USER MOD reduce.3.24.130724 H: found=0, std=0, add=683, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 685 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 74 MET CE :methyl -168:sc= -0.204 (180deg=-0.483) USER MOD Set 1.2: A 91 ASN : amide:sc= -3.99! K(o=-4.2!,f=-5.9) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 64:sc= -0.0729 USER MOD Single : A 22 ASN : amide:sc= 0.072 X(o=0.072,f=-0.0011) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00105) USER MOD Single : A 37 SER OG : rot -33:sc= 0.937 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= -2.05 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0.165 (180deg=0.165) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 116:sc= -7.54! USER MOD Single : A 64 TYR OH : rot -80:sc= 0.581 USER MOD Single : A 65 GLN : amide:sc= -0.862 K(o=-0.86,f=-2.9) USER MOD Single : A 67 GLN :FLIP amide:sc= -3.7! C(o=-4.7!,f=-3.7!) USER MOD Single : A 69 THR OG1 : rot 176:sc= 0.425 USER MOD Single : A 72 SER OG : rot 143:sc= 0.00903 USER MOD Single : A 76 ASN :FLIP amide:sc= -3.46! C(o=-5.5!,f=-3.5!) USER MOD Single : A 78 ASN : amide:sc= -0.817 X(o=-0.82,f=-0.77) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -9.88! C(o=-9.9!,f=-10!) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 89 N SER A 14 -1.463 -12.092 -2.630 1.00 0.00 N ATOM 90 CA SER A 14 -0.784 -13.364 -2.806 1.00 0.00 C ATOM 91 C SER A 14 -1.507 -14.457 -2.016 1.00 0.00 C ATOM 92 O SER A 14 -1.655 -15.579 -2.496 1.00 0.00 O ATOM 93 CB SER A 14 0.679 -13.272 -2.368 1.00 0.00 C ATOM 94 OG SER A 14 1.575 -13.576 -3.433 1.00 0.00 O ATOM 0 HA SER A 14 -0.803 -13.618 -3.866 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.884 -12.268 -1.997 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.853 -13.959 -1.540 1.00 0.00 H new ATOM 0 HG SER A 14 2.499 -13.505 -3.114 1.00 0.00 H new ATOM 100 N LEU A 15 -1.937 -14.090 -0.818 1.00 0.00 N ATOM 101 CA LEU A 15 -2.641 -15.025 0.043 1.00 0.00 C ATOM 102 C LEU A 15 -4.018 -15.322 -0.552 1.00 0.00 C ATOM 103 O LEU A 15 -4.684 -16.271 -0.141 1.00 0.00 O ATOM 104 CB LEU A 15 -2.692 -14.497 1.479 1.00 0.00 C ATOM 105 CG LEU A 15 -1.354 -14.438 2.220 1.00 0.00 C ATOM 106 CD1 LEU A 15 -1.253 -15.557 3.258 1.00 0.00 C ATOM 107 CD2 LEU A 15 -0.182 -14.459 1.237 1.00 0.00 C ATOM 0 H LEU A 15 -1.812 -13.158 -0.423 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.105 -15.973 0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -3.120 -13.494 1.461 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -3.375 -15.125 2.052 1.00 0.00 H new ATOM 0 HG LEU A 15 -1.303 -13.493 2.760 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.293 -15.493 3.770 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.059 -15.454 3.984 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.334 -16.523 2.760 1.00 0.00 H new ATOM 0 HD21 LEU A 15 0.757 -14.416 1.789 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.216 -15.377 0.650 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -0.251 -13.599 0.571 1.00 0.00 H new ATOM 119 N ARG A 16 -4.405 -14.493 -1.511 1.00 0.00 N ATOM 120 CA ARG A 16 -5.691 -14.656 -2.167 1.00 0.00 C ATOM 121 C ARG A 16 -5.498 -15.177 -3.592 1.00 0.00 C ATOM 122 O ARG A 16 -5.697 -14.443 -4.558 1.00 0.00 O ATOM 123 CB ARG A 16 -6.456 -13.332 -2.215 1.00 0.00 C ATOM 124 CG ARG A 16 -7.006 -12.965 -0.835 1.00 0.00 C ATOM 125 CD ARG A 16 -8.508 -12.683 -0.900 1.00 0.00 C ATOM 126 NE ARG A 16 -8.787 -11.666 -1.940 1.00 0.00 N ATOM 127 CZ ARG A 16 -8.731 -10.344 -1.731 1.00 0.00 C ATOM 128 NH1 ARG A 16 -8.406 -9.870 -0.521 1.00 0.00 N ATOM 129 NH2 ARG A 16 -9.000 -9.496 -2.733 1.00 0.00 N ATOM 0 H ARG A 16 -3.850 -13.707 -1.849 1.00 0.00 H new ATOM 0 HA ARG A 16 -6.269 -15.376 -1.588 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -5.797 -12.540 -2.570 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -7.276 -13.408 -2.929 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -6.815 -13.779 -0.136 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.484 -12.088 -0.453 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -9.050 -13.602 -1.124 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.863 -12.331 0.069 1.00 0.00 H new ATOM 0 HE ARG A 16 -9.037 -11.993 -2.873 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -8.201 -10.516 0.242 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -8.363 -8.863 -0.362 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -9.247 -9.857 -3.654 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -8.958 -8.489 -2.574 1.00 0.00 H new ATOM 143 N SER A 17 -5.112 -16.442 -3.678 1.00 0.00 N ATOM 144 CA SER A 17 -4.889 -17.070 -4.969 1.00 0.00 C ATOM 145 C SER A 17 -4.365 -18.494 -4.775 1.00 0.00 C ATOM 146 O SER A 17 -3.374 -18.705 -4.077 1.00 0.00 O ATOM 147 CB SER A 17 -3.911 -16.255 -5.817 1.00 0.00 C ATOM 148 OG SER A 17 -4.567 -15.215 -6.537 1.00 0.00 O ATOM 0 H SER A 17 -4.948 -17.049 -2.875 1.00 0.00 H new ATOM 0 HA SER A 17 -5.841 -17.109 -5.499 1.00 0.00 H new ATOM 0 HB2 SER A 17 -3.146 -15.823 -5.173 1.00 0.00 H new ATOM 0 HB3 SER A 17 -3.401 -16.916 -6.518 1.00 0.00 H new ATOM 0 HG SER A 17 -4.955 -14.574 -5.905 1.00 0.00 H new ATOM 154 N VAL A 18 -5.053 -19.436 -5.404 1.00 0.00 N ATOM 155 CA VAL A 18 -4.669 -20.834 -5.309 1.00 0.00 C ATOM 156 C VAL A 18 -4.331 -21.361 -6.705 1.00 0.00 C ATOM 157 O VAL A 18 -5.138 -21.250 -7.626 1.00 0.00 O ATOM 158 CB VAL A 18 -5.775 -21.634 -4.618 1.00 0.00 C ATOM 159 CG1 VAL A 18 -5.474 -21.812 -3.128 1.00 0.00 C ATOM 160 CG2 VAL A 18 -7.140 -20.977 -4.827 1.00 0.00 C ATOM 0 H VAL A 18 -5.875 -19.258 -5.982 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.775 -20.945 -4.695 1.00 0.00 H new ATOM 0 HB VAL A 18 -5.807 -22.624 -5.074 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -6.276 -22.384 -2.661 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.531 -22.345 -3.008 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -5.401 -20.834 -2.652 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -7.908 -21.566 -4.326 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -7.126 -19.969 -4.411 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -7.360 -20.927 -5.893 1.00 0.00 H new ATOM 170 N PHE A 19 -3.137 -21.925 -6.817 1.00 0.00 N ATOM 171 CA PHE A 19 -2.683 -22.470 -8.084 1.00 0.00 C ATOM 172 C PHE A 19 -3.293 -23.850 -8.338 1.00 0.00 C ATOM 173 O PHE A 19 -3.235 -24.726 -7.476 1.00 0.00 O ATOM 174 CB PHE A 19 -1.162 -22.607 -7.993 1.00 0.00 C ATOM 175 CG PHE A 19 -0.570 -23.631 -8.964 1.00 0.00 C ATOM 176 CD1 PHE A 19 -0.569 -24.952 -8.642 1.00 0.00 C ATOM 177 CD2 PHE A 19 -0.045 -23.219 -10.149 1.00 0.00 C ATOM 178 CE1 PHE A 19 -0.019 -25.902 -9.542 1.00 0.00 C ATOM 179 CE2 PHE A 19 0.505 -24.170 -11.050 1.00 0.00 C ATOM 180 CZ PHE A 19 0.506 -25.491 -10.728 1.00 0.00 C ATOM 0 H PHE A 19 -2.470 -22.016 -6.050 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.984 -21.813 -8.900 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -0.708 -21.635 -8.185 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -0.893 -22.889 -6.975 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.987 -25.279 -7.701 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.046 -22.170 -10.405 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.017 -26.951 -9.285 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.922 -23.843 -11.991 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.923 -26.214 -11.413 1.00 0.00 H new ATOM 190 N VAL A 20 -3.864 -24.001 -9.524 1.00 0.00 N ATOM 191 CA VAL A 20 -4.484 -25.260 -9.901 1.00 0.00 C ATOM 192 C VAL A 20 -3.725 -25.862 -11.085 1.00 0.00 C ATOM 193 O VAL A 20 -3.426 -25.166 -12.054 1.00 0.00 O ATOM 194 CB VAL A 20 -5.971 -25.045 -10.191 1.00 0.00 C ATOM 195 CG1 VAL A 20 -6.752 -26.352 -10.047 1.00 0.00 C ATOM 196 CG2 VAL A 20 -6.553 -23.955 -9.288 1.00 0.00 C ATOM 0 H VAL A 20 -3.910 -23.272 -10.236 1.00 0.00 H new ATOM 0 HA VAL A 20 -4.427 -25.975 -9.080 1.00 0.00 H new ATOM 0 HB VAL A 20 -6.067 -24.711 -11.224 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.806 -26.171 -10.258 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -6.362 -27.088 -10.750 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.646 -26.729 -9.030 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -7.611 -23.822 -9.514 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.439 -24.248 -8.244 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -6.024 -23.018 -9.462 1.00 0.00 H new ATOM 206 N GLY A 21 -3.436 -27.150 -10.969 1.00 0.00 N ATOM 207 CA GLY A 21 -2.718 -27.853 -12.018 1.00 0.00 C ATOM 208 C GLY A 21 -3.370 -29.205 -12.317 1.00 0.00 C ATOM 209 O GLY A 21 -4.309 -29.610 -11.633 1.00 0.00 O ATOM 0 H GLY A 21 -3.686 -27.725 -10.164 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -2.701 -27.245 -12.923 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -1.682 -28.004 -11.716 1.00 0.00 H new ATOM 213 N ASN A 22 -2.847 -29.865 -13.340 1.00 0.00 N ATOM 214 CA ASN A 22 -3.366 -31.162 -13.738 1.00 0.00 C ATOM 215 C ASN A 22 -4.738 -30.978 -14.391 1.00 0.00 C ATOM 216 O ASN A 22 -5.546 -31.906 -14.417 1.00 0.00 O ATOM 217 CB ASN A 22 -3.538 -32.082 -12.528 1.00 0.00 C ATOM 218 CG ASN A 22 -3.292 -33.543 -12.910 1.00 0.00 C ATOM 219 OD1 ASN A 22 -2.182 -34.047 -12.856 1.00 0.00 O ATOM 220 ND2 ASN A 22 -4.386 -34.191 -13.299 1.00 0.00 N ATOM 0 H ASN A 22 -2.069 -29.525 -13.905 1.00 0.00 H new ATOM 0 HA ASN A 22 -2.656 -31.610 -14.433 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -2.844 -31.787 -11.741 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -4.544 -31.973 -12.124 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -4.327 -35.171 -13.576 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -5.284 -33.708 -13.321 1.00 0.00 H new ATOM 227 N ILE A 23 -4.960 -29.776 -14.900 1.00 0.00 N ATOM 228 CA ILE A 23 -6.220 -29.459 -15.551 1.00 0.00 C ATOM 229 C ILE A 23 -6.075 -29.662 -17.060 1.00 0.00 C ATOM 230 O ILE A 23 -5.321 -28.945 -17.717 1.00 0.00 O ATOM 231 CB ILE A 23 -6.686 -28.055 -15.161 1.00 0.00 C ATOM 232 CG1 ILE A 23 -6.299 -27.730 -13.716 1.00 0.00 C ATOM 233 CG2 ILE A 23 -8.187 -27.888 -15.404 1.00 0.00 C ATOM 234 CD1 ILE A 23 -6.598 -26.267 -13.385 1.00 0.00 C ATOM 0 H ILE A 23 -4.288 -29.009 -14.875 1.00 0.00 H new ATOM 0 HA ILE A 23 -7.005 -30.136 -15.212 1.00 0.00 H new ATOM 0 HB ILE A 23 -6.175 -27.336 -15.801 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.847 -28.380 -13.034 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -5.238 -27.931 -13.566 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -8.492 -26.881 -15.118 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.405 -28.047 -16.460 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -8.736 -28.616 -14.807 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.314 -26.062 -12.353 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.030 -25.619 -14.053 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -7.663 -26.075 -13.513 1.00 0.00 H new ATOM 246 N PRO A 24 -6.828 -30.667 -17.580 1.00 0.00 N ATOM 247 CA PRO A 24 -6.791 -30.973 -19.000 1.00 0.00 C ATOM 248 C PRO A 24 -7.566 -29.929 -19.807 1.00 0.00 C ATOM 249 O PRO A 24 -8.110 -28.982 -19.242 1.00 0.00 O ATOM 250 CB PRO A 24 -7.378 -32.370 -19.117 1.00 0.00 C ATOM 251 CG PRO A 24 -8.147 -32.608 -17.827 1.00 0.00 C ATOM 252 CD PRO A 24 -7.732 -31.537 -16.833 1.00 0.00 C ATOM 0 HA PRO A 24 -5.781 -30.944 -19.410 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -8.035 -32.446 -19.983 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -6.592 -33.114 -19.246 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -9.221 -32.564 -18.009 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -7.931 -33.600 -17.431 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -8.596 -30.985 -16.462 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -7.236 -31.973 -15.966 1.00 0.00 H new ATOM 260 N TYR A 25 -7.591 -30.138 -21.115 1.00 0.00 N ATOM 261 CA TYR A 25 -8.290 -29.227 -22.005 1.00 0.00 C ATOM 262 C TYR A 25 -9.804 -29.432 -21.921 1.00 0.00 C ATOM 263 O TYR A 25 -10.570 -28.690 -22.534 1.00 0.00 O ATOM 264 CB TYR A 25 -7.818 -29.572 -23.418 1.00 0.00 C ATOM 265 CG TYR A 25 -6.296 -29.602 -23.576 1.00 0.00 C ATOM 266 CD1 TYR A 25 -5.601 -30.771 -23.340 1.00 0.00 C ATOM 267 CD2 TYR A 25 -5.619 -28.461 -23.954 1.00 0.00 C ATOM 268 CE1 TYR A 25 -4.169 -30.799 -23.489 1.00 0.00 C ATOM 269 CE2 TYR A 25 -4.187 -28.489 -24.102 1.00 0.00 C ATOM 270 CZ TYR A 25 -3.532 -29.656 -23.862 1.00 0.00 C ATOM 271 OH TYR A 25 -2.180 -29.683 -24.002 1.00 0.00 O ATOM 0 H TYR A 25 -7.138 -30.925 -21.580 1.00 0.00 H new ATOM 0 HA TYR A 25 -8.081 -28.192 -21.736 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -8.221 -30.545 -23.697 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -8.231 -28.844 -24.116 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -6.131 -31.664 -23.044 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -6.163 -27.547 -24.139 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -3.613 -31.707 -23.309 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -3.645 -27.603 -24.397 1.00 0.00 H new ATOM 0 HH TYR A 25 -1.861 -28.797 -24.273 1.00 0.00 H new ATOM 281 N GLU A 26 -10.190 -30.444 -21.158 1.00 0.00 N ATOM 282 CA GLU A 26 -11.599 -30.757 -20.987 1.00 0.00 C ATOM 283 C GLU A 26 -12.161 -30.024 -19.767 1.00 0.00 C ATOM 284 O GLU A 26 -13.372 -30.008 -19.551 1.00 0.00 O ATOM 285 CB GLU A 26 -11.815 -32.267 -20.866 1.00 0.00 C ATOM 286 CG GLU A 26 -12.741 -32.778 -21.972 1.00 0.00 C ATOM 287 CD GLU A 26 -12.332 -34.182 -22.424 1.00 0.00 C ATOM 288 OE1 GLU A 26 -11.110 -34.395 -22.578 1.00 0.00 O ATOM 289 OE2 GLU A 26 -13.251 -35.009 -22.606 1.00 0.00 O ATOM 0 H GLU A 26 -9.552 -31.058 -20.651 1.00 0.00 H new ATOM 0 HA GLU A 26 -12.137 -30.416 -21.872 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.856 -32.781 -20.923 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -12.244 -32.500 -19.891 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -13.770 -32.793 -21.612 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -12.711 -32.095 -22.821 1.00 0.00 H new ATOM 296 N ALA A 27 -11.254 -29.436 -19.000 1.00 0.00 N ATOM 297 CA ALA A 27 -11.644 -28.703 -17.808 1.00 0.00 C ATOM 298 C ALA A 27 -11.317 -27.220 -17.996 1.00 0.00 C ATOM 299 O ALA A 27 -10.186 -26.796 -17.764 1.00 0.00 O ATOM 300 CB ALA A 27 -10.944 -29.304 -16.587 1.00 0.00 C ATOM 0 H ALA A 27 -10.250 -29.453 -19.181 1.00 0.00 H new ATOM 0 HA ALA A 27 -12.718 -28.785 -17.642 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.237 -28.754 -15.693 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.232 -30.350 -16.480 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -9.864 -29.237 -16.717 1.00 0.00 H new ATOM 306 N THR A 28 -12.328 -26.472 -18.414 1.00 0.00 N ATOM 307 CA THR A 28 -12.162 -25.046 -18.636 1.00 0.00 C ATOM 308 C THR A 28 -12.490 -24.266 -17.361 1.00 0.00 C ATOM 309 O THR A 28 -12.929 -24.847 -16.369 1.00 0.00 O ATOM 310 CB THR A 28 -13.031 -24.649 -19.831 1.00 0.00 C ATOM 311 OG1 THR A 28 -14.351 -24.592 -19.297 1.00 0.00 O ATOM 312 CG2 THR A 28 -13.105 -25.749 -20.892 1.00 0.00 C ATOM 0 H THR A 28 -13.265 -26.827 -18.605 1.00 0.00 H new ATOM 0 HA THR A 28 -11.127 -24.801 -18.873 1.00 0.00 H new ATOM 0 HB THR A 28 -12.636 -23.738 -20.280 1.00 0.00 H new ATOM 0 HG1 THR A 28 -14.980 -24.339 -20.005 1.00 0.00 H new ATOM 0 HG21 THR A 28 -13.734 -25.416 -21.718 1.00 0.00 H new ATOM 0 HG22 THR A 28 -12.103 -25.965 -21.263 1.00 0.00 H new ATOM 0 HG23 THR A 28 -13.531 -26.651 -20.452 1.00 0.00 H new ATOM 320 N GLU A 29 -12.264 -22.963 -17.428 1.00 0.00 N ATOM 321 CA GLU A 29 -12.531 -22.097 -16.292 1.00 0.00 C ATOM 322 C GLU A 29 -13.996 -22.213 -15.868 1.00 0.00 C ATOM 323 O GLU A 29 -14.322 -22.046 -14.694 1.00 0.00 O ATOM 324 CB GLU A 29 -12.165 -20.646 -16.610 1.00 0.00 C ATOM 325 CG GLU A 29 -10.686 -20.378 -16.323 1.00 0.00 C ATOM 326 CD GLU A 29 -10.326 -18.920 -16.617 1.00 0.00 C ATOM 327 OE1 GLU A 29 -11.236 -18.074 -16.488 1.00 0.00 O ATOM 328 OE2 GLU A 29 -9.148 -18.686 -16.964 1.00 0.00 O ATOM 0 H GLU A 29 -11.899 -22.485 -18.252 1.00 0.00 H new ATOM 0 HA GLU A 29 -11.906 -22.420 -15.460 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -12.380 -20.434 -17.657 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -12.782 -19.973 -16.015 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -10.467 -20.607 -15.280 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -10.068 -21.039 -16.931 1.00 0.00 H new ATOM 335 N GLU A 30 -14.841 -22.498 -16.848 1.00 0.00 N ATOM 336 CA GLU A 30 -16.265 -22.638 -16.592 1.00 0.00 C ATOM 337 C GLU A 30 -16.516 -23.777 -15.601 1.00 0.00 C ATOM 338 O GLU A 30 -17.445 -23.711 -14.797 1.00 0.00 O ATOM 339 CB GLU A 30 -17.037 -22.863 -17.893 1.00 0.00 C ATOM 340 CG GLU A 30 -17.867 -21.631 -18.258 1.00 0.00 C ATOM 341 CD GLU A 30 -19.131 -22.028 -19.022 1.00 0.00 C ATOM 342 OE1 GLU A 30 -19.023 -22.183 -20.258 1.00 0.00 O ATOM 343 OE2 GLU A 30 -20.178 -22.168 -18.354 1.00 0.00 O ATOM 0 H GLU A 30 -14.567 -22.636 -17.821 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.628 -21.710 -16.149 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -16.339 -23.088 -18.700 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -17.691 -23.728 -17.787 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -18.140 -21.091 -17.352 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -17.269 -20.952 -18.866 1.00 0.00 H new ATOM 350 N GLN A 31 -15.672 -24.794 -15.692 1.00 0.00 N ATOM 351 CA GLN A 31 -15.791 -25.946 -14.813 1.00 0.00 C ATOM 352 C GLN A 31 -14.968 -25.731 -13.542 1.00 0.00 C ATOM 353 O GLN A 31 -15.442 -25.998 -12.439 1.00 0.00 O ATOM 354 CB GLN A 31 -15.367 -27.229 -15.531 1.00 0.00 C ATOM 355 CG GLN A 31 -16.391 -27.625 -16.597 1.00 0.00 C ATOM 356 CD GLN A 31 -16.758 -29.106 -16.480 1.00 0.00 C ATOM 357 OE1 GLN A 31 -17.708 -29.486 -15.816 1.00 0.00 O ATOM 358 NE2 GLN A 31 -15.954 -29.917 -17.161 1.00 0.00 N ATOM 0 H GLN A 31 -14.903 -24.845 -16.360 1.00 0.00 H new ATOM 0 HA GLN A 31 -16.838 -26.056 -14.530 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -14.391 -27.085 -15.995 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -15.260 -28.037 -14.807 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -17.288 -27.015 -16.490 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -15.985 -27.424 -17.589 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -15.176 -29.532 -17.697 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -16.115 -30.924 -17.148 1.00 0.00 H new ATOM 367 N LEU A 32 -13.749 -25.250 -13.738 1.00 0.00 N ATOM 368 CA LEU A 32 -12.856 -24.996 -12.621 1.00 0.00 C ATOM 369 C LEU A 32 -13.526 -24.025 -11.648 1.00 0.00 C ATOM 370 O LEU A 32 -13.562 -24.272 -10.444 1.00 0.00 O ATOM 371 CB LEU A 32 -11.491 -24.519 -13.124 1.00 0.00 C ATOM 372 CG LEU A 32 -10.649 -25.559 -13.866 1.00 0.00 C ATOM 373 CD1 LEU A 32 -11.246 -26.959 -13.711 1.00 0.00 C ATOM 374 CD2 LEU A 32 -10.470 -25.172 -15.335 1.00 0.00 C ATOM 0 H LEU A 32 -13.359 -25.030 -14.654 1.00 0.00 H new ATOM 0 HA LEU A 32 -12.663 -25.917 -12.070 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -11.647 -23.667 -13.786 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -10.917 -24.158 -12.270 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.657 -25.580 -13.415 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -10.629 -27.679 -14.248 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -11.279 -27.225 -12.655 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -12.256 -26.971 -14.120 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.868 -25.928 -15.840 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -11.446 -25.106 -15.815 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.968 -24.207 -15.398 1.00 0.00 H new ATOM 386 N LYS A 33 -14.042 -22.939 -12.206 1.00 0.00 N ATOM 387 CA LYS A 33 -14.709 -21.929 -11.403 1.00 0.00 C ATOM 388 C LYS A 33 -15.927 -22.552 -10.717 1.00 0.00 C ATOM 389 O LYS A 33 -16.231 -22.229 -9.570 1.00 0.00 O ATOM 390 CB LYS A 33 -15.043 -20.702 -12.253 1.00 0.00 C ATOM 391 CG LYS A 33 -15.070 -19.433 -11.398 1.00 0.00 C ATOM 392 CD LYS A 33 -14.429 -18.258 -12.140 1.00 0.00 C ATOM 393 CE LYS A 33 -15.480 -17.461 -12.914 1.00 0.00 C ATOM 394 NZ LYS A 33 -16.220 -16.558 -12.005 1.00 0.00 N ATOM 0 H LYS A 33 -14.011 -22.737 -13.205 1.00 0.00 H new ATOM 0 HA LYS A 33 -14.047 -21.571 -10.615 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -14.305 -20.594 -13.048 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -16.011 -20.841 -12.734 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -16.100 -19.186 -11.139 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.540 -19.609 -10.462 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -13.924 -17.605 -11.428 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -13.669 -18.628 -12.828 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.998 -16.880 -13.700 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -16.175 -18.144 -13.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.918 -16.012 -12.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -16.710 -17.120 -11.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.553 -15.906 -11.545 1.00 0.00 H new ATOM 408 N ASP A 34 -16.592 -23.434 -11.450 1.00 0.00 N ATOM 409 CA ASP A 34 -17.770 -24.105 -10.927 1.00 0.00 C ATOM 410 C ASP A 34 -17.362 -25.006 -9.759 1.00 0.00 C ATOM 411 O ASP A 34 -18.084 -25.108 -8.768 1.00 0.00 O ATOM 412 CB ASP A 34 -18.423 -24.983 -11.996 1.00 0.00 C ATOM 413 CG ASP A 34 -19.927 -24.766 -12.180 1.00 0.00 C ATOM 414 OD1 ASP A 34 -20.378 -23.639 -11.883 1.00 0.00 O ATOM 415 OD2 ASP A 34 -20.590 -25.733 -12.613 1.00 0.00 O ATOM 0 H ASP A 34 -16.337 -23.699 -12.401 1.00 0.00 H new ATOM 0 HA ASP A 34 -18.478 -23.342 -10.605 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.925 -24.801 -12.948 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -18.250 -26.029 -11.741 1.00 0.00 H new ATOM 420 N ILE A 35 -16.207 -25.636 -9.915 1.00 0.00 N ATOM 421 CA ILE A 35 -15.695 -26.525 -8.886 1.00 0.00 C ATOM 422 C ILE A 35 -15.308 -25.703 -7.655 1.00 0.00 C ATOM 423 O ILE A 35 -15.663 -26.056 -6.532 1.00 0.00 O ATOM 424 CB ILE A 35 -14.554 -27.382 -9.438 1.00 0.00 C ATOM 425 CG1 ILE A 35 -15.007 -28.175 -10.665 1.00 0.00 C ATOM 426 CG2 ILE A 35 -13.976 -28.290 -8.351 1.00 0.00 C ATOM 427 CD1 ILE A 35 -13.883 -28.276 -11.698 1.00 0.00 C ATOM 0 H ILE A 35 -15.611 -25.548 -10.738 1.00 0.00 H new ATOM 0 HA ILE A 35 -16.466 -27.228 -8.571 1.00 0.00 H new ATOM 0 HB ILE A 35 -13.754 -26.717 -9.762 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -15.318 -29.175 -10.362 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -15.876 -27.693 -11.113 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -13.167 -28.889 -8.769 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -13.591 -27.680 -7.534 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -14.758 -28.950 -7.974 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -14.231 -28.845 -12.560 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -13.591 -27.275 -12.017 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -13.025 -28.780 -11.254 1.00 0.00 H new ATOM 439 N PHE A 36 -14.584 -24.623 -7.908 1.00 0.00 N ATOM 440 CA PHE A 36 -14.145 -23.748 -6.834 1.00 0.00 C ATOM 441 C PHE A 36 -15.331 -23.017 -6.202 1.00 0.00 C ATOM 442 O PHE A 36 -15.299 -22.680 -5.020 1.00 0.00 O ATOM 443 CB PHE A 36 -13.199 -22.718 -7.455 1.00 0.00 C ATOM 444 CG PHE A 36 -11.723 -23.120 -7.405 1.00 0.00 C ATOM 445 CD1 PHE A 36 -11.253 -24.087 -8.238 1.00 0.00 C ATOM 446 CD2 PHE A 36 -10.882 -22.510 -6.527 1.00 0.00 C ATOM 447 CE1 PHE A 36 -9.883 -24.459 -8.191 1.00 0.00 C ATOM 448 CE2 PHE A 36 -9.512 -22.883 -6.481 1.00 0.00 C ATOM 449 CZ PHE A 36 -9.042 -23.850 -7.314 1.00 0.00 C ATOM 0 H PHE A 36 -14.290 -24.334 -8.841 1.00 0.00 H new ATOM 0 HA PHE A 36 -13.656 -24.333 -6.055 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -13.486 -22.556 -8.494 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -13.324 -21.767 -6.938 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -11.921 -24.572 -8.935 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -11.256 -21.743 -5.865 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -9.509 -25.226 -8.853 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -8.844 -22.399 -5.785 1.00 0.00 H new ATOM 0 HZ PHE A 36 -8.001 -24.134 -7.279 1.00 0.00 H new ATOM 459 N SER A 37 -16.351 -22.793 -7.019 1.00 0.00 N ATOM 460 CA SER A 37 -17.545 -22.108 -6.555 1.00 0.00 C ATOM 461 C SER A 37 -18.234 -22.936 -5.469 1.00 0.00 C ATOM 462 O SER A 37 -18.801 -22.383 -4.527 1.00 0.00 O ATOM 463 CB SER A 37 -18.511 -21.840 -7.711 1.00 0.00 C ATOM 464 OG SER A 37 -19.133 -23.035 -8.175 1.00 0.00 O ATOM 0 H SER A 37 -16.374 -23.074 -7.999 1.00 0.00 H new ATOM 0 HA SER A 37 -17.247 -21.147 -6.136 1.00 0.00 H new ATOM 0 HB2 SER A 37 -19.277 -21.135 -7.388 1.00 0.00 H new ATOM 0 HB3 SER A 37 -17.971 -21.370 -8.533 1.00 0.00 H new ATOM 0 HG SER A 37 -18.510 -23.786 -8.080 1.00 0.00 H new ATOM 470 N GLU A 38 -18.163 -24.249 -5.635 1.00 0.00 N ATOM 471 CA GLU A 38 -18.774 -25.159 -4.681 1.00 0.00 C ATOM 472 C GLU A 38 -17.992 -25.151 -3.366 1.00 0.00 C ATOM 473 O GLU A 38 -18.465 -25.669 -2.355 1.00 0.00 O ATOM 474 CB GLU A 38 -18.867 -26.574 -5.255 1.00 0.00 C ATOM 475 CG GLU A 38 -19.013 -27.610 -4.138 1.00 0.00 C ATOM 476 CD GLU A 38 -20.312 -27.396 -3.358 1.00 0.00 C ATOM 477 OE1 GLU A 38 -21.302 -26.990 -4.005 1.00 0.00 O ATOM 478 OE2 GLU A 38 -20.285 -27.643 -2.133 1.00 0.00 O ATOM 0 H GLU A 38 -17.691 -24.704 -6.416 1.00 0.00 H new ATOM 0 HA GLU A 38 -19.789 -24.817 -4.480 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -19.719 -26.641 -5.931 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -17.975 -26.791 -5.843 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -19.001 -28.613 -4.564 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -18.162 -27.542 -3.460 1.00 0.00 H new ATOM 485 N VAL A 39 -16.808 -24.558 -3.421 1.00 0.00 N ATOM 486 CA VAL A 39 -15.956 -24.476 -2.247 1.00 0.00 C ATOM 487 C VAL A 39 -16.010 -23.056 -1.681 1.00 0.00 C ATOM 488 O VAL A 39 -15.264 -22.721 -0.763 1.00 0.00 O ATOM 489 CB VAL A 39 -14.537 -24.926 -2.598 1.00 0.00 C ATOM 490 CG1 VAL A 39 -13.812 -25.468 -1.364 1.00 0.00 C ATOM 491 CG2 VAL A 39 -14.553 -25.963 -3.724 1.00 0.00 C ATOM 0 H VAL A 39 -16.419 -24.130 -4.261 1.00 0.00 H new ATOM 0 HA VAL A 39 -16.313 -25.150 -1.468 1.00 0.00 H new ATOM 0 HB VAL A 39 -13.988 -24.054 -2.953 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.805 -25.781 -1.642 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -13.753 -24.688 -0.605 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -14.360 -26.322 -0.966 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -13.532 -26.266 -3.954 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -15.128 -26.834 -3.408 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -15.011 -25.528 -4.612 1.00 0.00 H new ATOM 501 N GLY A 40 -16.901 -22.259 -2.253 1.00 0.00 N ATOM 502 CA GLY A 40 -17.062 -20.882 -1.817 1.00 0.00 C ATOM 503 C GLY A 40 -17.154 -19.935 -3.015 1.00 0.00 C ATOM 504 O GLY A 40 -17.141 -20.376 -4.163 1.00 0.00 O ATOM 0 H GLY A 40 -17.519 -22.540 -3.014 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -17.962 -20.792 -1.208 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -16.220 -20.596 -1.186 1.00 0.00 H new ATOM 508 N PRO A 41 -17.247 -18.615 -2.698 1.00 0.00 N ATOM 509 CA PRO A 41 -17.341 -17.602 -3.735 1.00 0.00 C ATOM 510 C PRO A 41 -15.986 -17.380 -4.409 1.00 0.00 C ATOM 511 O PRO A 41 -15.003 -17.056 -3.744 1.00 0.00 O ATOM 512 CB PRO A 41 -17.863 -16.362 -3.027 1.00 0.00 C ATOM 513 CG PRO A 41 -17.601 -16.586 -1.547 1.00 0.00 C ATOM 514 CD PRO A 41 -17.266 -18.056 -1.350 1.00 0.00 C ATOM 0 HA PRO A 41 -18.008 -17.891 -4.547 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -17.354 -15.466 -3.382 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -18.927 -16.222 -3.218 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -16.778 -15.958 -1.206 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -18.477 -16.312 -0.959 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -16.302 -18.180 -0.856 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -18.010 -18.552 -0.726 1.00 0.00 H new ATOM 522 N VAL A 42 -15.976 -17.563 -5.721 1.00 0.00 N ATOM 523 CA VAL A 42 -14.758 -17.386 -6.493 1.00 0.00 C ATOM 524 C VAL A 42 -14.790 -16.022 -7.184 1.00 0.00 C ATOM 525 O VAL A 42 -15.715 -15.726 -7.939 1.00 0.00 O ATOM 526 CB VAL A 42 -14.586 -18.549 -7.473 1.00 0.00 C ATOM 527 CG1 VAL A 42 -15.674 -18.526 -8.547 1.00 0.00 C ATOM 528 CG2 VAL A 42 -13.192 -18.532 -8.104 1.00 0.00 C ATOM 0 H VAL A 42 -16.793 -17.832 -6.269 1.00 0.00 H new ATOM 0 HA VAL A 42 -13.886 -17.398 -5.839 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.689 -19.478 -6.912 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.529 -19.363 -9.230 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -16.653 -18.609 -8.075 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -15.617 -17.590 -9.103 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -13.096 -19.368 -8.796 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -13.048 -17.596 -8.644 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.438 -18.619 -7.322 1.00 0.00 H new ATOM 538 N VAL A 43 -13.768 -15.227 -6.901 1.00 0.00 N ATOM 539 CA VAL A 43 -13.668 -13.900 -7.486 1.00 0.00 C ATOM 540 C VAL A 43 -13.316 -14.027 -8.969 1.00 0.00 C ATOM 541 O VAL A 43 -14.175 -13.855 -9.832 1.00 0.00 O ATOM 542 CB VAL A 43 -12.660 -13.058 -6.702 1.00 0.00 C ATOM 543 CG1 VAL A 43 -12.647 -11.612 -7.203 1.00 0.00 C ATOM 544 CG2 VAL A 43 -12.947 -13.115 -5.200 1.00 0.00 C ATOM 0 H VAL A 43 -13.002 -15.476 -6.275 1.00 0.00 H new ATOM 0 HA VAL A 43 -14.624 -13.381 -7.422 1.00 0.00 H new ATOM 0 HB VAL A 43 -11.669 -13.480 -6.869 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -11.922 -11.035 -6.629 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -12.372 -11.595 -8.257 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -13.638 -11.175 -7.080 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -12.216 -12.508 -4.667 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.948 -12.731 -5.006 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -12.882 -14.147 -4.856 1.00 0.00 H new ATOM 554 N SER A 44 -12.050 -14.328 -9.221 1.00 0.00 N ATOM 555 CA SER A 44 -11.574 -14.480 -10.585 1.00 0.00 C ATOM 556 C SER A 44 -10.702 -15.732 -10.698 1.00 0.00 C ATOM 557 O SER A 44 -10.207 -16.241 -9.693 1.00 0.00 O ATOM 558 CB SER A 44 -10.791 -13.245 -11.036 1.00 0.00 C ATOM 559 OG SER A 44 -9.436 -13.282 -10.595 1.00 0.00 O ATOM 0 H SER A 44 -11.340 -14.471 -8.503 1.00 0.00 H new ATOM 0 HA SER A 44 -12.439 -14.587 -11.239 1.00 0.00 H new ATOM 0 HB2 SER A 44 -10.817 -13.177 -12.124 1.00 0.00 H new ATOM 0 HB3 SER A 44 -11.274 -12.348 -10.649 1.00 0.00 H new ATOM 0 HG SER A 44 -8.969 -12.478 -10.904 1.00 0.00 H new ATOM 565 N PHE A 45 -10.540 -16.192 -11.930 1.00 0.00 N ATOM 566 CA PHE A 45 -9.736 -17.375 -12.187 1.00 0.00 C ATOM 567 C PHE A 45 -9.141 -17.338 -13.596 1.00 0.00 C ATOM 568 O PHE A 45 -9.872 -17.379 -14.584 1.00 0.00 O ATOM 569 CB PHE A 45 -10.669 -18.583 -12.072 1.00 0.00 C ATOM 570 CG PHE A 45 -9.946 -19.902 -11.789 1.00 0.00 C ATOM 571 CD1 PHE A 45 -8.610 -20.009 -12.020 1.00 0.00 C ATOM 572 CD2 PHE A 45 -10.640 -20.967 -11.307 1.00 0.00 C ATOM 573 CE1 PHE A 45 -7.940 -21.233 -11.757 1.00 0.00 C ATOM 574 CE2 PHE A 45 -9.970 -22.191 -11.044 1.00 0.00 C ATOM 575 CZ PHE A 45 -8.634 -22.298 -11.275 1.00 0.00 C ATOM 0 H PHE A 45 -10.952 -15.767 -12.761 1.00 0.00 H new ATOM 0 HA PHE A 45 -8.912 -17.427 -11.475 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -11.390 -18.398 -11.276 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -11.235 -18.682 -12.998 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -8.059 -19.163 -12.403 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -11.701 -20.882 -11.124 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -6.879 -21.318 -11.940 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -10.521 -23.037 -10.661 1.00 0.00 H new ATOM 0 HZ PHE A 45 -8.124 -23.229 -11.076 1.00 0.00 H new ATOM 585 N ARG A 46 -7.819 -17.260 -13.644 1.00 0.00 N ATOM 586 CA ARG A 46 -7.117 -17.216 -14.915 1.00 0.00 C ATOM 587 C ARG A 46 -5.976 -18.234 -14.926 1.00 0.00 C ATOM 588 O ARG A 46 -5.292 -18.417 -13.920 1.00 0.00 O ATOM 589 CB ARG A 46 -6.549 -15.821 -15.183 1.00 0.00 C ATOM 590 CG ARG A 46 -7.671 -14.812 -15.441 1.00 0.00 C ATOM 591 CD ARG A 46 -7.161 -13.620 -16.253 1.00 0.00 C ATOM 592 NE ARG A 46 -7.689 -12.359 -15.686 1.00 0.00 N ATOM 593 CZ ARG A 46 -8.935 -11.909 -15.888 1.00 0.00 C ATOM 594 NH1 ARG A 46 -9.788 -12.613 -16.644 1.00 0.00 N ATOM 595 NH2 ARG A 46 -9.327 -10.753 -15.335 1.00 0.00 N ATOM 0 H ARG A 46 -7.216 -17.226 -12.822 1.00 0.00 H new ATOM 0 HA ARG A 46 -7.834 -17.460 -15.698 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -5.953 -15.497 -14.330 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.881 -15.856 -16.044 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -8.487 -15.299 -15.976 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -8.076 -14.463 -14.491 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -6.071 -13.604 -16.245 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -7.471 -13.719 -17.293 1.00 0.00 H new ATOM 0 HE ARG A 46 -7.066 -11.798 -15.105 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.489 -13.492 -17.066 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -10.736 -12.270 -16.797 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -8.677 -10.216 -14.761 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -10.275 -10.410 -15.488 1.00 0.00 H new ATOM 609 N LEU A 47 -5.805 -18.872 -16.075 1.00 0.00 N ATOM 610 CA LEU A 47 -4.758 -19.867 -16.231 1.00 0.00 C ATOM 611 C LEU A 47 -3.783 -19.410 -17.318 1.00 0.00 C ATOM 612 O LEU A 47 -3.989 -18.372 -17.945 1.00 0.00 O ATOM 613 CB LEU A 47 -5.365 -21.247 -16.490 1.00 0.00 C ATOM 614 CG LEU A 47 -6.708 -21.528 -15.812 1.00 0.00 C ATOM 615 CD1 LEU A 47 -7.793 -21.827 -16.848 1.00 0.00 C ATOM 616 CD2 LEU A 47 -6.577 -22.648 -14.779 1.00 0.00 C ATOM 0 H LEU A 47 -6.375 -18.719 -16.907 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.185 -19.964 -15.309 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -5.491 -21.370 -17.566 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.651 -22.003 -16.164 1.00 0.00 H new ATOM 0 HG LEU A 47 -7.014 -20.630 -15.275 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -8.737 -22.023 -16.340 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -7.909 -20.970 -17.511 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.507 -22.702 -17.432 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -7.545 -22.828 -14.312 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -6.237 -23.559 -15.271 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.855 -22.357 -14.016 1.00 0.00 H new ATOM 628 N VAL A 48 -2.742 -20.208 -17.508 1.00 0.00 N ATOM 629 CA VAL A 48 -1.735 -19.898 -18.508 1.00 0.00 C ATOM 630 C VAL A 48 -2.170 -20.473 -19.858 1.00 0.00 C ATOM 631 O VAL A 48 -2.381 -21.678 -19.984 1.00 0.00 O ATOM 632 CB VAL A 48 -0.368 -20.413 -18.051 1.00 0.00 C ATOM 633 CG1 VAL A 48 0.238 -19.492 -16.990 1.00 0.00 C ATOM 634 CG2 VAL A 48 -0.468 -21.851 -17.537 1.00 0.00 C ATOM 0 H VAL A 48 -2.575 -21.068 -16.986 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.637 -18.819 -18.630 1.00 0.00 H new ATOM 0 HB VAL A 48 0.297 -20.412 -18.915 1.00 0.00 H new ATOM 0 HG11 VAL A 48 1.209 -19.881 -16.682 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.362 -18.492 -17.405 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.425 -19.447 -16.126 1.00 0.00 H new ATOM 0 HG21 VAL A 48 0.517 -22.193 -17.219 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.156 -21.888 -16.692 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -0.836 -22.497 -18.334 1.00 0.00 H new ATOM 644 N TYR A 49 -2.289 -19.583 -20.832 1.00 0.00 N ATOM 645 CA TYR A 49 -2.695 -19.987 -22.168 1.00 0.00 C ATOM 646 C TYR A 49 -1.673 -19.532 -23.212 1.00 0.00 C ATOM 647 O TYR A 49 -1.427 -18.336 -23.366 1.00 0.00 O ATOM 648 CB TYR A 49 -4.027 -19.283 -22.435 1.00 0.00 C ATOM 649 CG TYR A 49 -5.242 -20.211 -22.382 1.00 0.00 C ATOM 650 CD1 TYR A 49 -5.638 -20.895 -23.514 1.00 0.00 C ATOM 651 CD2 TYR A 49 -5.942 -20.364 -21.203 1.00 0.00 C ATOM 652 CE1 TYR A 49 -6.782 -21.768 -23.464 1.00 0.00 C ATOM 653 CE2 TYR A 49 -7.086 -21.237 -21.153 1.00 0.00 C ATOM 654 CZ TYR A 49 -7.450 -21.896 -22.286 1.00 0.00 C ATOM 655 OH TYR A 49 -8.530 -22.720 -22.239 1.00 0.00 O ATOM 0 H TYR A 49 -2.112 -18.584 -20.723 1.00 0.00 H new ATOM 0 HA TYR A 49 -2.775 -21.072 -22.233 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -4.159 -18.487 -21.703 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -3.986 -18.810 -23.416 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -5.090 -20.775 -24.437 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -5.632 -19.829 -20.318 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -7.102 -22.309 -24.342 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -7.643 -21.366 -20.236 1.00 0.00 H new ATOM 0 HH TYR A 49 -8.907 -22.714 -21.334 1.00 0.00 H new ATOM 665 N ASP A 50 -1.105 -20.509 -23.903 1.00 0.00 N ATOM 666 CA ASP A 50 -0.116 -20.225 -24.928 1.00 0.00 C ATOM 667 C ASP A 50 -0.812 -19.622 -26.150 1.00 0.00 C ATOM 668 O ASP A 50 -1.538 -20.317 -26.861 1.00 0.00 O ATOM 669 CB ASP A 50 0.600 -21.502 -25.374 1.00 0.00 C ATOM 670 CG ASP A 50 1.876 -21.832 -24.598 1.00 0.00 C ATOM 671 OD1 ASP A 50 2.412 -20.898 -23.963 1.00 0.00 O ATOM 672 OD2 ASP A 50 2.287 -23.011 -24.657 1.00 0.00 O ATOM 0 H ASP A 50 -1.311 -21.499 -23.773 1.00 0.00 H new ATOM 0 HA ASP A 50 0.613 -19.531 -24.509 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -0.091 -22.340 -25.280 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.849 -21.411 -26.431 1.00 0.00 H new ATOM 677 N ARG A 51 -0.567 -18.337 -26.357 1.00 0.00 N ATOM 678 CA ARG A 51 -1.162 -17.633 -27.481 1.00 0.00 C ATOM 679 C ARG A 51 -0.500 -18.068 -28.790 1.00 0.00 C ATOM 680 O ARG A 51 -1.134 -18.056 -29.844 1.00 0.00 O ATOM 681 CB ARG A 51 -1.016 -16.118 -27.322 1.00 0.00 C ATOM 682 CG ARG A 51 -1.987 -15.582 -26.268 1.00 0.00 C ATOM 683 CD ARG A 51 -1.830 -14.069 -26.098 1.00 0.00 C ATOM 684 NE ARG A 51 -3.132 -13.462 -25.743 1.00 0.00 N ATOM 685 CZ ARG A 51 -4.066 -13.111 -26.637 1.00 0.00 C ATOM 686 NH1 ARG A 51 -3.848 -13.305 -27.945 1.00 0.00 N ATOM 687 NH2 ARG A 51 -5.219 -12.567 -26.224 1.00 0.00 N ATOM 0 H ARG A 51 0.035 -17.764 -25.766 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.223 -17.883 -27.505 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.007 -15.876 -27.036 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.204 -15.628 -28.278 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -3.011 -15.815 -26.560 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -1.806 -16.080 -25.315 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.096 -13.856 -25.321 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -1.453 -13.628 -27.021 1.00 0.00 H new ATOM 0 HE ARG A 51 -3.331 -13.301 -24.756 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -2.971 -13.720 -28.260 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -4.559 -13.038 -28.626 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -5.386 -12.420 -25.229 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -5.930 -12.300 -26.905 1.00 0.00 H new ATOM 701 N GLU A 52 0.767 -18.441 -28.680 1.00 0.00 N ATOM 702 CA GLU A 52 1.521 -18.878 -29.842 1.00 0.00 C ATOM 703 C GLU A 52 1.022 -20.245 -30.315 1.00 0.00 C ATOM 704 O GLU A 52 1.062 -20.545 -31.507 1.00 0.00 O ATOM 705 CB GLU A 52 3.021 -18.918 -29.539 1.00 0.00 C ATOM 706 CG GLU A 52 3.843 -18.804 -30.824 1.00 0.00 C ATOM 707 CD GLU A 52 4.539 -20.127 -31.148 1.00 0.00 C ATOM 708 OE1 GLU A 52 5.028 -20.761 -30.188 1.00 0.00 O ATOM 709 OE2 GLU A 52 4.567 -20.475 -32.348 1.00 0.00 O ATOM 0 H GLU A 52 1.290 -18.449 -27.804 1.00 0.00 H new ATOM 0 HA GLU A 52 1.364 -18.157 -30.645 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.281 -18.103 -28.863 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.267 -19.848 -29.027 1.00 0.00 H new ATOM 0 HG2 GLU A 52 3.193 -18.518 -31.651 1.00 0.00 H new ATOM 0 HG3 GLU A 52 4.587 -18.015 -30.715 1.00 0.00 H new ATOM 716 N THR A 53 0.563 -21.036 -29.357 1.00 0.00 N ATOM 717 CA THR A 53 0.057 -22.364 -29.661 1.00 0.00 C ATOM 718 C THR A 53 -1.465 -22.402 -29.508 1.00 0.00 C ATOM 719 O THR A 53 -2.095 -23.423 -29.780 1.00 0.00 O ATOM 720 CB THR A 53 0.783 -23.365 -28.760 1.00 0.00 C ATOM 721 OG1 THR A 53 0.154 -23.210 -27.491 1.00 0.00 O ATOM 722 CG2 THR A 53 2.240 -22.973 -28.505 1.00 0.00 C ATOM 0 H THR A 53 0.531 -20.783 -28.369 1.00 0.00 H new ATOM 0 HA THR A 53 0.256 -22.635 -30.698 1.00 0.00 H new ATOM 0 HB THR A 53 0.748 -24.355 -29.215 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.563 -23.824 -26.846 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.709 -23.716 -27.860 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.775 -22.925 -29.453 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.275 -21.998 -28.019 1.00 0.00 H new ATOM 730 N GLY A 54 -2.012 -21.276 -29.073 1.00 0.00 N ATOM 731 CA GLY A 54 -3.448 -21.168 -28.881 1.00 0.00 C ATOM 732 C GLY A 54 -3.976 -22.323 -28.027 1.00 0.00 C ATOM 733 O GLY A 54 -5.172 -22.609 -28.034 1.00 0.00 O ATOM 0 H GLY A 54 -1.487 -20.431 -28.848 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -3.684 -20.218 -28.400 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -3.949 -21.168 -29.849 1.00 0.00 H new ATOM 737 N LYS A 55 -3.057 -22.956 -27.311 1.00 0.00 N ATOM 738 CA LYS A 55 -3.415 -24.073 -26.454 1.00 0.00 C ATOM 739 C LYS A 55 -3.085 -23.722 -25.002 1.00 0.00 C ATOM 740 O LYS A 55 -2.103 -23.030 -24.735 1.00 0.00 O ATOM 741 CB LYS A 55 -2.746 -25.359 -26.943 1.00 0.00 C ATOM 742 CG LYS A 55 -3.610 -26.060 -27.994 1.00 0.00 C ATOM 743 CD LYS A 55 -2.781 -26.429 -29.227 1.00 0.00 C ATOM 744 CE LYS A 55 -3.572 -26.181 -30.512 1.00 0.00 C ATOM 745 NZ LYS A 55 -2.663 -25.792 -31.613 1.00 0.00 N ATOM 0 H LYS A 55 -2.066 -22.716 -27.307 1.00 0.00 H new ATOM 0 HA LYS A 55 -4.488 -24.261 -26.501 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.769 -25.127 -27.366 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.577 -26.029 -26.100 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -4.052 -26.960 -27.566 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -4.434 -25.409 -28.286 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -1.863 -25.842 -29.242 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.488 -27.477 -29.172 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -4.122 -27.081 -30.787 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -4.309 -25.395 -30.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.216 -25.627 -32.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.157 -24.921 -31.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -1.976 -26.554 -31.781 1.00 0.00 H new ATOM 759 N PRO A 56 -3.945 -24.227 -24.078 1.00 0.00 N ATOM 760 CA PRO A 56 -3.754 -23.975 -22.660 1.00 0.00 C ATOM 761 C PRO A 56 -2.606 -24.818 -22.103 1.00 0.00 C ATOM 762 O PRO A 56 -2.481 -25.997 -22.430 1.00 0.00 O ATOM 763 CB PRO A 56 -5.094 -24.298 -22.019 1.00 0.00 C ATOM 764 CG PRO A 56 -5.841 -25.158 -23.025 1.00 0.00 C ATOM 765 CD PRO A 56 -5.118 -25.050 -24.358 1.00 0.00 C ATOM 0 HA PRO A 56 -3.466 -22.945 -22.451 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -4.958 -24.828 -21.076 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -5.649 -23.387 -21.795 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -5.873 -26.195 -22.691 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -6.873 -24.822 -23.122 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -4.832 -26.032 -24.734 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -5.752 -24.591 -25.116 1.00 0.00 H new ATOM 773 N LYS A 57 -1.796 -24.180 -21.270 1.00 0.00 N ATOM 774 CA LYS A 57 -0.662 -24.857 -20.664 1.00 0.00 C ATOM 775 C LYS A 57 -1.154 -26.101 -19.921 1.00 0.00 C ATOM 776 O LYS A 57 -0.711 -27.213 -20.205 1.00 0.00 O ATOM 777 CB LYS A 57 0.131 -23.889 -19.783 1.00 0.00 C ATOM 778 CG LYS A 57 1.491 -23.569 -20.408 1.00 0.00 C ATOM 779 CD LYS A 57 2.443 -24.761 -20.288 1.00 0.00 C ATOM 780 CE LYS A 57 2.857 -25.272 -21.670 1.00 0.00 C ATOM 781 NZ LYS A 57 4.011 -26.192 -21.557 1.00 0.00 N ATOM 0 H LYS A 57 -1.903 -23.202 -21.001 1.00 0.00 H new ATOM 0 HA LYS A 57 0.033 -25.197 -21.431 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -0.436 -22.968 -19.646 1.00 0.00 H new ATOM 0 HB3 LYS A 57 0.274 -24.325 -18.794 1.00 0.00 H new ATOM 0 HG2 LYS A 57 1.360 -23.308 -21.458 1.00 0.00 H new ATOM 0 HG3 LYS A 57 1.927 -22.700 -19.915 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.329 -24.469 -19.724 1.00 0.00 H new ATOM 0 HD3 LYS A 57 1.960 -25.563 -19.729 1.00 0.00 H new ATOM 0 HE2 LYS A 57 2.019 -25.786 -22.140 1.00 0.00 H new ATOM 0 HE3 LYS A 57 3.116 -24.431 -22.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 4.280 -26.530 -22.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 4.814 -25.690 -21.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 3.751 -27.003 -20.961 1.00 0.00 H new ATOM 795 N GLY A 58 -2.063 -25.872 -18.985 1.00 0.00 N ATOM 796 CA GLY A 58 -2.619 -26.961 -18.200 1.00 0.00 C ATOM 797 C GLY A 58 -2.816 -26.541 -16.742 1.00 0.00 C ATOM 798 O GLY A 58 -3.587 -27.162 -16.012 1.00 0.00 O ATOM 0 H GLY A 58 -2.428 -24.949 -18.752 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -3.574 -27.270 -18.625 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -1.955 -27.824 -18.247 1.00 0.00 H new ATOM 802 N TYR A 59 -2.106 -25.489 -16.362 1.00 0.00 N ATOM 803 CA TYR A 59 -2.193 -24.979 -15.004 1.00 0.00 C ATOM 804 C TYR A 59 -2.587 -23.500 -14.998 1.00 0.00 C ATOM 805 O TYR A 59 -2.380 -22.795 -15.985 1.00 0.00 O ATOM 806 CB TYR A 59 -0.791 -25.123 -14.408 1.00 0.00 C ATOM 807 CG TYR A 59 0.303 -24.421 -15.215 1.00 0.00 C ATOM 808 CD1 TYR A 59 0.891 -25.064 -16.285 1.00 0.00 C ATOM 809 CD2 TYR A 59 0.702 -23.145 -14.872 1.00 0.00 C ATOM 810 CE1 TYR A 59 1.921 -24.403 -17.044 1.00 0.00 C ATOM 811 CE2 TYR A 59 1.731 -22.484 -15.631 1.00 0.00 C ATOM 812 CZ TYR A 59 2.291 -23.146 -16.680 1.00 0.00 C ATOM 813 OH TYR A 59 3.263 -22.522 -17.397 1.00 0.00 O ATOM 0 H TYR A 59 -1.468 -24.976 -16.970 1.00 0.00 H new ATOM 0 HA TYR A 59 -2.946 -25.525 -14.437 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.795 -24.721 -13.395 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -0.547 -26.183 -14.330 1.00 0.00 H new ATOM 0 HD1 TYR A 59 0.579 -26.063 -16.553 1.00 0.00 H new ATOM 0 HD2 TYR A 59 0.242 -22.642 -14.034 1.00 0.00 H new ATOM 0 HE1 TYR A 59 2.389 -24.895 -17.884 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.051 -21.485 -15.374 1.00 0.00 H new ATOM 0 HH TYR A 59 3.423 -21.630 -17.024 1.00 0.00 H new ATOM 823 N GLY A 60 -3.147 -23.074 -13.876 1.00 0.00 N ATOM 824 CA GLY A 60 -3.572 -21.692 -13.729 1.00 0.00 C ATOM 825 C GLY A 60 -3.705 -21.314 -12.252 1.00 0.00 C ATOM 826 O GLY A 60 -3.359 -22.101 -11.372 1.00 0.00 O ATOM 0 H GLY A 60 -3.317 -23.661 -13.060 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.852 -21.033 -14.213 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -4.527 -21.546 -14.233 1.00 0.00 H new ATOM 830 N PHE A 61 -4.208 -20.109 -12.026 1.00 0.00 N ATOM 831 CA PHE A 61 -4.392 -19.617 -10.672 1.00 0.00 C ATOM 832 C PHE A 61 -5.789 -19.020 -10.490 1.00 0.00 C ATOM 833 O PHE A 61 -6.296 -18.337 -11.379 1.00 0.00 O ATOM 834 CB PHE A 61 -3.348 -18.521 -10.448 1.00 0.00 C ATOM 835 CG PHE A 61 -1.904 -19.024 -10.468 1.00 0.00 C ATOM 836 CD1 PHE A 61 -1.270 -19.226 -11.654 1.00 0.00 C ATOM 837 CD2 PHE A 61 -1.253 -19.270 -9.299 1.00 0.00 C ATOM 838 CE1 PHE A 61 0.071 -19.694 -11.672 1.00 0.00 C ATOM 839 CE2 PHE A 61 0.087 -19.737 -9.317 1.00 0.00 C ATOM 840 CZ PHE A 61 0.721 -19.939 -10.503 1.00 0.00 C ATOM 0 H PHE A 61 -4.494 -19.459 -12.758 1.00 0.00 H new ATOM 0 HA PHE A 61 -4.281 -20.436 -9.961 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -3.467 -17.758 -11.217 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -3.541 -18.040 -9.489 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -1.786 -19.031 -12.582 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -1.756 -19.110 -8.357 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.574 -19.855 -12.614 1.00 0.00 H new ATOM 0 HE2 PHE A 61 0.603 -19.932 -8.389 1.00 0.00 H new ATOM 0 HZ PHE A 61 1.741 -20.294 -10.516 1.00 0.00 H new ATOM 850 N CYS A 62 -6.371 -19.298 -9.333 1.00 0.00 N ATOM 851 CA CYS A 62 -7.699 -18.797 -9.023 1.00 0.00 C ATOM 852 C CYS A 62 -7.594 -17.882 -7.802 1.00 0.00 C ATOM 853 O CYS A 62 -7.148 -18.309 -6.738 1.00 0.00 O ATOM 854 CB CYS A 62 -8.696 -19.936 -8.800 1.00 0.00 C ATOM 855 SG CYS A 62 -10.408 -19.296 -8.892 1.00 0.00 S ATOM 0 H CYS A 62 -5.947 -19.864 -8.598 1.00 0.00 H new ATOM 0 HA CYS A 62 -8.083 -18.228 -9.870 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -8.548 -20.712 -9.551 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -8.523 -20.397 -7.827 1.00 0.00 H new ATOM 0 HG CYS A 62 -11.018 -19.833 -9.907 1.00 0.00 H new ATOM 861 N GLU A 63 -8.014 -16.640 -7.994 1.00 0.00 N ATOM 862 CA GLU A 63 -7.973 -15.661 -6.921 1.00 0.00 C ATOM 863 C GLU A 63 -9.357 -15.513 -6.285 1.00 0.00 C ATOM 864 O GLU A 63 -10.331 -15.211 -6.972 1.00 0.00 O ATOM 865 CB GLU A 63 -7.456 -14.313 -7.428 1.00 0.00 C ATOM 866 CG GLU A 63 -7.884 -13.177 -6.498 1.00 0.00 C ATOM 867 CD GLU A 63 -6.912 -11.999 -6.588 1.00 0.00 C ATOM 868 OE1 GLU A 63 -5.743 -12.196 -6.193 1.00 0.00 O ATOM 869 OE2 GLU A 63 -7.360 -10.927 -7.049 1.00 0.00 O ATOM 0 H GLU A 63 -8.385 -16.289 -8.877 1.00 0.00 H new ATOM 0 HA GLU A 63 -7.280 -16.015 -6.158 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -6.369 -14.340 -7.499 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -7.836 -14.128 -8.433 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -8.888 -12.845 -6.762 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -7.927 -13.540 -5.471 1.00 0.00 H new ATOM 876 N TYR A 64 -9.398 -15.734 -4.979 1.00 0.00 N ATOM 877 CA TYR A 64 -10.646 -15.629 -4.242 1.00 0.00 C ATOM 878 C TYR A 64 -10.808 -14.234 -3.633 1.00 0.00 C ATOM 879 O TYR A 64 -10.062 -13.316 -3.969 1.00 0.00 O ATOM 880 CB TYR A 64 -10.557 -16.658 -3.113 1.00 0.00 C ATOM 881 CG TYR A 64 -11.185 -18.011 -3.453 1.00 0.00 C ATOM 882 CD1 TYR A 64 -11.396 -18.362 -4.771 1.00 0.00 C ATOM 883 CD2 TYR A 64 -11.541 -18.880 -2.442 1.00 0.00 C ATOM 884 CE1 TYR A 64 -11.988 -19.635 -5.091 1.00 0.00 C ATOM 885 CE2 TYR A 64 -12.132 -20.154 -2.763 1.00 0.00 C ATOM 886 CZ TYR A 64 -12.326 -20.468 -4.071 1.00 0.00 C ATOM 887 OH TYR A 64 -12.884 -21.671 -4.374 1.00 0.00 O ATOM 0 H TYR A 64 -8.588 -15.985 -4.413 1.00 0.00 H new ATOM 0 HA TYR A 64 -11.496 -15.804 -4.901 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -9.509 -16.810 -2.856 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -11.047 -16.254 -2.227 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -11.117 -17.682 -5.562 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -11.377 -18.605 -1.411 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -12.160 -19.922 -6.118 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -12.415 -20.844 -1.982 1.00 0.00 H new ATOM 0 HH TYR A 64 -13.838 -21.551 -4.563 1.00 0.00 H new ATOM 897 N GLN A 65 -11.788 -14.120 -2.749 1.00 0.00 N ATOM 898 CA GLN A 65 -12.057 -12.853 -2.090 1.00 0.00 C ATOM 899 C GLN A 65 -11.769 -12.962 -0.592 1.00 0.00 C ATOM 900 O GLN A 65 -11.693 -11.951 0.105 1.00 0.00 O ATOM 901 CB GLN A 65 -13.498 -12.400 -2.340 1.00 0.00 C ATOM 902 CG GLN A 65 -13.536 -10.975 -2.894 1.00 0.00 C ATOM 903 CD GLN A 65 -14.873 -10.690 -3.582 1.00 0.00 C ATOM 904 OE1 GLN A 65 -14.985 -10.675 -4.797 1.00 0.00 O ATOM 905 NE2 GLN A 65 -15.878 -10.466 -2.740 1.00 0.00 N ATOM 0 H GLN A 65 -12.405 -14.884 -2.474 1.00 0.00 H new ATOM 0 HA GLN A 65 -11.395 -12.098 -2.513 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -13.980 -13.080 -3.042 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -14.065 -12.448 -1.410 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -13.380 -10.262 -2.084 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -12.721 -10.835 -3.604 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -15.716 -10.493 -1.733 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -16.811 -10.267 -3.101 1.00 0.00 H new ATOM 914 N ASP A 66 -11.615 -14.198 -0.140 1.00 0.00 N ATOM 915 CA ASP A 66 -11.337 -14.452 1.264 1.00 0.00 C ATOM 916 C ASP A 66 -10.183 -15.450 1.377 1.00 0.00 C ATOM 917 O ASP A 66 -10.191 -16.491 0.722 1.00 0.00 O ATOM 918 CB ASP A 66 -12.555 -15.055 1.967 1.00 0.00 C ATOM 919 CG ASP A 66 -13.840 -15.067 1.137 1.00 0.00 C ATOM 920 OD1 ASP A 66 -13.955 -15.973 0.283 1.00 0.00 O ATOM 921 OD2 ASP A 66 -14.678 -14.171 1.374 1.00 0.00 O ATOM 0 H ASP A 66 -11.677 -15.034 -0.721 1.00 0.00 H new ATOM 0 HA ASP A 66 -11.083 -13.502 1.735 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -12.318 -16.079 2.257 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -12.739 -14.497 2.885 1.00 0.00 H new ATOM 926 N GLN A 67 -9.218 -15.098 2.215 1.00 0.00 N ATOM 927 CA GLN A 67 -8.060 -15.950 2.423 1.00 0.00 C ATOM 928 C GLN A 67 -8.493 -17.310 2.975 1.00 0.00 C ATOM 929 O GLN A 67 -7.995 -18.347 2.542 1.00 0.00 O ATOM 930 CB GLN A 67 -7.045 -15.279 3.351 1.00 0.00 C ATOM 931 CG GLN A 67 -5.704 -15.076 2.642 1.00 0.00 C ATOM 932 CD GLN A 67 -5.069 -13.743 3.042 1.00 0.00 C ATOM 933 OE1 GLN A 67 -5.293 -12.757 2.178 1.00 0.00 O flip ATOM 934 NE2 GLN A 67 -4.420 -13.618 4.067 1.00 0.00 N flip ATOM 0 H GLN A 67 -9.215 -14.234 2.758 1.00 0.00 H new ATOM 0 HA GLN A 67 -7.573 -16.109 1.461 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -7.433 -14.317 3.685 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -6.901 -15.891 4.241 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -5.029 -15.894 2.892 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -5.852 -15.103 1.562 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -4.287 -14.417 4.687 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -4.011 -12.714 4.304 1.00 0.00 H new ATOM 943 N GLU A 68 -9.418 -17.260 3.923 1.00 0.00 N ATOM 944 CA GLU A 68 -9.924 -18.474 4.539 1.00 0.00 C ATOM 945 C GLU A 68 -10.565 -19.378 3.484 1.00 0.00 C ATOM 946 O GLU A 68 -10.436 -20.599 3.547 1.00 0.00 O ATOM 947 CB GLU A 68 -10.916 -18.149 5.658 1.00 0.00 C ATOM 948 CG GLU A 68 -11.547 -19.425 6.219 1.00 0.00 C ATOM 949 CD GLU A 68 -13.037 -19.495 5.878 1.00 0.00 C ATOM 950 OE1 GLU A 68 -13.646 -18.409 5.768 1.00 0.00 O ATOM 951 OE2 GLU A 68 -13.533 -20.633 5.735 1.00 0.00 O ATOM 0 H GLU A 68 -9.830 -16.397 4.279 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.085 -19.008 4.985 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -10.406 -17.610 6.456 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.696 -17.490 5.277 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -11.036 -20.297 5.812 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -11.416 -19.455 7.301 1.00 0.00 H new ATOM 958 N THR A 69 -11.241 -18.742 2.539 1.00 0.00 N ATOM 959 CA THR A 69 -11.902 -19.472 1.471 1.00 0.00 C ATOM 960 C THR A 69 -10.869 -20.145 0.566 1.00 0.00 C ATOM 961 O THR A 69 -11.048 -21.292 0.158 1.00 0.00 O ATOM 962 CB THR A 69 -12.818 -18.498 0.728 1.00 0.00 C ATOM 963 OG1 THR A 69 -13.726 -18.044 1.728 1.00 0.00 O ATOM 964 CG2 THR A 69 -13.713 -19.200 -0.296 1.00 0.00 C ATOM 0 H THR A 69 -11.345 -17.728 2.491 1.00 0.00 H new ATOM 0 HA THR A 69 -12.517 -20.280 1.867 1.00 0.00 H new ATOM 0 HB THR A 69 -12.213 -17.744 0.225 1.00 0.00 H new ATOM 0 HG1 THR A 69 -14.318 -17.362 1.347 1.00 0.00 H new ATOM 0 HG21 THR A 69 -14.343 -18.463 -0.795 1.00 0.00 H new ATOM 0 HG22 THR A 69 -13.092 -19.706 -1.035 1.00 0.00 H new ATOM 0 HG23 THR A 69 -14.342 -19.931 0.211 1.00 0.00 H new ATOM 972 N ALA A 70 -9.809 -19.404 0.278 1.00 0.00 N ATOM 973 CA ALA A 70 -8.747 -19.914 -0.572 1.00 0.00 C ATOM 974 C ALA A 70 -8.047 -21.076 0.137 1.00 0.00 C ATOM 975 O ALA A 70 -7.690 -22.069 -0.496 1.00 0.00 O ATOM 976 CB ALA A 70 -7.783 -18.779 -0.922 1.00 0.00 C ATOM 0 H ALA A 70 -9.663 -18.454 0.619 1.00 0.00 H new ATOM 0 HA ALA A 70 -9.154 -20.295 -1.508 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.986 -19.162 -1.560 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -8.323 -17.992 -1.449 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -7.352 -18.373 -0.007 1.00 0.00 H new ATOM 982 N LEU A 71 -7.871 -20.913 1.440 1.00 0.00 N ATOM 983 CA LEU A 71 -7.220 -21.936 2.241 1.00 0.00 C ATOM 984 C LEU A 71 -8.136 -23.158 2.341 1.00 0.00 C ATOM 985 O LEU A 71 -7.696 -24.286 2.124 1.00 0.00 O ATOM 986 CB LEU A 71 -6.802 -21.367 3.598 1.00 0.00 C ATOM 987 CG LEU A 71 -7.465 -22.000 4.823 1.00 0.00 C ATOM 988 CD1 LEU A 71 -6.956 -23.426 5.047 1.00 0.00 C ATOM 989 CD2 LEU A 71 -7.276 -21.124 6.063 1.00 0.00 C ATOM 0 H LEU A 71 -8.168 -20.088 1.961 1.00 0.00 H new ATOM 0 HA LEU A 71 -6.298 -22.267 1.763 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -5.722 -21.475 3.698 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -7.018 -20.299 3.604 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.537 -22.066 4.635 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.443 -23.853 5.924 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.184 -24.035 4.173 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -5.878 -23.407 5.204 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.757 -21.597 6.919 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.212 -21.004 6.265 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.725 -20.146 5.889 1.00 0.00 H new ATOM 1001 N SER A 72 -9.391 -22.891 2.671 1.00 0.00 N ATOM 1002 CA SER A 72 -10.372 -23.955 2.803 1.00 0.00 C ATOM 1003 C SER A 72 -10.513 -24.704 1.476 1.00 0.00 C ATOM 1004 O SER A 72 -10.681 -25.923 1.461 1.00 0.00 O ATOM 1005 CB SER A 72 -11.727 -23.403 3.247 1.00 0.00 C ATOM 1006 OG SER A 72 -11.808 -23.263 4.663 1.00 0.00 O ATOM 0 H SER A 72 -9.751 -21.954 2.851 1.00 0.00 H new ATOM 0 HA SER A 72 -10.024 -24.648 3.569 1.00 0.00 H new ATOM 0 HB2 SER A 72 -11.896 -22.434 2.777 1.00 0.00 H new ATOM 0 HB3 SER A 72 -12.520 -24.067 2.902 1.00 0.00 H new ATOM 0 HG SER A 72 -12.317 -22.455 4.883 1.00 0.00 H new ATOM 1012 N ALA A 73 -10.441 -23.944 0.393 1.00 0.00 N ATOM 1013 CA ALA A 73 -10.559 -24.520 -0.935 1.00 0.00 C ATOM 1014 C ALA A 73 -9.351 -25.419 -1.206 1.00 0.00 C ATOM 1015 O ALA A 73 -9.485 -26.479 -1.815 1.00 0.00 O ATOM 1016 CB ALA A 73 -10.694 -23.399 -1.968 1.00 0.00 C ATOM 0 H ALA A 73 -10.302 -22.934 0.409 1.00 0.00 H new ATOM 0 HA ALA A 73 -11.453 -25.139 -1.006 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.783 -23.831 -2.965 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.583 -22.807 -1.749 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -9.813 -22.759 -1.927 1.00 0.00 H new ATOM 1022 N MET A 74 -8.198 -24.964 -0.738 1.00 0.00 N ATOM 1023 CA MET A 74 -6.967 -25.714 -0.922 1.00 0.00 C ATOM 1024 C MET A 74 -7.032 -27.060 -0.197 1.00 0.00 C ATOM 1025 O MET A 74 -6.691 -28.094 -0.769 1.00 0.00 O ATOM 1026 CB MET A 74 -5.788 -24.900 -0.384 1.00 0.00 C ATOM 1027 CG MET A 74 -4.719 -24.707 -1.461 1.00 0.00 C ATOM 1028 SD MET A 74 -3.139 -25.283 -0.863 1.00 0.00 S ATOM 1029 CE MET A 74 -2.767 -23.998 0.320 1.00 0.00 C ATOM 0 H MET A 74 -8.090 -24.085 -0.232 1.00 0.00 H new ATOM 0 HA MET A 74 -6.834 -25.902 -1.987 1.00 0.00 H new ATOM 0 HB2 MET A 74 -6.140 -23.928 -0.038 1.00 0.00 H new ATOM 0 HB3 MET A 74 -5.354 -25.407 0.478 1.00 0.00 H new ATOM 0 HG2 MET A 74 -4.997 -25.253 -2.363 1.00 0.00 H new ATOM 0 HG3 MET A 74 -4.652 -23.654 -1.734 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.726 -24.081 0.632 1.00 0.00 H new ATOM 0 HE2 MET A 74 -2.931 -23.023 -0.138 1.00 0.00 H new ATOM 0 HE3 MET A 74 -3.416 -24.104 1.189 1.00 0.00 H new ATOM 1039 N ARG A 75 -7.472 -27.003 1.051 1.00 0.00 N ATOM 1040 CA ARG A 75 -7.586 -28.204 1.860 1.00 0.00 C ATOM 1041 C ARG A 75 -8.838 -28.991 1.468 1.00 0.00 C ATOM 1042 O ARG A 75 -8.897 -30.205 1.657 1.00 0.00 O ATOM 1043 CB ARG A 75 -7.652 -27.861 3.350 1.00 0.00 C ATOM 1044 CG ARG A 75 -7.376 -29.096 4.209 1.00 0.00 C ATOM 1045 CD ARG A 75 -8.362 -29.185 5.375 1.00 0.00 C ATOM 1046 NE ARG A 75 -8.871 -30.569 5.504 1.00 0.00 N ATOM 1047 CZ ARG A 75 -8.167 -31.583 6.026 1.00 0.00 C ATOM 1048 NH1 ARG A 75 -6.921 -31.373 6.472 1.00 0.00 N ATOM 1049 NH2 ARG A 75 -8.710 -32.806 6.102 1.00 0.00 N ATOM 0 H ARG A 75 -7.754 -26.143 1.522 1.00 0.00 H new ATOM 0 HA ARG A 75 -6.699 -28.812 1.678 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -6.924 -27.083 3.580 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -8.636 -27.458 3.591 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -7.451 -29.994 3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -6.357 -29.056 4.593 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -7.872 -28.881 6.300 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -9.192 -28.497 5.213 1.00 0.00 H new ATOM 0 HE ARG A 75 -9.817 -30.763 5.175 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -6.509 -30.442 6.414 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -6.385 -32.144 6.869 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -9.659 -32.965 5.763 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -8.175 -33.578 6.499 1.00 0.00 H new ATOM 1063 N ASN A 76 -9.808 -28.267 0.930 1.00 0.00 N ATOM 1064 CA ASN A 76 -11.056 -28.882 0.510 1.00 0.00 C ATOM 1065 C ASN A 76 -10.832 -29.634 -0.804 1.00 0.00 C ATOM 1066 O ASN A 76 -11.430 -30.685 -1.031 1.00 0.00 O ATOM 1067 CB ASN A 76 -12.138 -27.827 0.272 1.00 0.00 C ATOM 1068 CG ASN A 76 -12.813 -27.427 1.585 1.00 0.00 C ATOM 1069 OD1 ASN A 76 -13.164 -26.146 1.645 1.00 0.00 O flip ATOM 1070 ND2 ASN A 76 -13.002 -28.230 2.485 1.00 0.00 N flip ATOM 0 H ASN A 76 -9.755 -27.260 0.775 1.00 0.00 H new ATOM 0 HA ASN A 76 -11.381 -29.559 1.300 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -11.696 -26.947 -0.196 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -12.884 -28.216 -0.421 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -12.707 -29.200 2.373 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -13.455 -27.931 3.349 1.00 0.00 H new ATOM 1077 N LEU A 77 -9.970 -29.067 -1.634 1.00 0.00 N ATOM 1078 CA LEU A 77 -9.659 -29.670 -2.919 1.00 0.00 C ATOM 1079 C LEU A 77 -8.290 -30.348 -2.841 1.00 0.00 C ATOM 1080 O LEU A 77 -8.191 -31.516 -2.469 1.00 0.00 O ATOM 1081 CB LEU A 77 -9.770 -28.634 -4.038 1.00 0.00 C ATOM 1082 CG LEU A 77 -11.166 -28.054 -4.280 1.00 0.00 C ATOM 1083 CD1 LEU A 77 -11.090 -26.563 -4.614 1.00 0.00 C ATOM 1084 CD2 LEU A 77 -11.909 -28.846 -5.358 1.00 0.00 C ATOM 0 H LEU A 77 -9.476 -28.195 -1.442 1.00 0.00 H new ATOM 0 HA LEU A 77 -10.385 -30.445 -3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -9.091 -27.812 -3.813 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -9.422 -29.091 -4.965 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.740 -28.148 -3.358 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -12.095 -26.176 -4.781 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -10.628 -26.027 -3.785 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -10.492 -26.422 -5.515 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -12.898 -28.414 -5.511 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -11.347 -28.806 -6.291 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -12.012 -29.884 -5.041 1.00 0.00 H new ATOM 1096 N ASN A 78 -7.267 -29.586 -3.200 1.00 0.00 N ATOM 1097 CA ASN A 78 -5.907 -30.098 -3.176 1.00 0.00 C ATOM 1098 C ASN A 78 -5.910 -31.561 -3.622 1.00 0.00 C ATOM 1099 O ASN A 78 -5.991 -32.467 -2.793 1.00 0.00 O ATOM 1100 CB ASN A 78 -5.320 -30.035 -1.764 1.00 0.00 C ATOM 1101 CG ASN A 78 -4.201 -31.064 -1.590 1.00 0.00 C ATOM 1102 OD1 ASN A 78 -4.242 -31.923 -0.724 1.00 0.00 O ATOM 1103 ND2 ASN A 78 -3.202 -30.929 -2.458 1.00 0.00 N ATOM 0 H ASN A 78 -7.353 -28.618 -3.509 1.00 0.00 H new ATOM 0 HA ASN A 78 -5.303 -29.485 -3.845 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -4.932 -29.035 -1.572 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -6.105 -30.219 -1.031 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -2.407 -31.567 -2.424 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -3.231 -30.188 -3.158 1.00 0.00 H new ATOM 1110 N GLY A 79 -5.821 -31.748 -4.930 1.00 0.00 N ATOM 1111 CA GLY A 79 -5.813 -33.086 -5.497 1.00 0.00 C ATOM 1112 C GLY A 79 -7.225 -33.672 -5.541 1.00 0.00 C ATOM 1113 O GLY A 79 -7.415 -34.864 -5.305 1.00 0.00 O ATOM 0 H GLY A 79 -5.754 -30.995 -5.614 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.397 -33.055 -6.504 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.166 -33.732 -4.904 1.00 0.00 H new ATOM 1117 N ARG A 80 -8.181 -32.806 -5.847 1.00 0.00 N ATOM 1118 CA ARG A 80 -9.571 -33.222 -5.926 1.00 0.00 C ATOM 1119 C ARG A 80 -9.865 -33.833 -7.297 1.00 0.00 C ATOM 1120 O ARG A 80 -9.696 -33.176 -8.323 1.00 0.00 O ATOM 1121 CB ARG A 80 -10.514 -32.041 -5.689 1.00 0.00 C ATOM 1122 CG ARG A 80 -11.975 -32.466 -5.846 1.00 0.00 C ATOM 1123 CD ARG A 80 -12.673 -32.542 -4.486 1.00 0.00 C ATOM 1124 NE ARG A 80 -14.049 -32.006 -4.593 1.00 0.00 N ATOM 1125 CZ ARG A 80 -14.748 -31.519 -3.559 1.00 0.00 C ATOM 1126 NH1 ARG A 80 -14.205 -31.499 -2.334 1.00 0.00 N ATOM 1127 NH2 ARG A 80 -15.990 -31.054 -3.749 1.00 0.00 N ATOM 0 H ARG A 80 -8.020 -31.818 -6.043 1.00 0.00 H new ATOM 0 HA ARG A 80 -9.738 -33.967 -5.149 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -10.354 -31.638 -4.689 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -10.286 -31.242 -6.394 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -12.497 -31.756 -6.488 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -12.024 -33.437 -6.339 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -12.702 -33.575 -4.140 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -12.109 -31.974 -3.746 1.00 0.00 H new ATOM 0 HE ARG A 80 -14.493 -32.008 -5.511 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -13.260 -31.854 -2.189 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -14.737 -31.128 -1.546 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -16.404 -31.071 -4.681 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -16.522 -30.683 -2.961 1.00 0.00 H new ATOM 1141 N GLU A 81 -10.299 -35.085 -7.271 1.00 0.00 N ATOM 1142 CA GLU A 81 -10.618 -35.792 -8.500 1.00 0.00 C ATOM 1143 C GLU A 81 -11.758 -35.086 -9.238 1.00 0.00 C ATOM 1144 O GLU A 81 -12.763 -34.721 -8.631 1.00 0.00 O ATOM 1145 CB GLU A 81 -10.971 -37.253 -8.215 1.00 0.00 C ATOM 1146 CG GLU A 81 -10.060 -37.837 -7.134 1.00 0.00 C ATOM 1147 CD GLU A 81 -10.860 -38.206 -5.883 1.00 0.00 C ATOM 1148 OE1 GLU A 81 -11.234 -37.265 -5.150 1.00 0.00 O ATOM 1149 OE2 GLU A 81 -11.080 -39.421 -5.689 1.00 0.00 O ATOM 0 H GLU A 81 -10.437 -35.628 -6.418 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.736 -35.784 -9.141 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -12.011 -37.324 -7.896 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -10.877 -37.838 -9.130 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.553 -38.721 -7.520 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -9.287 -37.114 -6.875 1.00 0.00 H new ATOM 1156 N PHE A 82 -11.563 -34.916 -10.537 1.00 0.00 N ATOM 1157 CA PHE A 82 -12.561 -34.261 -11.365 1.00 0.00 C ATOM 1158 C PHE A 82 -12.164 -34.305 -12.841 1.00 0.00 C ATOM 1159 O PHE A 82 -12.999 -34.569 -13.705 1.00 0.00 O ATOM 1160 CB PHE A 82 -12.631 -32.801 -10.910 1.00 0.00 C ATOM 1161 CG PHE A 82 -13.549 -31.926 -11.766 1.00 0.00 C ATOM 1162 CD1 PHE A 82 -13.141 -31.514 -12.997 1.00 0.00 C ATOM 1163 CD2 PHE A 82 -14.772 -31.561 -11.297 1.00 0.00 C ATOM 1164 CE1 PHE A 82 -13.993 -30.702 -13.791 1.00 0.00 C ATOM 1165 CE2 PHE A 82 -15.623 -30.749 -12.092 1.00 0.00 C ATOM 1166 CZ PHE A 82 -15.216 -30.336 -13.322 1.00 0.00 C ATOM 0 H PHE A 82 -10.728 -35.221 -11.037 1.00 0.00 H new ATOM 0 HA PHE A 82 -13.521 -34.766 -11.260 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -12.976 -32.769 -9.876 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -11.626 -32.378 -10.924 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -12.170 -31.804 -13.370 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -15.096 -31.889 -10.320 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -13.670 -30.375 -14.768 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -16.594 -30.459 -11.720 1.00 0.00 H new ATOM 0 HZ PHE A 82 -15.864 -29.718 -13.926 1.00 0.00 H new ATOM 1218 N ALA A 86 -6.925 -35.467 -10.726 1.00 0.00 N ATOM 1219 CA ALA A 86 -6.976 -34.715 -9.483 1.00 0.00 C ATOM 1220 C ALA A 86 -6.591 -33.260 -9.756 1.00 0.00 C ATOM 1221 O ALA A 86 -5.691 -32.991 -10.550 1.00 0.00 O ATOM 1222 CB ALA A 86 -6.062 -35.377 -8.449 1.00 0.00 C ATOM 0 HA ALA A 86 -7.986 -34.717 -9.074 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.100 -34.814 -7.517 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.396 -36.399 -8.269 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.039 -35.390 -8.824 1.00 0.00 H new ATOM 1228 N LEU A 87 -7.291 -32.360 -9.082 1.00 0.00 N ATOM 1229 CA LEU A 87 -7.033 -30.939 -9.241 1.00 0.00 C ATOM 1230 C LEU A 87 -5.989 -30.496 -8.214 1.00 0.00 C ATOM 1231 O LEU A 87 -6.329 -30.176 -7.076 1.00 0.00 O ATOM 1232 CB LEU A 87 -8.340 -30.146 -9.171 1.00 0.00 C ATOM 1233 CG LEU A 87 -9.059 -29.920 -10.502 1.00 0.00 C ATOM 1234 CD1 LEU A 87 -8.452 -28.738 -11.260 1.00 0.00 C ATOM 1235 CD2 LEU A 87 -9.068 -31.197 -11.344 1.00 0.00 C ATOM 0 H LEU A 87 -8.037 -32.587 -8.424 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.616 -30.736 -10.227 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.021 -30.665 -8.496 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.129 -29.174 -8.725 1.00 0.00 H new ATOM 0 HG LEU A 87 -10.098 -29.667 -10.290 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.982 -28.599 -12.202 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.542 -27.834 -10.657 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.399 -28.937 -11.461 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.585 -31.009 -12.285 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.043 -31.505 -11.549 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -9.583 -31.988 -10.799 1.00 0.00 H new ATOM 1247 N ARG A 88 -4.739 -30.491 -8.653 1.00 0.00 N ATOM 1248 CA ARG A 88 -3.643 -30.092 -7.786 1.00 0.00 C ATOM 1249 C ARG A 88 -3.782 -28.619 -7.398 1.00 0.00 C ATOM 1250 O ARG A 88 -3.445 -27.732 -8.182 1.00 0.00 O ATOM 1251 CB ARG A 88 -2.292 -30.307 -8.472 1.00 0.00 C ATOM 1252 CG ARG A 88 -1.955 -31.796 -8.565 1.00 0.00 C ATOM 1253 CD ARG A 88 -0.550 -32.006 -9.133 1.00 0.00 C ATOM 1254 NE ARG A 88 0.398 -32.317 -8.040 1.00 0.00 N ATOM 1255 CZ ARG A 88 1.633 -32.799 -8.231 1.00 0.00 C ATOM 1256 NH1 ARG A 88 2.079 -33.027 -9.474 1.00 0.00 N ATOM 1257 NH2 ARG A 88 2.424 -33.052 -7.179 1.00 0.00 N ATOM 0 H ARG A 88 -4.461 -30.757 -9.598 1.00 0.00 H new ATOM 0 HA ARG A 88 -3.686 -30.712 -6.891 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -2.314 -29.873 -9.471 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -1.511 -29.788 -7.916 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.023 -32.250 -7.577 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -2.686 -32.299 -9.198 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -0.560 -32.819 -9.859 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.226 -31.110 -9.663 1.00 0.00 H new ATOM 0 HE ARG A 88 0.092 -32.154 -7.081 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.478 -32.833 -10.275 1.00 0.00 H new ATOM 0 HH12 ARG A 88 3.020 -33.394 -9.619 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.085 -32.878 -6.233 1.00 0.00 H new ATOM 0 HH22 ARG A 88 3.364 -33.419 -7.325 1.00 0.00 H new ATOM 1271 N VAL A 89 -4.278 -28.402 -6.189 1.00 0.00 N ATOM 1272 CA VAL A 89 -4.465 -27.052 -5.687 1.00 0.00 C ATOM 1273 C VAL A 89 -3.395 -26.749 -4.636 1.00 0.00 C ATOM 1274 O VAL A 89 -3.287 -27.456 -3.635 1.00 0.00 O ATOM 1275 CB VAL A 89 -5.890 -26.884 -5.156 1.00 0.00 C ATOM 1276 CG1 VAL A 89 -6.145 -25.440 -4.717 1.00 0.00 C ATOM 1277 CG2 VAL A 89 -6.919 -27.331 -6.195 1.00 0.00 C ATOM 0 H VAL A 89 -4.556 -29.140 -5.542 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.344 -26.326 -6.491 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.999 -27.524 -4.281 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -7.165 -25.348 -4.344 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.444 -25.171 -3.927 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.008 -24.772 -5.567 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -7.923 -27.201 -5.792 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.810 -26.730 -7.097 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -6.759 -28.382 -6.437 1.00 0.00 H new ATOM 1287 N ASP A 90 -2.632 -25.699 -4.900 1.00 0.00 N ATOM 1288 CA ASP A 90 -1.574 -25.295 -3.989 1.00 0.00 C ATOM 1289 C ASP A 90 -1.545 -23.768 -3.894 1.00 0.00 C ATOM 1290 O ASP A 90 -1.672 -23.077 -4.903 1.00 0.00 O ATOM 1291 CB ASP A 90 -0.207 -25.763 -4.490 1.00 0.00 C ATOM 1292 CG ASP A 90 -0.236 -26.571 -5.789 1.00 0.00 C ATOM 1293 OD1 ASP A 90 -1.137 -27.431 -5.903 1.00 0.00 O ATOM 1294 OD2 ASP A 90 0.643 -26.311 -6.639 1.00 0.00 O ATOM 0 H ASP A 90 -2.725 -25.116 -5.731 1.00 0.00 H new ATOM 0 HA ASP A 90 -1.775 -25.746 -3.017 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.428 -24.889 -4.637 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.260 -26.369 -3.713 1.00 0.00 H new ATOM 1299 N ASN A 91 -1.379 -23.287 -2.671 1.00 0.00 N ATOM 1300 CA ASN A 91 -1.332 -21.855 -2.430 1.00 0.00 C ATOM 1301 C ASN A 91 -0.530 -21.181 -3.545 1.00 0.00 C ATOM 1302 O ASN A 91 0.535 -21.664 -3.928 1.00 0.00 O ATOM 1303 CB ASN A 91 -0.645 -21.542 -1.099 1.00 0.00 C ATOM 1304 CG ASN A 91 -1.372 -20.417 -0.359 1.00 0.00 C ATOM 1305 OD1 ASN A 91 -2.486 -20.569 0.115 1.00 0.00 O ATOM 1306 ND2 ASN A 91 -0.681 -19.283 -0.286 1.00 0.00 N ATOM 0 H ASN A 91 -1.275 -23.864 -1.836 1.00 0.00 H new ATOM 0 HA ASN A 91 -2.357 -21.484 -2.403 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -0.624 -22.437 -0.477 1.00 0.00 H new ATOM 0 HB3 ASN A 91 0.391 -21.254 -1.279 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -1.079 -18.473 0.189 1.00 0.00 H new ATOM 0 HD22 ASN A 91 0.247 -19.224 -0.705 1.00 0.00 H new ATOM 1313 N ALA A 92 -1.071 -20.075 -4.035 1.00 0.00 N ATOM 1314 CA ALA A 92 -0.419 -19.330 -5.099 1.00 0.00 C ATOM 1315 C ALA A 92 0.794 -18.593 -4.529 1.00 0.00 C ATOM 1316 O ALA A 92 1.626 -18.086 -5.280 1.00 0.00 O ATOM 1317 CB ALA A 92 -1.427 -18.380 -5.748 1.00 0.00 C ATOM 0 H ALA A 92 -1.954 -19.677 -3.715 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.060 -20.004 -5.876 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -0.938 -17.821 -6.546 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.255 -18.956 -6.162 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.807 -17.686 -4.999 1.00 0.00 H new ATOM 1323 N ALA A 93 0.857 -18.556 -3.206 1.00 0.00 N ATOM 1324 CA ALA A 93 1.955 -17.889 -2.527 1.00 0.00 C ATOM 1325 C ALA A 93 3.067 -18.902 -2.248 1.00 0.00 C ATOM 1326 O ALA A 93 3.855 -18.724 -1.321 1.00 0.00 O ATOM 1327 CB ALA A 93 1.437 -17.225 -1.250 1.00 0.00 C ATOM 0 H ALA A 93 0.165 -18.977 -2.586 1.00 0.00 H new ATOM 0 HA ALA A 93 2.375 -17.104 -3.156 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.260 -16.725 -0.740 1.00 0.00 H new ATOM 0 HB2 ALA A 93 0.670 -16.494 -1.505 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.011 -17.983 -0.593 1.00 0.00 H new ATOM 1333 N SER A 94 3.095 -19.943 -3.067 1.00 0.00 N ATOM 1334 CA SER A 94 4.097 -20.985 -2.920 1.00 0.00 C ATOM 1335 C SER A 94 5.402 -20.555 -3.593 1.00 0.00 C ATOM 1336 O SER A 94 5.384 -19.803 -4.566 1.00 0.00 O ATOM 1337 CB SER A 94 3.606 -22.309 -3.510 1.00 0.00 C ATOM 1338 OG SER A 94 3.397 -23.296 -2.504 1.00 0.00 O ATOM 0 H SER A 94 2.439 -20.087 -3.835 1.00 0.00 H new ATOM 0 HA SER A 94 4.278 -21.138 -1.856 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.676 -22.141 -4.052 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.335 -22.676 -4.233 1.00 0.00 H new ATOM 0 HG SER A 94 3.082 -24.126 -2.920 1.00 0.00 H new ATOM 1344 N GLU A 95 6.503 -21.050 -3.048 1.00 0.00 N ATOM 1345 CA GLU A 95 7.814 -20.727 -3.584 1.00 0.00 C ATOM 1346 C GLU A 95 7.971 -21.308 -4.991 1.00 0.00 C ATOM 1347 O GLU A 95 8.590 -20.690 -5.856 1.00 0.00 O ATOM 1348 CB GLU A 95 8.924 -21.227 -2.657 1.00 0.00 C ATOM 1349 CG GLU A 95 9.280 -20.172 -1.608 1.00 0.00 C ATOM 1350 CD GLU A 95 10.658 -20.444 -1.002 1.00 0.00 C ATOM 1351 OE1 GLU A 95 10.845 -21.575 -0.504 1.00 0.00 O ATOM 1352 OE2 GLU A 95 11.493 -19.515 -1.051 1.00 0.00 O ATOM 0 H GLU A 95 6.514 -21.673 -2.240 1.00 0.00 H new ATOM 0 HA GLU A 95 7.901 -19.642 -3.649 1.00 0.00 H new ATOM 0 HB2 GLU A 95 8.604 -22.144 -2.162 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.809 -21.474 -3.244 1.00 0.00 H new ATOM 0 HG2 GLU A 95 9.268 -19.182 -2.064 1.00 0.00 H new ATOM 0 HG3 GLU A 95 8.527 -20.169 -0.820 1.00 0.00 H new ATOM 1359 N LYS A 96 7.399 -22.489 -5.176 1.00 0.00 N ATOM 1360 CA LYS A 96 7.468 -23.160 -6.462 1.00 0.00 C ATOM 1361 C LYS A 96 6.481 -22.502 -7.429 1.00 0.00 C ATOM 1362 O LYS A 96 6.740 -22.425 -8.629 1.00 0.00 O ATOM 1363 CB LYS A 96 7.252 -24.665 -6.294 1.00 0.00 C ATOM 1364 CG LYS A 96 5.775 -24.984 -6.056 1.00 0.00 C ATOM 1365 CD LYS A 96 5.485 -26.464 -6.314 1.00 0.00 C ATOM 1366 CE LYS A 96 5.260 -27.217 -5.001 1.00 0.00 C ATOM 1367 NZ LYS A 96 6.506 -27.889 -4.569 1.00 0.00 N ATOM 0 H LYS A 96 6.886 -22.998 -4.456 1.00 0.00 H new ATOM 0 HA LYS A 96 8.462 -23.050 -6.896 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.602 -25.188 -7.184 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.846 -25.030 -5.456 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.505 -24.730 -5.031 1.00 0.00 H new ATOM 0 HG3 LYS A 96 5.157 -24.369 -6.710 1.00 0.00 H new ATOM 0 HD2 LYS A 96 4.604 -26.560 -6.948 1.00 0.00 H new ATOM 0 HD3 LYS A 96 6.318 -26.912 -6.856 1.00 0.00 H new ATOM 0 HE2 LYS A 96 4.928 -26.523 -4.229 1.00 0.00 H new ATOM 0 HE3 LYS A 96 4.468 -27.954 -5.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.336 -28.395 -3.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.807 -28.566 -5.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.252 -27.179 -4.427 1.00 0.00 H new ATOM 1381 N ASN A 97 5.370 -22.044 -6.870 1.00 0.00 N ATOM 1382 CA ASN A 97 4.344 -21.395 -7.667 1.00 0.00 C ATOM 1383 C ASN A 97 4.837 -20.014 -8.100 1.00 0.00 C ATOM 1384 O ASN A 97 4.320 -19.437 -9.056 1.00 0.00 O ATOM 1385 CB ASN A 97 3.057 -21.206 -6.861 1.00 0.00 C ATOM 1386 CG ASN A 97 1.951 -22.134 -7.367 1.00 0.00 C ATOM 1387 OD1 ASN A 97 1.446 -21.996 -8.469 1.00 0.00 O ATOM 1388 ND2 ASN A 97 1.604 -23.084 -6.504 1.00 0.00 N ATOM 0 H ASN A 97 5.159 -22.110 -5.874 1.00 0.00 H new ATOM 0 HA ASN A 97 4.139 -22.027 -8.531 1.00 0.00 H new ATOM 0 HB2 ASN A 97 3.251 -21.407 -5.807 1.00 0.00 H new ATOM 0 HB3 ASN A 97 2.728 -20.169 -6.933 1.00 0.00 H new ATOM 0 HD21 ASN A 97 0.874 -23.754 -6.749 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.067 -23.143 -5.597 1.00 0.00 H new ATOM 1395 N LYS A 98 5.833 -19.522 -7.377 1.00 0.00 N ATOM 1396 CA LYS A 98 6.402 -18.219 -7.674 1.00 0.00 C ATOM 1397 C LYS A 98 7.062 -18.259 -9.054 1.00 0.00 C ATOM 1398 O LYS A 98 7.049 -17.267 -9.781 1.00 0.00 O ATOM 1399 CB LYS A 98 7.346 -17.778 -6.553 1.00 0.00 C ATOM 1400 CG LYS A 98 6.871 -16.469 -5.920 1.00 0.00 C ATOM 1401 CD LYS A 98 7.864 -15.979 -4.864 1.00 0.00 C ATOM 1402 CE LYS A 98 7.822 -14.454 -4.739 1.00 0.00 C ATOM 1403 NZ LYS A 98 8.091 -14.042 -3.343 1.00 0.00 N ATOM 0 H LYS A 98 6.260 -20.003 -6.586 1.00 0.00 H new ATOM 0 HA LYS A 98 5.619 -17.462 -7.716 1.00 0.00 H new ATOM 0 HB2 LYS A 98 7.400 -18.556 -5.791 1.00 0.00 H new ATOM 0 HB3 LYS A 98 8.353 -17.650 -6.950 1.00 0.00 H new ATOM 0 HG2 LYS A 98 6.752 -15.709 -6.693 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.892 -16.616 -5.464 1.00 0.00 H new ATOM 0 HD2 LYS A 98 7.630 -16.433 -3.901 1.00 0.00 H new ATOM 0 HD3 LYS A 98 8.871 -16.298 -5.131 1.00 0.00 H new ATOM 0 HE2 LYS A 98 8.561 -14.008 -5.405 1.00 0.00 H new ATOM 0 HE3 LYS A 98 6.846 -14.084 -5.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 8.059 -13.005 -3.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 7.371 -14.453 -2.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 9.032 -14.379 -3.057 1.00 0.00 H new ATOM 1417 N GLU A 99 7.624 -19.416 -9.372 1.00 0.00 N ATOM 1418 CA GLU A 99 8.289 -19.598 -10.652 1.00 0.00 C ATOM 1419 C GLU A 99 7.272 -19.522 -11.793 1.00 0.00 C ATOM 1420 O GLU A 99 7.537 -18.908 -12.825 1.00 0.00 O ATOM 1421 CB GLU A 99 9.056 -20.921 -10.688 1.00 0.00 C ATOM 1422 CG GLU A 99 10.077 -20.931 -11.828 1.00 0.00 C ATOM 1423 CD GLU A 99 9.968 -22.217 -12.650 1.00 0.00 C ATOM 1424 OE1 GLU A 99 10.267 -23.286 -12.075 1.00 0.00 O ATOM 1425 OE2 GLU A 99 9.586 -22.102 -13.835 1.00 0.00 O ATOM 0 H GLU A 99 7.633 -20.236 -8.766 1.00 0.00 H new ATOM 0 HA GLU A 99 9.013 -18.793 -10.782 1.00 0.00 H new ATOM 0 HB2 GLU A 99 9.566 -21.076 -9.737 1.00 0.00 H new ATOM 0 HB3 GLU A 99 8.357 -21.748 -10.814 1.00 0.00 H new ATOM 0 HG2 GLU A 99 9.915 -20.068 -12.473 1.00 0.00 H new ATOM 0 HG3 GLU A 99 11.084 -20.840 -11.420 1.00 0.00 H new ATOM 1432 N GLU A 100 6.131 -20.157 -11.569 1.00 0.00 N ATOM 1433 CA GLU A 100 5.073 -20.169 -12.566 1.00 0.00 C ATOM 1434 C GLU A 100 4.422 -18.788 -12.666 1.00 0.00 C ATOM 1435 O GLU A 100 4.151 -18.304 -13.764 1.00 0.00 O ATOM 1436 CB GLU A 100 4.032 -21.244 -12.247 1.00 0.00 C ATOM 1437 CG GLU A 100 3.711 -22.081 -13.487 1.00 0.00 C ATOM 1438 CD GLU A 100 4.599 -23.325 -13.554 1.00 0.00 C ATOM 1439 OE1 GLU A 100 4.322 -24.262 -12.774 1.00 0.00 O ATOM 1440 OE2 GLU A 100 5.533 -23.311 -14.384 1.00 0.00 O ATOM 0 H GLU A 100 5.916 -20.667 -10.712 1.00 0.00 H new ATOM 0 HA GLU A 100 5.514 -20.412 -13.533 1.00 0.00 H new ATOM 0 HB2 GLU A 100 4.404 -21.892 -11.453 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.121 -20.775 -11.875 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.663 -22.379 -13.468 1.00 0.00 H new ATOM 0 HG3 GLU A 100 3.855 -21.479 -14.384 1.00 0.00 H new ATOM 1447 N LEU A 101 4.190 -18.193 -11.506 1.00 0.00 N ATOM 1448 CA LEU A 101 3.576 -16.877 -11.449 1.00 0.00 C ATOM 1449 C LEU A 101 4.488 -15.863 -12.144 1.00 0.00 C ATOM 1450 O LEU A 101 4.009 -14.904 -12.748 1.00 0.00 O ATOM 1451 CB LEU A 101 3.234 -16.507 -10.005 1.00 0.00 C ATOM 1452 CG LEU A 101 1.905 -17.047 -9.471 1.00 0.00 C ATOM 1453 CD1 LEU A 101 2.113 -17.826 -8.171 1.00 0.00 C ATOM 1454 CD2 LEU A 101 0.882 -15.921 -9.307 1.00 0.00 C ATOM 0 H LEU A 101 4.416 -18.598 -10.597 1.00 0.00 H new ATOM 0 HA LEU A 101 2.628 -16.876 -11.987 1.00 0.00 H new ATOM 0 HB2 LEU A 101 4.035 -16.866 -9.359 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.221 -15.420 -9.923 1.00 0.00 H new ATOM 0 HG LEU A 101 1.501 -17.745 -10.204 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.153 -18.199 -7.813 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.783 -18.666 -8.353 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.551 -17.169 -7.419 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.053 -16.332 -8.926 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.265 -15.180 -8.605 1.00 0.00 H new ATOM 0 HD23 LEU A 101 0.704 -15.448 -10.273 1.00 0.00 H new ATOM 1466 N LYS A 102 5.785 -16.110 -12.035 1.00 0.00 N ATOM 1467 CA LYS A 102 6.768 -15.231 -12.646 1.00 0.00 C ATOM 1468 C LYS A 102 6.451 -15.075 -14.135 1.00 0.00 C ATOM 1469 O LYS A 102 6.730 -14.033 -14.726 1.00 0.00 O ATOM 1470 CB LYS A 102 8.185 -15.737 -12.368 1.00 0.00 C ATOM 1471 CG LYS A 102 9.013 -14.676 -11.641 1.00 0.00 C ATOM 1472 CD LYS A 102 10.479 -15.100 -11.538 1.00 0.00 C ATOM 1473 CE LYS A 102 11.360 -13.928 -11.102 1.00 0.00 C ATOM 1474 NZ LYS A 102 12.792 -14.274 -11.246 1.00 0.00 N ATOM 0 H LYS A 102 6.178 -16.906 -11.533 1.00 0.00 H new ATOM 0 HA LYS A 102 6.717 -14.236 -12.203 1.00 0.00 H new ATOM 0 HB2 LYS A 102 8.139 -16.644 -11.765 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.671 -16.002 -13.307 1.00 0.00 H new ATOM 0 HG2 LYS A 102 8.942 -13.727 -12.172 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.607 -14.514 -10.643 1.00 0.00 H new ATOM 0 HD2 LYS A 102 10.575 -15.917 -10.823 1.00 0.00 H new ATOM 0 HD3 LYS A 102 10.821 -15.477 -12.502 1.00 0.00 H new ATOM 0 HE2 LYS A 102 11.130 -13.049 -11.704 1.00 0.00 H new ATOM 0 HE3 LYS A 102 11.145 -13.670 -10.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 13.376 -13.467 -10.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.011 -15.100 -10.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 12.997 -14.498 -12.241 1.00 0.00 H new ATOM 1488 N SER A 103 5.872 -16.125 -14.697 1.00 0.00 N ATOM 1489 CA SER A 103 5.514 -16.118 -16.105 1.00 0.00 C ATOM 1490 C SER A 103 4.135 -15.482 -16.291 1.00 0.00 C ATOM 1491 O SER A 103 3.889 -14.803 -17.288 1.00 0.00 O ATOM 1492 CB SER A 103 5.528 -17.534 -16.685 1.00 0.00 C ATOM 1493 OG SER A 103 5.561 -17.527 -18.109 1.00 0.00 O ATOM 0 H SER A 103 5.642 -16.987 -14.203 1.00 0.00 H new ATOM 0 HA SER A 103 6.255 -15.527 -16.643 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.396 -18.073 -16.305 1.00 0.00 H new ATOM 0 HB3 SER A 103 4.644 -18.074 -16.345 1.00 0.00 H new ATOM 0 HG SER A 103 5.571 -18.449 -18.441 1.00 0.00 H new ATOM 1499 N LEU A 104 3.270 -15.724 -15.317 1.00 0.00 N ATOM 1500 CA LEU A 104 1.922 -15.183 -15.361 1.00 0.00 C ATOM 1501 C LEU A 104 1.951 -13.717 -14.925 1.00 0.00 C ATOM 1502 O LEU A 104 0.912 -13.061 -14.872 1.00 0.00 O ATOM 1503 CB LEU A 104 0.970 -16.051 -14.536 1.00 0.00 C ATOM 1504 CG LEU A 104 -0.458 -16.176 -15.072 1.00 0.00 C ATOM 1505 CD1 LEU A 104 -0.456 -16.467 -16.574 1.00 0.00 C ATOM 1506 CD2 LEU A 104 -1.248 -17.224 -14.286 1.00 0.00 C ATOM 0 H LEU A 104 3.476 -16.288 -14.492 1.00 0.00 H new ATOM 0 HA LEU A 104 1.535 -15.205 -16.380 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.397 -17.051 -14.459 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.923 -15.645 -13.525 1.00 0.00 H new ATOM 0 HG LEU A 104 -0.962 -15.220 -14.930 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.483 -16.551 -16.930 1.00 0.00 H new ATOM 0 HD12 LEU A 104 0.045 -15.655 -17.101 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.071 -17.402 -16.763 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -2.259 -17.293 -14.687 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -0.756 -18.192 -14.374 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.293 -16.934 -13.236 1.00 0.00 H new