3 LYS A 85 3.096 -36.103 13.692 1.00 0.00 H new ATOM 0 HG2 LYS A 85 0.752 -37.823 13.992 1.00 0.00 H new ATOM 0 HG3 LYS A 85 2.183 -38.572 14.670 1.00 0.00 H new ATOM 0 HD2 LYS A 85 2.643 -36.431 15.930 1.00 0.00 H new ATOM 0 HD3 LYS A 85 1.127 -35.792 15.325 1.00 0.00 H new ATOM 0 HE2 LYS A 85 0.202 -38.126 16.326 1.00 0.00 H new ATOM 0 HE3 LYS A 85 1.612 -37.948 17.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -0.331 -36.924 18.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 0.832 -35.738 17.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -0.533 -35.911 16.997 1.00 0.00 H new ATOM 1234 N PHE A 86 2.693 -34.746 10.736 1.00 0.00 N ATOM 1235 CA PHE A 86 3.545 -34.119 9.732 1.00 0.00 C ATOM 1236 C PHE A 86 4.853 -33.636 10.352 1.00 0.00 C ATOM 1237 O PHE A 86 4.853 -32.969 11.387 1.00 0.00 O ATOM 1238 CB PHE A 86 2.815 -32.945 9.075 1.00 0.00 C ATOM 1239 CG PHE A 86 1.464 -33.309 8.529 1.00 0.00 C ATOM 1240 CD1 PHE A 86 1.302 -34.433 7.735 1.00 0.00 C ATOM 1241 CD2 PHE A 86 0.355 -32.527 8.809 1.00 0.00 C ATOM 1242 CE1 PHE A 86 0.060 -34.771 7.232 1.00 0.00 C ATOM 1243 CE2 PHE A 86 -0.889 -32.860 8.309 1.00 0.00 C ATOM 1244 CZ PHE A 86 -1.037 -33.983 7.518 1.00 0.00 C ATOM 0 H PHE A 86 2.074 -34.101 11.227 1.00 0.00 H new ATOM 0 HA PHE A 86 3.778 -34.865 8.972 1.00 0.00 H new ATOM 0 HB2 PHE A 86 2.699 -32.145 9.806 1.00 0.00 H new ATOM 0 HB3 PHE A 86 3.431 -32.551 8.266 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.157 -35.052 7.506 1.00 0.00 H new ATOM 0 HD2 PHE A 86 0.464 -31.647 9.425 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.052 -35.651 6.616 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -1.746 -32.243 8.536 1.00 0.00 H new ATOM 0 HZ PHE A 86 -2.008 -34.244 7.124 1.00 0.00 H new ATOM 1254 N VAL A 87 5.966 -33.979 9.713 1.00 0.00 N ATOM 1255 CA VAL A 87 7.281 -33.581 10.201 1.00 0.00 C ATOM 1256 C VAL A 87 7.892 -32.501 9.315 1.00 0.00 C ATOM 1257 O VAL A 87 7.718 -32.510 8.096 1.00 0.00 O ATOM 1258 CB VAL A 87 8.244 -34.782 10.264 1.00 0.00 C ATOM 1259 CG1 VAL A 87 9.542 -34.390 10.952 1.00 0.00 C ATOM 1260 CG2 VAL A 87 7.586 -35.954 10.976 1.00 0.00 C ATOM 0 H VAL A 87 5.984 -34.532 8.856 1.00 0.00 H new ATOM 0 HA VAL A 87 7.139 -33.185 11.207 1.00 0.00 H new ATOM 0 HB VAL A 87 8.480 -35.091 9.246 1.00 0.00 H new ATOM 0 HG11 VAL A 87 10.210 -35.251 10.987 1.00 0.00 H new ATOM 0 HG12 VAL A 87 10.019 -33.583 10.396 1.00 0.00 H new ATOM 0 HG13 VAL A 87 9.329 -34.054 11.967 1.00 0.00 H new ATOM 0 HG21 VAL A 87 8.280 -36.794 11.012 1.00 0.00 H new ATOM 0 HG22 VAL A 87 7.320 -35.660 11.991 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.686 -36.249 10.436 1.00 0.00 H new ATOM 1270 N LEU A 88 8.608 -31.570 9.936 1.00 0.00 N ATOM 1271 CA LEU A 88 9.247 -30.481 9.204 1.00 0.00 C ATOM 1272 C LEU A 88 10.758 -30.500 9.409 1.00 0.00 C ATOM 1273 O LEU A 88 11.241 -30.455 10.541 1.00 0.00 O ATOM 1274 CB LEU A 88 8.676 -29.135 9.654 1.00 0.00 C ATOM 1275 CG LEU A 88 8.742 -28.002 8.629 1.00 0.00 C ATOM 1276 CD1 LEU A 88 10.187 -27.663 8.299 1.00 0.00 C ATOM 1277 CD2 LEU A 88 7.979 -28.380 7.367 1.00 0.00 C ATOM 0 H LEU A 88 8.761 -31.547 10.944 1.00 0.00 H new ATOM 0 HA LEU A 88 9.042 -30.619 8.142 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.634 -29.282 9.937 1.00 0.00 H new ATOM 0 HB3 LEU A 88 9.209 -28.818 10.551 1.00 0.00 H new ATOM 0 HG LEU A 88 8.274 -27.118 9.062 1.00 0.00 H new ATOM 0 HD11 LEU A 88 10.213 -26.855 7.568 1.00 0.00 H new ATOM 0 HD12 LEU A 88 10.703 -27.349 9.206 1.00 0.00 H new ATOM 0 HD13 LEU A 88 10.682 -28.542 7.886 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.036 -27.562 6.648 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.418 -29.277 6.931 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.935 -28.571 7.616 1.00 0.00 H new ATOM 1289 N ILE A 89 11.498 -30.564 8.308 1.00 0.00 N ATOM 1290 CA ILE A 89 12.955 -30.585 8.367 1.00 0.00 C ATOM 1291 C ILE A 89 13.553 -29.418 7.589 1.00 0.00 C ATOM 1292 O ILE A 89 13.208 -29.188 6.431 1.00 0.00 O ATOM 1293 CB ILE A 89 13.522 -31.904 7.809 1.00 0.00 C ATOM 1294 CG1 ILE A 89 12.966 -33.095 8.592 1.00 0.00 C ATOM 1295 CG2 ILE A 89 15.042 -31.890 7.862 1.00 0.00 C ATOM 1296 CD1 ILE A 89 13.101 -34.413 7.863 1.00 0.00 C ATOM 0 H ILE A 89 11.113 -30.602 7.364 1.00 0.00 H new ATOM 0 HA ILE A 89 13.230 -30.497 9.418 1.00 0.00 H new ATOM 0 HB ILE A 89 13.215 -32.004 6.768 1.00 0.00 H new ATOM 0 HG12 ILE A 89 13.483 -33.164 9.549 1.00 0.00 H new ATOM 0 HG13 ILE A 89 11.913 -32.916 8.811 1.00 0.00 H new ATOM 0 HG21 ILE A 89 15.429 -32.828 7.465 1.00 0.00 H new ATOM 0 HG22 ILE A 89 15.419 -31.060 7.265 1.00 0.00 H new ATOM 0 HG23 ILE A 89 15.369 -31.771 8.895 1.00 0.00 H new ATOM 0 HD11 ILE A 89 12.686 -35.213 8.477 1.00 0.00 H new ATOM 0 HD12 ILE A 89 12.560 -34.363 6.918 1.00 0.00 H new ATOM 0 HD13 ILE A 89 14.154 -34.615 7.668 1.00 0.00 H new ATOM 1308 N ASN A 90 14.455 -28.684 8.234 1.00 0.00 N ATOM 1309 CA ASN A 90 15.103 -27.541 7.602 1.00 0.00 C ATOM 1310 C ASN A 90 16.461 -27.934 7.028 1.00 0.00 C ATOM 1311 O ASN A 90 17.503 -27.625 7.606 1.00 0.00 O ATOM 1312 CB ASN A 90 15.274 -26.403 8.611 1.00 0.00 C ATOM 1313 CG ASN A 90 14.009 -25.583 8.777 1.00 0.00 C ATOM 1314 OD1 ASN A 90 13.749 -24.659 8.007 1.00 0.00 O ATOM 1315 ND2 ASN A 90 13.215 -25.919 9.787 1.00 0.00 N ATOM 0 H ASN A 90 14.753 -28.861 9.193 1.00 0.00 H new ATOM 0 HA ASN A 90 14.467 -27.201 6.785 1.00 0.00 H new ATOM 0 HB2 ASN A 90 15.564 -26.818 9.576 1.00 0.00 H new ATOM 0 HB3 ASN A 90 16.086 -25.752 8.286 1.00 0.00 H new ATOM 0 HD21 ASN A 90 12.350 -25.403 9.949 1.00 0.00 H new ATOM 0 HD22 ASN A 90 13.470 -26.693 10.401 1.00 0.00 H new ATOM 1322 N TRP A 91 16.440 -28.616 5.889 1.00 0.00 N ATOM 1323 CA TRP A 91 17.669 -29.051 5.236 1.00 0.00 C ATOM 1324 C TRP A 91 18.633 -27.884 5.057 1.00 0.00 C ATOM 1325 O TRP A 91 18.278 -26.854 4.482 1.00 0.00 O ATOM 1326 CB TRP A 91 17.355 -29.682 3.879 1.00 0.00 C ATOM 1327 CG TRP A 91 18.576 -30.133 3.136 1.00 0.00 C ATOM 1328 CD1 TRP A 91 19.078 -29.599 1.984 1.00 0.00 C ATOM 1329 CD2 TRP A 91 19.446 -31.212 3.493 1.00 0.00 C ATOM 1330 NE1 TRP A 91 20.209 -30.280 1.603 1.00 0.00 N ATOM 1331 CE2 TRP A 91 20.456 -31.274 2.513 1.00 0.00 C ATOM 1332 CE3 TRP A 91 19.473 -32.130 4.546 1.00 0.00 C ATOM 1333 CZ2 TRP A 91 21.478 -32.219 2.557 1.00 0.00 C ATOM 1334 CZ3 TRP A 91 20.487 -33.067 4.588 1.00 0.00 C ATOM 1335 CH2 TRP A 91 21.479 -33.105 3.599 1.00 0.00 C ATOM 0 H TRP A 91 15.586 -28.880 5.398 1.00 0.00 H new ATOM 0 HA TRP A 91 18.145 -29.796 5.873 1.00 0.00 H new ATOM 0 HB2 TRP A 91 16.693 -30.535 4.028 1.00 0.00 H new ATOM 0 HB3 TRP A 91 16.813 -28.961 3.268 1.00 0.00 H new ATOM 0 HD1 TRP A 91 18.649 -28.764 1.450 1.00 0.00 H new ATOM 0 HE1 TRP A 91 20.773 -30.078 0.777 1.00 0.00 H new ATOM 0 HE3 TRP A 91 18.714 -32.107 5.314 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 22.243 -32.251 1.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 20.516 -33.782 5.397 1.00 0.00 H new ATOM 0 HH2 TRP A 91 22.260 -33.849 3.661 1.00 0.00 H new ATOM 1346 N THR A 92 19.856 -28.050 5.552 1.00 0.00 N ATOM 1347 CA THR A 92 20.871 -27.009 5.448 1.00 0.00 C ATOM 1348 C THR A 92 22.226 -27.598 5.072 1.00 0.00 C ATOM 1349 O THR A 92 23.002 -27.995 5.940 1.00 0.00 O ATOM 1350 CB THR A 92 21.011 -26.227 6.767 1.00 0.00 C ATOM 1351 OG1 THR A 92 19.718 -25.856 7.257 1.00 0.00 O ATOM 1352 CG2 THR A 92 21.861 -24.980 6.569 1.00 0.00 C ATOM 0 H THR A 92 20.167 -28.896 6.029 1.00 0.00 H new ATOM 0 HA THR A 92 20.545 -26.326 4.663 1.00 0.00 H new ATOM 0 HB THR A 92 21.503 -26.872 7.495 1.00 0.00 H new ATOM 0 HG1 THR A 92 19.190 -26.663 7.431 1.00 0.00 H new ATOM 0 HG21 THR A 92 21.946 -24.444 7.514 1.00 0.00 H new ATOM 0 HG22 THR A 92 22.854 -25.268 6.224 1.00 0.00 H new ATOM 0 HG23 THR A 92 21.392 -24.334 5.826 1.00 0.00 H new ATOM 1360 N GLY A 93 22.504 -27.651 3.773 1.00 0.00 N ATOM 1361 CA GLY A 93 23.766 -28.192 3.306 1.00 0.00 C ATOM 1362 C GLY A 93 24.960 -27.551 3.986 1.00 0.00 C ATOM 1363 O GLY A 93 25.018 -26.330 4.129 1.00 0.00 O ATOM 0 H GLY A 93 21.877 -27.329 3.036 1.00 0.00 H new ATOM 0 HA2 GLY A 93 23.785 -29.267 3.484 1.00 0.00 H new ATOM 0 HA3 GLY A 93 23.844 -28.046 2.229 1.00 0.00 H new ATOM 1367 N GLU A 94 25.913 -28.376 4.408 1.00 0.00 N ATOM 1368 CA GLU A 94 27.109 -27.880 5.079 1.00 0.00 C ATOM 1369 C GLU A 94 27.974 -27.068 4.120 1.00 0.00 C ATOM 1370 O GLU A 94 28.676 -26.145 4.530 1.00 0.00 O ATOM 1371 CB GLU A 94 27.919 -29.045 5.652 1.00 0.00 C ATOM 1372 CG GLU A 94 28.425 -30.012 4.594 1.00 0.00 C ATOM 1373 CD GLU A 94 28.412 -31.453 5.067 1.00 0.00 C ATOM 1374 OE1 GLU A 94 29.135 -31.766 6.036 1.00 0.00 O ATOM 1375 OE2 GLU A 94 27.678 -32.267 4.469 1.00 0.00 O ATOM 0 H GLU A 94 25.880 -29.389 4.297 1.00 0.00 H new ATOM 0 HA GLU A 94 26.793 -27.230 5.895 1.00 0.00 H new ATOM 0 HB2 GLU A 94 28.770 -28.648 6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 94 27.301 -29.590 6.365 1.00 0.00 H new ATOM 0 HG2 GLU A 94 27.808 -29.921 3.700 1.00 0.00 H new ATOM 0 HG3 GLU A 94 29.441 -29.736 4.310 1.00 0.00 H new ATOM 1382 N GLY A 95 27.917 -27.419 2.839 1.00 0.00 N ATOM 1383 CA GLY A 95 28.700 -26.714 1.841 1.00 0.00 C ATOM 1384 C GLY A 95 28.364 -25.237 1.778 1.00 0.00 C ATOM 1385 O GLY A 95 29.149 -24.436 1.270 1.00 0.00 O ATOM 0 H GLY A 95 27.343 -28.179 2.475 1.00 0.00 H new ATOM 0 HA2 GLY A 95 29.760 -26.833 2.065 1.00 0.00 H new ATOM 0 HA3 GLY A 95 28.528 -27.165 0.864 1.00 0.00 H new ATOM 1389 N VAL A 96 27.194 -24.875 2.295 1.00 0.00 N ATOM 1390 CA VAL A 96 26.756 -23.485 2.295 1.00 0.00 C ATOM 1391 C VAL A 96 27.553 -22.657 3.297 1.00 0.00 C ATOM 1392 O VAL A 96 27.596 -22.974 4.485 1.00 0.00 O ATOM 1393 CB VAL A 96 25.257 -23.369 2.628 1.00 0.00 C ATOM 1394 CG1 VAL A 96 24.803 -21.919 2.554 1.00 0.00 C ATOM 1395 CG2 VAL A 96 24.434 -24.242 1.692 1.00 0.00 C ATOM 0 H VAL A 96 26.533 -25.526 2.719 1.00 0.00 H new ATOM 0 HA VAL A 96 26.929 -23.099 1.290 1.00 0.00 H new ATOM 0 HB VAL A 96 25.102 -23.721 3.648 1.00 0.00 H new ATOM 0 HG11 VAL A 96 23.741 -21.858 2.792 1.00 0.00 H new ATOM 0 HG12 VAL A 96 25.370 -21.323 3.269 1.00 0.00 H new ATOM 0 HG13 VAL A 96 24.972 -21.536 1.548 1.00 0.00 H new ATOM 0 HG21 VAL A 96 23.377 -24.148 1.942 1.00 0.00 H new ATOM 0 HG22 VAL A 96 24.593 -23.922 0.662 1.00 0.00 H new ATOM 0 HG23 VAL A 96 24.741 -25.282 1.801 1.00 0.00 H new ATOM 1405 N ASN A 97 28.184 -21.594 2.809 1.00 0.00 N ATOM 1406 CA ASN A 97 28.981 -20.720 3.662 1.00 0.00 C ATOM 1407 C ASN A 97 28.148 -20.189 4.825 1.00 0.00 C ATOM 1408 O ASN A 97 26.942 -20.424 4.898 1.00 0.00 O ATOM 1409 CB ASN A 97 29.543 -19.552 2.848 1.00 0.00 C ATOM 1410 CG ASN A 97 28.500 -18.921 1.947 1.00 0.00 C ATOM 1411 OD1 ASN A 97 28.036 -19.538 0.988 1.00 0.00 O ATOM 1412 ND2 ASN A 97 28.126 -17.683 2.252 1.00 0.00 N ATOM 0 H ASN A 97 28.159 -21.317 1.828 1.00 0.00 H new ATOM 0 HA ASN A 97 29.808 -21.304 4.066 1.00 0.00 H new ATOM 0 HB2 ASN A 97 29.938 -18.796 3.527 1.00 0.00 H new ATOM 0 HB3 ASN A 97 30.378 -19.904 2.242 1.00 0.00 H new ATOM 0 HD21 ASN A 97 27.428 -17.206 1.682 1.00 0.00 H new ATOM 0 HD22 ASN A 97 28.537 -17.210 3.056 1.00 0.00 H new ATOM 1419 N ASP A 98 28.801 -19.471 5.733 1.00 0.00 N ATOM 1420 CA ASP A 98 28.121 -18.904 6.892 1.00 0.00 C ATOM 1421 C ASP A 98 27.296 -17.684 6.496 1.00 0.00 C ATOM 1422 O ASP A 98 26.157 -17.523 6.933 1.00 0.00 O ATOM 1423 CB ASP A 98 29.138 -18.521 7.969 1.00 0.00 C ATOM 1424 CG ASP A 98 30.232 -19.558 8.128 1.00 0.00 C ATOM 1425 OD1 ASP A 98 29.903 -20.761 8.200 1.00 0.00 O ATOM 1426 OD2 ASP A 98 31.417 -19.167 8.179 1.00 0.00 O ATOM 0 H ASP A 98 29.800 -19.268 5.689 1.00 0.00 H new ATOM 0 HA ASP A 98 27.446 -19.661 7.293 1.00 0.00 H new ATOM 0 HB2 ASP A 98 29.586 -17.560 7.716 1.00 0.00 H new ATOM 0 HB3 ASP A 98 28.623 -18.392 8.921 1.00 0.00 H new ATOM 1431 N VAL A 99 27.880 -16.825 5.667 1.00 0.00 N ATOM 1432 CA VAL A 99 27.200 -15.619 5.211 1.00 0.00 C ATOM 1433 C VAL A 99 25.888 -15.958 4.512 1.00 0.00 C ATOM 1434 O VAL A 99 24.963 -15.147 4.478 1.00 0.00 O ATOM 1435 CB VAL A 99 28.085 -14.803 4.250 1.00 0.00 C ATOM 1436 CG1 VAL A 99 27.435 -13.466 3.930 1.00 0.00 C ATOM 1437 CG2 VAL A 99 29.471 -14.603 4.844 1.00 0.00 C ATOM 0 H VAL A 99 28.823 -16.942 5.297 1.00 0.00 H new ATOM 0 HA VAL A 99 26.992 -15.020 6.098 1.00 0.00 H new ATOM 0 HB VAL A 99 28.190 -15.360 3.319 1.00 0.00 H new ATOM 0 HG11 VAL A 99 28.075 -12.904 3.250 1.00 0.00 H new ATOM 0 HG12 VAL A 99 26.466 -13.636 3.460 1.00 0.00 H new ATOM 0 HG13 VAL A 99 27.297 -12.899 4.851 1.00 0.00 H new ATOM 0 HG21 VAL A 99 30.083 -14.025 4.152 1.00 0.00 H new ATOM 0 HG22 VAL A 99 29.388 -14.068 5.790 1.00 0.00 H new ATOM 0 HG23 VAL A 99 29.936 -15.573 5.016 1.00 0.00 H new ATOM 1447 N ARG A 100 25.815 -17.163 3.956 1.00 0.00 N ATOM 1448 CA ARG A 100 24.617 -17.610 3.256 1.00 0.00 C ATOM 1449 C ARG A 100 23.670 -18.335 4.209 1.00 0.00 C ATOM 1450 O ARG A 100 22.456 -18.140 4.163 1.00 0.00 O ATOM 1451 CB ARG A 100 24.993 -18.532 2.094 1.00 0.00 C ATOM 1452 CG ARG A 100 23.800 -18.993 1.273 1.00 0.00 C ATOM 1453 CD ARG A 100 23.635 -18.159 0.012 1.00 0.00 C ATOM 1454 NE ARG A 100 23.158 -18.957 -1.114 1.00 0.00 N ATOM 1455 CZ ARG A 100 22.712 -18.432 -2.249 1.00 0.00 C ATOM 1456 NH1 ARG A 100 22.681 -17.116 -2.409 1.00 0.00 N ATOM 1457 NH2 ARG A 100 22.294 -19.224 -3.229 1.00 0.00 N ATOM 0 H ARG A 100 26.571 -17.847 3.977 1.00 0.00 H new ATOM 0 HA ARG A 100 24.107 -16.731 2.862 1.00 0.00 H new ATOM 0 HB2 ARG A 100 25.694 -18.012 1.441 1.00 0.00 H new ATOM 0 HB3 ARG A 100 25.512 -19.406 2.488 1.00 0.00 H new ATOM 0 HG2 ARG A 100 23.926 -20.041 1.003 1.00 0.00 H new ATOM 0 HG3 ARG A 100 22.894 -18.926 1.876 1.00 0.00 H new ATOM 0 HD2 ARG A 100 22.933 -17.347 0.204 1.00 0.00 H new ATOM 0 HD3 ARG A 100 24.590 -17.701 -0.247 1.00 0.00 H new ATOM 0 HE ARG A 100 23.168 -19.973 -1.024 1.00 0.00 H new ATOM 0 HH11 ARG A 100 23.000 -16.503 -1.659 1.00 0.00 H new ATOM 0 HH12 ARG A 100 22.338 -16.716 -3.282 1.00 0.00 H new ATOM 0 HH21 ARG A 100 22.315 -20.237 -3.110 1.00 0.00 H new ATOM 0 HH22 ARG A 100 21.952 -18.820 -4.101 1.00 0.00 H new ATOM 1471 N LYS A 101 24.235 -19.174 5.071 1.00 0.00 N ATOM 1472 CA LYS A 101 23.443 -19.928 6.035 1.00 0.00 C ATOM 1473 C LYS A 101 22.523 -19.004 6.826 1.00 0.00 C ATOM 1474 O LYS A 101 21.352 -19.313 7.041 1.00 0.00 O ATOM 1475 CB LYS A 101 24.360 -20.693 6.992 1.00 0.00 C ATOM 1476 CG LYS A 101 24.699 -22.096 6.518 1.00 0.00 C ATOM 1477 CD LYS A 101 25.312 -22.928 7.632 1.00 0.00 C ATOM 1478 CE LYS A 101 26.740 -23.336 7.303 1.00 0.00 C ATOM 1479 NZ LYS A 101 27.553 -23.551 8.532 1.00 0.00 N ATOM 0 H LYS A 101 25.239 -19.349 5.121 1.00 0.00 H new ATOM 0 HA LYS A 101 22.828 -20.639 5.484 1.00 0.00 H new ATOM 0 HB2 LYS A 101 25.284 -20.130 7.124 1.00 0.00 H new ATOM 0 HB3 LYS A 101 23.881 -20.754 7.969 1.00 0.00 H new ATOM 0 HG2 LYS A 101 23.796 -22.585 6.152 1.00 0.00 H new ATOM 0 HG3 LYS A 101 25.394 -22.040 5.680 1.00 0.00 H new ATOM 0 HD2 LYS A 101 25.300 -22.358 8.561 1.00 0.00 H new ATOM 0 HD3 LYS A 101 24.707 -23.819 7.797 1.00 0.00 H new ATOM 0 HE2 LYS A 101 26.729 -24.251 6.710 1.00 0.00 H new ATOM 0 HE3 LYS A 101 27.206 -22.565 6.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 28.519 -23.828 8.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 27.585 -22.671 9.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 27.123 -24.305 9.105 1.00 0.00 H new ATOM 1493 N GLY A 102 23.062 -17.866 7.256 1.00 0.00 N ATOM 1494 CA GLY A 102 22.275 -16.914 8.017 1.00 0.00 C ATOM 1495 C GLY A 102 21.261 -16.183 7.159 1.00 0.00 C ATOM 1496 O GLY A 102 20.204 -15.780 7.643 1.00 0.00 O ATOM 0 H GLY A 102 24.029 -17.587 7.091 1.00 0.00 H new ATOM 0 HA2 GLY A 102 21.757 -17.436 8.821 1.00 0.00 H new ATOM 0 HA3 GLY A 102 22.941 -16.189 8.485 1.00 0.00 H new ATOM 1500 N ALA A 103 21.585 -16.009 5.882 1.00 0.00 N ATOM 1501 CA ALA A 103 20.694 -15.322 4.955 1.00 0.00 C ATOM 1502 C ALA A 103 19.460 -16.165 4.652 1.00 0.00 C ATOM 1503 O ALA A 103 18.359 -15.637 4.494 1.00 0.00 O ATOM 1504 CB ALA A 103 21.432 -14.981 3.669 1.00 0.00 C ATOM 0 H ALA A 103 22.458 -16.334 5.466 1.00 0.00 H new ATOM 0 HA ALA A 103 20.362 -14.397 5.427 1.00 0.00 H new ATOM 0 HB1 ALA A 103 20.755 -14.468 2.986 1.00 0.00 H new ATOM 0 HB2 ALA A 103 22.278 -14.332 3.896 1.00 0.00 H new ATOM 0 HB3 ALA A 103 21.793 -15.898 3.202 1.00 0.00 H new ATOM 1510 N CYS A 104 19.652 -17.477 4.571 1.00 0.00 N ATOM 1511 CA CYS A 104 18.554 -18.394 4.285 1.00 0.00 C ATOM 1512 C CYS A 104 17.625 -18.522 5.488 1.00 0.00 C ATOM 1513 O CYS A 104 16.430 -18.773 5.338 1.00 0.00 O ATOM 1514 CB CYS A 104 19.098 -19.769 3.896 1.00 0.00 C ATOM 1515 SG CYS A 104 19.633 -19.891 2.173 1.00 0.00 S ATOM 0 H CYS A 104 20.557 -17.930 4.699 1.00 0.00 H new ATOM 0 HA CYS A 104 17.983 -17.988 3.450 1.00 0.00 H new ATOM 0 HB2 CYS A 104 19.940 -20.012 4.545 1.00 0.00 H new ATOM 0 HB3 CYS A 104 18.328 -20.518 4.080 1.00 0.00 H new ATOM 0 HG CYS A 104 20.751 -20.551 2.112 1.00 0.00 H new ATOM 1521 N ALA A 105 18.184 -18.351 6.682 1.00 0.00 N ATOM 1522 CA ALA A 105 17.407 -18.447 7.911 1.00 0.00 C ATOM 1523 C ALA A 105 16.230 -17.477 7.894 1.00 0.00 C ATOM 1524 O ALA A 105 15.150 -17.788 8.395 1.00 0.00 O ATOM 1525 CB ALA A 105 18.294 -18.183 9.118 1.00 0.00 C ATOM 0 H ALA A 105 19.173 -18.145 6.824 1.00 0.00 H new ATOM 0 HA ALA A 105 17.008 -19.459 7.981 1.00 0.00 H new ATOM 0 HB1 ALA A 105 17.700 -18.258 10.029 1.00 0.00 H new ATOM 0 HB2 ALA A 105 19.098 -18.919 9.147 1.00 0.00 H new ATOM 0 HB3 ALA A 105 18.721 -17.183 9.044 1.00 0.00 H new ATOM 1531 N SER A 106 16.447 -16.301 7.314 1.00 0.00 N ATOM 1532 CA SER A 106 15.406 -15.284 7.236 1.00 0.00 C ATOM 1533 C SER A 106 14.213 -15.788 6.429 1.00 0.00 C ATOM 1534 O SER A 106 13.073 -15.389 6.670 1.00 0.00 O ATOM 1535 CB SER A 106 15.959 -14.005 6.604 1.00 0.00 C ATOM 1536 OG SER A 106 16.524 -13.154 7.587 1.00 0.00 O ATOM 0 H SER A 106 17.335 -16.029 6.891 1.00 0.00 H new ATOM 0 HA SER A 106 15.071 -15.065 8.250 1.00 0.00 H new ATOM 0 HB2 SER A 106 16.715 -14.260 5.861 1.00 0.00 H new ATOM 0 HB3 SER A 106 15.161 -13.480 6.079 1.00 0.00 H new ATOM 0 HG SER A 106 16.872 -12.344 7.158 1.00 0.00 H new ATOM 1542 N HIS A 107 14.485 -16.667 5.470 1.00 0.00 N ATOM 1543 CA HIS A 107 13.435 -17.228 4.627 1.00 0.00 C ATOM 1544 C HIS A 107 12.665 -18.316 5.369 1.00 0.00 C ATOM 1545 O HIS A 107 11.484 -18.545 5.106 1.00 0.00 O ATOM 1546 CB HIS A 107 14.034 -17.797 3.341 1.00 0.00 C ATOM 1547 CG HIS A 107 14.379 -16.751 2.326 1.00 0.00 C ATOM 1548 ND1 HIS A 107 14.430 -17.004 0.972 1.00 0.00 N ATOM 1549 CD2 HIS A 107 14.688 -15.442 2.475 1.00 0.00 C ATOM 1550 CE1 HIS A 107 14.759 -15.896 0.331 1.00 0.00 C ATOM 1551 NE2 HIS A 107 14.920 -14.933 1.220 1.00 0.00 N ATOM 0 H HIS A 107 15.423 -17.006 5.257 1.00 0.00 H new ATOM 0 HA HIS A 107 12.741 -16.427 4.372 1.00 0.00 H new ATOM 0 HB2 HIS A 107 14.933 -18.362 3.588 1.00 0.00 H new ATOM 0 HB3 HIS A 107 13.327 -18.500 2.900 1.00 0.00 H new ATOM 0 HD2 HIS A 107 14.742 -14.899 3.407 1.00 0.00 H new ATOM 0 HE1 HIS A 107 14.876 -15.795 -0.738 1.00 0.00 H new ATOM 0 HE2 HIS A 107 15.175 -13.968 1.009 1.00 0.00 H new ATOM 1559 N VAL A 108 13.342 -18.986 6.296 1.00 0.00 N ATOM 1560 CA VAL A 108 12.722 -20.050 7.077 1.00 0.00 C ATOM 1561 C VAL A 108 11.443 -19.565 7.749 1.00 0.00 C ATOM 1562 O VAL A 108 10.475 -20.315 7.880 1.00 0.00 O ATOM 1563 CB VAL A 108 13.682 -20.588 8.154 1.00 0.00 C ATOM 1564 CG1 VAL A 108 13.008 -21.678 8.974 1.00 0.00 C ATOM 1565 CG2 VAL A 108 14.963 -21.105 7.516 1.00 0.00 C ATOM 0 H VAL A 108 14.320 -18.811 6.525 1.00 0.00 H new ATOM 0 HA VAL A 108 12.481 -20.854 6.381 1.00 0.00 H new ATOM 0 HB VAL A 108 13.942 -19.770 8.825 1.00 0.00 H new ATOM 0 HG11 VAL A 108 13.702 -22.046 9.730 1.00 0.00 H new ATOM 0 HG12 VAL A 108 12.122 -21.271 9.462 1.00 0.00 H new ATOM 0 HG13 VAL A 108 12.717 -22.499 8.319 1.00 0.00 H new ATOM 0 HG21 VAL A 108 15.630 -21.481 8.292 1.00 0.00 H new ATOM 0 HG22 VAL A 108 14.724 -21.910 6.821 1.00 0.00 H new ATOM 0 HG23 VAL A 108 15.454 -20.295 6.977 1.00 0.00 H new ATOM 1575 N SER A 109 11.445 -18.305 8.173 1.00 0.00 N ATOM 1576 CA SER A 109 10.285 -17.720 8.835 1.00 0.00 C ATOM 1577 C SER A 109 9.071 -17.727 7.910 1.00 0.00 C ATOM 1578 O SER A 109 7.930 -17.829 8.364 1.00 0.00 O ATOM 1579 CB SER A 109 10.593 -16.289 9.279 1.00 0.00 C ATOM 1580 OG SER A 109 9.486 -15.714 9.952 1.00 0.00 O ATOM 0 H SER A 109 12.237 -17.670 8.070 1.00 0.00 H new ATOM 0 HA SER A 109 10.055 -18.324 9.713 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.463 -16.288 9.936 1.00 0.00 H new ATOM 0 HB3 SER A 109 10.849 -15.683 8.410 1.00 0.00 H new ATOM 0 HG SER A 109 9.709 -14.800 10.227 1.00 0.00 H new ATOM 1586 N THR A 110 9.324 -17.618 6.610 1.00 0.00 N ATOM 1587 CA THR A 110 8.254 -17.610 5.621 1.00 0.00 C ATOM 1588 C THR A 110 7.843 -19.029 5.245 1.00 0.00 C ATOM 1589 O THR A 110 6.660 -19.368 5.263 1.00 0.00 O ATOM 1590 CB THR A 110 8.673 -16.854 4.346 1.00 0.00 C ATOM 1591 OG1 THR A 110 9.043 -15.510 4.672 1.00 0.00 O ATOM 1592 CG2 THR A 110 7.542 -16.841 3.328 1.00 0.00 C ATOM 0 H THR A 110 10.262 -17.534 6.217 1.00 0.00 H new ATOM 0 HA THR A 110 7.406 -17.097 6.076 1.00 0.00 H new ATOM 0 HB THR A 110 9.528 -17.370 3.909 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.310 -15.037 3.856 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.861 -16.302 2.436 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.283 -17.865 3.059 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.671 -16.347 3.758 1.00 0.00 H new ATOM 1600 N MET A 111 8.827 -19.855 4.905 1.00 0.00 N ATOM 1601 CA MET A 111 8.566 -21.239 4.526 1.00 0.00 C ATOM 1602 C MET A 111 7.884 -21.994 5.663 1.00 0.00 C ATOM 1603 O MET A 111 6.913 -22.718 5.444 1.00 0.00 O ATOM 1604 CB MET A 111 9.871 -21.940 4.144 1.00 0.00 C ATOM 1605 CG MET A 111 10.348 -21.612 2.738 1.00 0.00 C ATOM 1606 SD MET A 111 9.295 -22.330 1.463 1.00 0.00 S ATOM 1607 CE MET A 111 9.623 -24.075 1.696 1.00 0.00 C ATOM 0 H MET A 111 9.812 -19.590 4.884 1.00 0.00 H new ATOM 0 HA MET A 111 7.899 -21.234 3.664 1.00 0.00 H new ATOM 0 HB2 MET A 111 10.647 -21.660 4.857 1.00 0.00 H new ATOM 0 HB3 MET A 111 9.734 -23.018 4.230 1.00 0.00 H new ATOM 0 HG2 MET A 111 10.378 -20.530 2.612 1.00 0.00 H new ATOM 0 HG3 MET A 111 11.367 -21.976 2.610 1.00 0.00 H new ATOM 0 HE1 MET A 111 8.761 -24.655 1.366 1.00 0.00 H new ATOM 0 HE2 MET A 111 10.498 -24.362 1.113 1.00 0.00 H new ATOM 0 HE3 MET A 111 9.810 -24.272 2.752 1.00 0.00 H new ATOM 1617 N ALA A 112 8.399 -21.820 6.876 1.00 0.00 N ATOM 1618 CA ALA A 112 7.837 -22.484 8.046 1.00 0.00 C ATOM 1619 C ALA A 112 6.334 -22.248 8.143 1.00 0.00 C ATOM 1620 O ALA A 112 5.568 -23.170 8.419 1.00 0.00 O ATOM 1621 CB ALA A 112 8.532 -22.001 9.310 1.00 0.00 C ATOM 0 H ALA A 112 9.204 -21.225 7.074 1.00 0.00 H new ATOM 0 HA ALA A 112 8.003 -23.556 7.940 1.00 0.00 H new ATOM 0 HB1 ALA A 112 8.103 -22.505 10.176 1.00 0.00 H new ATOM 0 HB2 ALA A 112 9.596 -22.227 9.249 1.00 0.00 H new ATOM 0 HB3 ALA A 112 8.395 -20.924 9.412 1.00 0.00 H new ATOM 1627 N SER A 113 5.919 -21.006 7.914 1.00 0.00 N ATOM 1628 CA SER A 113 4.507 -20.648 7.980 1.00 0.00 C ATOM 1629 C SER A 113 3.720 -21.332 6.867 1.00 0.00 C ATOM 1630 O SER A 113 2.577 -21.746 7.062 1.00 0.00 O ATOM 1631 CB SER A 113 4.339 -19.130 7.880 1.00 0.00 C ATOM 1632 OG SER A 113 4.021 -18.568 9.142 1.00 0.00 O ATOM 0 H SER A 113 6.540 -20.231 7.681 1.00 0.00 H new ATOM 0 HA SER A 113 4.116 -20.988 8.939 1.00 0.00 H new ATOM 0 HB2 SER A 113 5.258 -18.683 7.501 1.00 0.00 H new ATOM 0 HB3 SER A 113 3.551 -18.894 7.164 1.00 0.00 H new ATOM 0 HG SER A 113 3.921 -17.597 9.052 1.00 0.00 H new ATOM 1638 N PHE A 114 4.341 -21.448 5.697 1.00 0.00 N ATOM 1639 CA PHE A 114 3.699 -22.081 4.551 1.00 0.00 C ATOM 1640 C PHE A 114 3.406 -23.551 4.835 1.00 0.00 C ATOM 1641 O PHE A 114 2.286 -24.023 4.632 1.00 0.00 O ATOM 1642 CB PHE A 114 4.587 -21.957 3.310 1.00 0.00 C ATOM 1643 CG PHE A 114 4.086 -22.746 2.134 1.00 0.00 C ATOM 1644 CD1 PHE A 114 2.755 -22.681 1.756 1.00 0.00 C ATOM 1645 CD2 PHE A 114 4.947 -23.552 1.407 1.00 0.00 C ATOM 1646 CE1 PHE A 114 2.291 -23.406 0.674 1.00 0.00 C ATOM 1647 CE2 PHE A 114 4.489 -24.278 0.324 1.00 0.00 C ATOM 1648 CZ PHE A 114 3.159 -24.206 -0.043 1.00 0.00 C ATOM 0 H PHE A 114 5.287 -21.112 5.518 1.00 0.00 H new ATOM 0 HA PHE A 114 2.754 -21.569 4.367 1.00 0.00 H new ATOM 0 HB2 PHE A 114 4.660 -20.907 3.028 1.00 0.00 H new ATOM 0 HB3 PHE A 114 5.594 -22.291 3.559 1.00 0.00 H new ATOM 0 HD1 PHE A 114 2.072 -22.057 2.313 1.00 0.00 H new ATOM 0 HD2 PHE A 114 5.988 -23.614 1.690 1.00 0.00 H new ATOM 0 HE1 PHE A 114 1.251 -23.347 0.390 1.00 0.00 H new ATOM 0 HE2 PHE A 114 5.171 -24.902 -0.235 1.00 0.00 H new ATOM 0 HZ PHE A 114 2.799 -24.774 -0.888 1.00 0.00 H new ATOM 1658 N LEU A 115 4.419 -24.270 5.306 1.00 0.00 N ATOM 1659 CA LEU A 115 4.271 -25.687 5.618 1.00 0.00 C ATOM 1660 C LEU A 115 3.680 -25.879 7.011 1.00 0.00 C ATOM 1661 O LEU A 115 4.272 -26.542 7.863 1.00 0.00 O ATOM 1662 CB LEU A 115 5.625 -26.394 5.524 1.00 0.00 C ATOM 1663 CG LEU A 115 6.389 -26.209 4.213 1.00 0.00 C ATOM 1664 CD1 LEU A 115 7.730 -26.923 4.272 1.00 0.00 C ATOM 1665 CD2 LEU A 115 5.564 -26.715 3.039 1.00 0.00 C ATOM 0 H LEU A 115 5.351 -23.895 5.480 1.00 0.00 H new ATOM 0 HA LEU A 115 3.588 -26.125 4.890 1.00 0.00 H new ATOM 0 HB2 LEU A 115 6.254 -26.041 6.341 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.467 -27.461 5.682 1.00 0.00 H new ATOM 0 HG LEU A 115 6.574 -25.144 4.069 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.260 -26.780 3.330 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.325 -26.513 5.089 1.00 0.00 H new ATOM 0 HD13 LEU A 115 7.568 -27.988 4.440 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.124 -26.575 2.114 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.348 -27.775 3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 115 4.629 -26.158 2.985 1.00 0.00 H new ATOM 1677 N LYS A 116 2.507 -25.297 7.235 1.00 0.00 N ATOM 1678 CA LYS A 116 1.832 -25.406 8.523 1.00 0.00 C ATOM 1679 C LYS A 116 1.380 -26.840 8.781 1.00 0.00 C ATOM 1680 O LYS A 116 1.437 -27.688 7.892 1.00 0.00 O ATOM 1681 CB LYS A 116 0.628 -24.463 8.573 1.00 0.00 C ATOM 1682 CG LYS A 116 0.943 -23.105 9.176 1.00 0.00 C ATOM 1683 CD LYS A 116 0.455 -23.006 10.612 1.00 0.00 C ATOM 1684 CE LYS A 116 -0.010 -21.597 10.946 1.00 0.00 C ATOM 1685 NZ LYS A 116 -1.080 -21.598 11.983 1.00 0.00 N ATOM 0 H LYS A 116 2.004 -24.745 6.541 1.00 0.00 H new ATOM 0 HA LYS A 116 2.540 -25.122 9.301 1.00 0.00 H new ATOM 0 HB2 LYS A 116 0.245 -24.322 7.562 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -0.167 -24.933 9.152 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.019 -22.932 9.144 1.00 0.00 H new ATOM 0 HG3 LYS A 116 0.476 -22.323 8.577 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -0.365 -23.707 10.768 1.00 0.00 H new ATOM 0 HD3 LYS A 116 1.257 -23.296 11.291 1.00 0.00 H new ATOM 0 HE2 LYS A 116 0.837 -21.009 11.299 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -0.380 -21.113 10.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -1.370 -20.620 12.183 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -1.899 -22.138 11.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -0.719 -22.037 12.854 1.00 0.00 H new ATOM 1699 N GLY A 117 0.929 -27.102 10.004 1.00 0.00 N ATOM 1700 CA GLY A 117 0.472 -28.434 10.356 1.00 0.00 C ATOM 1701 C GLY A 117 1.576 -29.289 10.945 1.00 0.00 C ATOM 1702 O GLY A 117 1.307 -30.287 11.614 1.00 0.00 O ATOM 0 H GLY A 117 0.872 -26.416 10.757 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -0.345 -28.357 11.073 1.00 0.00 H new ATOM 0 HA3 GLY A 117 0.072 -28.924 9.468 1.00 0.00 H new ATOM 1706 N ALA A 118 2.821 -28.900 10.694 1.00 0.00 N ATOM 1707 CA ALA A 118 3.970 -29.638 11.205 1.00 0.00 C ATOM 1708 C ALA A 118 3.850 -29.868 12.708 1.00 0.00 C ATOM 1709 O ALA A 118 3.878 -28.922 13.495 1.00 0.00 O ATOM 1710 CB ALA A 118 5.259 -28.896 10.884 1.00 0.00 C ATOM 0 H ALA A 118 3.060 -28.078 10.140 1.00 0.00 H new ATOM 0 HA ALA A 118 3.993 -30.612 10.715 1.00 0.00 H new ATOM 0 HB1 ALA A 118 6.109 -29.458 11.271 1.00 0.00 H new ATOM 0 HB2 ALA A 118 5.357 -28.788 9.804 1.00 0.00 H new ATOM 0 HB3 ALA A 118 5.236 -27.909 11.347 1.00 0.00 H new ATOM 1716 N HIS A 119 3.716 -31.131 13.099 1.00 0.00 N ATOM 1717 CA HIS A 119 3.592 -31.486 14.509 1.00 0.00 C ATOM 1718 C HIS A 119 4.935 -31.360 15.221 1.00 0.00 C ATOM 1719 O HIS A 119 4.990 -31.143 16.431 1.00 0.00 O ATOM 1720 CB HIS A 119 3.056 -32.911 14.653 1.00 0.00 C ATOM 1721 CG HIS A 119 1.582 -33.024 14.411 1.00 0.00 C ATOM 1722 ND1 HIS A 119 1.011 -32.887 13.163 1.00 0.00 N ATOM 1723 CD2 HIS A 119 0.561 -33.264 15.266 1.00 0.00 C ATOM 1724 CE1 HIS A 119 -0.298 -33.036 13.262 1.00 0.00 C ATOM 1725 NE2 HIS A 119 -0.597 -33.266 14.528 1.00 0.00 N ATOM 0 H HIS A 119 3.690 -31.926 12.460 1.00 0.00 H new ATOM 0 HA HIS A 119 2.889 -30.793 14.972 1.00 0.00 H new ATOM 0 HB2 HIS A 119 3.582 -33.561 13.953 1.00 0.00 H new ATOM 0 HB3 HIS A 119 3.280 -33.275 15.656 1.00 0.00 H new ATOM 0 HD2 HIS A 119 0.642 -33.424 16.331 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -1.004 -32.979 12.446 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -1.535 -33.420 14.897 1.00 0.00 H new ATOM 1733 N VAL A 120 6.017 -31.500 14.461 1.00 0.00 N ATOM 1734 CA VAL A 120 7.361 -31.402 15.020 1.00 0.00 C ATOM 1735 C VAL A 120 8.339 -30.831 14.000 1.00 0.00 C ATOM 1736 O VAL A 120 8.246 -31.116 12.805 1.00 0.00 O ATOM 1737 CB VAL A 120 7.873 -32.775 15.493 1.00 0.00 C ATOM 1738 CG1 VAL A 120 9.267 -32.649 16.089 1.00 0.00 C ATOM 1739 CG2 VAL A 120 6.908 -33.386 16.498 1.00 0.00 C ATOM 0 H VAL A 120 5.989 -31.681 13.458 1.00 0.00 H new ATOM 0 HA VAL A 120 7.300 -30.731 15.876 1.00 0.00 H new ATOM 0 HB VAL A 120 7.931 -33.438 14.630 1.00 0.00 H new ATOM 0 HG11 VAL A 120 9.612 -33.629 16.418 1.00 0.00 H new ATOM 0 HG12 VAL A 120 9.951 -32.257 15.336 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.238 -31.970 16.941 1.00 0.00 H new ATOM 0 HG21 VAL A 120 7.286 -34.356 16.822 1.00 0.00 H new ATOM 0 HG22 VAL A 120 6.815 -32.726 17.361 1.00 0.00 H new ATOM 0 HG23 VAL A 120 5.931 -33.514 16.033 1.00 0.00 H new ATOM 1749 N THR A 121 9.280 -30.022 14.478 1.00 0.00 N ATOM 1750 CA THR A 121 10.276 -29.409 13.609 1.00 0.00 C ATOM 1751 C THR A 121 11.681 -29.880 13.966 1.00 0.00 C ATOM 1752 O THR A 121 11.991 -30.107 15.136 1.00 0.00 O ATOM 1753 CB THR A 121 10.225 -27.872 13.692 1.00 0.00 C ATOM 1754 OG1 THR A 121 8.875 -27.418 13.547 1.00 0.00 O ATOM 1755 CG2 THR A 121 11.095 -27.242 12.615 1.00 0.00 C ATOM 0 H THR A 121 9.373 -29.776 15.464 1.00 0.00 H new ATOM 0 HA THR A 121 10.040 -29.718 12.591 1.00 0.00 H new ATOM 0 HB THR A 121 10.607 -27.571 14.667 1.00 0.00 H new ATOM 0 HG1 THR A 121 8.851 -26.440 13.603 1.00 0.00 H new ATOM 0 HG21 THR A 121 11.043 -26.156 12.694 1.00 0.00 H new ATOM 0 HG22 THR A 121 12.128 -27.566 12.746 1.00 0.00 H new ATOM 0 HG23 THR A 121 10.739 -27.552 11.632 1.00 0.00 H new ATOM 1763 N ILE A 122 12.528 -30.023 12.952 1.00 0.00 N ATOM 1764 CA ILE A 122 13.901 -30.465 13.160 1.00 0.00 C ATOM 1765 C ILE A 122 14.865 -29.713 12.249 1.00 0.00 C ATOM 1766 O ILE A 122 14.611 -29.555 11.055 1.00 0.00 O ATOM 1767 CB ILE A 122 14.050 -31.977 12.910 1.00 0.00 C ATOM 1768 CG1 ILE A 122 13.108 -32.762 13.825 1.00 0.00 C ATOM 1769 CG2 ILE A 122 15.492 -32.410 13.128 1.00 0.00 C ATOM 1770 CD1 ILE A 122 13.002 -34.228 13.468 1.00 0.00 C ATOM 0 H ILE A 122 12.287 -29.839 11.978 1.00 0.00 H new ATOM 0 HA ILE A 122 14.147 -30.251 14.200 1.00 0.00 H new ATOM 0 HB ILE A 122 13.780 -32.188 11.875 1.00 0.00 H new ATOM 0 HG12 ILE A 122 13.455 -32.671 14.854 1.00 0.00 H new ATOM 0 HG13 ILE A 122 12.116 -32.313 13.782 1.00 0.00 H new ATOM 0 HG21 ILE A 122 15.581 -33.481 12.948 1.00 0.00 H new ATOM 0 HG22 ILE A 122 16.142 -31.870 12.439 1.00 0.00 H new ATOM 0 HG23 ILE A 122 15.787 -32.189 14.154 1.00 0.00 H new ATOM 0 HD11 ILE A 122 12.318 -34.722 14.158 1.00 0.00 H new ATOM 0 HD12 ILE A 122 12.626 -34.328 12.450 1.00 0.00 H new ATOM 0 HD13 ILE A 122 13.986 -34.692 13.538 1.00 0.00 H new ATOM 1782 N ASN A 123 15.973 -29.252 12.820 1.00 0.00 N ATOM 1783 CA ASN A 123 16.977 -28.518 12.058 1.00 0.00 C ATOM 1784 C ASN A 123 18.201 -29.388 11.789 1.00 0.00 C ATOM 1785 O ASN A 123 19.125 -29.443 12.599 1.00 0.00 O ATOM 1786 CB ASN A 123 17.392 -27.252 12.810 1.00 0.00 C ATOM 1787 CG ASN A 123 17.548 -27.489 14.300 1.00 0.00 C ATOM 1788 OD1 ASN A 123 18.576 -27.991 14.755 1.00 0.00 O ATOM 1789 ND2 ASN A 123 16.526 -27.129 15.066 1.00 0.00 N ATOM 0 H ASN A 123 16.198 -29.374 13.807 1.00 0.00 H new ATOM 0 HA ASN A 123 16.537 -28.237 11.101 1.00 0.00 H new ATOM 0 HB2 ASN A 123 18.334 -26.883 12.403 1.00 0.00 H new ATOM 0 HB3 ASN A 123 16.647 -26.474 12.645 1.00 0.00 H new ATOM 0 HD21 ASN A 123 16.573 -27.265 16.076 1.00 0.00 H new ATOM 0 HD22 ASN A 123 15.694 -26.716 14.645 1.00 0.00 H new ATOM 1796 N ALA A 124 18.198 -30.066 10.647 1.00 0.00 N ATOM 1797 CA ALA A 124 19.309 -30.932 10.270 1.00 0.00 C ATOM 1798 C ALA A 124 20.160 -30.289 9.180 1.00 0.00 C ATOM 1799 O ALA A 124 19.841 -29.207 8.687 1.00 0.00 O ATOM 1800 CB ALA A 124 18.790 -32.285 9.808 1.00 0.00 C ATOM 0 H ALA A 124 17.439 -30.033 9.966 1.00 0.00 H new ATOM 0 HA ALA A 124 19.939 -31.077 11.148 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.630 -32.921 9.530 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.231 -32.756 10.617 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.137 -32.149 8.946 1.00 0.00 H new ATOM 1806 N ARG A 125 21.244 -30.963 8.808 1.00 0.00 N ATOM 1807 CA ARG A 125 22.142 -30.456 7.777 1.00 0.00 C ATOM 1808 C ARG A 125 22.693 -31.597 6.928 1.00 0.00 C ATOM 1809 O ARG A 125 22.777 -31.489 5.704 1.00 0.00 O ATOM 1810 CB ARG A 125 23.295 -29.677 8.413 1.00 0.00 C ATOM 1811 CG ARG A 125 22.838 -28.532 9.303 1.00 0.00 C ATOM 1812 CD ARG A 125 22.705 -28.972 10.752 1.00 0.00 C ATOM 1813 NE ARG A 125 21.790 -28.116 11.503 1.00 0.00 N ATOM 1814 CZ ARG A 125 21.788 -28.026 12.828 1.00 0.00 C ATOM 1815 NH1 ARG A 125 22.648 -28.736 13.545 1.00 0.00 N ATOM 1816 NH2 ARG A 125 20.925 -27.223 13.438 1.00 0.00 N ATOM 0 H ARG A 125 21.521 -31.861 9.205 1.00 0.00 H new ATOM 0 HA ARG A 125 21.573 -29.787 7.131 1.00 0.00 H new ATOM 0 HB2 ARG A 125 23.905 -30.363 9.002 1.00 0.00 H new ATOM 0 HB3 ARG A 125 23.933 -29.280 7.624 1.00 0.00 H new ATOM 0 HG2 ARG A 125 23.551 -27.710 9.235 1.00 0.00 H new ATOM 0 HG3 ARG A 125 21.880 -28.153 8.947 1.00 0.00 H new ATOM 0 HD2 ARG A 125 22.349 -30.002 10.787 1.00 0.00 H new ATOM 0 HD3 ARG A 125 23.686 -28.958 11.227 1.00 0.00 H new ATOM 0 HE ARG A 125 21.115 -27.557 10.981 1.00 0.00 H new ATOM 0 HH11 ARG A 125 23.313 -29.353 13.079 1.00 0.00 H new ATOM 0 HH12 ARG A 125 22.644 -28.665 14.563 1.00 0.00 H new ATOM 0 HH21 ARG A 125 20.263 -26.675 12.889 1.00 0.00 H new ATOM 0 HH22 ARG A 125 20.924 -27.154 14.456 1.00 0.00 H new ATOM 1830 N ALA A 126 23.069 -32.690 7.585 1.00 0.00 N ATOM 1831 CA ALA A 126 23.610 -33.851 6.890 1.00 0.00 C ATOM 1832 C ALA A 126 22.529 -34.897 6.644 1.00 0.00 C ATOM 1833 O ALA A 126 21.446 -34.832 7.226 1.00 0.00 O ATOM 1834 CB ALA A 126 24.759 -34.453 7.685 1.00 0.00 C ATOM 0 H ALA A 126 23.009 -32.795 8.598 1.00 0.00 H new ATOM 0 HA ALA A 126 23.986 -33.521 5.921 1.00 0.00 H new ATOM 0 HB1 ALA A 126 25.154 -35.319 7.155 1.00 0.00 H new ATOM 0 HB2 ALA A 126 25.548 -33.710 7.804 1.00 0.00 H new ATOM 0 HB3 ALA A 126 24.400 -34.761 8.667 1.00 0.00 H new ATOM 1840 N GLU A 127 22.829 -35.861 5.779 1.00 0.00 N ATOM 1841 CA GLU A 127 21.880 -36.920 5.456 1.00 0.00 C ATOM 1842 C GLU A 127 21.680 -37.853 6.647 1.00 0.00 C ATOM 1843 O GLU A 127 20.639 -38.496 6.776 1.00 0.00 O ATOM 1844 CB GLU A 127 22.366 -37.718 4.244 1.00 0.00 C ATOM 1845 CG GLU A 127 21.838 -37.195 2.919 1.00 0.00 C ATOM 1846 CD GLU A 127 22.940 -36.675 2.016 1.00 0.00 C ATOM 1847 OE1 GLU A 127 23.417 -35.546 2.251 1.00 0.00 O ATOM 1848 OE2 GLU A 127 23.325 -37.400 1.074 1.00 0.00 O ATOM 0 H GLU A 127 23.721 -35.930 5.290 1.00 0.00 H new ATOM 0 HA GLU A 127 20.924 -36.456 5.216 1.00 0.00 H new ATOM 0 HB2 GLU A 127 23.456 -37.703 4.223 1.00 0.00 H new ATOM 0 HB3 GLU A 127 22.064 -38.759 4.360 1.00 0.00 H new ATOM 0 HG2 GLU A 127 21.300 -37.992 2.407 1.00 0.00 H new ATOM 0 HG3 GLU A 127 21.121 -36.396 3.108 1.00 0.00 H new ATOM 1855 N GLU A 128 22.686 -37.921 7.513 1.00 0.00 N ATOM 1856 CA GLU A 128 22.621 -38.776 8.692 1.00 0.00 C ATOM 1857 C GLU A 128 21.683 -38.186 9.741 1.00 0.00 C ATOM 1858 O GLU A 128 21.148 -38.905 10.586 1.00 0.00 O ATOM 1859 CB GLU A 128 24.017 -38.965 9.290 1.00 0.00 C ATOM 1860 CG GLU A 128 24.656 -37.672 9.766 1.00 0.00 C ATOM 1861 CD GLU A 128 26.160 -37.785 9.918 1.00 0.00 C ATOM 1862 OE1 GLU A 128 26.696 -38.893 9.701 1.00 0.00 O ATOM 1863 OE2 GLU A 128 26.802 -36.768 10.255 1.00 0.00 O ATOM 0 H GLU A 128 23.555 -37.395 7.420 1.00 0.00 H new ATOM 0 HA GLU A 128 22.230 -39.746 8.384 1.00 0.00 H new ATOM 0 HB2 GLU A 128 23.953 -39.659 10.128 1.00 0.00 H new ATOM 0 HB3 GLU A 128 24.663 -39.426 8.543 1.00 0.00 H new ATOM 0 HG2 GLU A 128 24.425 -36.875 9.059 1.00 0.00 H new ATOM 0 HG3 GLU A 128 24.219 -37.386 10.722 1.00 0.00 H new ATOM 1870 N ASP A 129 21.488 -36.873 9.681 1.00 0.00 N ATOM 1871 CA ASP A 129 20.614 -36.186 10.625 1.00 0.00 C ATOM 1872 C ASP A 129 19.216 -36.011 10.041 1.00 0.00 C ATOM 1873 O ASP A 129 18.480 -35.102 10.426 1.00 0.00 O ATOM 1874 CB ASP A 129 21.200 -34.822 10.995 1.00 0.00 C ATOM 1875 CG ASP A 129 22.378 -34.936 11.943 1.00 0.00 C ATOM 1876 OD1 ASP A 129 22.542 -36.010 12.559 1.00 0.00 O ATOM 1877 OD2 ASP A 129 23.135 -33.952 12.068 1.00 0.00 O ATOM 0 H ASP A 129 21.923 -36.263 8.989 1.00 0.00 H new ATOM 0 HA ASP A 129 20.539 -36.797 11.525 1.00 0.00 H new ATOM 0 HB2 ASP A 129 21.516 -34.307 10.088 1.00 0.00 H new ATOM 0 HB3 ASP A 129 20.425 -34.209 11.455 1.00 0.00 H new ATOM 1882 N VAL A 130 18.855 -36.887 9.110 1.00 0.00 N ATOM 1883 CA VAL A 130 17.544 -36.830 8.473 1.00 0.00 C ATOM 1884 C VAL A 130 17.081 -38.218 8.044 1.00 0.00 C ATOM 1885 O VAL A 130 16.294 -38.358 7.108 1.00 0.00 O ATOM 1886 CB VAL A 130 17.557 -35.902 7.244 1.00 0.00 C ATOM 1887 CG1 VAL A 130 17.912 -34.480 7.652 1.00 0.00 C ATOM 1888 CG2 VAL A 130 18.529 -36.422 6.195 1.00 0.00 C ATOM 0 H VAL A 130 19.452 -37.645 8.779 1.00 0.00 H new ATOM 0 HA VAL A 130 16.850 -36.431 9.212 1.00 0.00 H new ATOM 0 HB VAL A 130 16.558 -35.891 6.808 1.00 0.00 H new ATOM 0 HG11 VAL A 130 17.916 -33.839 6.771 1.00 0.00 H new ATOM 0 HG12 VAL A 130 17.175 -34.111 8.365 1.00 0.00 H new ATOM 0 HG13 VAL A 130 18.900 -34.470 8.113 1.00 0.00 H new ATOM 0 HG21 VAL A 130 18.526 -35.754 5.333 1.00 0.00 H new ATOM 0 HG22 VAL A 130 19.533 -36.464 6.618 1.00 0.00 H new ATOM 0 HG23 VAL A 130 18.226 -37.421 5.881 1.00 0.00 H new ATOM 1898 N GLU A 131 17.574 -39.241 8.735 1.00 0.00 N ATOM 1899 CA GLU A 131 17.210 -40.618 8.424 1.00 0.00 C ATOM 1900 C GLU A 131 15.831 -40.956 8.983 1.00 0.00 C ATOM 1901 O GLU A 131 15.303 -40.268 9.857 1.00 0.00 O ATOM 1902 CB GLU A 131 18.253 -41.585 8.989 1.00 0.00 C ATOM 1903 CG GLU A 131 19.029 -42.336 7.920 1.00 0.00 C ATOM 1904 CD GLU A 131 20.433 -41.794 7.730 1.00 0.00 C ATOM 1905 OE1 GLU A 131 21.272 -41.989 8.634 1.00 0.00 O ATOM 1906 OE2 GLU A 131 20.692 -41.176 6.676 1.00 0.00 O ATOM 0 H GLU A 131 18.226 -39.142 9.513 1.00 0.00 H new ATOM 0 HA GLU A 131 17.179 -40.722 7.339 1.00 0.00 H new ATOM 0 HB2 GLU A 131 18.954 -41.028 9.611 1.00 0.00 H new ATOM 0 HB3 GLU A 131 17.755 -42.305 9.638 1.00 0.00 H new ATOM 0 HG2 GLU A 131 19.084 -43.391 8.190 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.489 -42.276 6.975 1.00 0.00 H new ATOM 1913 N PRO A 132 15.234 -42.041 8.469 1.00 0.00 N ATOM 1914 CA PRO A 132 13.909 -42.495 8.901 1.00 0.00 C ATOM 1915 C PRO A 132 13.783 -42.551 10.420 1.00 0.00 C ATOM 1916 O PRO A 132 12.869 -41.964 10.997 1.00 0.00 O ATOM 1917 CB PRO A 132 13.804 -43.901 8.304 1.00 0.00 C ATOM 1918 CG PRO A 132 14.706 -43.877 7.119 1.00 0.00 C ATOM 1919 CD PRO A 132 15.806 -42.908 7.424 1.00 0.00 C ATOM 0 HA PRO A 132 13.119 -41.818 8.575 1.00 0.00 H new ATOM 0 HB2 PRO A 132 14.114 -44.660 9.022 1.00 0.00 H new ATOM 0 HB3 PRO A 132 12.779 -44.134 8.017 1.00 0.00 H new ATOM 0 HG2 PRO A 132 15.111 -44.870 6.922 1.00 0.00 H new ATOM 0 HG3 PRO A 132 14.161 -43.572 6.226 1.00 0.00 H new ATOM 0 HD2 PRO A 132 16.703 -43.419 7.775 1.00 0.00 H new ATOM 0 HD3 PRO A 132 16.090 -42.335 6.541 1.00 0.00 H new ATOM 1927 N GLU A 133 14.707 -43.261 11.060 1.00 0.00 N ATOM 1928 CA GLU A 133 14.697 -43.393 12.513 1.00 0.00 C ATOM 1929 C GLU A 133 14.982 -42.052 13.183 1.00 0.00 C ATOM 1930 O GLU A 133 14.476 -41.768 14.269 1.00 0.00 O ATOM 1931 CB GLU A 133 15.731 -44.429 12.960 1.00 0.00 C ATOM 1932 CG GLU A 133 17.168 -43.999 12.717 1.00 0.00 C ATOM 1933 CD GLU A 133 18.163 -45.109 12.992 1.00 0.00 C ATOM 1934 OE1 GLU A 133 17.758 -46.141 13.566 1.00 0.00 O ATOM 1935 OE2 GLU A 133 19.348 -44.945 12.632 1.00 0.00 O ATOM 0 H GLU A 133 15.471 -43.753 10.596 1.00 0.00 H new ATOM 0 HA GLU A 133 13.704 -43.727 12.815 1.00 0.00 H new ATOM 0 HB2 GLU A 133 15.596 -44.630 14.023 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.547 -45.365 12.433 1.00 0.00 H new ATOM 0 HG2 GLU A 133 17.275 -43.668 11.684 1.00 0.00 H new ATOM 0 HG3 GLU A 133 17.399 -43.143 13.351 1.00 0.00 H new ATOM 1942 N CYS A 134 15.797 -41.231 12.528 1.00 0.00 N ATOM 1943 CA CYS A 134 16.151 -39.920 13.060 1.00 0.00 C ATOM 1944 C CYS A 134 14.921 -39.024 13.161 1.00 0.00 C ATOM 1945 O CYS A 134 14.873 -38.110 13.985 1.00 0.00 O ATOM 1946 CB CYS A 134 17.209 -39.257 12.176 1.00 0.00 C ATOM 1947 SG CYS A 134 18.719 -38.792 13.055 1.00 0.00 S ATOM 0 H CYS A 134 16.224 -41.450 11.628 1.00 0.00 H new ATOM 0 HA CYS A 134 16.559 -40.059 14.061 1.00 0.00 H new ATOM 0 HB2 CYS A 134 17.468 -39.938 11.365 1.00 0.00 H new ATOM 0 HB3 CYS A 134 16.779 -38.366 11.719 1.00 0.00 H new ATOM 0 HG CYS A 134 19.722 -38.799 12.228 1.00 0.00 H new ATOM 1953 N ILE A 135 13.930 -39.291 12.318 1.00 0.00 N ATOM 1954 CA ILE A 135 12.700 -38.509 12.313 1.00 0.00 C ATOM 1955 C ILE A 135 11.603 -39.202 13.114 1.00 0.00 C ATOM 1956 O ILE A 135 10.872 -38.561 13.868 1.00 0.00 O ATOM 1957 CB ILE A 135 12.195 -38.263 10.879 1.00 0.00 C ATOM 1958 CG1 ILE A 135 13.262 -37.537 10.057 1.00 0.00 C ATOM 1959 CG2 ILE A 135 10.902 -37.462 10.903 1.00 0.00 C ATOM 1960 CD1 ILE A 135 13.470 -38.129 8.680 1.00 0.00 C ATOM 0 H ILE A 135 13.955 -40.043 11.629 1.00 0.00 H new ATOM 0 HA ILE A 135 12.934 -37.551 12.777 1.00 0.00 H new ATOM 0 HB ILE A 135 11.994 -39.226 10.410 1.00 0.00 H new ATOM 0 HG12 ILE A 135 12.980 -36.489 9.954 1.00 0.00 H new ATOM 0 HG13 ILE A 135 14.207 -37.561 10.600 1.00 0.00 H new ATOM 0 HG21 ILE A 135 10.558 -37.296 9.882 1.00 0.00 H new ATOM 0 HG22 ILE A 135 10.143 -38.014 11.457 1.00 0.00 H new ATOM 0 HG23 ILE A 135 11.078 -36.501 11.387 1.00 0.00 H new ATOM 0 HD11 ILE A 135 14.240 -37.565 8.154 1.00 0.00 H new ATOM 0 HD12 ILE A 135 13.783 -39.169 8.774 1.00 0.00 H new ATOM 0 HD13 ILE A 135 12.537 -38.081 8.118 1.00 0.00 H new ATOM 1972 N MET A 136 11.497 -40.516 12.946 1.00 0.00 N ATOM 1973 CA MET A 136 10.491 -41.298 13.656 1.00 0.00 C ATOM 1974 C MET A 136 10.744 -41.271 15.160 1.00 0.00 C ATOM 1975 O MET A 136 9.820 -41.434 15.956 1.00 0.00 O ATOM 1976 CB MET A 136 10.488 -42.743 13.153 1.00 0.00 C ATOM 1977 CG MET A 136 9.545 -42.977 11.984 1.00 0.00 C ATOM 1978 SD MET A 136 7.997 -43.754 12.486 1.00 0.00 S ATOM 1979 CE MET A 136 7.036 -42.318 12.959 1.00 0.00 C ATOM 0 H MET A 136 12.095 -41.061 12.325 1.00 0.00 H new ATOM 0 HA MET A 136 9.516 -40.852 13.461 1.00 0.00 H new ATOM 0 HB2 MET A 136 11.500 -43.017 12.854 1.00 0.00 H new ATOM 0 HB3 MET A 136 10.208 -43.404 13.973 1.00 0.00 H new ATOM 0 HG2 MET A 136 9.329 -42.024 11.500 1.00 0.00 H new ATOM 0 HG3 MET A 136 10.039 -43.606 11.243 1.00 0.00 H new ATOM 0 HE1 MET A 136 6.871 -42.329 14.036 1.00 0.00 H new ATOM 0 HE2 MET A 136 7.576 -41.412 12.684 1.00 0.00 H new ATOM 0 HE3 MET A 136 6.075 -42.338 12.445 1.00 0.00 H new ATOM 1989 N GLU A 137 12.001 -41.066 15.541 1.00 0.00 N ATOM 1990 CA GLU A 137 12.374 -41.019 16.950 1.00 0.00 C ATOM 1991 C GLU A 137 11.772 -39.795 17.632 1.00 0.00 C ATOM 1992 O GLU A 137 11.541 -39.793 18.841 1.00 0.00 O ATOM 1993 CB GLU A 137 13.897 -41.002 17.097 1.00 0.00 C ATOM 1994 CG GLU A 137 14.509 -42.383 17.253 1.00 0.00 C ATOM 1995 CD GLU A 137 14.587 -42.827 18.701 1.00 0.00 C ATOM 1996 OE1 GLU A 137 14.020 -42.127 19.566 1.00 0.00 O ATOM 1997 OE2 GLU A 137 15.215 -43.872 18.969 1.00 0.00 O ATOM 0 H GLU A 137 12.778 -40.930 14.894 1.00 0.00 H new ATOM 0 HA GLU A 137 11.980 -41.913 17.434 1.00 0.00 H new ATOM 0 HB2 GLU A 137 14.332 -40.518 16.223 1.00 0.00 H new ATOM 0 HB3 GLU A 137 14.163 -40.396 17.963 1.00 0.00 H new ATOM 0 HG2 GLU A 137 13.919 -43.104 16.687 1.00 0.00 H new ATOM 0 HG3 GLU A 137 15.510 -42.383 16.822 1.00 0.00 H new ATOM 2004 N LYS A 138 11.520 -38.752 16.848 1.00 0.00 N ATOM 2005 CA LYS A 138 10.944 -37.520 17.373 1.00 0.00 C ATOM 2006 C LYS A 138 9.427 -37.517 17.214 1.00 0.00 C ATOM 2007 O LYS A 138 8.712 -36.878 17.986 1.00 0.00 O ATOM 2008 CB LYS A 138 11.545 -36.307 16.660 1.00 0.00 C ATOM 2009 CG LYS A 138 13.060 -36.242 16.742 1.00 0.00 C ATOM 2010 CD LYS A 138 13.535 -34.881 17.222 1.00 0.00 C ATOM 2011 CE LYS A 138 15.054 -34.797 17.247 1.00 0.00 C ATOM 2012 NZ LYS A 138 15.576 -33.887 16.190 1.00 0.00 N ATOM 0 H LYS A 138 11.706 -38.736 15.845 1.00 0.00 H new ATOM 0 HA LYS A 138 11.180 -37.463 18.436 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.247 -36.328 15.612 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.127 -35.398 17.092 1.00 0.00 H new ATOM 0 HG2 LYS A 138 13.422 -37.015 17.420 1.00 0.00 H new ATOM 0 HG3 LYS A 138 13.488 -36.453 15.762 1.00 0.00 H new ATOM 0 HD2 LYS A 138 13.137 -34.105 16.568 1.00 0.00 H new ATOM 0 HD3 LYS A 138 13.143 -34.689 18.221 1.00 0.00 H new ATOM 0 HE2 LYS A 138 15.382 -34.444 18.225 1.00 0.00 H new ATOM 0 HE3 LYS A 138 15.475 -35.793 17.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 16.614 -33.857 16.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 15.284 -34.237 15.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 15.194 -32.931 16.336 1.00 0.00 H new ATOM 2026 N VAL A 139 8.941 -38.236 16.206 1.00 0.00 N ATOM 2027 CA VAL A 139 7.508 -38.318 15.947 1.00 0.00 C ATOM 2028 C VAL A 139 6.771 -38.938 17.128 1.00 0.00 C ATOM 2029 O VAL A 139 5.645 -38.553 17.441 1.00 0.00 O ATOM 2030 CB VAL A 139 7.214 -39.144 14.681 1.00 0.00 C ATOM 2031 CG1 VAL A 139 5.714 -39.246 14.447 1.00 0.00 C ATOM 2032 CG2 VAL A 139 7.910 -38.534 13.474 1.00 0.00 C ATOM 0 H VAL A 139 9.518 -38.770 15.556 1.00 0.00 H new ATOM 0 HA VAL A 139 7.154 -37.298 15.797 1.00 0.00 H new ATOM 0 HB VAL A 139 7.604 -40.151 14.826 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.525 -39.833 13.548 1.00 0.00 H new ATOM 0 HG12 VAL A 139 5.244 -39.731 15.303 1.00 0.00 H new ATOM 0 HG13 VAL A 139 5.296 -38.247 14.322 1.00 0.00 H new ATOM 0 HG21 VAL A 139 7.691 -39.130 12.588 1.00 0.00 H new ATOM 0 HG22 VAL A 139 7.552 -37.516 13.323 1.00 0.00 H new ATOM 0 HG23 VAL A 139 8.987 -38.518 13.644 1.00 0.00 H new ATOM 2042 N ALA A 140 7.414 -39.900 17.782 1.00 0.00 N ATOM 2043 CA ALA A 140 6.820 -40.572 18.931 1.00 0.00 C ATOM 2044 C ALA A 140 6.677 -39.618 20.111 1.00 0.00 C ATOM 2045 O ALA A 140 5.787 -39.777 20.947 1.00 0.00 O ATOM 2046 CB ALA A 140 7.655 -41.781 19.325 1.00 0.00 C ATOM 0 H ALA A 140 8.347 -40.231 17.535 1.00 0.00 H new ATOM 0 HA ALA A 140 5.823 -40.910 18.648 1.00 0.00 H new ATOM 0 HB1 ALA A 140 7.200 -42.273 20.184 1.00 0.00 H new ATOM 0 HB2 ALA A 140 7.701 -42.479 18.489 1.00 0.00 H new ATOM 0 HB3 ALA A 140 8.663 -41.458 19.584 1.00 0.00 H new ATOM 2052 N SER A 141 7.560 -38.626 20.175 1.00 0.00 N ATOM 2053 CA SER A 141 7.535 -37.648 21.257 1.00 0.00 C ATOM 2054 C SER A 141 6.493 -36.566 20.987 1.00 0.00 C ATOM 2055 O SER A 141 6.701 -35.681 20.159 1.00 0.00 O ATOM 2056 CB SER A 141 8.915 -37.011 21.429 1.00 0.00 C ATOM 2057 OG SER A 141 8.843 -35.847 22.234 1.00 0.00 O ATOM 0 H SER A 141 8.302 -38.478 19.490 1.00 0.00 H new ATOM 0 HA SER A 141 7.265 -38.167 22.177 1.00 0.00 H new ATOM 0 HB2 SER A 141 9.597 -37.730 21.884 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.326 -36.756 20.452 1.00 0.00 H new ATOM 0 HG SER A 141 9.738 -35.460 22.330 1.00 0.00 H new