USER MOD reduce.3.24.130724 H: found=0, std=0, add=810, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 813 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 61 GLN : amide:sc= -0.335 X(o=-0.094,f=-0.59) USER MOD Set 1.2: A 68 HIS : no HD1:sc= 0.241 K(o=-0.094,f=-3) USER MOD Set 2.1: A 2 GLN : amide:sc= 0.426 K(o=0.89,f=0.011) USER MOD Set 2.2: A 66 GLN : amide:sc= 0.467 K(o=0.89,f=0.011) USER MOD Single : A 1 MET CE :methyl -160:sc= -0.0186 (180deg=-0.321) USER MOD Single : A 1 MET N :NH3+ 149:sc= 1.81 (180deg=1.09) USER MOD Single : A 3 THR OG1 : rot 127:sc= 1.39 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -173:sc= 0.581 USER MOD Single : A 18 LYS NZ :NH3+ 179:sc= 0.74 (180deg=0.647) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 48:sc= 1.18 USER MOD Single : A 26 ASN : amide:sc=-0.000897 K(o=-0.0009,f=-0.54) USER MOD Single : A 32 GLN : amide:sc= 0.226 K(o=0.23,f=-3.9!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.215 X(o=-0.22,f=0) USER MOD Single : A 35 TYR OH : rot -153:sc= 1.19 USER MOD Single : A 44 THR OG1 : rot -93:sc= 1.03 USER MOD Single : A 45 LYS NZ :NH3+ 160:sc= 1.67 (180deg=-0.507!) USER MOD Single : A 49 GLN : amide:sc= 0.273 X(o=0.27,f=0) USER MOD Single : A 50 GLN : amide:sc= 0.868 K(o=0.87,f=0) USER MOD Single : A 51 LYS NZ :NH3+ -119:sc= 0.899 (180deg=-0.452!) USER MOD Single : A 54 LYS NZ :NH3+ -156:sc= 1.17 (180deg=0.78) USER MOD Single : A 58 THR OG1 : rot 136:sc= 1.09 USER MOD Single : A 67 GLN : amide:sc= 0.899 K(o=0.9,f=-0.27) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -166:sc= 1.25 (180deg=1.21) USER MOD Single : A 82 ASN : amide:sc= 1.58 K(o=1.6,f=-0.041) USER MOD Single : B 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 137 SER OG : rot 6:sc= 0.615 USER MOD Single : B 139 GLN : amide:sc= 0.301 K(o=0.3,f=-0.27) USER MOD Single : B 143 SER OG : rot 180:sc= 0 USER MOD Single : B 145 SER OG : rot 180:sc= -0.0808 USER MOD Single : B 149 LYS NZ :NH3+ -120:sc= 1.27 (180deg=-0.194) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.365 -16.553 -0.582 1.00 1.00 N ATOM 2 CA MET A 1 12.883 -15.163 -0.762 1.00 1.00 C ATOM 3 C MET A 1 13.915 -14.118 -0.333 1.00 1.00 C ATOM 4 O MET A 1 14.480 -14.229 0.748 1.00 1.00 O ATOM 5 CB MET A 1 11.566 -14.934 0.000 1.00 1.00 C ATOM 6 CG MET A 1 11.029 -13.501 -0.203 1.00 1.00 C ATOM 7 SD MET A 1 9.234 -13.342 -0.267 1.00 1.00 S ATOM 8 CE MET A 1 8.944 -14.175 -1.855 1.00 1.00 C ATOM 0 H1 MET A 1 12.559 -17.175 -0.370 1.00 1.00 H new ATOM 0 H2 MET A 1 13.831 -16.875 -1.454 1.00 1.00 H new ATOM 0 H3 MET A 1 14.044 -16.586 0.205 1.00 1.00 H new ATOM 0 HA MET A 1 12.712 -15.037 -1.831 1.00 1.00 H new ATOM 0 HB2 MET A 1 10.820 -15.653 -0.339 1.00 1.00 H new ATOM 0 HB3 MET A 1 11.725 -15.116 1.063 1.00 1.00 H new ATOM 0 HG2 MET A 1 11.402 -12.874 0.607 1.00 1.00 H new ATOM 0 HG3 MET A 1 11.444 -13.105 -1.130 1.00 1.00 H new ATOM 0 HE1 MET A 1 7.970 -13.881 -2.247 1.00 1.00 H new ATOM 0 HE2 MET A 1 9.722 -13.889 -2.563 1.00 1.00 H new ATOM 0 HE3 MET A 1 8.966 -15.255 -1.709 1.00 1.00 H new ATOM 20 N GLN A 2 14.115 -13.088 -1.167 1.00 1.00 N ATOM 21 CA GLN A 2 14.878 -11.853 -0.871 1.00 1.00 C ATOM 22 C GLN A 2 13.943 -10.622 -0.844 1.00 1.00 C ATOM 23 O GLN A 2 13.274 -10.368 -1.842 1.00 1.00 O ATOM 24 CB GLN A 2 15.964 -11.592 -1.931 1.00 1.00 C ATOM 25 CG GLN A 2 17.329 -12.258 -1.685 1.00 1.00 C ATOM 26 CD GLN A 2 18.419 -11.373 -2.298 1.00 1.00 C ATOM 27 OE1 GLN A 2 18.684 -11.388 -3.491 1.00 1.00 O ATOM 28 NE2 GLN A 2 18.987 -10.459 -1.547 1.00 1.00 N ATOM 0 H GLN A 2 13.734 -13.087 -2.113 1.00 1.00 H new ATOM 0 HA GLN A 2 15.342 -12.001 0.104 1.00 1.00 H new ATOM 0 HB2 GLN A 2 15.588 -11.929 -2.897 1.00 1.00 H new ATOM 0 HB3 GLN A 2 16.117 -10.515 -2.007 1.00 1.00 H new ATOM 0 HG2 GLN A 2 17.501 -12.386 -0.616 1.00 1.00 H new ATOM 0 HG3 GLN A 2 17.352 -13.252 -2.132 1.00 1.00 H new ATOM 0 HE21 GLN A 2 18.785 -10.422 -0.548 1.00 1.00 H new ATOM 0 HE22 GLN A 2 19.631 -9.785 -1.962 1.00 1.00 H new ATOM 37 N THR A 3 13.900 -9.860 0.258 1.00 1.00 N ATOM 38 CA THR A 3 13.112 -8.599 0.393 1.00 1.00 C ATOM 39 C THR A 3 13.954 -7.381 0.816 1.00 1.00 C ATOM 40 O THR A 3 14.554 -7.381 1.889 1.00 1.00 O ATOM 41 CB THR A 3 11.905 -8.773 1.335 1.00 1.00 C ATOM 42 OG1 THR A 3 11.113 -9.859 0.912 1.00 1.00 O ATOM 43 CG2 THR A 3 10.975 -7.557 1.321 1.00 1.00 C ATOM 0 H THR A 3 14.418 -10.096 1.104 1.00 1.00 H new ATOM 0 HA THR A 3 12.744 -8.389 -0.611 1.00 1.00 H new ATOM 0 HB THR A 3 12.323 -8.921 2.331 1.00 1.00 H new ATOM 0 HG1 THR A 3 10.978 -10.476 1.661 1.00 1.00 H new ATOM 0 HG21 THR A 3 10.141 -7.729 2.001 1.00 1.00 H new ATOM 0 HG22 THR A 3 11.527 -6.673 1.641 1.00 1.00 H new ATOM 0 HG23 THR A 3 10.594 -7.402 0.311 1.00 1.00 H new ATOM 51 N VAL A 4 13.962 -6.314 0.004 1.00 1.00 N ATOM 52 CA VAL A 4 14.723 -5.049 0.185 1.00 1.00 C ATOM 53 C VAL A 4 13.789 -3.853 0.464 1.00 1.00 C ATOM 54 O VAL A 4 12.860 -3.595 -0.302 1.00 1.00 O ATOM 55 CB VAL A 4 15.640 -4.742 -1.032 1.00 1.00 C ATOM 56 CG1 VAL A 4 16.576 -3.554 -0.731 1.00 1.00 C ATOM 57 CG2 VAL A 4 16.498 -5.951 -1.467 1.00 1.00 C ATOM 0 H VAL A 4 13.407 -6.301 -0.851 1.00 1.00 H new ATOM 0 HA VAL A 4 15.359 -5.196 1.058 1.00 1.00 H new ATOM 0 HB VAL A 4 14.966 -4.495 -1.852 1.00 1.00 H new ATOM 0 HG11 VAL A 4 17.207 -3.359 -1.598 1.00 1.00 H new ATOM 0 HG12 VAL A 4 15.980 -2.668 -0.510 1.00 1.00 H new ATOM 0 HG13 VAL A 4 17.203 -3.793 0.128 1.00 1.00 H new ATOM 0 HG21 VAL A 4 17.115 -5.671 -2.321 1.00 1.00 H new ATOM 0 HG22 VAL A 4 17.139 -6.258 -0.641 1.00 1.00 H new ATOM 0 HG23 VAL A 4 15.846 -6.778 -1.747 1.00 1.00 H new ATOM 67 N ILE A 5 14.032 -3.109 1.555 1.00 1.00 N ATOM 68 CA ILE A 5 13.168 -2.034 2.104 1.00 1.00 C ATOM 69 C ILE A 5 13.857 -0.655 2.121 1.00 1.00 C ATOM 70 O ILE A 5 14.906 -0.480 2.745 1.00 1.00 O ATOM 71 CB ILE A 5 12.625 -2.395 3.517 1.00 1.00 C ATOM 72 CG1 ILE A 5 12.038 -3.838 3.626 1.00 1.00 C ATOM 73 CG2 ILE A 5 11.568 -1.345 3.935 1.00 1.00 C ATOM 74 CD1 ILE A 5 12.995 -4.831 4.306 1.00 1.00 C ATOM 0 H ILE A 5 14.877 -3.242 2.111 1.00 1.00 H new ATOM 0 HA ILE A 5 12.322 -1.957 1.421 1.00 1.00 H new ATOM 0 HB ILE A 5 13.476 -2.379 4.198 1.00 1.00 H new ATOM 0 HG12 ILE A 5 11.104 -3.802 4.186 1.00 1.00 H new ATOM 0 HG13 ILE A 5 11.797 -4.202 2.627 1.00 1.00 H new ATOM 0 HG21 ILE A 5 11.182 -1.591 4.924 1.00 1.00 H new ATOM 0 HG22 ILE A 5 12.027 -0.357 3.960 1.00 1.00 H new ATOM 0 HG23 ILE A 5 10.749 -1.347 3.216 1.00 1.00 H new ATOM 0 HD11 ILE A 5 12.527 -5.815 4.350 1.00 1.00 H new ATOM 0 HD12 ILE A 5 13.920 -4.895 3.734 1.00 1.00 H new ATOM 0 HD13 ILE A 5 13.217 -4.489 5.317 1.00 1.00 H new ATOM 86 N PHE A 6 13.224 0.343 1.491 1.00 1.00 N ATOM 87 CA PHE A 6 13.749 1.693 1.214 1.00 1.00 C ATOM 88 C PHE A 6 13.112 2.787 2.113 1.00 1.00 C ATOM 89 O PHE A 6 11.982 3.224 1.890 1.00 1.00 O ATOM 90 CB PHE A 6 13.592 1.985 -0.295 1.00 1.00 C ATOM 91 CG PHE A 6 14.398 1.062 -1.210 1.00 1.00 C ATOM 92 CD1 PHE A 6 13.905 -0.224 -1.534 1.00 1.00 C ATOM 93 CD2 PHE A 6 15.660 1.462 -1.715 1.00 1.00 C ATOM 94 CE1 PHE A 6 14.665 -1.097 -2.341 1.00 1.00 C ATOM 95 CE2 PHE A 6 16.409 0.597 -2.543 1.00 1.00 C ATOM 96 CZ PHE A 6 15.911 -0.684 -2.854 1.00 1.00 C ATOM 0 H PHE A 6 12.274 0.226 1.138 1.00 1.00 H new ATOM 0 HA PHE A 6 14.808 1.720 1.470 1.00 1.00 H new ATOM 0 HB2 PHE A 6 12.537 1.906 -0.559 1.00 1.00 H new ATOM 0 HB3 PHE A 6 13.892 3.016 -0.485 1.00 1.00 H new ATOM 0 HD1 PHE A 6 12.942 -0.539 -1.162 1.00 1.00 H new ATOM 0 HD2 PHE A 6 16.052 2.437 -1.465 1.00 1.00 H new ATOM 0 HE1 PHE A 6 14.291 -2.085 -2.566 1.00 1.00 H new ATOM 0 HE2 PHE A 6 17.362 0.917 -2.937 1.00 1.00 H new ATOM 0 HZ PHE A 6 16.483 -1.348 -3.485 1.00 1.00 H new ATOM 106 N GLY A 7 13.861 3.248 3.129 1.00 1.00 N ATOM 107 CA GLY A 7 13.525 4.398 3.993 1.00 1.00 C ATOM 108 C GLY A 7 12.543 4.168 5.158 1.00 1.00 C ATOM 109 O GLY A 7 11.575 4.915 5.282 1.00 1.00 O ATOM 0 H GLY A 7 14.750 2.816 3.382 1.00 1.00 H new ATOM 0 HA2 GLY A 7 14.455 4.783 4.412 1.00 1.00 H new ATOM 0 HA3 GLY A 7 13.112 5.182 3.359 1.00 1.00 H new ATOM 113 N ARG A 8 12.799 3.202 6.062 1.00 1.00 N ATOM 114 CA ARG A 8 12.042 2.948 7.332 1.00 1.00 C ATOM 115 C ARG A 8 11.881 4.184 8.271 1.00 1.00 C ATOM 116 O ARG A 8 10.920 4.260 9.029 1.00 1.00 O ATOM 117 CB ARG A 8 12.698 1.753 8.081 1.00 1.00 C ATOM 118 CG ARG A 8 11.854 1.145 9.233 1.00 1.00 C ATOM 119 CD ARG A 8 12.689 0.641 10.428 1.00 1.00 C ATOM 120 NE ARG A 8 11.904 -0.114 11.445 1.00 1.00 N ATOM 121 CZ ARG A 8 12.234 -0.396 12.691 1.00 1.00 C ATOM 122 NH1 ARG A 8 13.350 -0.068 13.247 1.00 1.00 N ATOM 123 NH2 ARG A 8 11.441 -1.088 13.428 1.00 1.00 N ATOM 0 H ARG A 8 13.567 2.543 5.935 1.00 1.00 H new ATOM 0 HA ARG A 8 11.020 2.708 7.038 1.00 1.00 H new ATOM 0 HB2 ARG A 8 12.914 0.967 7.357 1.00 1.00 H new ATOM 0 HB3 ARG A 8 13.654 2.082 8.488 1.00 1.00 H new ATOM 0 HG2 ARG A 8 11.149 1.896 9.588 1.00 1.00 H new ATOM 0 HG3 ARG A 8 11.266 0.316 8.839 1.00 1.00 H new ATOM 0 HD2 ARG A 8 13.489 0.002 10.054 1.00 1.00 H new ATOM 0 HD3 ARG A 8 13.163 1.495 10.912 1.00 1.00 H new ATOM 0 HE ARG A 8 10.994 -0.457 11.138 1.00 1.00 H new ATOM 0 HH11 ARG A 8 14.052 0.447 12.716 1.00 1.00 H new ATOM 0 HH12 ARG A 8 13.531 -0.324 14.218 1.00 1.00 H new ATOM 0 HH21 ARG A 8 10.554 -1.421 13.050 1.00 1.00 H new ATOM 0 HH22 ARG A 8 11.699 -1.305 14.391 1.00 1.00 H new ATOM 137 N SER A 9 12.818 5.137 8.217 1.00 1.00 N ATOM 138 CA SER A 9 13.007 6.302 9.117 1.00 1.00 C ATOM 139 C SER A 9 11.883 7.372 9.152 1.00 1.00 C ATOM 140 O SER A 9 11.503 7.965 8.134 1.00 1.00 O ATOM 141 CB SER A 9 14.340 6.978 8.763 1.00 1.00 C ATOM 142 OG SER A 9 14.652 8.011 9.675 1.00 1.00 O ATOM 0 H SER A 9 13.528 5.120 7.485 1.00 1.00 H new ATOM 0 HA SER A 9 12.987 5.877 10.121 1.00 1.00 H new ATOM 0 HB2 SER A 9 15.138 6.236 8.765 1.00 1.00 H new ATOM 0 HB3 SER A 9 14.286 7.386 7.754 1.00 1.00 H new ATOM 0 HG SER A 9 15.506 8.421 9.425 1.00 1.00 H new ATOM 148 N GLY A 10 11.389 7.665 10.363 1.00 1.00 N ATOM 149 CA GLY A 10 10.470 8.764 10.727 1.00 1.00 C ATOM 150 C GLY A 10 8.991 8.675 10.297 1.00 1.00 C ATOM 151 O GLY A 10 8.269 9.668 10.453 1.00 1.00 O ATOM 0 H GLY A 10 11.636 7.102 11.177 1.00 1.00 H new ATOM 0 HA2 GLY A 10 10.492 8.866 11.812 1.00 1.00 H new ATOM 0 HA3 GLY A 10 10.878 9.686 10.312 1.00 1.00 H new ATOM 155 N CYS A 11 8.524 7.555 9.729 1.00 1.00 N ATOM 156 CA CYS A 11 7.141 7.344 9.275 1.00 1.00 C ATOM 157 C CYS A 11 6.600 5.909 9.546 1.00 1.00 C ATOM 158 O CYS A 11 7.134 4.941 8.986 1.00 1.00 O ATOM 159 CB CYS A 11 7.051 7.741 7.792 1.00 1.00 C ATOM 160 SG CYS A 11 8.276 6.950 6.703 1.00 1.00 S ATOM 0 H CYS A 11 9.119 6.742 9.567 1.00 1.00 H new ATOM 0 HA CYS A 11 6.485 7.982 9.867 1.00 1.00 H new ATOM 0 HB2 CYS A 11 6.053 7.498 7.427 1.00 1.00 H new ATOM 0 HB3 CYS A 11 7.164 8.822 7.714 1.00 1.00 H new ATOM 165 N PRO A 12 5.495 5.741 10.320 1.00 1.00 N ATOM 166 CA PRO A 12 4.968 4.422 10.731 1.00 1.00 C ATOM 167 C PRO A 12 4.565 3.508 9.554 1.00 1.00 C ATOM 168 O PRO A 12 4.794 2.301 9.615 1.00 1.00 O ATOM 169 CB PRO A 12 3.801 4.707 11.689 1.00 1.00 C ATOM 170 CG PRO A 12 3.348 6.118 11.310 1.00 1.00 C ATOM 171 CD PRO A 12 4.636 6.798 10.845 1.00 1.00 C ATOM 0 HA PRO A 12 5.753 3.848 11.224 1.00 1.00 H new ATOM 0 HB2 PRO A 12 2.996 3.982 11.565 1.00 1.00 H new ATOM 0 HB3 PRO A 12 4.118 4.656 12.731 1.00 1.00 H new ATOM 0 HG2 PRO A 12 2.597 6.099 10.520 1.00 1.00 H new ATOM 0 HG3 PRO A 12 2.904 6.638 12.159 1.00 1.00 H new ATOM 0 HD2 PRO A 12 4.426 7.544 10.079 1.00 1.00 H new ATOM 0 HD3 PRO A 12 5.121 7.318 11.671 1.00 1.00 H new ATOM 179 N TYR A 13 4.093 4.091 8.442 1.00 1.00 N ATOM 180 CA TYR A 13 3.821 3.438 7.148 1.00 1.00 C ATOM 181 C TYR A 13 5.016 2.599 6.631 1.00 1.00 C ATOM 182 O TYR A 13 4.882 1.420 6.297 1.00 1.00 O ATOM 183 CB TYR A 13 3.447 4.541 6.133 1.00 1.00 C ATOM 184 CG TYR A 13 2.189 5.338 6.451 1.00 1.00 C ATOM 185 CD1 TYR A 13 0.920 4.737 6.277 1.00 1.00 C ATOM 186 CD2 TYR A 13 2.274 6.679 6.908 1.00 1.00 C ATOM 187 CE1 TYR A 13 -0.258 5.469 6.539 1.00 1.00 C ATOM 188 CE2 TYR A 13 1.096 7.415 7.171 1.00 1.00 C ATOM 189 CZ TYR A 13 -0.169 6.808 6.983 1.00 1.00 C ATOM 190 OH TYR A 13 -1.307 7.503 7.230 1.00 1.00 O ATOM 0 H TYR A 13 3.878 5.088 8.418 1.00 1.00 H new ATOM 0 HA TYR A 13 3.001 2.732 7.278 1.00 1.00 H new ATOM 0 HB2 TYR A 13 4.284 5.235 6.055 1.00 1.00 H new ATOM 0 HB3 TYR A 13 3.324 4.080 5.153 1.00 1.00 H new ATOM 0 HD1 TYR A 13 0.852 3.713 5.942 1.00 1.00 H new ATOM 0 HD2 TYR A 13 3.240 7.138 7.055 1.00 1.00 H new ATOM 0 HE1 TYR A 13 -1.225 5.007 6.401 1.00 1.00 H new ATOM 0 HE2 TYR A 13 1.161 8.437 7.514 1.00 1.00 H new ATOM 0 HH TYR A 13 -1.079 8.408 7.529 1.00 1.00 H new ATOM 200 N SER A 14 6.205 3.220 6.605 1.00 1.00 N ATOM 201 CA SER A 14 7.503 2.610 6.261 1.00 1.00 C ATOM 202 C SER A 14 8.041 1.634 7.321 1.00 1.00 C ATOM 203 O SER A 14 8.545 0.561 6.971 1.00 1.00 O ATOM 204 CB SER A 14 8.544 3.708 6.021 1.00 1.00 C ATOM 205 OG SER A 14 9.494 3.260 5.084 1.00 1.00 O ATOM 0 H SER A 14 6.294 4.210 6.834 1.00 1.00 H new ATOM 0 HA SER A 14 7.327 2.025 5.358 1.00 1.00 H new ATOM 0 HB2 SER A 14 8.057 4.612 5.656 1.00 1.00 H new ATOM 0 HB3 SER A 14 9.037 3.967 6.958 1.00 1.00 H new ATOM 0 HG SER A 14 10.218 3.917 5.012 1.00 1.00 H new ATOM 211 N VAL A 15 7.891 1.965 8.619 1.00 1.00 N ATOM 212 CA VAL A 15 8.208 1.059 9.751 1.00 1.00 C ATOM 213 C VAL A 15 7.452 -0.269 9.644 1.00 1.00 C ATOM 214 O VAL A 15 8.117 -1.299 9.563 1.00 1.00 O ATOM 215 CB VAL A 15 8.006 1.700 11.148 1.00 1.00 C ATOM 216 CG1 VAL A 15 8.264 0.682 12.277 1.00 1.00 C ATOM 217 CG2 VAL A 15 8.954 2.895 11.367 1.00 1.00 C ATOM 0 H VAL A 15 7.543 2.876 8.918 1.00 1.00 H new ATOM 0 HA VAL A 15 9.276 0.859 9.664 1.00 1.00 H new ATOM 0 HB VAL A 15 6.970 2.038 11.178 1.00 1.00 H new ATOM 0 HG11 VAL A 15 8.114 1.164 13.243 1.00 1.00 H new ATOM 0 HG12 VAL A 15 7.573 -0.155 12.178 1.00 1.00 H new ATOM 0 HG13 VAL A 15 9.288 0.316 12.210 1.00 1.00 H new ATOM 0 HG21 VAL A 15 8.783 3.318 12.357 1.00 1.00 H new ATOM 0 HG22 VAL A 15 9.988 2.558 11.290 1.00 1.00 H new ATOM 0 HG23 VAL A 15 8.762 3.655 10.609 1.00 1.00 H new ATOM 227 N ARG A 16 6.109 -0.260 9.520 1.00 1.00 N ATOM 228 CA ARG A 16 5.287 -1.481 9.322 1.00 1.00 C ATOM 229 C ARG A 16 5.713 -2.271 8.071 1.00 1.00 C ATOM 230 O ARG A 16 5.935 -3.471 8.176 1.00 1.00 O ATOM 231 CB ARG A 16 3.769 -1.163 9.348 1.00 1.00 C ATOM 232 CG ARG A 16 3.291 -0.652 10.731 1.00 1.00 C ATOM 233 CD ARG A 16 1.756 -0.560 10.882 1.00 1.00 C ATOM 234 NE ARG A 16 1.160 -1.767 11.511 1.00 1.00 N ATOM 235 CZ ARG A 16 0.517 -1.877 12.653 1.00 1.00 C ATOM 236 NH1 ARG A 16 0.268 -0.914 13.466 1.00 1.00 N ATOM 237 NH2 ARG A 16 0.097 -3.021 13.049 1.00 1.00 N ATOM 0 H ARG A 16 5.557 0.597 9.554 1.00 1.00 H new ATOM 0 HA ARG A 16 5.477 -2.139 10.170 1.00 1.00 H new ATOM 0 HB2 ARG A 16 3.546 -0.412 8.590 1.00 1.00 H new ATOM 0 HB3 ARG A 16 3.209 -2.060 9.083 1.00 1.00 H new ATOM 0 HG2 ARG A 16 3.681 -1.314 11.504 1.00 1.00 H new ATOM 0 HG3 ARG A 16 3.721 0.334 10.909 1.00 1.00 H new ATOM 0 HD2 ARG A 16 1.508 0.316 11.482 1.00 1.00 H new ATOM 0 HD3 ARG A 16 1.308 -0.411 9.899 1.00 1.00 H new ATOM 0 HE ARG A 16 1.264 -2.633 10.982 1.00 1.00 H new ATOM 0 HH11 ARG A 16 0.578 0.033 13.246 1.00 1.00 H new ATOM 0 HH12 ARG A 16 -0.239 -1.096 14.332 1.00 1.00 H new ATOM 0 HH21 ARG A 16 0.261 -3.850 12.478 1.00 1.00 H new ATOM 0 HH22 ARG A 16 -0.401 -3.103 13.935 1.00 1.00 H new ATOM 251 N ALA A 17 5.971 -1.611 6.935 1.00 1.00 N ATOM 252 CA ALA A 17 6.498 -2.241 5.712 1.00 1.00 C ATOM 253 C ALA A 17 7.823 -3.037 5.917 1.00 1.00 C ATOM 254 O ALA A 17 7.905 -4.181 5.464 1.00 1.00 O ATOM 255 CB ALA A 17 6.583 -1.169 4.609 1.00 1.00 C ATOM 0 H ALA A 17 5.818 -0.607 6.835 1.00 1.00 H new ATOM 0 HA ALA A 17 5.803 -3.020 5.400 1.00 1.00 H new ATOM 0 HB1 ALA A 17 6.972 -1.618 3.695 1.00 1.00 H new ATOM 0 HB2 ALA A 17 5.590 -0.762 4.420 1.00 1.00 H new ATOM 0 HB3 ALA A 17 7.248 -0.368 4.931 1.00 1.00 H new ATOM 261 N LYS A 18 8.834 -2.477 6.618 1.00 1.00 N ATOM 262 CA LYS A 18 10.068 -3.195 7.052 1.00 1.00 C ATOM 263 C LYS A 18 9.801 -4.309 8.071 1.00 1.00 C ATOM 264 O LYS A 18 10.253 -5.439 7.894 1.00 1.00 O ATOM 265 CB LYS A 18 11.127 -2.227 7.624 1.00 1.00 C ATOM 266 CG LYS A 18 12.533 -2.879 7.761 1.00 1.00 C ATOM 267 CD LYS A 18 13.082 -2.914 9.206 1.00 1.00 C ATOM 268 CE LYS A 18 12.576 -4.096 10.051 1.00 1.00 C ATOM 269 NZ LYS A 18 12.521 -3.782 11.502 1.00 1.00 N ATOM 0 H LYS A 18 8.822 -1.499 6.906 1.00 1.00 H new ATOM 0 HA LYS A 18 10.453 -3.660 6.144 1.00 1.00 H new ATOM 0 HB2 LYS A 18 11.199 -1.352 6.977 1.00 1.00 H new ATOM 0 HB3 LYS A 18 10.799 -1.874 8.602 1.00 1.00 H new ATOM 0 HG2 LYS A 18 12.486 -3.898 7.378 1.00 1.00 H new ATOM 0 HG3 LYS A 18 13.236 -2.334 7.131 1.00 1.00 H new ATOM 0 HD2 LYS A 18 14.171 -2.951 9.167 1.00 1.00 H new ATOM 0 HD3 LYS A 18 12.812 -1.984 9.706 1.00 1.00 H new ATOM 0 HE2 LYS A 18 11.582 -4.383 9.708 1.00 1.00 H new ATOM 0 HE3 LYS A 18 13.228 -4.955 9.894 1.00 1.00 H new ATOM 0 HZ1 LYS A 18 12.158 -4.606 12.022 1.00 1.00 H new ATOM 0 HZ2 LYS A 18 13.476 -3.550 11.843 1.00 1.00 H new ATOM 0 HZ3 LYS A 18 11.891 -2.969 11.658 1.00 1.00 H new ATOM 283 N ASP A 19 9.146 -3.958 9.173 1.00 1.00 N ATOM 284 CA ASP A 19 8.816 -4.812 10.321 1.00 1.00 C ATOM 285 C ASP A 19 8.066 -6.104 9.906 1.00 1.00 C ATOM 286 O ASP A 19 8.393 -7.191 10.385 1.00 1.00 O ATOM 287 CB ASP A 19 8.075 -3.943 11.370 1.00 1.00 C ATOM 288 CG ASP A 19 9.007 -2.946 12.127 1.00 1.00 C ATOM 289 OD1 ASP A 19 10.073 -2.544 11.596 1.00 1.00 O ATOM 290 OD2 ASP A 19 8.672 -2.481 13.247 1.00 1.00 O ATOM 0 H ASP A 19 8.806 -3.005 9.302 1.00 1.00 H new ATOM 0 HA ASP A 19 9.727 -5.194 10.782 1.00 1.00 H new ATOM 0 HB2 ASP A 19 7.285 -3.381 10.871 1.00 1.00 H new ATOM 0 HB3 ASP A 19 7.592 -4.597 12.095 1.00 1.00 H new ATOM 295 N LEU A 20 7.120 -6.021 8.959 1.00 1.00 N ATOM 296 CA LEU A 20 6.452 -7.158 8.292 1.00 1.00 C ATOM 297 C LEU A 20 7.438 -8.156 7.617 1.00 1.00 C ATOM 298 O LEU A 20 7.296 -9.370 7.784 1.00 1.00 O ATOM 299 CB LEU A 20 5.422 -6.608 7.267 1.00 1.00 C ATOM 300 CG LEU A 20 3.966 -6.405 7.760 1.00 1.00 C ATOM 301 CD1 LEU A 20 3.806 -5.715 9.124 1.00 1.00 C ATOM 302 CD2 LEU A 20 3.189 -5.621 6.686 1.00 1.00 C ATOM 0 H LEU A 20 6.782 -5.121 8.619 1.00 1.00 H new ATOM 0 HA LEU A 20 5.945 -7.737 9.063 1.00 1.00 H new ATOM 0 HB2 LEU A 20 5.790 -5.650 6.900 1.00 1.00 H new ATOM 0 HB3 LEU A 20 5.398 -7.288 6.415 1.00 1.00 H new ATOM 0 HG LEU A 20 3.566 -7.407 7.915 1.00 1.00 H new ATOM 0 HD11 LEU A 20 2.747 -5.627 9.365 1.00 1.00 H new ATOM 0 HD12 LEU A 20 4.305 -6.306 9.892 1.00 1.00 H new ATOM 0 HD13 LEU A 20 4.253 -4.721 9.084 1.00 1.00 H new ATOM 0 HD21 LEU A 20 2.162 -5.470 7.018 1.00 1.00 H new ATOM 0 HD22 LEU A 20 3.665 -4.653 6.526 1.00 1.00 H new ATOM 0 HD23 LEU A 20 3.190 -6.184 5.753 1.00 1.00 H new ATOM 314 N ALA A 21 8.403 -7.668 6.822 1.00 1.00 N ATOM 315 CA ALA A 21 9.512 -8.443 6.234 1.00 1.00 C ATOM 316 C ALA A 21 10.503 -9.051 7.267 1.00 1.00 C ATOM 317 O ALA A 21 10.867 -10.221 7.161 1.00 1.00 O ATOM 318 CB ALA A 21 10.209 -7.564 5.182 1.00 1.00 C ATOM 0 H ALA A 21 8.435 -6.683 6.559 1.00 1.00 H new ATOM 0 HA ALA A 21 9.088 -9.328 5.759 1.00 1.00 H new ATOM 0 HB1 ALA A 21 11.034 -8.118 4.734 1.00 1.00 H new ATOM 0 HB2 ALA A 21 9.494 -7.288 4.407 1.00 1.00 H new ATOM 0 HB3 ALA A 21 10.594 -6.663 5.659 1.00 1.00 H new ATOM 324 N GLU A 22 10.925 -8.290 8.285 1.00 1.00 N ATOM 325 CA GLU A 22 11.748 -8.769 9.424 1.00 1.00 C ATOM 326 C GLU A 22 11.074 -9.901 10.234 1.00 1.00 C ATOM 327 O GLU A 22 11.722 -10.908 10.517 1.00 1.00 O ATOM 328 CB GLU A 22 12.108 -7.578 10.316 1.00 1.00 C ATOM 329 CG GLU A 22 13.027 -7.917 11.503 1.00 1.00 C ATOM 330 CD GLU A 22 13.279 -6.637 12.302 1.00 1.00 C ATOM 331 OE1 GLU A 22 12.356 -6.185 13.021 1.00 1.00 O ATOM 332 OE2 GLU A 22 14.303 -5.953 12.102 1.00 1.00 O ATOM 0 H GLU A 22 10.702 -7.297 8.349 1.00 1.00 H new ATOM 0 HA GLU A 22 12.656 -9.212 9.016 1.00 1.00 H new ATOM 0 HB2 GLU A 22 12.593 -6.817 9.704 1.00 1.00 H new ATOM 0 HB3 GLU A 22 11.188 -7.139 10.701 1.00 1.00 H new ATOM 0 HG2 GLU A 22 12.564 -8.674 12.136 1.00 1.00 H new ATOM 0 HG3 GLU A 22 13.969 -8.333 11.146 1.00 1.00 H new ATOM 339 N LYS A 23 9.769 -9.768 10.535 1.00 1.00 N ATOM 340 CA LYS A 23 8.857 -10.787 11.117 1.00 1.00 C ATOM 341 C LYS A 23 8.917 -12.102 10.323 1.00 1.00 C ATOM 342 O LYS A 23 9.243 -13.132 10.901 1.00 1.00 O ATOM 343 CB LYS A 23 7.439 -10.168 11.173 1.00 1.00 C ATOM 344 CG LYS A 23 6.206 -11.072 11.444 1.00 1.00 C ATOM 345 CD LYS A 23 5.024 -10.692 10.518 1.00 1.00 C ATOM 346 CE LYS A 23 3.654 -11.213 10.977 1.00 1.00 C ATOM 347 NZ LYS A 23 2.570 -10.855 10.017 1.00 1.00 N ATOM 0 H LYS A 23 9.284 -8.886 10.369 1.00 1.00 H new ATOM 0 HA LYS A 23 9.162 -11.054 12.129 1.00 1.00 H new ATOM 0 HB2 LYS A 23 7.452 -9.398 11.944 1.00 1.00 H new ATOM 0 HB3 LYS A 23 7.268 -9.664 10.222 1.00 1.00 H new ATOM 0 HG2 LYS A 23 6.475 -12.116 11.286 1.00 1.00 H new ATOM 0 HG3 LYS A 23 5.902 -10.975 12.486 1.00 1.00 H new ATOM 0 HD2 LYS A 23 4.977 -9.606 10.440 1.00 1.00 H new ATOM 0 HD3 LYS A 23 5.226 -11.075 9.518 1.00 1.00 H new ATOM 0 HE2 LYS A 23 3.697 -12.296 11.088 1.00 1.00 H new ATOM 0 HE3 LYS A 23 3.420 -10.801 11.959 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 1.662 -11.225 10.364 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 2.511 -9.820 9.930 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 2.780 -11.269 9.086 1.00 1.00 H new ATOM 361 N LEU A 24 8.715 -12.045 9.001 1.00 1.00 N ATOM 362 CA LEU A 24 8.886 -13.161 8.050 1.00 1.00 C ATOM 363 C LEU A 24 10.316 -13.760 8.063 1.00 1.00 C ATOM 364 O LEU A 24 10.447 -14.980 8.128 1.00 1.00 O ATOM 365 CB LEU A 24 8.498 -12.674 6.636 1.00 1.00 C ATOM 366 CG LEU A 24 6.975 -12.663 6.381 1.00 1.00 C ATOM 367 CD1 LEU A 24 6.666 -11.813 5.148 1.00 1.00 C ATOM 368 CD2 LEU A 24 6.383 -14.056 6.151 1.00 1.00 C ATOM 0 H LEU A 24 8.415 -11.186 8.541 1.00 1.00 H new ATOM 0 HA LEU A 24 8.228 -13.972 8.361 1.00 1.00 H new ATOM 0 HB2 LEU A 24 8.890 -11.668 6.487 1.00 1.00 H new ATOM 0 HB3 LEU A 24 8.977 -13.315 5.896 1.00 1.00 H new ATOM 0 HG LEU A 24 6.522 -12.251 7.283 1.00 1.00 H new ATOM 0 HD11 LEU A 24 5.591 -11.807 4.970 1.00 1.00 H new ATOM 0 HD12 LEU A 24 7.012 -10.793 5.313 1.00 1.00 H new ATOM 0 HD13 LEU A 24 7.175 -12.233 4.280 1.00 1.00 H new ATOM 0 HD21 LEU A 24 5.310 -13.971 5.979 1.00 1.00 H new ATOM 0 HD22 LEU A 24 6.855 -14.513 5.281 1.00 1.00 H new ATOM 0 HD23 LEU A 24 6.562 -14.677 7.029 1.00 1.00 H new ATOM 380 N SER A 25 11.382 -12.940 8.044 1.00 1.00 N ATOM 381 CA SER A 25 12.782 -13.414 8.214 1.00 1.00 C ATOM 382 C SER A 25 13.066 -14.082 9.578 1.00 1.00 C ATOM 383 O SER A 25 13.871 -15.007 9.634 1.00 1.00 O ATOM 384 CB SER A 25 13.822 -12.306 7.971 1.00 1.00 C ATOM 385 OG SER A 25 15.099 -12.885 7.724 1.00 1.00 O ATOM 0 H SER A 25 11.306 -11.932 7.911 1.00 1.00 H new ATOM 0 HA SER A 25 12.885 -14.179 7.444 1.00 1.00 H new ATOM 0 HB2 SER A 25 13.521 -11.693 7.122 1.00 1.00 H new ATOM 0 HB3 SER A 25 13.873 -11.647 8.838 1.00 1.00 H new ATOM 0 HG SER A 25 15.011 -13.598 7.058 1.00 1.00 H new ATOM 391 N ASN A 26 12.428 -13.645 10.676 1.00 1.00 N ATOM 392 CA ASN A 26 12.424 -14.269 12.014 1.00 1.00 C ATOM 393 C ASN A 26 11.665 -15.628 12.050 1.00 1.00 C ATOM 394 O ASN A 26 12.236 -16.638 12.471 1.00 1.00 O ATOM 395 CB ASN A 26 11.881 -13.244 13.043 1.00 1.00 C ATOM 396 CG ASN A 26 12.184 -13.636 14.481 1.00 1.00 C ATOM 397 OD1 ASN A 26 11.730 -14.646 14.986 1.00 1.00 O ATOM 398 ND2 ASN A 26 12.962 -12.876 15.204 1.00 1.00 N ATOM 0 H ASN A 26 11.866 -12.794 10.654 1.00 1.00 H new ATOM 0 HA ASN A 26 13.448 -14.528 12.283 1.00 1.00 H new ATOM 0 HB2 ASN A 26 12.316 -12.266 12.839 1.00 1.00 H new ATOM 0 HB3 ASN A 26 10.803 -13.146 12.917 1.00 1.00 H new ATOM 0 HD21 ASN A 26 13.176 -13.135 16.167 1.00 1.00 H new ATOM 0 HD22 ASN A 26 13.356 -12.024 14.805 1.00 1.00 H new ATOM 405 N GLU A 27 10.412 -15.637 11.582 1.00 1.00 N ATOM 406 CA GLU A 27 9.440 -16.748 11.473 1.00 1.00 C ATOM 407 C GLU A 27 9.868 -17.893 10.514 1.00 1.00 C ATOM 408 O GLU A 27 9.574 -19.067 10.773 1.00 1.00 O ATOM 409 CB GLU A 27 8.091 -16.107 11.039 1.00 1.00 C ATOM 410 CG GLU A 27 6.947 -17.038 10.595 1.00 1.00 C ATOM 411 CD GLU A 27 5.655 -16.272 10.219 1.00 1.00 C ATOM 412 OE1 GLU A 27 5.700 -15.259 9.487 1.00 1.00 O ATOM 413 OE2 GLU A 27 4.556 -16.715 10.644 1.00 1.00 O ATOM 0 H GLU A 27 10.002 -14.772 11.229 1.00 1.00 H new ATOM 0 HA GLU A 27 9.364 -17.248 12.439 1.00 1.00 H new ATOM 0 HB2 GLU A 27 7.726 -15.506 11.872 1.00 1.00 H new ATOM 0 HB3 GLU A 27 8.298 -15.421 10.218 1.00 1.00 H new ATOM 0 HG2 GLU A 27 7.276 -17.626 9.738 1.00 1.00 H new ATOM 0 HG3 GLU A 27 6.725 -17.741 11.398 1.00 1.00 H new ATOM 420 N ARG A 28 10.568 -17.591 9.409 1.00 1.00 N ATOM 421 CA ARG A 28 10.917 -18.498 8.285 1.00 1.00 C ATOM 422 C ARG A 28 12.442 -18.667 8.108 1.00 1.00 C ATOM 423 O ARG A 28 13.242 -17.819 8.490 1.00 1.00 O ATOM 424 CB ARG A 28 10.275 -17.962 6.978 1.00 1.00 C ATOM 425 CG ARG A 28 8.771 -17.590 7.082 1.00 1.00 C ATOM 426 CD ARG A 28 8.184 -16.882 5.852 1.00 1.00 C ATOM 427 NE ARG A 28 8.290 -17.676 4.616 1.00 1.00 N ATOM 428 CZ ARG A 28 7.528 -18.649 4.180 1.00 1.00 C ATOM 429 NH1 ARG A 28 6.436 -19.046 4.745 1.00 1.00 N ATOM 430 NH2 ARG A 28 7.879 -19.253 3.113 1.00 1.00 N ATOM 0 H ARG A 28 10.932 -16.650 9.260 1.00 1.00 H new ATOM 0 HA ARG A 28 10.521 -19.486 8.519 1.00 1.00 H new ATOM 0 HB2 ARG A 28 10.829 -17.080 6.655 1.00 1.00 H new ATOM 0 HB3 ARG A 28 10.393 -18.715 6.199 1.00 1.00 H new ATOM 0 HG2 ARG A 28 8.200 -18.501 7.264 1.00 1.00 H new ATOM 0 HG3 ARG A 28 8.632 -16.948 7.952 1.00 1.00 H new ATOM 0 HD2 ARG A 28 7.135 -16.653 6.040 1.00 1.00 H new ATOM 0 HD3 ARG A 28 8.697 -15.931 5.710 1.00 1.00 H new ATOM 0 HE ARG A 28 9.073 -17.432 4.009 1.00 1.00 H new ATOM 0 HH11 ARG A 28 6.109 -18.592 5.598 1.00 1.00 H new ATOM 0 HH12 ARG A 28 5.901 -19.813 4.338 1.00 1.00 H new ATOM 0 HH21 ARG A 28 8.731 -18.974 2.626 1.00 1.00 H new ATOM 0 HH22 ARG A 28 7.308 -20.015 2.747 1.00 1.00 H new ATOM 444 N ASP A 29 12.832 -19.755 7.448 1.00 1.00 N ATOM 445 CA ASP A 29 14.193 -20.081 6.967 1.00 1.00 C ATOM 446 C ASP A 29 14.487 -19.582 5.530 1.00 1.00 C ATOM 447 O ASP A 29 15.618 -19.228 5.198 1.00 1.00 O ATOM 448 CB ASP A 29 14.394 -21.611 7.068 1.00 1.00 C ATOM 449 CG ASP A 29 13.457 -22.455 6.188 1.00 1.00 C ATOM 450 OD1 ASP A 29 12.233 -22.180 6.176 1.00 1.00 O ATOM 451 OD2 ASP A 29 13.937 -23.389 5.509 1.00 1.00 O ATOM 0 H ASP A 29 12.166 -20.491 7.213 1.00 1.00 H new ATOM 0 HA ASP A 29 14.903 -19.552 7.603 1.00 1.00 H new ATOM 0 HB2 ASP A 29 15.425 -21.844 6.801 1.00 1.00 H new ATOM 0 HB3 ASP A 29 14.258 -21.911 8.107 1.00 1.00 H new ATOM 456 N ASP A 30 13.446 -19.556 4.691 1.00 1.00 N ATOM 457 CA ASP A 30 13.416 -19.203 3.257 1.00 1.00 C ATOM 458 C ASP A 30 13.760 -17.722 2.947 1.00 1.00 C ATOM 459 O ASP A 30 14.347 -17.376 1.915 1.00 1.00 O ATOM 460 CB ASP A 30 11.979 -19.533 2.744 1.00 1.00 C ATOM 461 CG ASP A 30 11.210 -18.459 1.941 1.00 1.00 C ATOM 462 OD1 ASP A 30 11.586 -18.257 0.757 1.00 1.00 O ATOM 463 OD2 ASP A 30 10.221 -17.885 2.454 1.00 1.00 O ATOM 0 H ASP A 30 12.514 -19.804 5.024 1.00 1.00 H new ATOM 0 HA ASP A 30 14.191 -19.779 2.752 1.00 1.00 H new ATOM 0 HB2 ASP A 30 12.048 -20.425 2.121 1.00 1.00 H new ATOM 0 HB3 ASP A 30 11.372 -19.795 3.610 1.00 1.00 H new ATOM 468 N PHE A 31 13.339 -16.869 3.872 1.00 1.00 N ATOM 469 CA PHE A 31 13.263 -15.406 3.811 1.00 1.00 C ATOM 470 C PHE A 31 14.460 -14.624 4.410 1.00 1.00 C ATOM 471 O PHE A 31 14.704 -14.618 5.617 1.00 1.00 O ATOM 472 CB PHE A 31 11.934 -15.024 4.499 1.00 1.00 C ATOM 473 CG PHE A 31 11.406 -13.646 4.152 1.00 1.00 C ATOM 474 CD1 PHE A 31 12.059 -12.483 4.621 1.00 1.00 C ATOM 475 CD2 PHE A 31 10.229 -13.519 3.380 1.00 1.00 C ATOM 476 CE1 PHE A 31 11.536 -11.207 4.336 1.00 1.00 C ATOM 477 CE2 PHE A 31 9.695 -12.245 3.109 1.00 1.00 C ATOM 478 CZ PHE A 31 10.340 -11.089 3.602 1.00 1.00 C ATOM 0 H PHE A 31 13.009 -17.213 4.774 1.00 1.00 H new ATOM 0 HA PHE A 31 13.307 -15.111 2.763 1.00 1.00 H new ATOM 0 HB2 PHE A 31 11.179 -15.764 4.233 1.00 1.00 H new ATOM 0 HB3 PHE A 31 12.071 -15.083 5.579 1.00 1.00 H new ATOM 0 HD1 PHE A 31 12.965 -12.574 5.202 1.00 1.00 H new ATOM 0 HD2 PHE A 31 9.738 -14.401 2.997 1.00 1.00 H new ATOM 0 HE1 PHE A 31 12.051 -10.322 4.679 1.00 1.00 H new ATOM 0 HE2 PHE A 31 8.792 -12.151 2.524 1.00 1.00 H new ATOM 0 HZ PHE A 31 9.915 -10.114 3.416 1.00 1.00 H new ATOM 488 N GLN A 32 15.138 -13.859 3.543 1.00 1.00 N ATOM 489 CA GLN A 32 16.213 -12.882 3.813 1.00 1.00 C ATOM 490 C GLN A 32 15.822 -11.413 3.520 1.00 1.00 C ATOM 491 O GLN A 32 15.205 -11.113 2.494 1.00 1.00 O ATOM 492 CB GLN A 32 17.532 -13.284 3.100 1.00 1.00 C ATOM 493 CG GLN A 32 18.685 -13.586 4.076 1.00 1.00 C ATOM 494 CD GLN A 32 19.107 -12.348 4.871 1.00 1.00 C ATOM 495 OE1 GLN A 32 18.402 -11.850 5.729 1.00 1.00 O ATOM 496 NE2 GLN A 32 20.222 -11.727 4.600 1.00 1.00 N ATOM 0 H GLN A 32 14.933 -13.909 2.545 1.00 1.00 H new ATOM 0 HA GLN A 32 16.382 -12.919 4.889 1.00 1.00 H new ATOM 0 HB2 GLN A 32 17.349 -14.163 2.482 1.00 1.00 H new ATOM 0 HB3 GLN A 32 17.834 -12.480 2.429 1.00 1.00 H new ATOM 0 HG2 GLN A 32 18.378 -14.372 4.766 1.00 1.00 H new ATOM 0 HG3 GLN A 32 19.541 -13.967 3.519 1.00 1.00 H new ATOM 0 HE21 GLN A 32 20.853 -12.098 3.890 1.00 1.00 H new ATOM 0 HE22 GLN A 32 20.463 -10.870 5.099 1.00 1.00 H new ATOM 505 N TYR A 33 16.164 -10.503 4.438 1.00 1.00 N ATOM 506 CA TYR A 33 15.787 -9.076 4.489 1.00 1.00 C ATOM 507 C TYR A 33 16.988 -8.093 4.398 1.00 1.00 C ATOM 508 O TYR A 33 18.043 -8.325 4.995 1.00 1.00 O ATOM 509 CB TYR A 33 14.845 -8.802 5.687 1.00 1.00 C ATOM 510 CG TYR A 33 15.476 -8.694 7.074 1.00 1.00 C ATOM 511 CD1 TYR A 33 16.191 -9.784 7.630 1.00 1.00 C ATOM 512 CD2 TYR A 33 15.319 -7.509 7.838 1.00 1.00 C ATOM 513 CE1 TYR A 33 16.745 -9.696 8.928 1.00 1.00 C ATOM 514 CE2 TYR A 33 15.870 -7.417 9.139 1.00 1.00 C ATOM 515 CZ TYR A 33 16.583 -8.511 9.685 1.00 1.00 C ATOM 516 OH TYR A 33 17.108 -8.427 10.935 1.00 1.00 O ATOM 0 H TYR A 33 16.757 -10.759 5.228 1.00 1.00 H new ATOM 0 HA TYR A 33 15.226 -8.866 3.578 1.00 1.00 H new ATOM 0 HB2 TYR A 33 14.310 -7.873 5.488 1.00 1.00 H new ATOM 0 HB3 TYR A 33 14.101 -9.598 5.718 1.00 1.00 H new ATOM 0 HD1 TYR A 33 16.314 -10.691 7.057 1.00 1.00 H new ATOM 0 HD2 TYR A 33 14.776 -6.672 7.425 1.00 1.00 H new ATOM 0 HE1 TYR A 33 17.291 -10.531 9.341 1.00 1.00 H new ATOM 0 HE2 TYR A 33 15.746 -6.512 9.715 1.00 1.00 H new ATOM 0 HH TYR A 33 16.907 -7.546 11.316 1.00 1.00 H new ATOM 526 N GLN A 34 16.838 -6.998 3.635 1.00 1.00 N ATOM 527 CA GLN A 34 17.806 -5.888 3.445 1.00 1.00 C ATOM 528 C GLN A 34 17.136 -4.510 3.696 1.00 1.00 C ATOM 529 O GLN A 34 16.094 -4.206 3.120 1.00 1.00 O ATOM 530 CB GLN A 34 18.359 -5.925 1.997 1.00 1.00 C ATOM 531 CG GLN A 34 19.544 -4.966 1.745 1.00 1.00 C ATOM 532 CD GLN A 34 19.975 -4.922 0.274 1.00 1.00 C ATOM 533 OE1 GLN A 34 20.329 -5.913 -0.347 1.00 1.00 O ATOM 534 NE2 GLN A 34 20.029 -3.774 -0.358 1.00 1.00 N ATOM 0 H GLN A 34 15.985 -6.848 3.097 1.00 1.00 H new ATOM 0 HA GLN A 34 18.616 -6.017 4.163 1.00 1.00 H new ATOM 0 HB2 GLN A 34 18.675 -6.943 1.767 1.00 1.00 H new ATOM 0 HB3 GLN A 34 17.553 -5.678 1.306 1.00 1.00 H new ATOM 0 HG2 GLN A 34 19.267 -3.962 2.067 1.00 1.00 H new ATOM 0 HG3 GLN A 34 20.391 -5.275 2.357 1.00 1.00 H new ATOM 0 HE21 GLN A 34 19.744 -2.917 0.116 1.00 1.00 H new ATOM 0 HE22 GLN A 34 20.356 -3.738 -1.324 1.00 1.00 H new ATOM 543 N TYR A 35 17.760 -3.632 4.477 1.00 1.00 N ATOM 544 CA TYR A 35 17.305 -2.263 4.798 1.00 1.00 C ATOM 545 C TYR A 35 18.228 -1.175 4.194 1.00 1.00 C ATOM 546 O TYR A 35 19.444 -1.182 4.405 1.00 1.00 O ATOM 547 CB TYR A 35 17.109 -2.120 6.324 1.00 1.00 C ATOM 548 CG TYR A 35 16.936 -0.675 6.768 1.00 1.00 C ATOM 549 CD1 TYR A 35 15.967 0.150 6.141 1.00 1.00 C ATOM 550 CD2 TYR A 35 17.857 -0.111 7.681 1.00 1.00 C ATOM 551 CE1 TYR A 35 15.979 1.546 6.365 1.00 1.00 C ATOM 552 CE2 TYR A 35 17.835 1.272 7.940 1.00 1.00 C ATOM 553 CZ TYR A 35 16.919 2.105 7.259 1.00 1.00 C ATOM 554 OH TYR A 35 16.975 3.445 7.445 1.00 1.00 O ATOM 0 H TYR A 35 18.644 -3.859 4.932 1.00 1.00 H new ATOM 0 HA TYR A 35 16.337 -2.099 4.324 1.00 1.00 H new ATOM 0 HB2 TYR A 35 16.234 -2.695 6.628 1.00 1.00 H new ATOM 0 HB3 TYR A 35 17.968 -2.552 6.837 1.00 1.00 H new ATOM 0 HD1 TYR A 35 15.221 -0.288 5.494 1.00 1.00 H new ATOM 0 HD2 TYR A 35 18.578 -0.742 8.180 1.00 1.00 H new ATOM 0 HE1 TYR A 35 15.272 2.183 5.854 1.00 1.00 H new ATOM 0 HE2 TYR A 35 18.519 1.697 8.660 1.00 1.00 H new ATOM 0 HH TYR A 35 17.881 3.700 7.720 1.00 1.00 H new ATOM 564 N VAL A 36 17.645 -0.241 3.428 1.00 1.00 N ATOM 565 CA VAL A 36 18.300 0.877 2.705 1.00 1.00 C ATOM 566 C VAL A 36 17.745 2.248 3.142 1.00 1.00 C ATOM 567 O VAL A 36 16.591 2.586 2.881 1.00 1.00 O ATOM 568 CB VAL A 36 18.169 0.709 1.169 1.00 1.00 C ATOM 569 CG1 VAL A 36 18.883 1.845 0.414 1.00 1.00 C ATOM 570 CG2 VAL A 36 18.737 -0.644 0.676 1.00 1.00 C ATOM 0 H VAL A 36 16.635 -0.240 3.283 1.00 1.00 H new ATOM 0 HA VAL A 36 19.357 0.845 2.968 1.00 1.00 H new ATOM 0 HB VAL A 36 17.100 0.742 0.957 1.00 1.00 H new ATOM 0 HG11 VAL A 36 18.771 1.695 -0.660 1.00 1.00 H new ATOM 0 HG12 VAL A 36 18.442 2.802 0.695 1.00 1.00 H new ATOM 0 HG13 VAL A 36 19.942 1.844 0.672 1.00 1.00 H new ATOM 0 HG21 VAL A 36 18.622 -0.714 -0.406 1.00 1.00 H new ATOM 0 HG22 VAL A 36 19.794 -0.710 0.934 1.00 1.00 H new ATOM 0 HG23 VAL A 36 18.195 -1.461 1.152 1.00 1.00 H new ATOM 580 N ASP A 37 18.551 3.076 3.809 1.00 1.00 N ATOM 581 CA ASP A 37 18.217 4.433 4.286 1.00 1.00 C ATOM 582 C ASP A 37 18.166 5.547 3.205 1.00 1.00 C ATOM 583 O ASP A 37 18.947 6.487 3.215 1.00 1.00 O ATOM 584 CB ASP A 37 19.042 4.867 5.532 1.00 1.00 C ATOM 585 CG ASP A 37 19.888 3.809 6.254 1.00 1.00 C ATOM 586 OD1 ASP A 37 20.745 3.156 5.612 1.00 1.00 O ATOM 587 OD2 ASP A 37 19.652 3.626 7.461 1.00 1.00 O ATOM 0 H ASP A 37 19.507 2.811 4.047 1.00 1.00 H new ATOM 0 HA ASP A 37 17.179 4.322 4.599 1.00 1.00 H new ATOM 0 HB2 ASP A 37 19.710 5.672 5.224 1.00 1.00 H new ATOM 0 HB3 ASP A 37 18.348 5.289 6.259 1.00 1.00 H new ATOM 592 N ILE A 38 17.175 5.550 2.308 1.00 1.00 N ATOM 593 CA ILE A 38 16.977 6.583 1.245 1.00 1.00 C ATOM 594 C ILE A 38 16.899 8.015 1.827 1.00 1.00 C ATOM 595 O ILE A 38 17.521 8.938 1.310 1.00 1.00 O ATOM 596 CB ILE A 38 15.780 6.236 0.305 1.00 1.00 C ATOM 597 CG1 ILE A 38 14.368 6.382 0.934 1.00 1.00 C ATOM 598 CG2 ILE A 38 15.978 4.818 -0.260 1.00 1.00 C ATOM 599 CD1 ILE A 38 13.705 7.745 0.661 1.00 1.00 C ATOM 0 H ILE A 38 16.461 4.822 2.287 1.00 1.00 H new ATOM 0 HA ILE A 38 17.867 6.567 0.615 1.00 1.00 H new ATOM 0 HB ILE A 38 15.797 6.985 -0.487 1.00 1.00 H new ATOM 0 HG12 ILE A 38 13.725 5.591 0.548 1.00 1.00 H new ATOM 0 HG13 ILE A 38 14.443 6.234 2.011 1.00 1.00 H new ATOM 0 HG21 ILE A 38 15.145 4.569 -0.918 1.00 1.00 H new ATOM 0 HG22 ILE A 38 16.910 4.778 -0.824 1.00 1.00 H new ATOM 0 HG23 ILE A 38 16.019 4.102 0.561 1.00 1.00 H new ATOM 0 HD11 ILE A 38 12.722 7.772 1.131 1.00 1.00 H new ATOM 0 HD12 ILE A 38 14.326 8.541 1.072 1.00 1.00 H new ATOM 0 HD13 ILE A 38 13.597 7.888 -0.414 1.00 1.00 H new ATOM 611 N ARG A 39 16.239 8.145 2.988 1.00 1.00 N ATOM 612 CA ARG A 39 16.100 9.336 3.862 1.00 1.00 C ATOM 613 C ARG A 39 17.386 9.757 4.611 1.00 1.00 C ATOM 614 O ARG A 39 17.370 10.782 5.287 1.00 1.00 O ATOM 615 CB ARG A 39 14.891 9.101 4.811 1.00 1.00 C ATOM 616 CG ARG A 39 14.255 10.404 5.332 1.00 1.00 C ATOM 617 CD ARG A 39 13.011 10.162 6.201 1.00 1.00 C ATOM 618 NE ARG A 39 12.293 11.428 6.467 1.00 1.00 N ATOM 619 CZ ARG A 39 11.097 11.590 6.985 1.00 1.00 C ATOM 620 NH1 ARG A 39 10.371 10.634 7.456 1.00 1.00 N ATOM 621 NH2 ARG A 39 10.538 12.748 7.029 1.00 1.00 N ATOM 0 H ARG A 39 15.740 7.348 3.382 1.00 1.00 H new ATOM 0 HA ARG A 39 15.913 10.198 3.222 1.00 1.00 H new ATOM 0 HB2 ARG A 39 14.133 8.522 4.284 1.00 1.00 H new ATOM 0 HB3 ARG A 39 15.217 8.501 5.660 1.00 1.00 H new ATOM 0 HG2 ARG A 39 14.995 10.956 5.912 1.00 1.00 H new ATOM 0 HG3 ARG A 39 13.982 11.032 4.484 1.00 1.00 H new ATOM 0 HD2 ARG A 39 12.344 9.460 5.700 1.00 1.00 H new ATOM 0 HD3 ARG A 39 13.306 9.703 7.144 1.00 1.00 H new ATOM 0 HE ARG A 39 12.790 12.283 6.216 1.00 1.00 H new ATOM 0 HH11 ARG A 39 10.718 9.675 7.441 1.00 1.00 H new ATOM 0 HH12 ARG A 39 9.450 10.837 7.844 1.00 1.00 H new ATOM 0 HH21 ARG A 39 11.025 13.564 6.657 1.00 1.00 H new ATOM 0 HH22 ARG A 39 9.608 12.850 7.436 1.00 1.00 H new ATOM 635 N ALA A 40 18.493 9.008 4.500 1.00 1.00 N ATOM 636 CA ALA A 40 19.827 9.378 5.025 1.00 1.00 C ATOM 637 C ALA A 40 20.947 9.342 3.944 1.00 1.00 C ATOM 638 O ALA A 40 21.729 10.283 3.832 1.00 1.00 O ATOM 639 CB ALA A 40 20.155 8.512 6.256 1.00 1.00 C ATOM 0 H ALA A 40 18.491 8.102 4.031 1.00 1.00 H new ATOM 0 HA ALA A 40 19.788 10.422 5.337 1.00 1.00 H new ATOM 0 HB1 ALA A 40 21.137 8.785 6.642 1.00 1.00 H new ATOM 0 HB2 ALA A 40 19.403 8.677 7.028 1.00 1.00 H new ATOM 0 HB3 ALA A 40 20.157 7.460 5.971 1.00 1.00 H new ATOM 645 N GLU A 41 20.947 8.320 3.079 1.00 1.00 N ATOM 646 CA GLU A 41 21.777 8.118 1.864 1.00 1.00 C ATOM 647 C GLU A 41 21.591 9.209 0.768 1.00 1.00 C ATOM 648 O GLU A 41 22.516 9.432 -0.017 1.00 1.00 O ATOM 649 CB GLU A 41 21.492 6.694 1.306 1.00 1.00 C ATOM 650 CG GLU A 41 22.593 6.112 0.395 1.00 1.00 C ATOM 651 CD GLU A 41 22.417 4.589 0.156 1.00 1.00 C ATOM 652 OE1 GLU A 41 22.723 3.791 1.078 1.00 1.00 O ATOM 653 OE2 GLU A 41 22.004 4.152 -0.940 1.00 1.00 O ATOM 0 H GLU A 41 20.310 7.535 3.216 1.00 1.00 H new ATOM 0 HA GLU A 41 22.822 8.214 2.160 1.00 1.00 H new ATOM 0 HB2 GLU A 41 21.342 6.016 2.146 1.00 1.00 H new ATOM 0 HB3 GLU A 41 20.557 6.721 0.747 1.00 1.00 H new ATOM 0 HG2 GLU A 41 22.581 6.631 -0.563 1.00 1.00 H new ATOM 0 HG3 GLU A 41 23.569 6.296 0.845 1.00 1.00 H new ATOM 660 N GLY A 42 20.470 9.955 0.777 1.00 1.00 N ATOM 661 CA GLY A 42 20.178 11.154 -0.047 1.00 1.00 C ATOM 662 C GLY A 42 19.289 10.938 -1.286 1.00 1.00 C ATOM 663 O GLY A 42 19.433 11.660 -2.277 1.00 1.00 O ATOM 0 H GLY A 42 19.693 9.726 1.397 1.00 1.00 H new ATOM 0 HA2 GLY A 42 19.699 11.897 0.590 1.00 1.00 H new ATOM 0 HA3 GLY A 42 21.126 11.580 -0.377 1.00 1.00 H new ATOM 667 N ILE A 43 18.367 9.970 -1.237 1.00 1.00 N ATOM 668 CA ILE A 43 17.525 9.426 -2.331 1.00 1.00 C ATOM 669 C ILE A 43 16.022 9.650 -2.052 1.00 1.00 C ATOM 670 O ILE A 43 15.574 9.694 -0.906 1.00 1.00 O ATOM 671 CB ILE A 43 17.865 7.916 -2.519 1.00 1.00 C ATOM 672 CG1 ILE A 43 19.368 7.640 -2.826 1.00 1.00 C ATOM 673 CG2 ILE A 43 16.980 7.244 -3.593 1.00 1.00 C ATOM 674 CD1 ILE A 43 19.810 6.219 -2.425 1.00 1.00 C ATOM 0 H ILE A 43 18.166 9.499 -0.355 1.00 1.00 H new ATOM 0 HA ILE A 43 17.743 9.957 -3.258 1.00 1.00 H new ATOM 0 HB ILE A 43 17.647 7.468 -1.550 1.00 1.00 H new ATOM 0 HG12 ILE A 43 19.549 7.784 -3.891 1.00 1.00 H new ATOM 0 HG13 ILE A 43 19.982 8.369 -2.297 1.00 1.00 H new ATOM 0 HG21 ILE A 43 17.256 6.194 -3.686 1.00 1.00 H new ATOM 0 HG22 ILE A 43 15.933 7.320 -3.301 1.00 1.00 H new ATOM 0 HG23 ILE A 43 17.127 7.744 -4.550 1.00 1.00 H new ATOM 0 HD11 ILE A 43 20.865 6.086 -2.663 1.00 1.00 H new ATOM 0 HD12 ILE A 43 19.659 6.079 -1.355 1.00 1.00 H new ATOM 0 HD13 ILE A 43 19.219 5.486 -2.974 1.00 1.00 H new ATOM 686 N THR A 44 15.222 9.766 -3.120 1.00 1.00 N ATOM 687 CA THR A 44 13.800 10.195 -3.088 1.00 1.00 C ATOM 688 C THR A 44 12.831 9.340 -3.934 1.00 1.00 C ATOM 689 O THR A 44 13.241 8.527 -4.764 1.00 1.00 O ATOM 690 CB THR A 44 13.733 11.690 -3.484 1.00 1.00 C ATOM 691 OG1 THR A 44 12.428 12.191 -3.299 1.00 1.00 O ATOM 692 CG2 THR A 44 14.217 11.944 -4.912 1.00 1.00 C ATOM 0 H THR A 44 15.548 9.560 -4.064 1.00 1.00 H new ATOM 0 HA THR A 44 13.446 10.042 -2.068 1.00 1.00 H new ATOM 0 HB THR A 44 14.415 12.226 -2.824 1.00 1.00 H new ATOM 0 HG1 THR A 44 11.925 12.111 -4.136 1.00 1.00 H new ATOM 0 HG21 THR A 44 14.148 13.009 -5.136 1.00 1.00 H new ATOM 0 HG22 THR A 44 15.253 11.619 -5.008 1.00 1.00 H new ATOM 0 HG23 THR A 44 13.595 11.385 -5.612 1.00 1.00 H new ATOM 700 N LYS A 45 11.521 9.569 -3.755 1.00 1.00 N ATOM 701 CA LYS A 45 10.371 9.046 -4.536 1.00 1.00 C ATOM 702 C LYS A 45 10.541 9.170 -6.066 1.00 1.00 C ATOM 703 O LYS A 45 10.242 8.221 -6.787 1.00 1.00 O ATOM 704 CB LYS A 45 9.082 9.694 -3.966 1.00 1.00 C ATOM 705 CG LYS A 45 7.827 9.798 -4.859 1.00 1.00 C ATOM 706 CD LYS A 45 7.818 11.064 -5.753 1.00 1.00 C ATOM 707 CE LYS A 45 6.420 11.623 -6.052 1.00 1.00 C ATOM 708 NZ LYS A 45 5.715 12.066 -4.820 1.00 1.00 N ATOM 0 H LYS A 45 11.204 10.175 -2.998 1.00 1.00 H new ATOM 0 HA LYS A 45 10.303 7.965 -4.412 1.00 1.00 H new ATOM 0 HB2 LYS A 45 8.802 9.135 -3.073 1.00 1.00 H new ATOM 0 HB3 LYS A 45 9.338 10.703 -3.643 1.00 1.00 H new ATOM 0 HG2 LYS A 45 7.765 8.913 -5.492 1.00 1.00 H new ATOM 0 HG3 LYS A 45 6.939 9.801 -4.227 1.00 1.00 H new ATOM 0 HD2 LYS A 45 8.409 11.840 -5.268 1.00 1.00 H new ATOM 0 HD3 LYS A 45 8.311 10.830 -6.696 1.00 1.00 H new ATOM 0 HE2 LYS A 45 6.507 12.463 -6.741 1.00 1.00 H new ATOM 0 HE3 LYS A 45 5.825 10.860 -6.554 1.00 1.00 H new ATOM 0 HZ1 LYS A 45 4.953 12.726 -5.075 1.00 1.00 H new ATOM 0 HZ2 LYS A 45 5.310 11.240 -4.336 1.00 1.00 H new ATOM 0 HZ3 LYS A 45 6.389 12.542 -4.187 1.00 1.00 H new ATOM 722 N GLU A 46 11.060 10.305 -6.546 1.00 1.00 N ATOM 723 CA GLU A 46 11.380 10.625 -7.958 1.00 1.00 C ATOM 724 C GLU A 46 12.430 9.657 -8.566 1.00 1.00 C ATOM 725 O GLU A 46 12.280 9.254 -9.721 1.00 1.00 O ATOM 726 CB GLU A 46 11.892 12.081 -8.068 1.00 1.00 C ATOM 727 CG GLU A 46 10.819 13.161 -7.815 1.00 1.00 C ATOM 728 CD GLU A 46 10.498 13.429 -6.325 1.00 1.00 C ATOM 729 OE1 GLU A 46 11.116 12.820 -5.416 1.00 1.00 O ATOM 730 OE2 GLU A 46 9.597 14.262 -6.079 1.00 1.00 O ATOM 0 H GLU A 46 11.286 11.082 -5.925 1.00 1.00 H new ATOM 0 HA GLU A 46 10.458 10.507 -8.528 1.00 1.00 H new ATOM 0 HB2 GLU A 46 12.705 12.221 -7.355 1.00 1.00 H new ATOM 0 HB3 GLU A 46 12.311 12.230 -9.063 1.00 1.00 H new ATOM 0 HG2 GLU A 46 11.149 14.093 -8.273 1.00 1.00 H new ATOM 0 HG3 GLU A 46 9.900 12.864 -8.321 1.00 1.00 H new ATOM 737 N ASP A 47 13.454 9.251 -7.790 1.00 1.00 N ATOM 738 CA ASP A 47 14.412 8.181 -8.130 1.00 1.00 C ATOM 739 C ASP A 47 13.731 6.793 -8.103 1.00 1.00 C ATOM 740 O ASP A 47 13.766 6.051 -9.087 1.00 1.00 O ATOM 741 CB ASP A 47 15.632 8.190 -7.171 1.00 1.00 C ATOM 742 CG ASP A 47 16.719 7.189 -7.605 1.00 1.00 C ATOM 743 OD1 ASP A 47 17.059 7.102 -8.812 1.00 1.00 O ATOM 744 OD2 ASP A 47 17.225 6.422 -6.761 1.00 1.00 O ATOM 0 H ASP A 47 13.643 9.672 -6.880 1.00 1.00 H new ATOM 0 HA ASP A 47 14.767 8.376 -9.142 1.00 1.00 H new ATOM 0 HB2 ASP A 47 16.057 9.193 -7.136 1.00 1.00 H new ATOM 0 HB3 ASP A 47 15.300 7.949 -6.161 1.00 1.00 H new ATOM 749 N LEU A 48 13.100 6.446 -6.967 1.00 1.00 N ATOM 750 CA LEU A 48 12.479 5.144 -6.679 1.00 1.00 C ATOM 751 C LEU A 48 11.464 4.685 -7.749 1.00 1.00 C ATOM 752 O LEU A 48 11.515 3.517 -8.133 1.00 1.00 O ATOM 753 CB LEU A 48 11.908 5.149 -5.239 1.00 1.00 C ATOM 754 CG LEU A 48 13.006 5.117 -4.139 1.00 1.00 C ATOM 755 CD1 LEU A 48 12.466 5.544 -2.765 1.00 1.00 C ATOM 756 CD2 LEU A 48 13.623 3.716 -3.996 1.00 1.00 C ATOM 0 H LEU A 48 13.006 7.098 -6.189 1.00 1.00 H new ATOM 0 HA LEU A 48 13.257 4.382 -6.732 1.00 1.00 H new ATOM 0 HB2 LEU A 48 11.294 6.039 -5.103 1.00 1.00 H new ATOM 0 HB3 LEU A 48 11.253 4.287 -5.113 1.00 1.00 H new ATOM 0 HG LEU A 48 13.767 5.827 -4.463 1.00 1.00 H new ATOM 0 HD11 LEU A 48 13.270 5.505 -2.030 1.00 1.00 H new ATOM 0 HD12 LEU A 48 12.079 6.561 -2.826 1.00 1.00 H new ATOM 0 HD13 LEU A 48 11.666 4.869 -2.463 1.00 1.00 H new ATOM 0 HD21 LEU A 48 14.386 3.732 -3.218 1.00 1.00 H new ATOM 0 HD22 LEU A 48 12.845 3.002 -3.726 1.00 1.00 H new ATOM 0 HD23 LEU A 48 14.076 3.419 -4.942 1.00 1.00 H new ATOM 768 N GLN A 49 10.621 5.579 -8.301 1.00 1.00 N ATOM 769 CA GLN A 49 9.734 5.278 -9.451 1.00 1.00 C ATOM 770 C GLN A 49 10.485 4.824 -10.730 1.00 1.00 C ATOM 771 O GLN A 49 10.168 3.788 -11.321 1.00 1.00 O ATOM 772 CB GLN A 49 8.746 6.434 -9.738 1.00 1.00 C ATOM 773 CG GLN A 49 9.301 7.816 -10.114 1.00 1.00 C ATOM 774 CD GLN A 49 8.181 8.752 -10.564 1.00 1.00 C ATOM 775 OE1 GLN A 49 8.081 9.123 -11.724 1.00 1.00 O ATOM 776 NE2 GLN A 49 7.235 9.102 -9.725 1.00 1.00 N ATOM 0 H GLN A 49 10.533 6.537 -7.962 1.00 1.00 H new ATOM 0 HA GLN A 49 9.149 4.412 -9.142 1.00 1.00 H new ATOM 0 HB2 GLN A 49 8.090 6.112 -10.547 1.00 1.00 H new ATOM 0 HB3 GLN A 49 8.122 6.560 -8.853 1.00 1.00 H new ATOM 0 HG2 GLN A 49 9.819 8.249 -9.258 1.00 1.00 H new ATOM 0 HG3 GLN A 49 10.036 7.712 -10.913 1.00 1.00 H new ATOM 0 HE21 GLN A 49 7.285 8.810 -8.749 1.00 1.00 H new ATOM 0 HE22 GLN A 49 6.449 9.666 -10.049 1.00 1.00 H new ATOM 785 N GLN A 50 11.534 5.553 -11.132 1.00 1.00 N ATOM 786 CA GLN A 50 12.434 5.231 -12.263 1.00 1.00 C ATOM 787 C GLN A 50 13.235 3.928 -12.012 1.00 1.00 C ATOM 788 O GLN A 50 13.242 3.027 -12.854 1.00 1.00 O ATOM 789 CB GLN A 50 13.377 6.420 -12.538 1.00 1.00 C ATOM 790 CG GLN A 50 12.644 7.713 -12.933 1.00 1.00 C ATOM 791 CD GLN A 50 13.623 8.873 -13.055 1.00 1.00 C ATOM 792 OE1 GLN A 50 14.453 8.943 -13.948 1.00 1.00 O ATOM 793 NE2 GLN A 50 13.593 9.833 -12.169 1.00 1.00 N ATOM 0 H GLN A 50 11.795 6.420 -10.663 1.00 1.00 H new ATOM 0 HA GLN A 50 11.819 5.056 -13.146 1.00 1.00 H new ATOM 0 HB2 GLN A 50 13.976 6.610 -11.648 1.00 1.00 H new ATOM 0 HB3 GLN A 50 14.068 6.147 -13.335 1.00 1.00 H new ATOM 0 HG2 GLN A 50 12.125 7.568 -13.881 1.00 1.00 H new ATOM 0 HG3 GLN A 50 11.885 7.949 -12.187 1.00 1.00 H new ATOM 0 HE21 GLN A 50 12.912 9.805 -11.410 1.00 1.00 H new ATOM 0 HE22 GLN A 50 14.250 10.610 -12.236 1.00 1.00 H new ATOM 802 N LYS A 51 13.847 3.801 -10.824 1.00 1.00 N ATOM 803 CA LYS A 51 14.582 2.629 -10.289 1.00 1.00 C ATOM 804 C LYS A 51 13.740 1.332 -10.242 1.00 1.00 C ATOM 805 O LYS A 51 14.254 0.246 -10.517 1.00 1.00 O ATOM 806 CB LYS A 51 15.155 3.019 -8.910 1.00 1.00 C ATOM 807 CG LYS A 51 16.260 2.074 -8.382 1.00 1.00 C ATOM 808 CD LYS A 51 17.457 2.850 -7.803 1.00 1.00 C ATOM 809 CE LYS A 51 18.242 3.554 -8.923 1.00 1.00 C ATOM 810 NZ LYS A 51 18.776 4.872 -8.516 1.00 1.00 N ATOM 0 H LYS A 51 13.844 4.571 -10.156 1.00 1.00 H new ATOM 0 HA LYS A 51 15.394 2.381 -10.973 1.00 1.00 H new ATOM 0 HB2 LYS A 51 15.558 4.030 -8.971 1.00 1.00 H new ATOM 0 HB3 LYS A 51 14.340 3.044 -8.186 1.00 1.00 H new ATOM 0 HG2 LYS A 51 15.843 1.424 -7.613 1.00 1.00 H new ATOM 0 HG3 LYS A 51 16.603 1.430 -9.192 1.00 1.00 H new ATOM 0 HD2 LYS A 51 17.104 3.587 -7.081 1.00 1.00 H new ATOM 0 HD3 LYS A 51 18.114 2.166 -7.266 1.00 1.00 H new ATOM 0 HE2 LYS A 51 19.068 2.915 -9.237 1.00 1.00 H new ATOM 0 HE3 LYS A 51 17.592 3.683 -9.788 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 18.370 5.613 -9.122 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 18.523 5.058 -7.525 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 19.811 4.873 -8.615 1.00 1.00 H new ATOM 824 N ALA A 52 12.449 1.457 -9.913 1.00 1.00 N ATOM 825 CA ALA A 52 11.394 0.435 -10.006 1.00 1.00 C ATOM 826 C ALA A 52 10.838 0.188 -11.428 1.00 1.00 C ATOM 827 O ALA A 52 10.254 -0.869 -11.671 1.00 1.00 O ATOM 828 CB ALA A 52 10.222 0.907 -9.129 1.00 1.00 C ATOM 0 H ALA A 52 12.086 2.338 -9.548 1.00 1.00 H new ATOM 0 HA ALA A 52 11.846 -0.504 -9.687 1.00 1.00 H new ATOM 0 HB1 ALA A 52 9.417 0.173 -9.172 1.00 1.00 H new ATOM 0 HB2 ALA A 52 10.560 1.016 -8.098 1.00 1.00 H new ATOM 0 HB3 ALA A 52 9.858 1.867 -9.495 1.00 1.00 H new ATOM 834 N GLY A 53 10.957 1.153 -12.353 1.00 1.00 N ATOM 835 CA GLY A 53 10.312 1.152 -13.673 1.00 1.00 C ATOM 836 C GLY A 53 8.782 1.335 -13.633 1.00 1.00 C ATOM 837 O GLY A 53 8.100 0.982 -14.596 1.00 1.00 O ATOM 0 H GLY A 53 11.526 1.985 -12.196 1.00 1.00 H new ATOM 0 HA2 GLY A 53 10.746 1.949 -14.277 1.00 1.00 H new ATOM 0 HA3 GLY A 53 10.540 0.212 -14.175 1.00 1.00 H new ATOM 841 N LYS A 54 8.223 1.838 -12.518 1.00 1.00 N ATOM 842 CA LYS A 54 6.799 1.956 -12.101 1.00 1.00 C ATOM 843 C LYS A 54 6.527 3.368 -11.524 1.00 1.00 C ATOM 844 O LYS A 54 7.253 3.750 -10.604 1.00 1.00 O ATOM 845 CB LYS A 54 6.512 0.865 -11.021 1.00 1.00 C ATOM 846 CG LYS A 54 5.277 1.041 -10.096 1.00 1.00 C ATOM 847 CD LYS A 54 3.922 0.602 -10.678 1.00 1.00 C ATOM 848 CE LYS A 54 2.801 0.674 -9.626 1.00 1.00 C ATOM 849 NZ LYS A 54 2.254 2.041 -9.419 1.00 1.00 N ATOM 0 H LYS A 54 8.828 2.221 -11.792 1.00 1.00 H new ATOM 0 HA LYS A 54 6.144 1.810 -12.960 1.00 1.00 H new ATOM 0 HB2 LYS A 54 6.407 -0.090 -11.535 1.00 1.00 H new ATOM 0 HB3 LYS A 54 7.394 0.789 -10.385 1.00 1.00 H new ATOM 0 HG2 LYS A 54 5.454 0.479 -9.179 1.00 1.00 H new ATOM 0 HG3 LYS A 54 5.205 2.092 -9.817 1.00 1.00 H new ATOM 0 HD2 LYS A 54 3.667 1.238 -11.526 1.00 1.00 H new ATOM 0 HD3 LYS A 54 4.001 -0.417 -11.056 1.00 1.00 H new ATOM 0 HE2 LYS A 54 1.990 0.011 -9.928 1.00 1.00 H new ATOM 0 HE3 LYS A 54 3.183 0.299 -8.677 1.00 1.00 H new ATOM 0 HZ1 LYS A 54 1.830 2.106 -8.471 1.00 1.00 H new ATOM 0 HZ2 LYS A 54 3.021 2.738 -9.504 1.00 1.00 H new ATOM 0 HZ3 LYS A 54 1.528 2.237 -10.137 1.00 1.00 H new ATOM 863 N PRO A 55 5.484 4.109 -11.969 1.00 1.00 N ATOM 864 CA PRO A 55 5.083 5.372 -11.332 1.00 1.00 C ATOM 865 C PRO A 55 4.703 5.161 -9.847 1.00 1.00 C ATOM 866 O PRO A 55 3.825 4.350 -9.539 1.00 1.00 O ATOM 867 CB PRO A 55 3.921 5.911 -12.184 1.00 1.00 C ATOM 868 CG PRO A 55 3.318 4.657 -12.823 1.00 1.00 C ATOM 869 CD PRO A 55 4.533 3.750 -13.019 1.00 1.00 C ATOM 0 HA PRO A 55 5.899 6.094 -11.301 1.00 1.00 H new ATOM 0 HB2 PRO A 55 3.189 6.439 -11.573 1.00 1.00 H new ATOM 0 HB3 PRO A 55 4.272 6.614 -12.939 1.00 1.00 H new ATOM 0 HG2 PRO A 55 2.570 4.196 -12.178 1.00 1.00 H new ATOM 0 HG3 PRO A 55 2.827 4.883 -13.769 1.00 1.00 H new ATOM 0 HD2 PRO A 55 4.251 2.700 -12.946 1.00 1.00 H new ATOM 0 HD3 PRO A 55 4.971 3.894 -14.007 1.00 1.00 H new ATOM 877 N VAL A 56 5.405 5.845 -8.931 1.00 1.00 N ATOM 878 CA VAL A 56 5.109 5.935 -7.477 1.00 1.00 C ATOM 879 C VAL A 56 5.001 7.387 -6.978 1.00 1.00 C ATOM 880 O VAL A 56 5.767 8.264 -7.389 1.00 1.00 O ATOM 881 CB VAL A 56 6.091 5.148 -6.563 1.00 1.00 C ATOM 882 CG1 VAL A 56 6.186 3.655 -6.924 1.00 1.00 C ATOM 883 CG2 VAL A 56 7.533 5.688 -6.464 1.00 1.00 C ATOM 0 H VAL A 56 6.236 6.379 -9.187 1.00 1.00 H new ATOM 0 HA VAL A 56 4.135 5.452 -7.392 1.00 1.00 H new ATOM 0 HB VAL A 56 5.623 5.295 -5.590 1.00 1.00 H new ATOM 0 HG11 VAL A 56 6.887 3.162 -6.250 1.00 1.00 H new ATOM 0 HG12 VAL A 56 5.203 3.194 -6.827 1.00 1.00 H new ATOM 0 HG13 VAL A 56 6.536 3.551 -7.951 1.00 1.00 H new ATOM 0 HG21 VAL A 56 8.115 5.051 -5.798 1.00 1.00 H new ATOM 0 HG22 VAL A 56 7.989 5.690 -7.454 1.00 1.00 H new ATOM 0 HG23 VAL A 56 7.515 6.704 -6.071 1.00 1.00 H new ATOM 893 N GLU A 57 4.105 7.609 -6.015 1.00 1.00 N ATOM 894 CA GLU A 57 3.822 8.899 -5.353 1.00 1.00 C ATOM 895 C GLU A 57 4.080 8.897 -3.825 1.00 1.00 C ATOM 896 O GLU A 57 4.530 9.907 -3.273 1.00 1.00 O ATOM 897 CB GLU A 57 2.369 9.320 -5.680 1.00 1.00 C ATOM 898 CG GLU A 57 2.027 10.777 -5.306 1.00 1.00 C ATOM 899 CD GLU A 57 2.908 11.830 -6.008 1.00 1.00 C ATOM 900 OE1 GLU A 57 3.446 11.572 -7.108 1.00 1.00 O ATOM 901 OE2 GLU A 57 3.193 12.891 -5.414 1.00 1.00 O ATOM 0 H GLU A 57 3.521 6.856 -5.650 1.00 1.00 H new ATOM 0 HA GLU A 57 4.527 9.630 -5.749 1.00 1.00 H new ATOM 0 HB2 GLU A 57 2.195 9.182 -6.747 1.00 1.00 H new ATOM 0 HB3 GLU A 57 1.684 8.653 -5.156 1.00 1.00 H new ATOM 0 HG2 GLU A 57 0.983 10.969 -5.554 1.00 1.00 H new ATOM 0 HG3 GLU A 57 2.126 10.897 -4.227 1.00 1.00 H new ATOM 908 N THR A 58 3.849 7.758 -3.155 1.00 1.00 N ATOM 909 CA THR A 58 3.822 7.537 -1.685 1.00 1.00 C ATOM 910 C THR A 58 4.540 6.250 -1.220 1.00 1.00 C ATOM 911 O THR A 58 5.066 5.472 -2.017 1.00 1.00 O ATOM 912 CB THR A 58 2.354 7.462 -1.182 1.00 1.00 C ATOM 913 OG1 THR A 58 1.702 6.396 -1.834 1.00 1.00 O ATOM 914 CG2 THR A 58 1.534 8.736 -1.389 1.00 1.00 C ATOM 0 H THR A 58 3.660 6.892 -3.660 1.00 1.00 H new ATOM 0 HA THR A 58 4.358 8.387 -1.263 1.00 1.00 H new ATOM 0 HB THR A 58 2.417 7.316 -0.104 1.00 1.00 H new ATOM 0 HG1 THR A 58 1.181 5.883 -1.182 1.00 1.00 H new ATOM 0 HG21 THR A 58 0.525 8.585 -1.006 1.00 1.00 H new ATOM 0 HG22 THR A 58 2.004 9.562 -0.856 1.00 1.00 H new ATOM 0 HG23 THR A 58 1.488 8.970 -2.453 1.00 1.00 H new ATOM 922 N VAL A 59 4.560 6.001 0.102 1.00 1.00 N ATOM 923 CA VAL A 59 4.981 4.711 0.721 1.00 1.00 C ATOM 924 C VAL A 59 3.817 3.679 0.694 1.00 1.00 C ATOM 925 O VAL A 59 2.661 4.087 0.530 1.00 1.00 O ATOM 926 CB VAL A 59 5.534 4.857 2.173 1.00 1.00 C ATOM 927 CG1 VAL A 59 7.069 4.945 2.160 1.00 1.00 C ATOM 928 CG2 VAL A 59 4.934 6.018 2.976 1.00 1.00 C ATOM 0 H VAL A 59 4.280 6.699 0.792 1.00 1.00 H new ATOM 0 HA VAL A 59 5.809 4.350 0.111 1.00 1.00 H new ATOM 0 HB VAL A 59 5.217 3.953 2.694 1.00 1.00 H new ATOM 0 HG11 VAL A 59 7.436 5.046 3.181 1.00 1.00 H new ATOM 0 HG12 VAL A 59 7.482 4.040 1.714 1.00 1.00 H new ATOM 0 HG13 VAL A 59 7.379 5.811 1.575 1.00 1.00 H new ATOM 0 HG21 VAL A 59 5.378 6.040 3.971 1.00 1.00 H new ATOM 0 HG22 VAL A 59 5.141 6.959 2.465 1.00 1.00 H new ATOM 0 HG23 VAL A 59 3.856 5.881 3.063 1.00 1.00 H new ATOM 938 N PRO A 60 4.097 2.360 0.833 1.00 1.00 N ATOM 939 CA PRO A 60 5.427 1.739 1.014 1.00 1.00 C ATOM 940 C PRO A 60 6.330 1.747 -0.245 1.00 1.00 C ATOM 941 O PRO A 60 5.882 2.041 -1.352 1.00 1.00 O ATOM 942 CB PRO A 60 5.122 0.324 1.506 1.00 1.00 C ATOM 943 CG PRO A 60 3.800 -0.017 0.813 1.00 1.00 C ATOM 944 CD PRO A 60 3.075 1.321 0.724 1.00 1.00 C ATOM 0 HA PRO A 60 6.022 2.316 1.721 1.00 1.00 H new ATOM 0 HB2 PRO A 60 5.911 -0.376 1.231 1.00 1.00 H new ATOM 0 HB3 PRO A 60 5.027 0.288 2.591 1.00 1.00 H new ATOM 0 HG2 PRO A 60 3.966 -0.447 -0.175 1.00 1.00 H new ATOM 0 HG3 PRO A 60 3.225 -0.745 1.385 1.00 1.00 H new ATOM 0 HD2 PRO A 60 2.535 1.407 -0.219 1.00 1.00 H new ATOM 0 HD3 PRO A 60 2.339 1.416 1.523 1.00 1.00 H new ATOM 952 N GLN A 61 7.623 1.450 -0.051 1.00 1.00 N ATOM 953 CA GLN A 61 8.671 1.334 -1.082 1.00 1.00 C ATOM 954 C GLN A 61 9.610 0.139 -0.805 1.00 1.00 C ATOM 955 O GLN A 61 10.661 0.254 -0.167 1.00 1.00 O ATOM 956 CB GLN A 61 9.435 2.672 -1.264 1.00 1.00 C ATOM 957 CG GLN A 61 8.616 3.795 -1.942 1.00 1.00 C ATOM 958 CD GLN A 61 7.977 3.390 -3.277 1.00 1.00 C ATOM 959 OE1 GLN A 61 8.460 2.558 -4.033 1.00 1.00 O ATOM 960 NE2 GLN A 61 6.840 3.920 -3.631 1.00 1.00 N ATOM 0 H GLN A 61 7.990 1.273 0.884 1.00 1.00 H new ATOM 0 HA GLN A 61 8.184 1.124 -2.034 1.00 1.00 H new ATOM 0 HB2 GLN A 61 9.766 3.022 -0.286 1.00 1.00 H new ATOM 0 HB3 GLN A 61 10.331 2.486 -1.856 1.00 1.00 H new ATOM 0 HG2 GLN A 61 7.830 4.119 -1.259 1.00 1.00 H new ATOM 0 HG3 GLN A 61 9.267 4.653 -2.109 1.00 1.00 H new ATOM 0 HE21 GLN A 61 6.396 4.619 -3.035 1.00 1.00 H new ATOM 0 HE22 GLN A 61 6.395 3.636 -4.504 1.00 1.00 H new ATOM 969 N ILE A 62 9.181 -1.035 -1.269 1.00 1.00 N ATOM 970 CA ILE A 62 9.864 -2.345 -1.199 1.00 1.00 C ATOM 971 C ILE A 62 10.155 -2.960 -2.590 1.00 1.00 C ATOM 972 O ILE A 62 9.493 -2.683 -3.599 1.00 1.00 O ATOM 973 CB ILE A 62 9.073 -3.272 -0.225 1.00 1.00 C ATOM 974 CG1 ILE A 62 9.323 -2.757 1.219 1.00 1.00 C ATOM 975 CG2 ILE A 62 9.415 -4.774 -0.337 1.00 1.00 C ATOM 976 CD1 ILE A 62 8.490 -3.377 2.338 1.00 1.00 C ATOM 0 H ILE A 62 8.280 -1.110 -1.741 1.00 1.00 H new ATOM 0 HA ILE A 62 10.864 -2.210 -0.787 1.00 1.00 H new ATOM 0 HB ILE A 62 8.020 -3.217 -0.501 1.00 1.00 H new ATOM 0 HG12 ILE A 62 10.375 -2.914 1.455 1.00 1.00 H new ATOM 0 HG13 ILE A 62 9.151 -1.681 1.228 1.00 1.00 H new ATOM 0 HG21 ILE A 62 8.816 -5.338 0.378 1.00 1.00 H new ATOM 0 HG22 ILE A 62 9.198 -5.122 -1.347 1.00 1.00 H new ATOM 0 HG23 ILE A 62 10.473 -4.923 -0.122 1.00 1.00 H new ATOM 0 HD11 ILE A 62 8.767 -2.926 3.291 1.00 1.00 H new ATOM 0 HD12 ILE A 62 7.432 -3.198 2.146 1.00 1.00 H new ATOM 0 HD13 ILE A 62 8.675 -4.450 2.377 1.00 1.00 H new ATOM 988 N PHE A 63 11.200 -3.790 -2.643 1.00 1.00 N ATOM 989 CA PHE A 63 11.598 -4.639 -3.774 1.00 1.00 C ATOM 990 C PHE A 63 11.789 -6.098 -3.290 1.00 1.00 C ATOM 991 O PHE A 63 12.692 -6.372 -2.496 1.00 1.00 O ATOM 992 CB PHE A 63 12.880 -4.102 -4.459 1.00 1.00 C ATOM 993 CG PHE A 63 12.778 -2.810 -5.277 1.00 1.00 C ATOM 994 CD1 PHE A 63 12.447 -1.583 -4.655 1.00 1.00 C ATOM 995 CD2 PHE A 63 13.127 -2.801 -6.652 1.00 1.00 C ATOM 996 CE1 PHE A 63 12.470 -0.372 -5.376 1.00 1.00 C ATOM 997 CE2 PHE A 63 13.132 -1.591 -7.382 1.00 1.00 C ATOM 998 CZ PHE A 63 12.819 -0.372 -6.740 1.00 1.00 C ATOM 0 H PHE A 63 11.831 -3.895 -1.849 1.00 1.00 H new ATOM 0 HA PHE A 63 10.805 -4.619 -4.521 1.00 1.00 H new ATOM 0 HB2 PHE A 63 13.631 -3.947 -3.685 1.00 1.00 H new ATOM 0 HB3 PHE A 63 13.258 -4.884 -5.118 1.00 1.00 H new ATOM 0 HD1 PHE A 63 12.172 -1.574 -3.611 1.00 1.00 H new ATOM 0 HD2 PHE A 63 13.391 -3.725 -7.144 1.00 1.00 H new ATOM 0 HE1 PHE A 63 12.220 0.555 -4.882 1.00 1.00 H new ATOM 0 HE2 PHE A 63 13.376 -1.598 -8.434 1.00 1.00 H new ATOM 0 HZ PHE A 63 12.847 0.555 -7.293 1.00 1.00 H new ATOM 1008 N VAL A 64 10.947 -7.036 -3.741 1.00 1.00 N ATOM 1009 CA VAL A 64 11.080 -8.504 -3.510 1.00 1.00 C ATOM 1010 C VAL A 64 11.741 -9.170 -4.733 1.00 1.00 C ATOM 1011 O VAL A 64 11.586 -8.715 -5.860 1.00 1.00 O ATOM 1012 CB VAL A 64 9.726 -9.188 -3.196 1.00 1.00 C ATOM 1013 CG1 VAL A 64 9.887 -10.670 -2.802 1.00 1.00 C ATOM 1014 CG2 VAL A 64 8.966 -8.500 -2.049 1.00 1.00 C ATOM 0 H VAL A 64 10.124 -6.800 -4.296 1.00 1.00 H new ATOM 0 HA VAL A 64 11.710 -8.634 -2.630 1.00 1.00 H new ATOM 0 HB VAL A 64 9.162 -9.104 -4.125 1.00 1.00 H new ATOM 0 HG11 VAL A 64 8.907 -11.099 -2.593 1.00 1.00 H new ATOM 0 HG12 VAL A 64 10.355 -11.216 -3.621 1.00 1.00 H new ATOM 0 HG13 VAL A 64 10.513 -10.744 -1.913 1.00 1.00 H new ATOM 0 HG21 VAL A 64 8.025 -9.021 -1.872 1.00 1.00 H new ATOM 0 HG22 VAL A 64 9.572 -8.527 -1.143 1.00 1.00 H new ATOM 0 HG23 VAL A 64 8.762 -7.464 -2.318 1.00 1.00 H new ATOM 1024 N ASP A 65 12.538 -10.222 -4.525 1.00 1.00 N ATOM 1025 CA ASP A 65 13.319 -10.999 -5.519 1.00 1.00 C ATOM 1026 C ASP A 65 14.272 -10.203 -6.468 1.00 1.00 C ATOM 1027 O ASP A 65 14.902 -10.798 -7.347 1.00 1.00 O ATOM 1028 CB ASP A 65 12.396 -12.035 -6.211 1.00 1.00 C ATOM 1029 CG ASP A 65 11.431 -11.490 -7.287 1.00 1.00 C ATOM 1030 OD1 ASP A 65 11.907 -11.178 -8.405 1.00 1.00 O ATOM 1031 OD2 ASP A 65 10.195 -11.521 -7.079 1.00 1.00 O ATOM 0 H ASP A 65 12.671 -10.590 -3.583 1.00 1.00 H new ATOM 0 HA ASP A 65 14.077 -11.539 -4.951 1.00 1.00 H new ATOM 0 HB2 ASP A 65 13.024 -12.797 -6.671 1.00 1.00 H new ATOM 0 HB3 ASP A 65 11.804 -12.531 -5.442 1.00 1.00 H new ATOM 1036 N GLN A 66 14.432 -8.884 -6.238 1.00 1.00 N ATOM 1037 CA GLN A 66 15.110 -7.795 -6.991 1.00 1.00 C ATOM 1038 C GLN A 66 14.181 -6.946 -7.922 1.00 1.00 C ATOM 1039 O GLN A 66 14.678 -6.110 -8.679 1.00 1.00 O ATOM 1040 CB GLN A 66 16.390 -8.270 -7.726 1.00 1.00 C ATOM 1041 CG GLN A 66 17.482 -8.968 -6.885 1.00 1.00 C ATOM 1042 CD GLN A 66 18.081 -8.136 -5.751 1.00 1.00 C ATOM 1043 OE1 GLN A 66 18.351 -6.955 -5.886 1.00 1.00 O ATOM 1044 NE2 GLN A 66 18.355 -8.707 -4.603 1.00 1.00 N ATOM 0 H GLN A 66 14.026 -8.494 -5.387 1.00 1.00 H new ATOM 0 HA GLN A 66 15.422 -7.104 -6.208 1.00 1.00 H new ATOM 0 HB2 GLN A 66 16.088 -8.955 -8.518 1.00 1.00 H new ATOM 0 HB3 GLN A 66 16.841 -7.403 -8.209 1.00 1.00 H new ATOM 0 HG2 GLN A 66 17.060 -9.878 -6.459 1.00 1.00 H new ATOM 0 HG3 GLN A 66 18.288 -9.273 -7.552 1.00 1.00 H new ATOM 0 HE21 GLN A 66 18.141 -9.694 -4.460 1.00 1.00 H new ATOM 0 HE22 GLN A 66 18.783 -8.164 -3.853 1.00 1.00 H new ATOM 1053 N GLN A 67 12.847 -7.095 -7.861 1.00 1.00 N ATOM 1054 CA GLN A 67 11.808 -6.261 -8.524 1.00 1.00 C ATOM 1055 C GLN A 67 10.963 -5.438 -7.514 1.00 1.00 C ATOM 1056 O GLN A 67 10.697 -5.896 -6.405 1.00 1.00 O ATOM 1057 CB GLN A 67 10.886 -7.138 -9.412 1.00 1.00 C ATOM 1058 CG GLN A 67 10.081 -8.204 -8.629 1.00 1.00 C ATOM 1059 CD GLN A 67 8.987 -8.926 -9.406 1.00 1.00 C ATOM 1060 OE1 GLN A 67 8.396 -8.434 -10.352 1.00 1.00 O ATOM 1061 NE2 GLN A 67 8.592 -10.105 -9.002 1.00 1.00 N ATOM 0 H GLN A 67 12.430 -7.848 -7.314 1.00 1.00 H new ATOM 0 HA GLN A 67 12.337 -5.545 -9.153 1.00 1.00 H new ATOM 0 HB2 GLN A 67 10.189 -6.490 -9.944 1.00 1.00 H new ATOM 0 HB3 GLN A 67 11.494 -7.639 -10.165 1.00 1.00 H new ATOM 0 HG2 GLN A 67 10.779 -8.949 -8.248 1.00 1.00 H new ATOM 0 HG3 GLN A 67 9.626 -7.722 -7.764 1.00 1.00 H new ATOM 0 HE21 GLN A 67 9.057 -10.556 -8.214 1.00 1.00 H new ATOM 0 HE22 GLN A 67 7.819 -10.574 -9.475 1.00 1.00 H new ATOM 1070 N HIS A 68 10.471 -4.245 -7.888 1.00 1.00 N ATOM 1071 CA HIS A 68 9.546 -3.416 -7.072 1.00 1.00 C ATOM 1072 C HIS A 68 8.202 -4.121 -6.801 1.00 1.00 C ATOM 1073 O HIS A 68 7.384 -4.262 -7.712 1.00 1.00 O ATOM 1074 CB HIS A 68 9.334 -2.026 -7.706 1.00 1.00 C ATOM 1075 CG HIS A 68 8.333 -1.144 -6.964 1.00 1.00 C ATOM 1076 ND1 HIS A 68 6.959 -1.169 -7.130 1.00 1.00 N ATOM 1077 CD2 HIS A 68 8.613 -0.202 -6.008 1.00 1.00 C ATOM 1078 CE1 HIS A 68 6.413 -0.284 -6.271 1.00 1.00 C ATOM 1079 NE2 HIS A 68 7.403 0.316 -5.580 1.00 1.00 N ATOM 0 H HIS A 68 10.705 -3.815 -8.783 1.00 1.00 H new ATOM 0 HA HIS A 68 10.024 -3.275 -6.103 1.00 1.00 H new ATOM 0 HB2 HIS A 68 10.293 -1.510 -7.750 1.00 1.00 H new ATOM 0 HB3 HIS A 68 8.994 -2.156 -8.734 1.00 1.00 H new ATOM 0 HD2 HIS A 68 9.593 0.082 -5.655 1.00 1.00 H new ATOM 0 HE1 HIS A 68 5.357 -0.088 -6.156 1.00 1.00 H new ATOM 0 HE2 HIS A 68 7.281 1.031 -4.863 1.00 1.00 H new ATOM 1088 N ILE A 69 7.969 -4.482 -5.540 1.00 1.00 N ATOM 1089 CA ILE A 69 6.716 -4.995 -4.951 1.00 1.00 C ATOM 1090 C ILE A 69 6.386 -4.037 -3.795 1.00 1.00 C ATOM 1091 O ILE A 69 7.070 -4.064 -2.772 1.00 1.00 O ATOM 1092 CB ILE A 69 6.849 -6.462 -4.462 1.00 1.00 C ATOM 1093 CG1 ILE A 69 7.289 -7.497 -5.534 1.00 1.00 C ATOM 1094 CG2 ILE A 69 5.566 -6.910 -3.732 1.00 1.00 C ATOM 1095 CD1 ILE A 69 6.445 -7.646 -6.809 1.00 1.00 C ATOM 0 H ILE A 69 8.708 -4.421 -4.840 1.00 1.00 H new ATOM 0 HA ILE A 69 5.917 -5.023 -5.692 1.00 1.00 H new ATOM 0 HB ILE A 69 7.684 -6.447 -3.762 1.00 1.00 H new ATOM 0 HG12 ILE A 69 8.305 -7.245 -5.838 1.00 1.00 H new ATOM 0 HG13 ILE A 69 7.333 -8.473 -5.052 1.00 1.00 H new ATOM 0 HG21 ILE A 69 5.679 -7.941 -3.397 1.00 1.00 H new ATOM 0 HG22 ILE A 69 5.394 -6.265 -2.870 1.00 1.00 H new ATOM 0 HG23 ILE A 69 4.717 -6.841 -4.412 1.00 1.00 H new ATOM 0 HD11 ILE A 69 6.887 -8.408 -7.451 1.00 1.00 H new ATOM 0 HD12 ILE A 69 5.431 -7.942 -6.541 1.00 1.00 H new ATOM 0 HD13 ILE A 69 6.417 -6.695 -7.340 1.00 1.00 H new ATOM 1107 N GLY A 70 5.394 -3.156 -3.988 1.00 1.00 N ATOM 1108 CA GLY A 70 4.996 -2.013 -3.142 1.00 1.00 C ATOM 1109 C GLY A 70 5.513 -2.011 -1.699 1.00 1.00 C ATOM 1110 O GLY A 70 6.276 -1.133 -1.291 1.00 1.00 O ATOM 0 H GLY A 70 4.795 -3.228 -4.811 1.00 1.00 H new ATOM 0 HA2 GLY A 70 5.335 -1.097 -3.626 1.00 1.00 H new ATOM 0 HA3 GLY A 70 3.907 -1.974 -3.113 1.00 1.00 H new ATOM 1114 N GLY A 71 5.067 -3.001 -0.925 1.00 1.00 N ATOM 1115 CA GLY A 71 5.372 -3.237 0.493 1.00 1.00 C ATOM 1116 C GLY A 71 4.105 -3.524 1.293 1.00 1.00 C ATOM 1117 O GLY A 71 3.222 -4.180 0.771 1.00 1.00 O ATOM 0 H GLY A 71 4.437 -3.712 -1.296 1.00 1.00 H new ATOM 0 HA2 GLY A 71 6.060 -4.077 0.584 1.00 1.00 H new ATOM 0 HA3 GLY A 71 5.877 -2.365 0.908 1.00 1.00 H new ATOM 1121 N TYR A 72 3.949 -2.966 2.496 1.00 1.00 N ATOM 1122 CA TYR A 72 2.804 -3.141 3.431 1.00 1.00 C ATOM 1123 C TYR A 72 1.429 -3.423 2.748 1.00 1.00 C ATOM 1124 O TYR A 72 0.833 -4.459 3.026 1.00 1.00 O ATOM 1125 CB TYR A 72 2.824 -1.894 4.355 1.00 1.00 C ATOM 1126 CG TYR A 72 1.639 -1.508 5.232 1.00 1.00 C ATOM 1127 CD1 TYR A 72 0.626 -2.428 5.603 1.00 1.00 C ATOM 1128 CD2 TYR A 72 1.566 -0.171 5.694 1.00 1.00 C ATOM 1129 CE1 TYR A 72 -0.480 -1.988 6.355 1.00 1.00 C ATOM 1130 CE2 TYR A 72 0.479 0.256 6.494 1.00 1.00 C ATOM 1131 CZ TYR A 72 -0.555 -0.650 6.814 1.00 1.00 C ATOM 1132 OH TYR A 72 -1.617 -0.247 7.565 1.00 1.00 O ATOM 0 H TYR A 72 4.656 -2.338 2.879 1.00 1.00 H new ATOM 0 HA TYR A 72 2.926 -4.055 4.012 1.00 1.00 H new ATOM 0 HB2 TYR A 72 3.679 -2.012 5.020 1.00 1.00 H new ATOM 0 HB3 TYR A 72 3.033 -1.036 3.717 1.00 1.00 H new ATOM 0 HD1 TYR A 72 0.703 -3.464 5.309 1.00 1.00 H new ATOM 0 HD2 TYR A 72 2.346 0.529 5.434 1.00 1.00 H new ATOM 0 HE1 TYR A 72 -1.279 -2.677 6.584 1.00 1.00 H new ATOM 0 HE2 TYR A 72 0.441 1.272 6.858 1.00 1.00 H new ATOM 0 HH TYR A 72 -1.513 0.699 7.798 1.00 1.00 H new ATOM 1142 N THR A 73 0.962 -2.584 1.805 1.00 1.00 N ATOM 1143 CA THR A 73 -0.284 -2.783 0.998 1.00 1.00 C ATOM 1144 C THR A 73 -0.299 -3.952 -0.023 1.00 1.00 C ATOM 1145 O THR A 73 -1.311 -4.635 -0.162 1.00 1.00 O ATOM 1146 CB THR A 73 -0.687 -1.456 0.322 1.00 1.00 C ATOM 1147 OG1 THR A 73 -2.040 -1.461 -0.051 1.00 1.00 O ATOM 1148 CG2 THR A 73 0.182 -1.038 -0.869 1.00 1.00 C ATOM 0 H THR A 73 1.447 -1.719 1.567 1.00 1.00 H new ATOM 0 HA THR A 73 -1.024 -3.099 1.733 1.00 1.00 H new ATOM 0 HB THR A 73 -0.514 -0.704 1.092 1.00 1.00 H new ATOM 0 HG1 THR A 73 -2.266 -0.607 -0.475 1.00 1.00 H new ATOM 0 HG21 THR A 73 -0.184 -0.094 -1.273 1.00 1.00 H new ATOM 0 HG22 THR A 73 1.215 -0.917 -0.541 1.00 1.00 H new ATOM 0 HG23 THR A 73 0.134 -1.806 -1.641 1.00 1.00 H new ATOM 1156 N ASP A 74 0.803 -4.192 -0.750 1.00 1.00 N ATOM 1157 CA ASP A 74 1.062 -5.359 -1.635 1.00 1.00 C ATOM 1158 C ASP A 74 1.325 -6.656 -0.825 1.00 1.00 C ATOM 1159 O ASP A 74 0.613 -7.651 -0.928 1.00 1.00 O ATOM 1160 CB ASP A 74 2.266 -5.040 -2.575 1.00 1.00 C ATOM 1161 CG ASP A 74 1.940 -4.531 -3.989 1.00 1.00 C ATOM 1162 OD1 ASP A 74 0.752 -4.351 -4.344 1.00 1.00 O ATOM 1163 OD2 ASP A 74 2.914 -4.293 -4.739 1.00 1.00 O ATOM 0 H ASP A 74 1.590 -3.543 -0.742 1.00 1.00 H new ATOM 0 HA ASP A 74 0.169 -5.537 -2.234 1.00 1.00 H new ATOM 0 HB2 ASP A 74 2.890 -4.294 -2.083 1.00 1.00 H new ATOM 0 HB3 ASP A 74 2.867 -5.944 -2.672 1.00 1.00 H new ATOM 1168 N PHE A 75 2.376 -6.631 -0.005 1.00 1.00 N ATOM 1169 CA PHE A 75 2.935 -7.705 0.822 1.00 1.00 C ATOM 1170 C PHE A 75 1.938 -8.364 1.789 1.00 1.00 C ATOM 1171 O PHE A 75 1.959 -9.583 1.923 1.00 1.00 O ATOM 1172 CB PHE A 75 4.183 -7.162 1.560 1.00 1.00 C ATOM 1173 CG PHE A 75 5.362 -8.114 1.642 1.00 1.00 C ATOM 1174 CD1 PHE A 75 5.797 -8.801 0.481 1.00 1.00 C ATOM 1175 CD2 PHE A 75 6.106 -8.224 2.840 1.00 1.00 C ATOM 1176 CE1 PHE A 75 6.957 -9.593 0.522 1.00 1.00 C ATOM 1177 CE2 PHE A 75 7.288 -8.992 2.867 1.00 1.00 C ATOM 1178 CZ PHE A 75 7.716 -9.661 1.700 1.00 1.00 C ATOM 0 H PHE A 75 2.913 -5.771 0.109 1.00 1.00 H new ATOM 0 HA PHE A 75 3.213 -8.517 0.150 1.00 1.00 H new ATOM 0 HB2 PHE A 75 4.510 -6.250 1.061 1.00 1.00 H new ATOM 0 HB3 PHE A 75 3.892 -6.885 2.573 1.00 1.00 H new ATOM 0 HD1 PHE A 75 5.235 -8.716 -0.438 1.00 1.00 H new ATOM 0 HD2 PHE A 75 5.769 -7.720 3.734 1.00 1.00 H new ATOM 0 HE1 PHE A 75 7.264 -10.148 -0.352 1.00 1.00 H new ATOM 0 HE2 PHE A 75 7.864 -9.068 3.777 1.00 1.00 H new ATOM 0 HZ PHE A 75 8.634 -10.229 1.714 1.00 1.00 H new ATOM 1188 N ALA A 76 1.042 -7.598 2.428 1.00 1.00 N ATOM 1189 CA ALA A 76 -0.070 -8.149 3.212 1.00 1.00 C ATOM 1190 C ALA A 76 -1.086 -8.946 2.352 1.00 1.00 C ATOM 1191 O ALA A 76 -1.436 -10.067 2.721 1.00 1.00 O ATOM 1192 CB ALA A 76 -0.745 -7.020 3.983 1.00 1.00 C ATOM 0 H ALA A 76 1.069 -6.578 2.415 1.00 1.00 H new ATOM 0 HA ALA A 76 0.340 -8.875 3.914 1.00 1.00 H new ATOM 0 HB1 ALA A 76 -1.572 -7.422 4.568 1.00 1.00 H new ATOM 0 HB2 ALA A 76 -0.022 -6.553 4.651 1.00 1.00 H new ATOM 0 HB3 ALA A 76 -1.124 -6.277 3.282 1.00 1.00 H new ATOM 1198 N ALA A 77 -1.510 -8.414 1.192 1.00 1.00 N ATOM 1199 CA ALA A 77 -2.314 -9.137 0.191 1.00 1.00 C ATOM 1200 C ALA A 77 -1.623 -10.448 -0.283 1.00 1.00 C ATOM 1201 O ALA A 77 -2.256 -11.502 -0.298 1.00 1.00 O ATOM 1202 CB ALA A 77 -2.650 -8.170 -0.959 1.00 1.00 C ATOM 0 H ALA A 77 -1.300 -7.454 0.919 1.00 1.00 H new ATOM 0 HA ALA A 77 -3.248 -9.471 0.642 1.00 1.00 H new ATOM 0 HB1 ALA A 77 -3.245 -8.690 -1.709 1.00 1.00 H new ATOM 0 HB2 ALA A 77 -3.216 -7.324 -0.569 1.00 1.00 H new ATOM 0 HB3 ALA A 77 -1.727 -7.811 -1.414 1.00 1.00 H new ATOM 1208 N TRP A 78 -0.306 -10.418 -0.550 1.00 1.00 N ATOM 1209 CA TRP A 78 0.544 -11.603 -0.792 1.00 1.00 C ATOM 1210 C TRP A 78 0.528 -12.595 0.397 1.00 1.00 C ATOM 1211 O TRP A 78 0.259 -13.777 0.196 1.00 1.00 O ATOM 1212 CB TRP A 78 1.964 -11.173 -1.182 1.00 1.00 C ATOM 1213 CG TRP A 78 2.973 -12.282 -1.278 1.00 1.00 C ATOM 1214 CD1 TRP A 78 3.052 -13.226 -2.243 1.00 1.00 C ATOM 1215 CD2 TRP A 78 4.031 -12.594 -0.321 1.00 1.00 C ATOM 1216 NE1 TRP A 78 4.106 -14.085 -1.964 1.00 1.00 N ATOM 1217 CE2 TRP A 78 4.730 -13.751 -0.785 1.00 1.00 C ATOM 1218 CE3 TRP A 78 4.482 -11.996 0.876 1.00 1.00 C ATOM 1219 CZ2 TRP A 78 5.815 -14.305 -0.078 1.00 1.00 C ATOM 1220 CZ3 TRP A 78 5.573 -12.532 1.588 1.00 1.00 C ATOM 1221 CH2 TRP A 78 6.238 -13.684 1.115 1.00 1.00 C ATOM 0 H TRP A 78 0.215 -9.543 -0.606 1.00 1.00 H new ATOM 0 HA TRP A 78 0.121 -12.151 -1.634 1.00 1.00 H new ATOM 0 HB2 TRP A 78 1.919 -10.662 -2.144 1.00 1.00 H new ATOM 0 HB3 TRP A 78 2.318 -10.446 -0.451 1.00 1.00 H new ATOM 0 HD1 TRP A 78 2.397 -13.300 -3.098 1.00 1.00 H new ATOM 0 HE1 TRP A 78 4.383 -14.866 -2.559 1.00 1.00 H new ATOM 0 HE3 TRP A 78 3.983 -11.115 1.251 1.00 1.00 H new ATOM 0 HZ2 TRP A 78 6.314 -15.190 -0.443 1.00 1.00 H new ATOM 0 HZ3 TRP A 78 5.903 -12.059 2.501 1.00 1.00 H new ATOM 0 HH2 TRP A 78 7.072 -14.090 1.668 1.00 1.00 H new ATOM 1232 N VAL A 79 0.774 -12.156 1.641 1.00 1.00 N ATOM 1233 CA VAL A 79 0.597 -12.965 2.881 1.00 1.00 C ATOM 1234 C VAL A 79 -0.788 -13.643 2.954 1.00 1.00 C ATOM 1235 O VAL A 79 -0.836 -14.841 3.240 1.00 1.00 O ATOM 1236 CB VAL A 79 0.935 -12.166 4.167 1.00 1.00 C ATOM 1237 CG1 VAL A 79 0.511 -12.872 5.470 1.00 1.00 C ATOM 1238 CG2 VAL A 79 2.453 -11.915 4.254 1.00 1.00 C ATOM 0 H VAL A 79 1.109 -11.211 1.829 1.00 1.00 H new ATOM 0 HA VAL A 79 1.328 -13.771 2.823 1.00 1.00 H new ATOM 0 HB VAL A 79 0.371 -11.237 4.084 1.00 1.00 H new ATOM 0 HG11 VAL A 79 0.781 -12.251 6.324 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -0.567 -13.031 5.463 1.00 1.00 H new ATOM 0 HG13 VAL A 79 1.019 -13.833 5.545 1.00 1.00 H new ATOM 0 HG21 VAL A 79 2.678 -11.353 5.161 1.00 1.00 H new ATOM 0 HG22 VAL A 79 2.979 -12.869 4.279 1.00 1.00 H new ATOM 0 HG23 VAL A 79 2.778 -11.344 3.384 1.00 1.00 H new ATOM 1248 N LYS A 80 -1.895 -12.945 2.630 1.00 1.00 N ATOM 1249 CA LYS A 80 -3.247 -13.544 2.462 1.00 1.00 C ATOM 1250 C LYS A 80 -3.296 -14.606 1.338 1.00 1.00 C ATOM 1251 O LYS A 80 -3.815 -15.693 1.577 1.00 1.00 O ATOM 1252 CB LYS A 80 -4.356 -12.477 2.299 1.00 1.00 C ATOM 1253 CG LYS A 80 -4.450 -11.491 3.483 1.00 1.00 C ATOM 1254 CD LYS A 80 -5.853 -10.895 3.706 1.00 1.00 C ATOM 1255 CE LYS A 80 -5.823 -9.949 4.911 1.00 1.00 C ATOM 1256 NZ LYS A 80 -7.135 -9.319 5.181 1.00 1.00 N ATOM 0 H LYS A 80 -1.882 -11.937 2.474 1.00 1.00 H new ATOM 0 HA LYS A 80 -3.455 -14.070 3.394 1.00 1.00 H new ATOM 0 HB2 LYS A 80 -4.174 -11.914 1.383 1.00 1.00 H new ATOM 0 HB3 LYS A 80 -5.316 -12.979 2.179 1.00 1.00 H new ATOM 0 HG2 LYS A 80 -4.138 -12.004 4.393 1.00 1.00 H new ATOM 0 HG3 LYS A 80 -3.745 -10.676 3.318 1.00 1.00 H new ATOM 0 HD2 LYS A 80 -6.176 -10.356 2.815 1.00 1.00 H new ATOM 0 HD3 LYS A 80 -6.576 -11.693 3.875 1.00 1.00 H new ATOM 0 HE2 LYS A 80 -5.503 -10.503 5.794 1.00 1.00 H new ATOM 0 HE3 LYS A 80 -5.081 -9.170 4.737 1.00 1.00 H new ATOM 0 HZ1 LYS A 80 -7.009 -8.524 5.840 1.00 1.00 H new ATOM 0 HZ2 LYS A 80 -7.542 -8.969 4.290 1.00 1.00 H new ATOM 0 HZ3 LYS A 80 -7.777 -10.020 5.603 1.00 1.00 H new ATOM 1270 N GLU A 81 -2.685 -14.351 0.172 1.00 1.00 N ATOM 1271 CA GLU A 81 -2.427 -15.303 -0.948 1.00 1.00 C ATOM 1272 C GLU A 81 -1.546 -16.542 -0.579 1.00 1.00 C ATOM 1273 O GLU A 81 -1.459 -17.483 -1.374 1.00 1.00 O ATOM 1274 CB GLU A 81 -1.842 -14.574 -2.188 1.00 1.00 C ATOM 1275 CG GLU A 81 -2.845 -13.627 -2.871 1.00 1.00 C ATOM 1276 CD GLU A 81 -2.262 -12.727 -3.986 1.00 1.00 C ATOM 1277 OE1 GLU A 81 -1.149 -12.975 -4.528 1.00 1.00 O ATOM 1278 OE2 GLU A 81 -2.974 -11.768 -4.374 1.00 1.00 O ATOM 0 H GLU A 81 -2.330 -13.418 -0.040 1.00 1.00 H new ATOM 0 HA GLU A 81 -3.410 -15.707 -1.189 1.00 1.00 H new ATOM 0 HB2 GLU A 81 -0.964 -14.004 -1.884 1.00 1.00 H new ATOM 0 HB3 GLU A 81 -1.505 -15.317 -2.911 1.00 1.00 H new ATOM 0 HG2 GLU A 81 -3.651 -14.225 -3.296 1.00 1.00 H new ATOM 0 HG3 GLU A 81 -3.291 -12.988 -2.109 1.00 1.00 H new ATOM 1285 N ASN A 82 -0.887 -16.560 0.595 1.00 1.00 N ATOM 1286 CA ASN A 82 -0.186 -17.705 1.208 1.00 1.00 C ATOM 1287 C ASN A 82 -1.015 -18.373 2.352 1.00 1.00 C ATOM 1288 O ASN A 82 -1.306 -19.568 2.294 1.00 1.00 O ATOM 1289 CB ASN A 82 1.211 -17.263 1.735 1.00 1.00 C ATOM 1290 CG ASN A 82 2.286 -16.865 0.727 1.00 1.00 C ATOM 1291 OD1 ASN A 82 3.354 -17.452 0.640 1.00 1.00 O ATOM 1292 ND2 ASN A 82 2.121 -15.782 0.022 1.00 1.00 N ATOM 0 H ASN A 82 -0.826 -15.724 1.177 1.00 1.00 H new ATOM 0 HA ASN A 82 -0.057 -18.457 0.429 1.00 1.00 H new ATOM 0 HB2 ASN A 82 1.058 -16.417 2.405 1.00 1.00 H new ATOM 0 HB3 ASN A 82 1.610 -18.079 2.337 1.00 1.00 H new ATOM 0 HD21 ASN A 82 2.872 -15.447 -0.581 1.00 1.00 H new ATOM 0 HD22 ASN A 82 1.241 -15.269 0.073 1.00 1.00 H new ATOM 1299 N LEU A 83 -1.343 -17.640 3.427 1.00 1.00 N ATOM 1300 CA LEU A 83 -1.964 -18.135 4.679 1.00 1.00 C ATOM 1301 C LEU A 83 -3.500 -18.312 4.606 1.00 1.00 C ATOM 1302 O LEU A 83 -4.014 -19.386 4.925 1.00 1.00 O ATOM 1303 CB LEU A 83 -1.555 -17.225 5.867 1.00 1.00 C ATOM 1304 CG LEU A 83 -0.036 -16.966 6.035 1.00 1.00 C ATOM 1305 CD1 LEU A 83 0.234 -16.141 7.296 1.00 1.00 C ATOM 1306 CD2 LEU A 83 0.792 -18.254 6.096 1.00 1.00 C ATOM 0 H LEU A 83 -1.176 -16.634 3.454 1.00 1.00 H new ATOM 0 HA LEU A 83 -1.577 -19.142 4.836 1.00 1.00 H new ATOM 0 HB2 LEU A 83 -2.056 -16.264 5.752 1.00 1.00 H new ATOM 0 HB3 LEU A 83 -1.931 -17.672 6.787 1.00 1.00 H new ATOM 0 HG LEU A 83 0.274 -16.415 5.147 1.00 1.00 H new ATOM 0 HD11 LEU A 83 1.306 -15.970 7.396 1.00 1.00 H new ATOM 0 HD12 LEU A 83 -0.281 -15.183 7.221 1.00 1.00 H new ATOM 0 HD13 LEU A 83 -0.130 -16.682 8.169 1.00 1.00 H new ATOM 0 HD21 LEU A 83 1.846 -18.004 6.214 1.00 1.00 H new ATOM 0 HD22 LEU A 83 0.465 -18.857 6.943 1.00 1.00 H new ATOM 0 HD23 LEU A 83 0.654 -18.819 5.174 1.00 1.00 H new ATOM 1318 N ASP A 84 -4.222 -17.270 4.186 1.00 1.00 N ATOM 1319 CA ASP A 84 -5.696 -17.207 4.051 1.00 1.00 C ATOM 1320 C ASP A 84 -6.279 -17.780 2.731 1.00 1.00 C ATOM 1321 O ASP A 84 -7.502 -17.860 2.596 1.00 1.00 O ATOM 1322 CB ASP A 84 -6.117 -15.741 4.310 1.00 1.00 C ATOM 1323 CG ASP A 84 -5.749 -15.303 5.742 1.00 1.00 C ATOM 1324 OD1 ASP A 84 -6.153 -16.001 6.697 1.00 1.00 O ATOM 1325 OD2 ASP A 84 -4.979 -14.325 5.924 1.00 1.00 O ATOM 0 H ASP A 84 -3.777 -16.394 3.913 1.00 1.00 H new ATOM 0 HA ASP A 84 -6.131 -17.878 4.792 1.00 1.00 H new ATOM 0 HB2 ASP A 84 -5.628 -15.086 3.589 1.00 1.00 H new ATOM 0 HB3 ASP A 84 -7.191 -15.636 4.159 1.00 1.00 H new ATOM 1330 N ALA A 85 -5.397 -18.183 1.808 1.00 1.00 N ATOM 1331 CA ALA A 85 -5.558 -18.744 0.457 1.00 1.00 C ATOM 1332 C ALA A 85 -6.047 -20.206 0.335 1.00 1.00 C ATOM 1333 O ALA A 85 -5.437 -21.136 0.907 1.00 1.00 O ATOM 1334 CB ALA A 85 -4.195 -18.573 -0.234 1.00 1.00 C ATOM 1335 OXT ALA A 85 -6.964 -20.426 -0.492 1.00 1.00 O ATOM 0 H ALA A 85 -4.403 -18.112 2.025 1.00 1.00 H new ATOM 0 HA ALA A 85 -6.377 -18.198 -0.012 1.00 1.00 H new ATOM 0 HB1 ALA A 85 -4.248 -18.972 -1.247 1.00 1.00 H new ATOM 0 HB2 ALA A 85 -3.938 -17.515 -0.274 1.00 1.00 H new ATOM 0 HB3 ALA A 85 -3.432 -19.111 0.328 1.00 1.00 H new TER 1341 ALA A 85 ATOM 1342 N GLY B 126 -9.351 25.297 25.560 1.00 1.00 N ATOM 1343 CA GLY B 126 -9.554 26.677 25.083 1.00 1.00 C ATOM 1344 C GLY B 126 -10.005 26.613 23.645 1.00 1.00 C ATOM 1345 O GLY B 126 -11.191 26.395 23.425 1.00 1.00 O ATOM 0 HA2 GLY B 126 -10.300 27.185 25.694 1.00 1.00 H new ATOM 0 HA3 GLY B 126 -8.630 27.249 25.167 1.00 1.00 H new ATOM 1351 N ALA B 127 -9.080 26.820 22.711 1.00 1.00 N ATOM 1352 CA ALA B 127 -9.231 26.580 21.272 1.00 1.00 C ATOM 1353 C ALA B 127 -7.911 25.941 20.774 1.00 1.00 C ATOM 1354 O ALA B 127 -6.881 26.611 20.660 1.00 1.00 O ATOM 1355 CB ALA B 127 -9.607 27.898 20.570 1.00 1.00 C ATOM 0 H ALA B 127 -8.155 27.179 22.947 1.00 1.00 H new ATOM 0 HA ALA B 127 -10.041 25.889 21.040 1.00 1.00 H new ATOM 0 HB1 ALA B 127 -9.720 27.721 19.500 1.00 1.00 H new ATOM 0 HB2 ALA B 127 -10.547 28.272 20.977 1.00 1.00 H new ATOM 0 HB3 ALA B 127 -8.821 28.635 20.735 1.00 1.00 H new ATOM 1361 N GLU B 128 -7.944 24.633 20.529 1.00 1.00 N ATOM 1362 CA GLU B 128 -6.810 23.737 20.222 1.00 1.00 C ATOM 1363 C GLU B 128 -7.148 22.710 19.111 1.00 1.00 C ATOM 1364 O GLU B 128 -8.312 22.537 18.740 1.00 1.00 O ATOM 1365 CB GLU B 128 -6.344 23.003 21.513 1.00 1.00 C ATOM 1366 CG GLU B 128 -5.929 23.877 22.724 1.00 1.00 C ATOM 1367 CD GLU B 128 -7.100 24.459 23.545 1.00 1.00 C ATOM 1368 OE1 GLU B 128 -8.188 23.849 23.647 1.00 1.00 O ATOM 1369 OE2 GLU B 128 -6.975 25.546 24.166 1.00 1.00 O ATOM 0 H GLU B 128 -8.828 24.124 20.538 1.00 1.00 H new ATOM 0 HA GLU B 128 -6.000 24.360 19.843 1.00 1.00 H new ATOM 0 HB2 GLU B 128 -7.150 22.344 21.835 1.00 1.00 H new ATOM 0 HB3 GLU B 128 -5.498 22.367 21.252 1.00 1.00 H new ATOM 0 HG2 GLU B 128 -5.304 23.279 23.386 1.00 1.00 H new ATOM 0 HG3 GLU B 128 -5.314 24.701 22.363 1.00 1.00 H new ATOM 1376 N ASP B 129 -6.145 21.956 18.644 1.00 1.00 N ATOM 1377 CA ASP B 129 -6.300 20.801 17.734 1.00 1.00 C ATOM 1378 C ASP B 129 -6.306 19.459 18.516 1.00 1.00 C ATOM 1379 O ASP B 129 -5.272 19.051 19.066 1.00 1.00 O ATOM 1380 CB ASP B 129 -5.146 20.761 16.718 1.00 1.00 C ATOM 1381 CG ASP B 129 -5.074 21.943 15.744 1.00 1.00 C ATOM 1382 OD1 ASP B 129 -5.794 21.924 14.715 1.00 1.00 O ATOM 1383 OD2 ASP B 129 -4.172 22.791 15.936 1.00 1.00 O ATOM 0 H ASP B 129 -5.172 22.133 18.893 1.00 1.00 H new ATOM 0 HA ASP B 129 -7.254 20.923 17.221 1.00 1.00 H new ATOM 0 HB2 ASP B 129 -4.206 20.709 17.267 1.00 1.00 H new ATOM 0 HB3 ASP B 129 -5.229 19.841 16.139 1.00 1.00 H new ATOM 1388 N ALA B 130 -7.450 18.775 18.565 1.00 1.00 N ATOM 1389 CA ALA B 130 -7.670 17.468 19.210 1.00 1.00 C ATOM 1390 C ALA B 130 -8.195 16.430 18.185 1.00 1.00 C ATOM 1391 O ALA B 130 -9.363 16.461 17.792 1.00 1.00 O ATOM 1392 CB ALA B 130 -8.585 17.651 20.434 1.00 1.00 C ATOM 0 H ALA B 130 -8.301 19.134 18.132 1.00 1.00 H new ATOM 0 HA ALA B 130 -6.726 17.063 19.575 1.00 1.00 H new ATOM 0 HB1 ALA B 130 -8.749 16.686 20.913 1.00 1.00 H new ATOM 0 HB2 ALA B 130 -8.113 18.332 21.142 1.00 1.00 H new ATOM 0 HB3 ALA B 130 -9.541 18.065 20.115 1.00 1.00 H new ATOM 1398 N GLN B 131 -7.309 15.544 17.720 1.00 1.00 N ATOM 1399 CA GLN B 131 -7.548 14.527 16.672 1.00 1.00 C ATOM 1400 C GLN B 131 -7.161 13.097 17.116 1.00 1.00 C ATOM 1401 O GLN B 131 -6.055 12.853 17.607 1.00 1.00 O ATOM 1402 CB GLN B 131 -6.859 14.963 15.358 1.00 1.00 C ATOM 1403 CG GLN B 131 -5.331 15.175 15.437 1.00 1.00 C ATOM 1404 CD GLN B 131 -4.748 15.745 14.146 1.00 1.00 C ATOM 1405 OE1 GLN B 131 -4.019 15.082 13.422 1.00 1.00 O ATOM 1406 NE2 GLN B 131 -5.007 16.981 13.798 1.00 1.00 N ATOM 0 H GLN B 131 -6.354 15.509 18.078 1.00 1.00 H new ATOM 0 HA GLN B 131 -8.621 14.471 16.490 1.00 1.00 H new ATOM 0 HB2 GLN B 131 -7.063 14.211 14.596 1.00 1.00 H new ATOM 0 HB3 GLN B 131 -7.318 15.892 15.020 1.00 1.00 H new ATOM 0 HG2 GLN B 131 -5.104 15.850 16.262 1.00 1.00 H new ATOM 0 HG3 GLN B 131 -4.847 14.224 15.661 1.00 1.00 H new ATOM 0 HE21 GLN B 131 -5.612 17.559 14.382 1.00 1.00 H new ATOM 0 HE22 GLN B 131 -4.604 17.365 12.943 1.00 1.00 H new ATOM 1415 N ASP B 132 -8.068 12.136 16.914 1.00 1.00 N ATOM 1416 CA ASP B 132 -7.998 10.744 17.397 1.00 1.00 C ATOM 1417 C ASP B 132 -7.509 9.744 16.315 1.00 1.00 C ATOM 1418 O ASP B 132 -8.292 9.127 15.584 1.00 1.00 O ATOM 1419 CB ASP B 132 -9.349 10.376 18.051 1.00 1.00 C ATOM 1420 CG ASP B 132 -10.555 10.296 17.091 1.00 1.00 C ATOM 1421 OD1 ASP B 132 -10.714 11.195 16.229 1.00 1.00 O ATOM 1422 OD2 ASP B 132 -11.313 9.302 17.177 1.00 1.00 O ATOM 0 H ASP B 132 -8.919 12.313 16.380 1.00 1.00 H new ATOM 0 HA ASP B 132 -7.226 10.666 18.162 1.00 1.00 H new ATOM 0 HB2 ASP B 132 -9.240 9.413 18.550 1.00 1.00 H new ATOM 0 HB3 ASP B 132 -9.571 11.112 18.824 1.00 1.00 H new ATOM 1427 N ASP B 133 -6.183 9.586 16.220 1.00 1.00 N ATOM 1428 CA ASP B 133 -5.479 8.615 15.357 1.00 1.00 C ATOM 1429 C ASP B 133 -5.747 7.120 15.695 1.00 1.00 C ATOM 1430 O ASP B 133 -6.353 6.810 16.722 1.00 1.00 O ATOM 1431 CB ASP B 133 -3.980 8.983 15.270 1.00 1.00 C ATOM 1432 CG ASP B 133 -3.229 8.988 16.603 1.00 1.00 C ATOM 1433 OD1 ASP B 133 -3.718 9.580 17.591 1.00 1.00 O ATOM 1434 OD2 ASP B 133 -2.095 8.466 16.661 1.00 1.00 O ATOM 0 H ASP B 133 -5.537 10.156 16.766 1.00 1.00 H new ATOM 0 HA ASP B 133 -5.909 8.703 14.359 1.00 1.00 H new ATOM 0 HB2 ASP B 133 -3.489 8.280 14.598 1.00 1.00 H new ATOM 0 HB3 ASP B 133 -3.891 9.971 14.818 1.00 1.00 H new ATOM 1439 N LEU B 134 -5.308 6.178 14.831 1.00 1.00 N ATOM 1440 CA LEU B 134 -5.665 4.741 14.888 1.00 1.00 C ATOM 1441 C LEU B 134 -5.491 4.039 16.274 1.00 1.00 C ATOM 1442 O LEU B 134 -4.495 3.395 16.602 1.00 1.00 O ATOM 1443 CB LEU B 134 -5.063 3.957 13.682 1.00 1.00 C ATOM 1444 CG LEU B 134 -3.562 4.000 13.276 1.00 1.00 C ATOM 1445 CD1 LEU B 134 -3.090 5.362 12.753 1.00 1.00 C ATOM 1446 CD2 LEU B 134 -2.566 3.513 14.332 1.00 1.00 C ATOM 0 H LEU B 134 -4.682 6.400 14.057 1.00 1.00 H new ATOM 0 HA LEU B 134 -6.749 4.715 14.778 1.00 1.00 H new ATOM 0 HB2 LEU B 134 -5.302 2.907 13.852 1.00 1.00 H new ATOM 0 HB3 LEU B 134 -5.625 4.273 12.803 1.00 1.00 H new ATOM 0 HG LEU B 134 -3.553 3.275 12.462 1.00 1.00 H new ATOM 0 HD11 LEU B 134 -2.033 5.305 12.493 1.00 1.00 H new ATOM 0 HD12 LEU B 134 -3.668 5.632 11.869 1.00 1.00 H new ATOM 0 HD13 LEU B 134 -3.233 6.118 13.525 1.00 1.00 H new ATOM 0 HD21 LEU B 134 -1.552 3.588 13.938 1.00 1.00 H new ATOM 0 HD22 LEU B 134 -2.654 4.129 15.227 1.00 1.00 H new ATOM 0 HD23 LEU B 134 -2.781 2.474 14.583 1.00 1.00 H new ATOM 1458 N VAL B 135 -6.605 4.009 17.019 1.00 1.00 N ATOM 1459 CA VAL B 135 -6.845 3.369 18.337 1.00 1.00 C ATOM 1460 C VAL B 135 -8.097 2.464 18.424 1.00 1.00 C ATOM 1461 O VAL B 135 -7.993 1.473 19.154 1.00 1.00 O ATOM 1462 CB VAL B 135 -6.788 4.359 19.529 1.00 1.00 C ATOM 1463 CG1 VAL B 135 -5.419 5.055 19.627 1.00 1.00 C ATOM 1464 CG2 VAL B 135 -7.914 5.406 19.507 1.00 1.00 C ATOM 0 H VAL B 135 -7.449 4.476 16.688 1.00 1.00 H new ATOM 0 HA VAL B 135 -5.994 2.694 18.424 1.00 1.00 H new ATOM 0 HB VAL B 135 -6.937 3.747 20.419 1.00 1.00 H new ATOM 0 HG11 VAL B 135 -5.419 5.741 20.474 1.00 1.00 H new ATOM 0 HG12 VAL B 135 -4.639 4.306 19.766 1.00 1.00 H new ATOM 0 HG13 VAL B 135 -5.228 5.612 18.710 1.00 1.00 H new ATOM 0 HG21 VAL B 135 -7.814 6.066 20.369 1.00 1.00 H new ATOM 0 HG22 VAL B 135 -7.847 5.993 18.591 1.00 1.00 H new ATOM 0 HG23 VAL B 135 -8.880 4.902 19.546 1.00 1.00 H new ATOM 1474 N PRO B 136 -9.220 2.659 17.676 1.00 1.00 N ATOM 1475 CA PRO B 136 -10.308 1.665 17.638 1.00 1.00 C ATOM 1476 C PRO B 136 -9.962 0.410 16.804 1.00 1.00 C ATOM 1477 O PRO B 136 -10.511 -0.660 17.069 1.00 1.00 O ATOM 1478 CB PRO B 136 -11.526 2.412 17.072 1.00 1.00 C ATOM 1479 CG PRO B 136 -10.890 3.432 16.129 1.00 1.00 C ATOM 1480 CD PRO B 136 -9.590 3.805 16.837 1.00 1.00 C ATOM 0 HA PRO B 136 -10.500 1.271 18.636 1.00 1.00 H new ATOM 0 HB2 PRO B 136 -12.203 1.740 16.544 1.00 1.00 H new ATOM 0 HB3 PRO B 136 -12.106 2.895 17.859 1.00 1.00 H new ATOM 0 HG2 PRO B 136 -10.703 3.006 15.143 1.00 1.00 H new ATOM 0 HG3 PRO B 136 -11.532 4.301 15.984 1.00 1.00 H new ATOM 0 HD2 PRO B 136 -8.805 4.024 16.113 1.00 1.00 H new ATOM 0 HD3 PRO B 136 -9.723 4.701 17.443 1.00 1.00 H new ATOM 1488 N SER B 137 -9.093 0.518 15.779 1.00 1.00 N ATOM 1489 CA SER B 137 -8.592 -0.621 14.969 1.00 1.00 C ATOM 1490 C SER B 137 -7.201 -0.395 14.332 1.00 1.00 C ATOM 1491 O SER B 137 -7.063 0.308 13.332 1.00 1.00 O ATOM 1492 CB SER B 137 -9.619 -0.978 13.876 1.00 1.00 C ATOM 1493 OG SER B 137 -10.820 -1.444 14.470 1.00 1.00 O ATOM 0 H SER B 137 -8.710 1.415 15.482 1.00 1.00 H new ATOM 0 HA SER B 137 -8.466 -1.448 15.667 1.00 1.00 H new ATOM 0 HB2 SER B 137 -9.825 -0.103 13.259 1.00 1.00 H new ATOM 0 HB3 SER B 137 -9.209 -1.743 13.217 1.00 1.00 H new ATOM 0 HG SER B 137 -10.762 -1.347 15.444 1.00 1.00 H new ATOM 1499 N ILE B 138 -6.170 -1.051 14.875 1.00 1.00 N ATOM 1500 CA ILE B 138 -4.748 -1.114 14.422 1.00 1.00 C ATOM 1501 C ILE B 138 -4.433 -2.163 13.309 1.00 1.00 C ATOM 1502 O ILE B 138 -3.273 -2.513 13.097 1.00 1.00 O ATOM 1503 CB ILE B 138 -3.829 -1.229 15.682 1.00 1.00 C ATOM 1504 CG1 ILE B 138 -2.347 -0.859 15.408 1.00 1.00 C ATOM 1505 CG2 ILE B 138 -3.956 -2.604 16.374 1.00 1.00 C ATOM 1506 CD1 ILE B 138 -1.525 -0.448 16.641 1.00 1.00 C ATOM 0 H ILE B 138 -6.306 -1.606 15.720 1.00 1.00 H new ATOM 0 HA ILE B 138 -4.533 -0.183 13.897 1.00 1.00 H new ATOM 0 HB ILE B 138 -4.200 -0.476 16.378 1.00 1.00 H new ATOM 0 HG12 ILE B 138 -1.859 -1.712 14.937 1.00 1.00 H new ATOM 0 HG13 ILE B 138 -2.323 -0.041 14.688 1.00 1.00 H new ATOM 0 HG21 ILE B 138 -3.299 -2.636 17.243 1.00 1.00 H new ATOM 0 HG22 ILE B 138 -4.987 -2.757 16.693 1.00 1.00 H new ATOM 0 HG23 ILE B 138 -3.672 -3.391 15.675 1.00 1.00 H new ATOM 0 HD11 ILE B 138 -0.506 -0.211 16.336 1.00 1.00 H new ATOM 0 HD12 ILE B 138 -1.978 0.428 17.105 1.00 1.00 H new ATOM 0 HD13 ILE B 138 -1.508 -1.270 17.357 1.00 1.00 H new ATOM 1518 N GLN B 139 -5.456 -2.655 12.590 1.00 1.00 N ATOM 1519 CA GLN B 139 -5.396 -3.577 11.436 1.00 1.00 C ATOM 1520 C GLN B 139 -4.394 -3.128 10.339 1.00 1.00 C ATOM 1521 O GLN B 139 -4.503 -2.019 9.803 1.00 1.00 O ATOM 1522 CB GLN B 139 -6.822 -3.729 10.861 1.00 1.00 C ATOM 1523 CG GLN B 139 -6.929 -4.691 9.657 1.00 1.00 C ATOM 1524 CD GLN B 139 -8.331 -4.768 9.046 1.00 1.00 C ATOM 1525 OE1 GLN B 139 -9.340 -4.387 9.637 1.00 1.00 O ATOM 1526 NE2 GLN B 139 -8.459 -5.218 7.823 1.00 1.00 N ATOM 0 H GLN B 139 -6.418 -2.402 12.814 1.00 1.00 H new ATOM 0 HA GLN B 139 -5.021 -4.538 11.788 1.00 1.00 H new ATOM 0 HB2 GLN B 139 -7.483 -4.083 11.652 1.00 1.00 H new ATOM 0 HB3 GLN B 139 -7.184 -2.747 10.558 1.00 1.00 H new ATOM 0 HG2 GLN B 139 -6.225 -4.374 8.888 1.00 1.00 H new ATOM 0 HG3 GLN B 139 -6.626 -5.689 9.974 1.00 1.00 H new ATOM 0 HE21 GLN B 139 -7.639 -5.540 7.310 1.00 1.00 H new ATOM 0 HE22 GLN B 139 -9.379 -5.246 7.384 1.00 1.00 H new ATOM 1535 N ASP B 140 -3.454 -4.006 9.974 1.00 1.00 N ATOM 1536 CA ASP B 140 -2.463 -3.793 8.911 1.00 1.00 C ATOM 1537 C ASP B 140 -2.538 -4.833 7.762 1.00 1.00 C ATOM 1538 O ASP B 140 -1.894 -5.886 7.815 1.00 1.00 O ATOM 1539 CB ASP B 140 -1.056 -3.617 9.529 1.00 1.00 C ATOM 1540 CG ASP B 140 -0.473 -4.756 10.398 1.00 1.00 C ATOM 1541 OD1 ASP B 140 -1.117 -5.781 10.727 1.00 1.00 O ATOM 1542 OD2 ASP B 140 0.686 -4.563 10.852 1.00 1.00 O ATOM 0 H ASP B 140 -3.358 -4.916 10.425 1.00 1.00 H new ATOM 0 HA ASP B 140 -2.711 -2.861 8.403 1.00 1.00 H new ATOM 0 HB2 ASP B 140 -0.358 -3.436 8.712 1.00 1.00 H new ATOM 0 HB3 ASP B 140 -1.075 -2.714 10.139 1.00 1.00 H new ATOM 1547 N ASP B 141 -3.262 -4.505 6.680 1.00 1.00 N ATOM 1548 CA ASP B 141 -3.376 -5.338 5.457 1.00 1.00 C ATOM 1549 C ASP B 141 -3.727 -4.669 4.095 1.00 1.00 C ATOM 1550 O ASP B 141 -3.931 -5.382 3.109 1.00 1.00 O ATOM 1551 CB ASP B 141 -4.217 -6.610 5.732 1.00 1.00 C ATOM 1552 CG ASP B 141 -5.638 -6.378 6.244 1.00 1.00 C ATOM 1553 OD1 ASP B 141 -6.222 -5.289 6.047 1.00 1.00 O ATOM 1554 OD2 ASP B 141 -6.188 -7.349 6.811 1.00 1.00 O ATOM 0 H ASP B 141 -3.797 -3.639 6.623 1.00 1.00 H new ATOM 0 HA ASP B 141 -2.334 -5.594 5.265 1.00 1.00 H new ATOM 0 HB2 ASP B 141 -4.275 -7.189 4.810 1.00 1.00 H new ATOM 0 HB3 ASP B 141 -3.685 -7.222 6.461 1.00 1.00 H new ATOM 1559 N GLY B 142 -3.747 -3.333 3.990 1.00 1.00 N ATOM 1560 CA GLY B 142 -3.955 -2.612 2.714 1.00 1.00 C ATOM 1561 C GLY B 142 -4.012 -1.084 2.818 1.00 1.00 C ATOM 1562 O GLY B 142 -5.100 -0.520 2.726 1.00 1.00 O ATOM 0 H GLY B 142 -3.619 -2.713 4.790 1.00 1.00 H new ATOM 0 HA2 GLY B 142 -3.151 -2.882 2.030 1.00 1.00 H new ATOM 0 HA3 GLY B 142 -4.885 -2.963 2.267 1.00 1.00 H new ATOM 1566 N SER B 143 -2.864 -0.413 3.006 1.00 1.00 N ATOM 1567 CA SER B 143 -2.747 1.054 3.201 1.00 1.00 C ATOM 1568 C SER B 143 -1.677 1.703 2.299 1.00 1.00 C ATOM 1569 O SER B 143 -0.480 1.699 2.605 1.00 1.00 O ATOM 1570 CB SER B 143 -2.513 1.361 4.691 1.00 1.00 C ATOM 1571 OG SER B 143 -2.945 2.672 4.998 1.00 1.00 O ATOM 0 H SER B 143 -1.960 -0.885 3.028 1.00 1.00 H new ATOM 0 HA SER B 143 -3.689 1.506 2.891 1.00 1.00 H new ATOM 0 HB2 SER B 143 -3.052 0.640 5.306 1.00 1.00 H new ATOM 0 HB3 SER B 143 -1.455 1.255 4.929 1.00 1.00 H new ATOM 0 HG SER B 143 -2.792 2.853 5.949 1.00 1.00 H new ATOM 1577 N GLU B 144 -2.080 2.217 1.128 1.00 1.00 N ATOM 1578 CA GLU B 144 -1.221 2.711 0.016 1.00 1.00 C ATOM 1579 C GLU B 144 -0.597 4.138 0.138 1.00 1.00 C ATOM 1580 O GLU B 144 -0.139 4.700 -0.867 1.00 1.00 O ATOM 1581 CB GLU B 144 -1.978 2.556 -1.323 1.00 1.00 C ATOM 1582 CG GLU B 144 -3.144 3.545 -1.543 1.00 1.00 C ATOM 1583 CD GLU B 144 -3.515 3.603 -3.034 1.00 1.00 C ATOM 1584 OE1 GLU B 144 -4.114 2.622 -3.535 1.00 1.00 O ATOM 1585 OE2 GLU B 144 -3.125 4.573 -3.731 1.00 1.00 O ATOM 0 H GLU B 144 -3.072 2.309 0.908 1.00 1.00 H new ATOM 0 HA GLU B 144 -0.338 2.074 0.071 1.00 1.00 H new ATOM 0 HB2 GLU B 144 -1.265 2.673 -2.139 1.00 1.00 H new ATOM 0 HB3 GLU B 144 -2.369 1.540 -1.385 1.00 1.00 H new ATOM 0 HG2 GLU B 144 -4.009 3.235 -0.957 1.00 1.00 H new ATOM 0 HG3 GLU B 144 -2.860 4.537 -1.192 1.00 1.00 H new ATOM 1592 N SER B 145 -0.586 4.762 1.323 1.00 1.00 N ATOM 1593 CA SER B 145 -0.150 6.161 1.539 1.00 1.00 C ATOM 1594 C SER B 145 0.935 6.374 2.616 1.00 1.00 C ATOM 1595 O SER B 145 1.387 5.448 3.284 1.00 1.00 O ATOM 1596 CB SER B 145 -1.384 7.055 1.759 1.00 1.00 C ATOM 1597 OG SER B 145 -1.017 8.417 1.613 1.00 1.00 O ATOM 0 H SER B 145 -0.886 4.303 2.183 1.00 1.00 H new ATOM 0 HA SER B 145 0.366 6.458 0.626 1.00 1.00 H new ATOM 0 HB2 SER B 145 -2.164 6.799 1.041 1.00 1.00 H new ATOM 0 HB3 SER B 145 -1.797 6.884 2.753 1.00 1.00 H new ATOM 0 HG SER B 145 -1.804 8.984 1.752 1.00 1.00 H new ATOM 1603 N GLY B 146 1.402 7.625 2.720 1.00 1.00 N ATOM 1604 CA GLY B 146 2.300 8.222 3.729 1.00 1.00 C ATOM 1605 C GLY B 146 3.333 9.238 3.204 1.00 1.00 C ATOM 1606 O GLY B 146 3.971 9.899 4.017 1.00 1.00 O ATOM 0 H GLY B 146 1.133 8.323 2.026 1.00 1.00 H new ATOM 0 HA2 GLY B 146 1.687 8.715 4.484 1.00 1.00 H new ATOM 0 HA3 GLY B 146 2.836 7.416 4.230 1.00 1.00 H new ATOM 1610 N ALA B 147 3.524 9.339 1.869 1.00 1.00 N ATOM 1611 CA ALA B 147 4.400 10.310 1.142 1.00 1.00 C ATOM 1612 C ALA B 147 5.878 10.436 1.621 1.00 1.00 C ATOM 1613 O ALA B 147 6.589 11.371 1.249 1.00 1.00 O ATOM 1614 CB ALA B 147 3.652 11.649 1.074 1.00 1.00 C ATOM 0 H ALA B 147 3.046 8.711 1.224 1.00 1.00 H new ATOM 0 HA ALA B 147 4.566 9.905 0.144 1.00 1.00 H new ATOM 0 HB1 ALA B 147 4.265 12.382 0.549 1.00 1.00 H new ATOM 0 HB2 ALA B 147 2.711 11.513 0.541 1.00 1.00 H new ATOM 0 HB3 ALA B 147 3.449 12.004 2.084 1.00 1.00 H new ATOM 1620 N CYS B 148 6.361 9.478 2.414 1.00 1.00 N ATOM 1621 CA CYS B 148 7.629 9.502 3.139 1.00 1.00 C ATOM 1622 C CYS B 148 8.888 9.364 2.245 1.00 1.00 C ATOM 1623 O CYS B 148 9.024 8.374 1.513 1.00 1.00 O ATOM 1624 CB CYS B 148 7.556 8.378 4.185 1.00 1.00 C ATOM 1625 SG CYS B 148 8.879 8.392 5.405 1.00 1.00 S ATOM 0 H CYS B 148 5.845 8.613 2.576 1.00 1.00 H new ATOM 0 HA CYS B 148 7.750 10.483 3.599 1.00 1.00 H new ATOM 0 HB2 CYS B 148 6.601 8.447 4.705 1.00 1.00 H new ATOM 0 HB3 CYS B 148 7.568 7.419 3.668 1.00 1.00 H new ATOM 1630 N LYS B 149 9.838 10.304 2.411 1.00 1.00 N ATOM 1631 CA LYS B 149 11.174 10.464 1.759 1.00 1.00 C ATOM 1632 C LYS B 149 11.941 11.705 2.264 1.00 1.00 C ATOM 1633 O LYS B 149 11.389 12.500 3.031 1.00 1.00 O ATOM 1634 CB LYS B 149 11.050 10.443 0.201 1.00 1.00 C ATOM 1635 CG LYS B 149 10.280 11.582 -0.517 1.00 1.00 C ATOM 1636 CD LYS B 149 11.016 12.932 -0.509 1.00 1.00 C ATOM 1637 CE LYS B 149 10.485 13.964 -1.519 1.00 1.00 C ATOM 1638 NZ LYS B 149 11.361 15.163 -1.500 1.00 1.00 N ATOM 0 H LYS B 149 9.681 11.060 3.078 1.00 1.00 H new ATOM 0 HA LYS B 149 11.774 9.603 2.053 1.00 1.00 H new ATOM 0 HB2 LYS B 149 12.060 10.423 -0.207 1.00 1.00 H new ATOM 0 HB3 LYS B 149 10.576 9.502 -0.077 1.00 1.00 H new ATOM 0 HG2 LYS B 149 10.094 11.287 -1.550 1.00 1.00 H new ATOM 0 HG3 LYS B 149 9.308 11.706 -0.041 1.00 1.00 H new ATOM 0 HD2 LYS B 149 10.952 13.358 0.492 1.00 1.00 H new ATOM 0 HD3 LYS B 149 12.072 12.755 -0.713 1.00 1.00 H new ATOM 0 HE2 LYS B 149 10.461 13.532 -2.520 1.00 1.00 H new ATOM 0 HE3 LYS B 149 9.462 14.243 -1.268 1.00 1.00 H new ATOM 0 HZ1 LYS B 149 10.801 15.998 -1.232 1.00 1.00 H new ATOM 0 HZ2 LYS B 149 12.126 15.023 -0.810 1.00 1.00 H new ATOM 0 HZ3 LYS B 149 11.770 15.309 -2.445 1.00 1.00 H new ATOM 1652 N ILE B 150 13.200 11.863 1.824 1.00 1.00 N ATOM 1653 CA ILE B 150 14.123 13.016 2.024 1.00 1.00 C ATOM 1654 C ILE B 150 13.491 14.402 1.751 1.00 1.00 C ATOM 1655 O ILE B 150 13.176 14.746 0.588 1.00 1.00 O ATOM 1656 CB ILE B 150 15.475 12.742 1.289 1.00 1.00 C ATOM 1657 CG1 ILE B 150 16.628 13.672 1.747 1.00 1.00 C ATOM 1658 CG2 ILE B 150 15.335 12.786 -0.242 1.00 1.00 C ATOM 1659 CD1 ILE B 150 17.270 13.239 3.074 1.00 1.00 C ATOM 1660 OXT ILE B 150 13.249 15.152 2.721 1.00 1.00 O ATOM 0 H ILE B 150 13.646 11.131 1.271 1.00 1.00 H new ATOM 0 HA ILE B 150 14.345 13.089 3.089 1.00 1.00 H new ATOM 0 HB ILE B 150 15.743 11.726 1.579 1.00 1.00 H new ATOM 0 HG12 ILE B 150 17.394 13.697 0.972 1.00 1.00 H new ATOM 0 HG13 ILE B 150 16.246 14.688 1.851 1.00 1.00 H new ATOM 0 HG21 ILE B 150 16.303 12.589 -0.702 1.00 1.00 H new ATOM 0 HG22 ILE B 150 14.620 12.029 -0.564 1.00 1.00 H new ATOM 0 HG23 ILE B 150 14.982 13.771 -0.547 1.00 1.00 H new ATOM 0 HD11 ILE B 150 18.069 13.933 3.335 1.00 1.00 H new ATOM 0 HD12 ILE B 150 16.516 13.241 3.861 1.00 1.00 H new ATOM 0 HD13 ILE B 150 17.682 12.235 2.969 1.00 1.00 H new TER 1672 ILE B 150