USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1309 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 139 SER OG : rot 149:sc= -0.0641 USER MOD Set 1.2: A 140 SER OG : rot -147:sc= 0.558 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot -109:sc= -0.0621 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0219 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -1.78 K(o=-1.8,f=-4.2!) USER MOD Single : A 24 LYS NZ :NH3+ -178:sc= -0.635 (180deg=-0.642) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 CYS SG : rot 171:sc= 0.00286 USER MOD Single : A 42 HIS :FLIP no HD1:sc= 0.301 F(o=-1.7!,f=0.3) USER MOD Single : A 43 GLN : amide:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : A 45 MET CE :methyl -145:sc= -5.06! (180deg=-5.75!) USER MOD Single : A 54 THR OG1 : rot 80:sc= 1.06 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0243 USER MOD Single : A 61 SER OG : rot 180:sc= 0.0179 USER MOD Single : A 66 GLN : amide:sc= -1.14 K(o=-1.1,f=-2.3!) USER MOD Single : A 68 HIS : no HD1:sc= -0.278 X(o=-0.28,f=-0.44) USER MOD Single : A 70 THR OG1 : rot 91:sc= 0.0985 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN :FLIP amide:sc= -0.146 F(o=-0.87,f=-0.15) USER MOD Single : A 76 GLN : amide:sc= -0.439 X(o=-0.44,f=0) USER MOD Single : A 79 THR OG1 : rot 52:sc= 0.184 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot -64:sc= -0.615 USER MOD Single : A 87 GLN : amide:sc=-0.00039 K(o=-0.00039,f=-1.6!) USER MOD Single : A 91 ASN : amide:sc= -1.97! C(o=-2!,f=-8.4!) USER MOD Single : A 106 CYS SG : rot 89:sc= 0.942 USER MOD Single : A 109 SER OG : rot 180:sc= 0.0253 USER MOD Single : A 111 ASN : amide:sc= -0.285 K(o=-0.28,f=-2.9!) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -134:sc= -0.121 (180deg=-0.965) USER MOD Single : A 120 GLN : amide:sc= -2.65! C(o=-2.6!,f=-2.3!) USER MOD Single : A 122 GLN : amide:sc=-0.00184 K(o=-0.0018,f=-3.3!) USER MOD Single : A 125 MET CE :methyl 172:sc= -1.47 (180deg=-1.61) USER MOD Single : A 128 TYR OH : rot 96:sc= 0.0582 USER MOD Single : A 131 THR OG1 : rot 68:sc= 1.08 USER MOD Single : A 138 HIS : no HD1:sc= -0.261 X(o=-0.26,f=-0.34) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot -88:sc= -5.39! USER MOD Single : A 165 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 168 SER OG : rot 93:sc= 1.21 USER MOD Single : A 173 HIS : no HD1:sc= -0.316 K(o=-0.32,f=-4.1!) USER MOD Single : A 174 HIS : no HE2:sc= -0.794 K(o=-0.79,f=-1.8) USER MOD Single : A 175 HIS : no HD1:sc= -0.443 X(o=-0.44,f=-0.91!) USER MOD Single : A 176 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 177 HIS : no HD1:sc= -0.0176 X(o=-0.018,f=-0.01) USER MOD Single : A 178 HIS : no HD1:sc= -0.119 X(o=-0.12,f=-0.016) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -7.425 3.928 27.490 1.00 0.00 N ATOM 2 CA ALA A 1 -8.419 4.653 28.327 1.00 0.00 C ATOM 3 C ALA A 1 -8.669 6.056 27.787 1.00 0.00 C ATOM 4 O ALA A 1 -8.022 7.017 28.205 1.00 0.00 O ATOM 5 CB ALA A 1 -7.946 4.723 29.772 1.00 0.00 C ATOM 0 H1 ALA A 1 -7.273 2.976 27.879 1.00 0.00 H new ATOM 0 H2 ALA A 1 -7.781 3.851 26.516 1.00 0.00 H new ATOM 0 H3 ALA A 1 -6.525 4.450 27.489 1.00 0.00 H new ATOM 0 HA ALA A 1 -9.358 4.101 28.289 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -8.684 5.256 30.371 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -7.822 3.713 30.164 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -6.993 5.250 29.818 1.00 0.00 H new ATOM 13 N THR A 2 -9.608 6.169 26.853 1.00 0.00 N ATOM 14 CA THR A 2 -9.937 7.458 26.255 1.00 0.00 C ATOM 15 C THR A 2 -11.229 8.024 26.845 1.00 0.00 C ATOM 16 O THR A 2 -12.176 7.281 27.107 1.00 0.00 O ATOM 17 CB THR A 2 -10.060 7.324 24.733 1.00 0.00 C ATOM 18 OG1 THR A 2 -10.144 8.600 24.125 1.00 0.00 O ATOM 19 CG2 THR A 2 -11.266 6.524 24.283 1.00 0.00 C ATOM 0 H THR A 2 -10.154 5.385 26.494 1.00 0.00 H new ATOM 0 HA THR A 2 -9.128 8.153 26.483 1.00 0.00 H new ATOM 0 HB THR A 2 -9.162 6.790 24.424 1.00 0.00 H new ATOM 0 HG1 THR A 2 -11.053 8.743 23.788 1.00 0.00 H new ATOM 0 HG21 THR A 2 -11.284 6.474 23.194 1.00 0.00 H new ATOM 0 HG22 THR A 2 -11.207 5.515 24.692 1.00 0.00 H new ATOM 0 HG23 THR A 2 -12.176 7.007 24.639 1.00 0.00 H new ATOM 27 N PRO A 3 -11.288 9.351 27.063 1.00 0.00 N ATOM 28 CA PRO A 3 -12.474 10.005 27.623 1.00 0.00 C ATOM 29 C PRO A 3 -13.743 9.656 26.854 1.00 0.00 C ATOM 30 O PRO A 3 -14.728 9.200 27.434 1.00 0.00 O ATOM 31 CB PRO A 3 -12.160 11.497 27.488 1.00 0.00 C ATOM 32 CG PRO A 3 -10.673 11.571 27.470 1.00 0.00 C ATOM 33 CD PRO A 3 -10.206 10.318 26.782 1.00 0.00 C ATOM 0 HA PRO A 3 -12.665 9.690 28.649 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.588 11.911 26.575 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -12.575 12.066 28.320 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -10.333 12.459 26.937 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -10.273 11.633 28.482 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -10.073 10.473 25.711 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -9.249 9.976 27.176 1.00 0.00 H new ATOM 41 N ALA A 4 -13.710 9.873 25.542 1.00 0.00 N ATOM 42 CA ALA A 4 -14.856 9.583 24.688 1.00 0.00 C ATOM 43 C ALA A 4 -14.418 8.909 23.390 1.00 0.00 C ATOM 44 O ALA A 4 -13.239 8.607 23.202 1.00 0.00 O ATOM 45 CB ALA A 4 -15.626 10.860 24.389 1.00 0.00 C ATOM 0 H ALA A 4 -12.901 10.249 25.048 1.00 0.00 H new ATOM 0 HA ALA A 4 -15.510 8.893 25.221 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -16.479 10.630 23.751 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -15.979 11.299 25.322 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -14.972 11.568 23.880 1.00 0.00 H new ATOM 51 N SER A 5 -15.376 8.675 22.497 1.00 0.00 N ATOM 52 CA SER A 5 -15.091 8.036 21.216 1.00 0.00 C ATOM 53 C SER A 5 -15.885 8.696 20.092 1.00 0.00 C ATOM 54 O SER A 5 -17.106 8.825 20.175 1.00 0.00 O ATOM 55 CB SER A 5 -15.419 6.541 21.283 1.00 0.00 C ATOM 56 OG SER A 5 -14.239 5.753 21.341 1.00 0.00 O ATOM 0 H SER A 5 -16.357 8.918 22.637 1.00 0.00 H new ATOM 0 HA SER A 5 -14.029 8.157 21.005 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.035 6.341 22.160 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.006 6.256 20.410 1.00 0.00 H new ATOM 0 HG SER A 5 -14.481 4.804 21.385 1.00 0.00 H new ATOM 62 N ALA A 6 -15.183 9.112 19.042 1.00 0.00 N ATOM 63 CA ALA A 6 -15.821 9.757 17.900 1.00 0.00 C ATOM 64 C ALA A 6 -15.083 9.431 16.604 1.00 0.00 C ATOM 65 O ALA A 6 -13.911 9.054 16.626 1.00 0.00 O ATOM 66 CB ALA A 6 -15.881 11.263 18.110 1.00 0.00 C ATOM 0 H ALA A 6 -14.171 9.014 18.959 1.00 0.00 H new ATOM 0 HA ALA A 6 -16.837 9.372 17.817 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -16.360 11.732 17.250 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -16.456 11.482 19.009 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.870 11.655 18.221 1.00 0.00 H new ATOM 72 N PRO A 7 -15.762 9.572 15.454 1.00 0.00 N ATOM 73 CA PRO A 7 -15.165 9.289 14.144 1.00 0.00 C ATOM 74 C PRO A 7 -13.835 10.008 13.944 1.00 0.00 C ATOM 75 O PRO A 7 -13.756 11.233 14.050 1.00 0.00 O ATOM 76 CB PRO A 7 -16.209 9.812 13.157 1.00 0.00 C ATOM 77 CG PRO A 7 -17.499 9.743 13.899 1.00 0.00 C ATOM 78 CD PRO A 7 -17.164 10.015 15.339 1.00 0.00 C ATOM 0 HA PRO A 7 -14.936 8.230 14.022 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -15.985 10.833 12.847 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -16.239 9.204 12.253 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -18.208 10.478 13.518 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -17.963 8.763 13.785 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -17.273 11.071 15.584 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -17.817 9.462 16.015 1.00 0.00 H new ATOM 86 N ASP A 8 -12.790 9.239 13.656 1.00 0.00 N ATOM 87 CA ASP A 8 -11.460 9.798 13.440 1.00 0.00 C ATOM 88 C ASP A 8 -10.861 9.279 12.136 1.00 0.00 C ATOM 89 O ASP A 8 -11.476 8.473 11.436 1.00 0.00 O ATOM 90 CB ASP A 8 -10.545 9.446 14.618 1.00 0.00 C ATOM 91 CG ASP A 8 -9.401 10.430 14.787 1.00 0.00 C ATOM 92 OD1 ASP A 8 -9.286 11.359 13.960 1.00 0.00 O ATOM 93 OD2 ASP A 8 -8.617 10.270 15.747 1.00 0.00 O ATOM 0 H ASP A 8 -12.839 8.224 13.567 1.00 0.00 H new ATOM 0 HA ASP A 8 -11.549 10.882 13.369 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -11.134 9.419 15.535 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -10.139 8.445 14.471 1.00 0.00 H new ATOM 98 N THR A 9 -9.661 9.747 11.814 1.00 0.00 N ATOM 99 CA THR A 9 -8.977 9.333 10.595 1.00 0.00 C ATOM 100 C THR A 9 -8.495 7.889 10.706 1.00 0.00 C ATOM 101 O THR A 9 -8.497 7.144 9.725 1.00 0.00 O ATOM 102 CB THR A 9 -7.791 10.258 10.317 1.00 0.00 C ATOM 103 OG1 THR A 9 -8.049 11.567 10.796 1.00 0.00 O ATOM 104 CG2 THR A 9 -7.448 10.367 8.847 1.00 0.00 C ATOM 0 H THR A 9 -9.140 10.415 12.382 1.00 0.00 H new ATOM 0 HA THR A 9 -9.684 9.398 9.768 1.00 0.00 H new ATOM 0 HB THR A 9 -6.947 9.807 10.839 1.00 0.00 H new ATOM 0 HG1 THR A 9 -7.277 12.142 10.610 1.00 0.00 H new ATOM 0 HG21 THR A 9 -6.598 11.038 8.720 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.193 9.381 8.459 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.306 10.761 8.301 1.00 0.00 H new ATOM 112 N ARG A 10 -8.081 7.503 11.909 1.00 0.00 N ATOM 113 CA ARG A 10 -7.593 6.151 12.156 1.00 0.00 C ATOM 114 C ARG A 10 -8.639 5.112 11.764 1.00 0.00 C ATOM 115 O ARG A 10 -8.308 4.047 11.242 1.00 0.00 O ATOM 116 CB ARG A 10 -7.215 5.985 13.630 1.00 0.00 C ATOM 117 CG ARG A 10 -5.795 5.478 13.840 1.00 0.00 C ATOM 118 CD ARG A 10 -5.773 4.124 14.535 1.00 0.00 C ATOM 119 NE ARG A 10 -4.827 4.098 15.648 1.00 0.00 N ATOM 120 CZ ARG A 10 -3.533 3.805 15.522 1.00 0.00 C ATOM 121 NH1 ARG A 10 -3.021 3.505 14.335 1.00 0.00 N ATOM 122 NH2 ARG A 10 -2.747 3.818 16.590 1.00 0.00 N ATOM 0 H ARG A 10 -8.074 8.109 12.729 1.00 0.00 H new ATOM 0 HA ARG A 10 -6.707 5.993 11.541 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -7.328 6.944 14.136 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -7.913 5.292 14.100 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.291 5.400 12.877 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.236 6.200 14.434 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -6.772 3.888 14.902 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.507 3.350 13.815 1.00 0.00 H new ATOM 0 HE ARG A 10 -5.179 4.318 16.580 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -3.619 3.497 13.509 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -2.029 3.282 14.249 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -3.133 4.052 17.505 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -1.756 3.594 16.497 1.00 0.00 H new ATOM 136 N ALA A 11 -9.905 5.431 12.017 1.00 0.00 N ATOM 137 CA ALA A 11 -11.004 4.529 11.690 1.00 0.00 C ATOM 138 C ALA A 11 -10.945 4.104 10.227 1.00 0.00 C ATOM 139 O ALA A 11 -10.879 2.914 9.918 1.00 0.00 O ATOM 140 CB ALA A 11 -12.339 5.192 11.993 1.00 0.00 C ATOM 0 H ALA A 11 -10.195 6.309 12.448 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.905 3.636 12.307 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -13.150 4.508 11.744 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -12.388 5.443 13.053 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.437 6.101 11.400 1.00 0.00 H new ATOM 146 N LEU A 12 -10.966 5.085 9.330 1.00 0.00 N ATOM 147 CA LEU A 12 -10.912 4.812 7.899 1.00 0.00 C ATOM 148 C LEU A 12 -9.682 3.984 7.555 1.00 0.00 C ATOM 149 O LEU A 12 -9.729 3.114 6.686 1.00 0.00 O ATOM 150 CB LEU A 12 -10.901 6.121 7.110 1.00 0.00 C ATOM 151 CG LEU A 12 -12.266 6.565 6.586 1.00 0.00 C ATOM 152 CD1 LEU A 12 -12.276 8.063 6.327 1.00 0.00 C ATOM 153 CD2 LEU A 12 -12.625 5.794 5.325 1.00 0.00 C ATOM 0 H LEU A 12 -11.020 6.075 9.569 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.800 4.242 7.626 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -10.498 6.909 7.746 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -10.220 6.014 6.265 1.00 0.00 H new ATOM 0 HG LEU A 12 -13.018 6.348 7.345 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -13.256 8.361 5.954 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -12.064 8.594 7.255 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -11.516 8.309 5.586 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -13.600 6.121 4.964 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.873 5.980 4.558 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -12.660 4.728 5.548 1.00 0.00 H new ATOM 165 N VAL A 13 -8.582 4.256 8.247 1.00 0.00 N ATOM 166 CA VAL A 13 -7.343 3.529 8.015 1.00 0.00 C ATOM 167 C VAL A 13 -7.496 2.062 8.406 1.00 0.00 C ATOM 168 O VAL A 13 -7.236 1.167 7.604 1.00 0.00 O ATOM 169 CB VAL A 13 -6.169 4.148 8.801 1.00 0.00 C ATOM 170 CG1 VAL A 13 -4.856 3.489 8.406 1.00 0.00 C ATOM 171 CG2 VAL A 13 -6.105 5.653 8.572 1.00 0.00 C ATOM 0 H VAL A 13 -8.524 4.972 8.971 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.124 3.599 6.950 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.335 3.971 9.864 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.039 3.938 8.971 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.904 2.422 8.624 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.683 3.634 7.340 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.271 6.071 9.135 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -5.964 5.854 7.510 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -7.035 6.112 8.907 1.00 0.00 H new ATOM 181 N ALA A 14 -7.929 1.825 9.642 1.00 0.00 N ATOM 182 CA ALA A 14 -8.123 0.466 10.140 1.00 0.00 C ATOM 183 C ALA A 14 -9.230 -0.258 9.378 1.00 0.00 C ATOM 184 O ALA A 14 -9.231 -1.486 9.286 1.00 0.00 O ATOM 185 CB ALA A 14 -8.438 0.490 11.629 1.00 0.00 C ATOM 0 H ALA A 14 -8.152 2.557 10.317 1.00 0.00 H new ATOM 0 HA ALA A 14 -7.195 -0.082 9.980 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -8.580 -0.530 11.987 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -7.611 0.952 12.168 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.348 1.065 11.799 1.00 0.00 H new ATOM 191 N ASP A 15 -10.173 0.505 8.836 1.00 0.00 N ATOM 192 CA ASP A 15 -11.283 -0.072 8.085 1.00 0.00 C ATOM 193 C ASP A 15 -10.787 -0.703 6.788 1.00 0.00 C ATOM 194 O ASP A 15 -11.022 -1.884 6.531 1.00 0.00 O ATOM 195 CB ASP A 15 -12.333 1.000 7.783 1.00 0.00 C ATOM 196 CG ASP A 15 -13.654 0.727 8.477 1.00 0.00 C ATOM 197 OD1 ASP A 15 -13.637 0.438 9.692 1.00 0.00 O ATOM 198 OD2 ASP A 15 -14.704 0.802 7.806 1.00 0.00 O ATOM 0 H ASP A 15 -10.191 1.523 8.902 1.00 0.00 H new ATOM 0 HA ASP A 15 -11.740 -0.852 8.694 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -11.955 1.973 8.096 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -12.495 1.053 6.706 1.00 0.00 H new ATOM 203 N PHE A 16 -10.100 0.089 5.974 1.00 0.00 N ATOM 204 CA PHE A 16 -9.572 -0.396 4.706 1.00 0.00 C ATOM 205 C PHE A 16 -8.599 -1.550 4.922 1.00 0.00 C ATOM 206 O PHE A 16 -8.490 -2.447 4.087 1.00 0.00 O ATOM 207 CB PHE A 16 -8.871 0.735 3.956 1.00 0.00 C ATOM 208 CG PHE A 16 -8.432 0.351 2.572 1.00 0.00 C ATOM 209 CD1 PHE A 16 -9.340 0.340 1.531 1.00 0.00 C ATOM 210 CD2 PHE A 16 -7.116 0.005 2.313 1.00 0.00 C ATOM 211 CE1 PHE A 16 -8.950 -0.008 0.254 1.00 0.00 C ATOM 212 CE2 PHE A 16 -6.718 -0.346 1.037 1.00 0.00 C ATOM 213 CZ PHE A 16 -7.636 -0.351 0.005 1.00 0.00 C ATOM 0 H PHE A 16 -9.896 1.069 6.169 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.411 -0.757 4.111 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.544 1.590 3.891 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.001 1.056 4.529 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.369 0.607 1.719 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.394 0.010 3.116 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.672 -0.012 -0.550 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.690 -0.616 0.847 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.327 -0.622 -0.994 1.00 0.00 H new ATOM 223 N VAL A 17 -7.891 -1.517 6.047 1.00 0.00 N ATOM 224 CA VAL A 17 -6.925 -2.561 6.368 1.00 0.00 C ATOM 225 C VAL A 17 -7.628 -3.851 6.783 1.00 0.00 C ATOM 226 O VAL A 17 -7.461 -4.892 6.148 1.00 0.00 O ATOM 227 CB VAL A 17 -5.968 -2.118 7.496 1.00 0.00 C ATOM 228 CG1 VAL A 17 -4.962 -3.216 7.813 1.00 0.00 C ATOM 229 CG2 VAL A 17 -5.255 -0.824 7.121 1.00 0.00 C ATOM 0 H VAL A 17 -7.968 -0.781 6.749 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.344 -2.743 5.464 1.00 0.00 H new ATOM 0 HB VAL A 17 -6.561 -1.933 8.392 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -4.298 -2.882 8.610 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.492 -4.113 8.134 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.375 -3.440 6.922 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -4.586 -0.530 7.930 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -4.677 -0.978 6.210 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.991 -0.038 6.955 1.00 0.00 H new ATOM 239 N GLY A 18 -8.415 -3.775 7.854 1.00 0.00 N ATOM 240 CA GLY A 18 -9.132 -4.943 8.340 1.00 0.00 C ATOM 241 C GLY A 18 -9.865 -5.687 7.240 1.00 0.00 C ATOM 242 O GLY A 18 -9.784 -6.912 7.150 1.00 0.00 O ATOM 0 H GLY A 18 -8.569 -2.924 8.395 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.428 -5.620 8.823 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.848 -4.633 9.101 1.00 0.00 H new ATOM 246 N TYR A 19 -10.578 -4.945 6.401 1.00 0.00 N ATOM 247 CA TYR A 19 -11.324 -5.541 5.302 1.00 0.00 C ATOM 248 C TYR A 19 -10.377 -6.209 4.310 1.00 0.00 C ATOM 249 O TYR A 19 -10.583 -7.356 3.912 1.00 0.00 O ATOM 250 CB TYR A 19 -12.162 -4.476 4.592 1.00 0.00 C ATOM 251 CG TYR A 19 -13.416 -4.085 5.346 1.00 0.00 C ATOM 252 CD1 TYR A 19 -13.349 -3.610 6.651 1.00 0.00 C ATOM 253 CD2 TYR A 19 -14.667 -4.190 4.751 1.00 0.00 C ATOM 254 CE1 TYR A 19 -14.492 -3.250 7.340 1.00 0.00 C ATOM 255 CE2 TYR A 19 -15.815 -3.831 5.434 1.00 0.00 C ATOM 256 CZ TYR A 19 -15.722 -3.363 6.727 1.00 0.00 C ATOM 257 OH TYR A 19 -16.863 -3.005 7.410 1.00 0.00 O ATOM 0 H TYR A 19 -10.655 -3.930 6.462 1.00 0.00 H new ATOM 0 HA TYR A 19 -11.990 -6.301 5.711 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -11.550 -3.588 4.438 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -12.442 -4.845 3.605 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -12.387 -3.521 7.135 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -14.744 -4.558 3.739 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -14.422 -2.882 8.353 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -16.780 -3.917 4.956 1.00 0.00 H new ATOM 0 HH TYR A 19 -17.645 -3.144 6.836 1.00 0.00 H new ATOM 267 N LYS A 20 -9.333 -5.484 3.918 1.00 0.00 N ATOM 268 CA LYS A 20 -8.349 -6.006 2.977 1.00 0.00 C ATOM 269 C LYS A 20 -7.678 -7.262 3.528 1.00 0.00 C ATOM 270 O LYS A 20 -7.174 -8.089 2.768 1.00 0.00 O ATOM 271 CB LYS A 20 -7.294 -4.944 2.663 1.00 0.00 C ATOM 272 CG LYS A 20 -6.529 -5.214 1.377 1.00 0.00 C ATOM 273 CD LYS A 20 -5.028 -5.250 1.615 1.00 0.00 C ATOM 274 CE LYS A 20 -4.404 -3.876 1.436 1.00 0.00 C ATOM 275 NZ LYS A 20 -3.806 -3.710 0.083 1.00 0.00 N ATOM 0 H LYS A 20 -9.147 -4.533 4.238 1.00 0.00 H new ATOM 0 HA LYS A 20 -8.871 -6.270 2.057 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.779 -3.971 2.591 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.588 -4.887 3.492 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.853 -6.164 0.953 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.763 -4.441 0.645 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -4.827 -5.614 2.623 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -4.565 -5.954 0.923 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.163 -3.109 1.594 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -3.635 -3.725 2.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -3.391 -2.760 0.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -3.064 -4.425 -0.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -4.544 -3.829 -0.640 1.00 0.00 H new ATOM 289 N LEU A 21 -7.681 -7.403 4.851 1.00 0.00 N ATOM 290 CA LEU A 21 -7.077 -8.566 5.492 1.00 0.00 C ATOM 291 C LEU A 21 -8.001 -9.773 5.368 1.00 0.00 C ATOM 292 O LEU A 21 -7.577 -10.851 4.949 1.00 0.00 O ATOM 293 CB LEU A 21 -6.786 -8.272 6.972 1.00 0.00 C ATOM 294 CG LEU A 21 -5.532 -8.942 7.554 1.00 0.00 C ATOM 295 CD1 LEU A 21 -5.329 -8.517 9.001 1.00 0.00 C ATOM 296 CD2 LEU A 21 -5.623 -10.461 7.466 1.00 0.00 C ATOM 0 H LEU A 21 -8.093 -6.730 5.497 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.135 -8.789 4.990 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -6.689 -7.193 7.096 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.648 -8.585 7.561 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.676 -8.618 6.961 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -4.437 -9.000 9.400 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -5.208 -7.435 9.049 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -6.196 -8.812 9.592 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.720 -10.905 7.886 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -6.492 -10.807 8.026 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.722 -10.760 6.422 1.00 0.00 H new ATOM 308 N ARG A 22 -9.268 -9.584 5.719 1.00 0.00 N ATOM 309 CA ARG A 22 -10.248 -10.662 5.637 1.00 0.00 C ATOM 310 C ARG A 22 -10.656 -10.941 4.189 1.00 0.00 C ATOM 311 O ARG A 22 -11.385 -11.894 3.916 1.00 0.00 O ATOM 312 CB ARG A 22 -11.483 -10.326 6.475 1.00 0.00 C ATOM 313 CG ARG A 22 -12.263 -11.553 6.918 1.00 0.00 C ATOM 314 CD ARG A 22 -11.878 -11.977 8.326 1.00 0.00 C ATOM 315 NE ARG A 22 -12.837 -12.922 8.897 1.00 0.00 N ATOM 316 CZ ARG A 22 -12.600 -14.223 9.074 1.00 0.00 C ATOM 317 NH1 ARG A 22 -11.444 -14.761 8.706 1.00 0.00 N ATOM 318 NH2 ARG A 22 -13.532 -14.992 9.623 1.00 0.00 N ATOM 0 H ARG A 22 -9.640 -8.698 6.062 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.781 -11.563 6.035 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.173 -9.764 7.356 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.140 -9.676 5.897 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -13.331 -11.340 6.880 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -12.077 -12.374 6.226 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -10.888 -12.432 8.309 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.813 -11.096 8.965 1.00 0.00 H new ATOM 0 HE ARG A 22 -13.749 -12.562 9.179 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.722 -14.178 8.282 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.277 -15.757 8.848 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -14.424 -14.588 9.907 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -13.356 -15.987 9.761 1.00 0.00 H new ATOM 332 N GLN A 23 -10.179 -10.113 3.261 1.00 0.00 N ATOM 333 CA GLN A 23 -10.497 -10.286 1.848 1.00 0.00 C ATOM 334 C GLN A 23 -9.876 -11.569 1.294 1.00 0.00 C ATOM 335 O GLN A 23 -10.255 -12.036 0.220 1.00 0.00 O ATOM 336 CB GLN A 23 -10.011 -9.078 1.043 1.00 0.00 C ATOM 337 CG GLN A 23 -11.141 -8.224 0.494 1.00 0.00 C ATOM 338 CD GLN A 23 -10.782 -6.754 0.422 1.00 0.00 C ATOM 339 OE1 GLN A 23 -10.959 -6.012 1.389 1.00 0.00 O ATOM 340 NE2 GLN A 23 -10.276 -6.323 -0.727 1.00 0.00 N ATOM 0 H GLN A 23 -9.573 -9.318 3.463 1.00 0.00 H new ATOM 0 HA GLN A 23 -11.580 -10.365 1.755 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -9.374 -8.461 1.677 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -9.394 -9.427 0.215 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -11.407 -8.578 -0.502 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -12.023 -8.348 1.123 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -10.146 -6.973 -1.503 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -10.017 -5.342 -0.834 1.00 0.00 H new ATOM 349 N LYS A 24 -8.919 -12.132 2.028 1.00 0.00 N ATOM 350 CA LYS A 24 -8.254 -13.355 1.602 1.00 0.00 C ATOM 351 C LYS A 24 -8.986 -14.590 2.121 1.00 0.00 C ATOM 352 O LYS A 24 -8.845 -15.682 1.571 1.00 0.00 O ATOM 353 CB LYS A 24 -6.801 -13.360 2.084 1.00 0.00 C ATOM 354 CG LYS A 24 -5.786 -13.566 0.970 1.00 0.00 C ATOM 355 CD LYS A 24 -5.982 -12.572 -0.168 1.00 0.00 C ATOM 356 CE LYS A 24 -6.024 -13.266 -1.524 1.00 0.00 C ATOM 357 NZ LYS A 24 -7.165 -14.218 -1.635 1.00 0.00 N ATOM 0 H LYS A 24 -8.589 -11.760 2.918 1.00 0.00 H new ATOM 0 HA LYS A 24 -8.269 -13.387 0.513 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.591 -12.415 2.584 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.677 -14.148 2.826 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.779 -13.462 1.373 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.872 -14.582 0.584 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.909 -12.020 -0.013 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.172 -11.843 -0.158 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -6.101 -12.516 -2.311 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.089 -13.802 -1.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -7.134 -14.691 -2.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.098 -14.930 -0.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.061 -13.698 -1.542 1.00 0.00 H new ATOM 371 N GLY A 25 -9.772 -14.413 3.181 1.00 0.00 N ATOM 372 CA GLY A 25 -10.514 -15.524 3.748 1.00 0.00 C ATOM 373 C GLY A 25 -11.993 -15.457 3.418 1.00 0.00 C ATOM 374 O GLY A 25 -12.617 -16.476 3.122 1.00 0.00 O ATOM 0 H GLY A 25 -9.907 -13.520 3.656 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.103 -16.461 3.374 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.385 -15.529 4.830 1.00 0.00 H new ATOM 378 N TYR A 26 -12.554 -14.253 3.471 1.00 0.00 N ATOM 379 CA TYR A 26 -13.969 -14.055 3.177 1.00 0.00 C ATOM 380 C TYR A 26 -14.200 -12.734 2.444 1.00 0.00 C ATOM 381 O TYR A 26 -14.043 -11.658 3.020 1.00 0.00 O ATOM 382 CB TYR A 26 -14.785 -14.082 4.471 1.00 0.00 C ATOM 383 CG TYR A 26 -16.116 -14.787 4.336 1.00 0.00 C ATOM 384 CD1 TYR A 26 -16.913 -14.599 3.213 1.00 0.00 C ATOM 385 CD2 TYR A 26 -16.575 -15.639 5.332 1.00 0.00 C ATOM 386 CE1 TYR A 26 -18.129 -15.242 3.088 1.00 0.00 C ATOM 387 CE2 TYR A 26 -17.790 -16.287 5.213 1.00 0.00 C ATOM 388 CZ TYR A 26 -18.564 -16.084 4.090 1.00 0.00 C ATOM 389 OH TYR A 26 -19.775 -16.726 3.968 1.00 0.00 O ATOM 0 H TYR A 26 -12.051 -13.400 3.715 1.00 0.00 H new ATOM 0 HA TYR A 26 -14.295 -14.868 2.528 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -14.201 -14.574 5.248 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -14.958 -13.058 4.802 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -16.576 -13.940 2.426 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -15.973 -15.798 6.214 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -18.737 -15.086 2.209 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -18.131 -16.949 5.995 1.00 0.00 H new ATOM 0 HH TYR A 26 -19.931 -17.282 4.759 1.00 0.00 H new ATOM 399 N VAL A 27 -14.575 -12.826 1.170 1.00 0.00 N ATOM 400 CA VAL A 27 -14.833 -11.643 0.357 1.00 0.00 C ATOM 401 C VAL A 27 -15.998 -10.837 0.926 1.00 0.00 C ATOM 402 O VAL A 27 -16.955 -11.400 1.458 1.00 0.00 O ATOM 403 CB VAL A 27 -15.136 -12.033 -1.108 1.00 0.00 C ATOM 404 CG1 VAL A 27 -16.291 -13.016 -1.171 1.00 0.00 C ATOM 405 CG2 VAL A 27 -15.429 -10.805 -1.965 1.00 0.00 C ATOM 0 H VAL A 27 -14.707 -13.710 0.679 1.00 0.00 H new ATOM 0 HA VAL A 27 -13.934 -11.027 0.377 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.246 -12.515 -1.513 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -16.489 -13.278 -2.210 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -16.034 -13.916 -0.612 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -17.181 -12.561 -0.736 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -15.638 -11.117 -2.988 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -16.294 -10.279 -1.563 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -14.565 -10.141 -1.957 1.00 0.00 H new ATOM 415 N CYS A 28 -15.909 -9.517 0.808 1.00 0.00 N ATOM 416 CA CYS A 28 -16.952 -8.630 1.306 1.00 0.00 C ATOM 417 C CYS A 28 -17.229 -7.516 0.303 1.00 0.00 C ATOM 418 O CYS A 28 -16.374 -7.173 -0.512 1.00 0.00 O ATOM 419 CB CYS A 28 -16.545 -8.030 2.655 1.00 0.00 C ATOM 420 SG CYS A 28 -14.850 -7.404 2.704 1.00 0.00 S ATOM 0 H CYS A 28 -15.123 -9.037 0.370 1.00 0.00 H new ATOM 0 HA CYS A 28 -17.862 -9.214 1.441 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -17.228 -7.217 2.900 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -16.663 -8.789 3.428 1.00 0.00 H new ATOM 0 HG CYS A 28 -14.662 -6.748 3.810 1.00 0.00 H new ATOM 426 N GLY A 29 -18.431 -6.957 0.368 1.00 0.00 N ATOM 427 CA GLY A 29 -18.799 -5.887 -0.542 1.00 0.00 C ATOM 428 C GLY A 29 -19.863 -4.980 0.039 1.00 0.00 C ATOM 429 O GLY A 29 -20.232 -5.114 1.205 1.00 0.00 O ATOM 0 H GLY A 29 -19.157 -7.224 1.033 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -17.914 -5.298 -0.783 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -19.161 -6.316 -1.476 1.00 0.00 H new ATOM 433 N ALA A 30 -20.358 -4.055 -0.775 1.00 0.00 N ATOM 434 CA ALA A 30 -21.388 -3.126 -0.332 1.00 0.00 C ATOM 435 C ALA A 30 -22.605 -3.184 -1.245 1.00 0.00 C ATOM 436 O ALA A 30 -22.567 -3.800 -2.310 1.00 0.00 O ATOM 437 CB ALA A 30 -20.839 -1.709 -0.279 1.00 0.00 C ATOM 0 H ALA A 30 -20.063 -3.929 -1.743 1.00 0.00 H new ATOM 0 HA ALA A 30 -21.698 -3.421 0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -21.622 -1.028 0.054 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -20.002 -1.669 0.418 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -20.499 -1.413 -1.271 1.00 0.00 H new ATOM 443 N GLY A 31 -23.684 -2.539 -0.819 1.00 0.00 N ATOM 444 CA GLY A 31 -24.897 -2.530 -1.608 1.00 0.00 C ATOM 445 C GLY A 31 -25.347 -1.126 -1.967 1.00 0.00 C ATOM 446 O GLY A 31 -25.921 -0.429 -1.131 1.00 0.00 O ATOM 0 H GLY A 31 -23.739 -2.023 0.059 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -24.736 -3.101 -2.522 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -25.690 -3.032 -1.054 1.00 0.00 H new ATOM 450 N PRO A 32 -25.105 -0.675 -3.211 1.00 0.00 N ATOM 451 CA PRO A 32 -25.505 0.665 -3.656 1.00 0.00 C ATOM 452 C PRO A 32 -27.019 0.812 -3.821 1.00 0.00 C ATOM 453 O PRO A 32 -27.486 1.617 -4.628 1.00 0.00 O ATOM 454 CB PRO A 32 -24.806 0.813 -5.010 1.00 0.00 C ATOM 455 CG PRO A 32 -24.640 -0.582 -5.504 1.00 0.00 C ATOM 456 CD PRO A 32 -24.424 -1.431 -4.280 1.00 0.00 C ATOM 0 HA PRO A 32 -25.230 1.427 -2.927 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -25.402 1.409 -5.701 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -23.843 1.314 -4.906 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -25.522 -0.909 -6.055 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -23.793 -0.657 -6.185 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -24.851 -2.427 -4.402 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -23.364 -1.563 -4.065 1.00 0.00 H new ATOM 464 N GLY A 33 -27.783 0.036 -3.052 1.00 0.00 N ATOM 465 CA GLY A 33 -29.229 0.105 -3.130 1.00 0.00 C ATOM 466 C GLY A 33 -29.840 0.771 -1.914 1.00 0.00 C ATOM 467 O GLY A 33 -30.865 1.444 -2.016 1.00 0.00 O ATOM 0 H GLY A 33 -27.423 -0.639 -2.377 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -29.516 0.656 -4.026 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -29.634 -0.902 -3.231 1.00 0.00 H new ATOM 471 N GLU A 34 -29.208 0.584 -0.759 1.00 0.00 N ATOM 472 CA GLU A 34 -29.695 1.174 0.484 1.00 0.00 C ATOM 473 C GLU A 34 -28.708 2.213 1.018 1.00 0.00 C ATOM 474 O GLU A 34 -28.364 2.211 2.200 1.00 0.00 O ATOM 475 CB GLU A 34 -29.934 0.081 1.530 1.00 0.00 C ATOM 476 CG GLU A 34 -31.398 -0.094 1.897 1.00 0.00 C ATOM 477 CD GLU A 34 -32.121 -1.052 0.971 1.00 0.00 C ATOM 478 OE1 GLU A 34 -31.472 -1.990 0.464 1.00 0.00 O ATOM 479 OE2 GLU A 34 -33.336 -0.863 0.754 1.00 0.00 O ATOM 0 H GLU A 34 -28.358 0.029 -0.658 1.00 0.00 H new ATOM 0 HA GLU A 34 -30.639 1.677 0.277 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -29.547 -0.865 1.151 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -29.368 0.320 2.430 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -31.471 -0.460 2.921 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -31.894 0.876 1.869 1.00 0.00 H new ATOM 486 N GLY A 35 -28.259 3.102 0.136 1.00 0.00 N ATOM 487 CA GLY A 35 -27.319 4.136 0.535 1.00 0.00 C ATOM 488 C GLY A 35 -27.913 5.530 0.435 1.00 0.00 C ATOM 489 O GLY A 35 -27.765 6.196 -0.590 1.00 0.00 O ATOM 0 H GLY A 35 -28.529 3.125 -0.847 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -26.997 3.954 1.560 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -26.430 4.077 -0.093 1.00 0.00 H new ATOM 493 N PRO A 36 -28.597 6.003 1.491 1.00 0.00 N ATOM 494 CA PRO A 36 -29.213 7.334 1.502 1.00 0.00 C ATOM 495 C PRO A 36 -28.225 8.433 1.126 1.00 0.00 C ATOM 496 O PRO A 36 -28.409 9.133 0.130 1.00 0.00 O ATOM 497 CB PRO A 36 -29.675 7.504 2.952 1.00 0.00 C ATOM 498 CG PRO A 36 -29.857 6.114 3.457 1.00 0.00 C ATOM 499 CD PRO A 36 -28.824 5.277 2.755 1.00 0.00 C ATOM 0 HA PRO A 36 -30.019 7.414 0.773 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -28.936 8.046 3.542 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -30.605 8.070 3.007 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -29.724 6.072 4.538 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -30.863 5.751 3.245 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -27.908 5.194 3.341 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -29.182 4.263 2.577 1.00 0.00 H new ATOM 507 N ALA A 37 -27.174 8.581 1.927 1.00 0.00 N ATOM 508 CA ALA A 37 -26.159 9.596 1.674 1.00 0.00 C ATOM 509 C ALA A 37 -25.021 9.034 0.830 1.00 0.00 C ATOM 510 O ALA A 37 -24.535 7.931 1.079 1.00 0.00 O ATOM 511 CB ALA A 37 -25.622 10.146 2.986 1.00 0.00 C ATOM 0 H ALA A 37 -27.004 8.011 2.756 1.00 0.00 H new ATOM 0 HA ALA A 37 -26.625 10.408 1.116 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -24.865 10.903 2.781 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -26.438 10.593 3.554 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -25.178 9.336 3.565 1.00 0.00 H new ATOM 517 N ALA A 38 -24.602 9.800 -0.172 1.00 0.00 N ATOM 518 CA ALA A 38 -23.522 9.377 -1.054 1.00 0.00 C ATOM 519 C ALA A 38 -22.186 9.386 -0.325 1.00 0.00 C ATOM 520 O ALA A 38 -21.645 10.446 -0.007 1.00 0.00 O ATOM 521 CB ALA A 38 -23.459 10.269 -2.284 1.00 0.00 C ATOM 0 H ALA A 38 -24.994 10.716 -0.393 1.00 0.00 H new ATOM 0 HA ALA A 38 -23.728 8.355 -1.373 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -22.647 9.939 -2.932 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -24.403 10.209 -2.826 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -23.282 11.300 -1.977 1.00 0.00 H new ATOM 527 N ASP A 39 -21.657 8.197 -0.063 1.00 0.00 N ATOM 528 CA ASP A 39 -20.381 8.067 0.627 1.00 0.00 C ATOM 529 C ASP A 39 -19.473 7.071 -0.089 1.00 0.00 C ATOM 530 O ASP A 39 -19.426 5.896 0.272 1.00 0.00 O ATOM 531 CB ASP A 39 -20.600 7.621 2.075 1.00 0.00 C ATOM 532 CG ASP A 39 -20.973 8.773 2.988 1.00 0.00 C ATOM 533 OD1 ASP A 39 -22.102 9.290 2.860 1.00 0.00 O ATOM 534 OD2 ASP A 39 -20.137 9.156 3.834 1.00 0.00 O ATOM 0 H ASP A 39 -22.092 7.310 -0.318 1.00 0.00 H new ATOM 0 HA ASP A 39 -19.896 9.043 0.624 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -21.388 6.868 2.105 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -19.692 7.146 2.447 1.00 0.00 H new ATOM 539 N PRO A 40 -18.732 7.530 -1.112 1.00 0.00 N ATOM 540 CA PRO A 40 -17.812 6.673 -1.873 1.00 0.00 C ATOM 541 C PRO A 40 -16.586 6.260 -1.060 1.00 0.00 C ATOM 542 O PRO A 40 -15.468 6.242 -1.574 1.00 0.00 O ATOM 543 CB PRO A 40 -17.392 7.559 -3.047 1.00 0.00 C ATOM 544 CG PRO A 40 -17.553 8.952 -2.543 1.00 0.00 C ATOM 545 CD PRO A 40 -18.728 8.919 -1.605 1.00 0.00 C ATOM 0 HA PRO A 40 -18.285 5.737 -2.169 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -16.362 7.361 -3.344 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -18.016 7.379 -3.922 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -16.652 9.288 -2.029 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -17.729 9.647 -3.365 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -18.612 9.634 -0.791 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -19.658 9.166 -2.117 1.00 0.00 H new ATOM 553 N LEU A 41 -16.805 5.927 0.210 1.00 0.00 N ATOM 554 CA LEU A 41 -15.726 5.512 1.098 1.00 0.00 C ATOM 555 C LEU A 41 -15.011 4.287 0.557 1.00 0.00 C ATOM 556 O LEU A 41 -13.824 4.334 0.232 1.00 0.00 O ATOM 557 CB LEU A 41 -16.287 5.196 2.484 1.00 0.00 C ATOM 558 CG LEU A 41 -16.752 6.405 3.292 1.00 0.00 C ATOM 559 CD1 LEU A 41 -17.786 5.989 4.329 1.00 0.00 C ATOM 560 CD2 LEU A 41 -15.566 7.083 3.957 1.00 0.00 C ATOM 0 H LEU A 41 -17.726 5.937 0.648 1.00 0.00 H new ATOM 0 HA LEU A 41 -15.011 6.332 1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -17.127 4.511 2.370 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -15.522 4.670 3.056 1.00 0.00 H new ATOM 0 HG LEU A 41 -17.220 7.118 2.613 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -18.106 6.864 4.895 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -18.647 5.547 3.827 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -17.347 5.258 5.008 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -15.913 7.943 4.530 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -15.071 6.378 4.625 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.862 7.415 3.194 1.00 0.00 H new ATOM 572 N HIS A 42 -15.749 3.188 0.468 1.00 0.00 N ATOM 573 CA HIS A 42 -15.199 1.940 -0.033 1.00 0.00 C ATOM 574 C HIS A 42 -14.861 2.071 -1.509 1.00 0.00 C ATOM 575 O HIS A 42 -13.953 1.409 -2.007 1.00 0.00 O ATOM 576 CB HIS A 42 -16.190 0.786 0.171 1.00 0.00 C ATOM 577 CG HIS A 42 -16.967 0.855 1.455 1.00 0.00 C ATOM 578 ND1 HIS A 42 -17.962 1.686 1.852 1.00 0.00 N flip ATOM 579 CD2 HIS A 42 -16.762 -0.014 2.502 1.00 0.00 C flip ATOM 580 CE1 HIS A 42 -18.333 1.305 3.119 1.00 0.00 C flip ATOM 581 NE2 HIS A 42 -17.594 0.275 3.485 1.00 0.00 N flip ATOM 0 H HIS A 42 -16.732 3.138 0.737 1.00 0.00 H new ATOM 0 HA HIS A 42 -14.290 1.721 0.527 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -16.891 0.773 -0.664 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -15.643 -0.156 0.142 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -16.032 -0.810 2.517 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -19.102 1.771 3.716 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -17.655 -0.215 4.377 1.00 0.00 H new ATOM 589 N GLN A 43 -15.596 2.938 -2.204 1.00 0.00 N ATOM 590 CA GLN A 43 -15.374 3.161 -3.625 1.00 0.00 C ATOM 591 C GLN A 43 -13.977 3.705 -3.875 1.00 0.00 C ATOM 592 O GLN A 43 -13.205 3.123 -4.632 1.00 0.00 O ATOM 593 CB GLN A 43 -16.409 4.136 -4.185 1.00 0.00 C ATOM 594 CG GLN A 43 -17.741 3.488 -4.515 1.00 0.00 C ATOM 595 CD GLN A 43 -17.923 3.251 -6.001 1.00 0.00 C ATOM 596 OE1 GLN A 43 -19.005 3.464 -6.547 1.00 0.00 O ATOM 597 NE2 GLN A 43 -16.861 2.809 -6.667 1.00 0.00 N ATOM 0 H GLN A 43 -16.350 3.496 -1.803 1.00 0.00 H new ATOM 0 HA GLN A 43 -15.476 2.202 -4.132 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -16.573 4.934 -3.461 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -16.008 4.600 -5.086 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -17.819 2.537 -3.987 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -18.549 4.122 -4.151 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -15.982 2.645 -6.175 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -16.925 2.633 -7.670 1.00 0.00 H new ATOM 606 N ALA A 44 -13.666 4.829 -3.238 1.00 0.00 N ATOM 607 CA ALA A 44 -12.370 5.467 -3.390 1.00 0.00 C ATOM 608 C ALA A 44 -11.246 4.556 -2.922 1.00 0.00 C ATOM 609 O ALA A 44 -10.312 4.263 -3.669 1.00 0.00 O ATOM 610 CB ALA A 44 -12.354 6.776 -2.618 1.00 0.00 C ATOM 0 H ALA A 44 -14.302 5.318 -2.607 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.206 5.671 -4.448 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -11.381 7.254 -2.733 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -13.130 7.436 -3.005 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.539 6.578 -1.562 1.00 0.00 H new ATOM 616 N MET A 45 -11.347 4.114 -1.680 1.00 0.00 N ATOM 617 CA MET A 45 -10.351 3.235 -1.089 1.00 0.00 C ATOM 618 C MET A 45 -10.068 2.030 -1.990 1.00 0.00 C ATOM 619 O MET A 45 -8.916 1.751 -2.325 1.00 0.00 O ATOM 620 CB MET A 45 -10.845 2.771 0.279 1.00 0.00 C ATOM 621 CG MET A 45 -10.001 3.277 1.436 1.00 0.00 C ATOM 622 SD MET A 45 -9.874 5.077 1.464 1.00 0.00 S ATOM 623 CE MET A 45 -10.453 5.432 3.120 1.00 0.00 C ATOM 0 H MET A 45 -12.117 4.352 -1.055 1.00 0.00 H new ATOM 0 HA MET A 45 -9.417 3.786 -0.977 1.00 0.00 H new ATOM 0 HB2 MET A 45 -11.873 3.106 0.417 1.00 0.00 H new ATOM 0 HB3 MET A 45 -10.859 1.681 0.300 1.00 0.00 H new ATOM 0 HG2 MET A 45 -10.434 2.932 2.375 1.00 0.00 H new ATOM 0 HG3 MET A 45 -9.002 2.847 1.368 1.00 0.00 H new ATOM 0 HE1 MET A 45 -11.010 6.369 3.118 1.00 0.00 H new ATOM 0 HE2 MET A 45 -11.102 4.625 3.459 1.00 0.00 H new ATOM 0 HE3 MET A 45 -9.600 5.519 3.793 1.00 0.00 H new ATOM 633 N ARG A 46 -11.127 1.322 -2.376 1.00 0.00 N ATOM 634 CA ARG A 46 -10.996 0.149 -3.237 1.00 0.00 C ATOM 635 C ARG A 46 -10.487 0.546 -4.613 1.00 0.00 C ATOM 636 O ARG A 46 -9.723 -0.183 -5.246 1.00 0.00 O ATOM 637 CB ARG A 46 -12.347 -0.576 -3.371 1.00 0.00 C ATOM 638 CG ARG A 46 -13.310 0.063 -4.369 1.00 0.00 C ATOM 639 CD ARG A 46 -14.443 -0.884 -4.733 1.00 0.00 C ATOM 640 NE ARG A 46 -15.658 -0.618 -3.963 1.00 0.00 N ATOM 641 CZ ARG A 46 -16.048 -1.331 -2.906 1.00 0.00 C ATOM 642 NH1 ARG A 46 -15.322 -2.357 -2.473 1.00 0.00 N ATOM 643 NH2 ARG A 46 -17.169 -1.011 -2.277 1.00 0.00 N ATOM 0 H ARG A 46 -12.086 1.540 -2.106 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.275 -0.527 -2.778 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.164 -1.608 -3.671 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.826 -0.609 -2.393 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -13.722 0.979 -3.944 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -12.767 0.346 -5.271 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -14.662 -0.793 -5.797 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -14.124 -1.912 -4.561 1.00 0.00 H new ATOM 0 HE ARG A 46 -16.245 0.164 -4.254 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -14.456 -2.606 -2.951 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -15.631 -2.895 -1.663 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -17.729 -0.223 -2.602 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.472 -1.553 -1.468 1.00 0.00 H new ATOM 657 N ALA A 47 -10.934 1.703 -5.073 1.00 0.00 N ATOM 658 CA ALA A 47 -10.547 2.202 -6.375 1.00 0.00 C ATOM 659 C ALA A 47 -9.039 2.423 -6.452 1.00 0.00 C ATOM 660 O ALA A 47 -8.388 1.963 -7.385 1.00 0.00 O ATOM 661 CB ALA A 47 -11.309 3.480 -6.680 1.00 0.00 C ATOM 0 H ALA A 47 -11.568 2.314 -4.558 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.802 1.457 -7.129 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -11.015 3.853 -7.661 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -12.380 3.275 -6.675 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -11.080 4.230 -5.923 1.00 0.00 H new ATOM 667 N ALA A 48 -8.485 3.117 -5.461 1.00 0.00 N ATOM 668 CA ALA A 48 -7.046 3.378 -5.425 1.00 0.00 C ATOM 669 C ALA A 48 -6.263 2.076 -5.463 1.00 0.00 C ATOM 670 O ALA A 48 -5.380 1.884 -6.304 1.00 0.00 O ATOM 671 CB ALA A 48 -6.677 4.161 -4.177 1.00 0.00 C ATOM 0 H ALA A 48 -9.006 3.507 -4.676 1.00 0.00 H new ATOM 0 HA ALA A 48 -6.789 3.969 -6.304 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -5.603 4.346 -4.168 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.209 5.112 -4.174 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.954 3.588 -3.292 1.00 0.00 H new ATOM 677 N GLY A 49 -6.596 1.183 -4.544 1.00 0.00 N ATOM 678 CA GLY A 49 -5.923 -0.090 -4.483 1.00 0.00 C ATOM 679 C GLY A 49 -6.051 -0.860 -5.779 1.00 0.00 C ATOM 680 O GLY A 49 -5.056 -1.318 -6.346 1.00 0.00 O ATOM 0 H GLY A 49 -7.321 1.320 -3.840 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.868 0.068 -4.257 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -6.339 -0.681 -3.667 1.00 0.00 H new ATOM 684 N ASP A 50 -7.283 -1.000 -6.253 1.00 0.00 N ATOM 685 CA ASP A 50 -7.535 -1.718 -7.488 1.00 0.00 C ATOM 686 C ASP A 50 -6.958 -0.986 -8.695 1.00 0.00 C ATOM 687 O ASP A 50 -6.793 -1.570 -9.766 1.00 0.00 O ATOM 688 CB ASP A 50 -9.028 -1.957 -7.688 1.00 0.00 C ATOM 689 CG ASP A 50 -9.283 -3.187 -8.536 1.00 0.00 C ATOM 690 OD1 ASP A 50 -8.436 -3.495 -9.402 1.00 0.00 O ATOM 691 OD2 ASP A 50 -10.322 -3.845 -8.331 1.00 0.00 O ATOM 0 H ASP A 50 -8.117 -0.626 -5.801 1.00 0.00 H new ATOM 0 HA ASP A 50 -7.032 -2.682 -7.404 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -9.512 -2.075 -6.719 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -9.477 -1.085 -8.164 1.00 0.00 H new ATOM 696 N GLU A 51 -6.648 0.290 -8.522 1.00 0.00 N ATOM 697 CA GLU A 51 -6.089 1.082 -9.604 1.00 0.00 C ATOM 698 C GLU A 51 -4.664 0.635 -9.915 1.00 0.00 C ATOM 699 O GLU A 51 -4.332 0.360 -11.067 1.00 0.00 O ATOM 700 CB GLU A 51 -6.118 2.566 -9.241 1.00 0.00 C ATOM 701 CG GLU A 51 -7.336 3.296 -9.781 1.00 0.00 C ATOM 702 CD GLU A 51 -7.476 3.169 -11.284 1.00 0.00 C ATOM 703 OE1 GLU A 51 -6.455 3.306 -11.989 1.00 0.00 O ATOM 704 OE2 GLU A 51 -8.608 2.935 -11.756 1.00 0.00 O ATOM 0 H GLU A 51 -6.774 0.797 -7.646 1.00 0.00 H new ATOM 0 HA GLU A 51 -6.697 0.930 -10.496 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.094 2.667 -8.156 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.217 3.044 -9.626 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.232 2.902 -9.302 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.270 4.351 -9.514 1.00 0.00 H new ATOM 711 N PHE A 52 -3.824 0.567 -8.883 1.00 0.00 N ATOM 712 CA PHE A 52 -2.428 0.159 -9.060 1.00 0.00 C ATOM 713 C PHE A 52 -2.309 -1.308 -9.461 1.00 0.00 C ATOM 714 O PHE A 52 -1.416 -1.677 -10.218 1.00 0.00 O ATOM 715 CB PHE A 52 -1.616 0.411 -7.785 1.00 0.00 C ATOM 716 CG PHE A 52 -1.969 -0.499 -6.639 1.00 0.00 C ATOM 717 CD1 PHE A 52 -1.661 -1.851 -6.681 1.00 0.00 C ATOM 718 CD2 PHE A 52 -2.602 0.003 -5.517 1.00 0.00 C ATOM 719 CE1 PHE A 52 -1.984 -2.683 -5.628 1.00 0.00 C ATOM 720 CE2 PHE A 52 -2.924 -0.825 -4.459 1.00 0.00 C ATOM 721 CZ PHE A 52 -2.618 -2.168 -4.515 1.00 0.00 C ATOM 0 H PHE A 52 -4.082 0.787 -7.921 1.00 0.00 H new ATOM 0 HA PHE A 52 -2.024 0.767 -9.869 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.557 0.295 -8.013 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -1.763 1.445 -7.472 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -1.162 -2.258 -7.548 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.847 1.054 -5.467 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -1.741 -3.734 -5.675 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.416 -0.420 -3.587 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.874 -2.816 -3.690 1.00 0.00 H new ATOM 731 N GLU A 53 -3.192 -2.149 -8.935 1.00 0.00 N ATOM 732 CA GLU A 53 -3.146 -3.574 -9.241 1.00 0.00 C ATOM 733 C GLU A 53 -3.571 -3.843 -10.681 1.00 0.00 C ATOM 734 O GLU A 53 -3.022 -4.720 -11.347 1.00 0.00 O ATOM 735 CB GLU A 53 -4.046 -4.353 -8.287 1.00 0.00 C ATOM 736 CG GLU A 53 -5.520 -4.101 -8.528 1.00 0.00 C ATOM 737 CD GLU A 53 -6.416 -4.778 -7.507 1.00 0.00 C ATOM 738 OE1 GLU A 53 -6.171 -4.607 -6.292 1.00 0.00 O ATOM 739 OE2 GLU A 53 -7.373 -5.462 -7.923 1.00 0.00 O ATOM 0 H GLU A 53 -3.942 -1.873 -8.301 1.00 0.00 H new ATOM 0 HA GLU A 53 -2.115 -3.906 -9.116 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.843 -5.419 -8.393 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -3.799 -4.082 -7.260 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -5.706 -3.027 -8.510 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -5.784 -4.454 -9.525 1.00 0.00 H new ATOM 746 N THR A 54 -4.558 -3.088 -11.156 1.00 0.00 N ATOM 747 CA THR A 54 -5.055 -3.256 -12.516 1.00 0.00 C ATOM 748 C THR A 54 -4.154 -2.540 -13.506 1.00 0.00 C ATOM 749 O THR A 54 -3.981 -2.982 -14.640 1.00 0.00 O ATOM 750 CB THR A 54 -6.478 -2.723 -12.640 1.00 0.00 C ATOM 751 OG1 THR A 54 -7.304 -3.253 -11.616 1.00 0.00 O ATOM 752 CG2 THR A 54 -7.116 -3.056 -13.969 1.00 0.00 C ATOM 0 H THR A 54 -5.027 -2.357 -10.621 1.00 0.00 H new ATOM 0 HA THR A 54 -5.056 -4.322 -12.743 1.00 0.00 H new ATOM 0 HB THR A 54 -6.396 -1.640 -12.553 1.00 0.00 H new ATOM 0 HG1 THR A 54 -7.154 -2.756 -10.785 1.00 0.00 H new ATOM 0 HG21 THR A 54 -8.127 -2.651 -13.999 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.526 -2.619 -14.775 1.00 0.00 H new ATOM 0 HG23 THR A 54 -7.155 -4.138 -14.093 1.00 0.00 H new ATOM 760 N ARG A 55 -3.578 -1.434 -13.059 1.00 0.00 N ATOM 761 CA ARG A 55 -2.684 -0.649 -13.888 1.00 0.00 C ATOM 762 C ARG A 55 -1.638 -1.545 -14.565 1.00 0.00 C ATOM 763 O ARG A 55 -1.529 -1.569 -15.793 1.00 0.00 O ATOM 764 CB ARG A 55 -2.018 0.426 -13.022 1.00 0.00 C ATOM 765 CG ARG A 55 -2.559 1.831 -13.279 1.00 0.00 C ATOM 766 CD ARG A 55 -2.708 2.633 -11.996 1.00 0.00 C ATOM 767 NE ARG A 55 -1.460 3.284 -11.588 1.00 0.00 N ATOM 768 CZ ARG A 55 -1.384 4.533 -11.117 1.00 0.00 C ATOM 769 NH1 ARG A 55 -2.465 5.291 -11.027 1.00 0.00 N ATOM 770 NH2 ARG A 55 -0.216 5.020 -10.730 1.00 0.00 N ATOM 0 H ARG A 55 -3.717 -1.060 -12.120 1.00 0.00 H new ATOM 0 HA ARG A 55 -3.254 -0.166 -14.681 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -2.161 0.176 -11.971 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -0.944 0.418 -13.208 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -1.889 2.358 -13.959 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -3.527 1.761 -13.776 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -3.480 3.390 -12.133 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -3.047 1.973 -11.197 1.00 0.00 H new ATOM 0 HE ARG A 55 -0.594 2.750 -11.668 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -3.371 4.924 -11.319 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -2.392 6.242 -10.666 1.00 0.00 H new ATOM 0 HH21 ARG A 55 0.623 4.443 -10.792 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -0.155 5.972 -10.370 1.00 0.00 H new ATOM 784 N PHE A 56 -0.888 -2.291 -13.757 1.00 0.00 N ATOM 785 CA PHE A 56 0.134 -3.198 -14.264 1.00 0.00 C ATOM 786 C PHE A 56 -0.421 -4.602 -14.487 1.00 0.00 C ATOM 787 O PHE A 56 -1.575 -4.767 -14.884 1.00 0.00 O ATOM 788 CB PHE A 56 1.314 -3.251 -13.298 1.00 0.00 C ATOM 789 CG PHE A 56 1.774 -1.905 -12.824 1.00 0.00 C ATOM 790 CD1 PHE A 56 0.956 -1.092 -12.051 1.00 0.00 C ATOM 791 CD2 PHE A 56 3.031 -1.453 -13.159 1.00 0.00 C ATOM 792 CE1 PHE A 56 1.390 0.145 -11.626 1.00 0.00 C ATOM 793 CE2 PHE A 56 3.469 -0.224 -12.741 1.00 0.00 C ATOM 794 CZ PHE A 56 2.651 0.580 -11.973 1.00 0.00 C ATOM 0 H PHE A 56 -0.972 -2.283 -12.740 1.00 0.00 H new ATOM 0 HA PHE A 56 0.470 -2.814 -15.227 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.036 -3.854 -12.434 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.147 -3.758 -13.785 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.032 -1.433 -11.780 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.679 -2.075 -13.758 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.746 0.770 -11.025 1.00 0.00 H new ATOM 0 HE2 PHE A 56 4.457 0.117 -13.013 1.00 0.00 H new ATOM 0 HZ PHE A 56 2.999 1.548 -11.645 1.00 0.00 H new ATOM 804 N ARG A 57 0.399 -5.618 -14.195 1.00 0.00 N ATOM 805 CA ARG A 57 -0.014 -7.004 -14.332 1.00 0.00 C ATOM 806 C ARG A 57 0.545 -7.862 -13.192 1.00 0.00 C ATOM 807 O ARG A 57 -0.079 -7.992 -12.138 1.00 0.00 O ATOM 808 CB ARG A 57 0.416 -7.552 -15.690 1.00 0.00 C ATOM 809 CG ARG A 57 -0.066 -8.967 -15.943 1.00 0.00 C ATOM 810 CD ARG A 57 0.015 -9.327 -17.416 1.00 0.00 C ATOM 811 NE ARG A 57 -0.724 -10.547 -17.717 1.00 0.00 N ATOM 812 CZ ARG A 57 -0.342 -11.759 -17.324 1.00 0.00 C ATOM 813 NH1 ARG A 57 0.768 -11.918 -16.612 1.00 0.00 N ATOM 814 NH2 ARG A 57 -1.074 -12.816 -17.644 1.00 0.00 N ATOM 0 H ARG A 57 1.355 -5.497 -13.861 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.102 -7.045 -14.272 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.035 -6.899 -16.475 1.00 0.00 H new ATOM 0 HB3 ARG A 57 1.504 -7.528 -15.756 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.535 -9.667 -15.363 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.095 -9.069 -15.598 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.381 -8.506 -18.013 1.00 0.00 H new ATOM 0 HD3 ARG A 57 1.059 -9.455 -17.702 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.584 -10.467 -18.260 1.00 0.00 H new ATOM 0 HH11 ARG A 57 1.334 -11.107 -16.363 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.054 -12.851 -16.315 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -1.928 -12.699 -18.190 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.784 -13.747 -17.344 1.00 0.00 H new ATOM 828 N ARG A 58 1.728 -8.441 -13.405 1.00 0.00 N ATOM 829 CA ARG A 58 2.363 -9.278 -12.394 1.00 0.00 C ATOM 830 C ARG A 58 3.789 -8.806 -12.143 1.00 0.00 C ATOM 831 O ARG A 58 4.739 -9.588 -12.191 1.00 0.00 O ATOM 832 CB ARG A 58 2.369 -10.742 -12.841 1.00 0.00 C ATOM 833 CG ARG A 58 1.207 -11.548 -12.289 1.00 0.00 C ATOM 834 CD ARG A 58 1.455 -13.041 -12.422 1.00 0.00 C ATOM 835 NE ARG A 58 0.400 -13.698 -13.189 1.00 0.00 N ATOM 836 CZ ARG A 58 -0.440 -14.602 -12.689 1.00 0.00 C ATOM 837 NH1 ARG A 58 -0.373 -14.960 -11.412 1.00 0.00 N ATOM 838 NH2 ARG A 58 -1.356 -15.150 -13.475 1.00 0.00 N ATOM 0 H ARG A 58 2.263 -8.344 -14.268 1.00 0.00 H new ATOM 0 HA ARG A 58 1.794 -9.196 -11.468 1.00 0.00 H new ATOM 0 HB2 ARG A 58 2.343 -10.781 -13.930 1.00 0.00 H new ATOM 0 HB3 ARG A 58 3.304 -11.206 -12.527 1.00 0.00 H new ATOM 0 HG2 ARG A 58 1.053 -11.295 -11.240 1.00 0.00 H new ATOM 0 HG3 ARG A 58 0.293 -11.281 -12.819 1.00 0.00 H new ATOM 0 HD2 ARG A 58 2.416 -13.208 -12.908 1.00 0.00 H new ATOM 0 HD3 ARG A 58 1.517 -13.489 -11.430 1.00 0.00 H new ATOM 0 HE ARG A 58 0.300 -13.448 -14.173 1.00 0.00 H new ATOM 0 HH11 ARG A 58 0.328 -14.541 -10.801 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -1.023 -15.654 -11.042 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -1.414 -14.879 -14.456 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -2.003 -15.843 -13.098 1.00 0.00 H new ATOM 852 N THR A 59 3.928 -7.524 -11.859 1.00 0.00 N ATOM 853 CA THR A 59 5.231 -6.933 -11.598 1.00 0.00 C ATOM 854 C THR A 59 5.593 -7.038 -10.123 1.00 0.00 C ATOM 855 O THR A 59 6.772 -7.060 -9.773 1.00 0.00 O ATOM 856 CB THR A 59 5.272 -5.480 -12.050 1.00 0.00 C ATOM 857 OG1 THR A 59 4.111 -4.789 -11.631 1.00 0.00 O ATOM 858 CG2 THR A 59 5.384 -5.322 -13.554 1.00 0.00 C ATOM 0 H THR A 59 3.150 -6.867 -11.803 1.00 0.00 H new ATOM 0 HA THR A 59 5.968 -7.493 -12.173 1.00 0.00 H new ATOM 0 HB THR A 59 6.167 -5.062 -11.589 1.00 0.00 H new ATOM 0 HG1 THR A 59 4.159 -3.857 -11.930 1.00 0.00 H new ATOM 0 HG21 THR A 59 5.408 -4.262 -13.808 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.300 -5.800 -13.903 1.00 0.00 H new ATOM 0 HG23 THR A 59 4.525 -5.790 -14.034 1.00 0.00 H new ATOM 866 N PHE A 60 4.577 -7.092 -9.262 1.00 0.00 N ATOM 867 CA PHE A 60 4.798 -7.186 -7.822 1.00 0.00 C ATOM 868 C PHE A 60 5.969 -8.109 -7.504 1.00 0.00 C ATOM 869 O PHE A 60 7.019 -7.645 -7.074 1.00 0.00 O ATOM 870 CB PHE A 60 3.532 -7.708 -7.135 1.00 0.00 C ATOM 871 CG PHE A 60 2.716 -6.637 -6.474 1.00 0.00 C ATOM 872 CD1 PHE A 60 1.747 -5.949 -7.187 1.00 0.00 C ATOM 873 CD2 PHE A 60 2.913 -6.321 -5.141 1.00 0.00 C ATOM 874 CE1 PHE A 60 0.992 -4.962 -6.581 1.00 0.00 C ATOM 875 CE2 PHE A 60 2.161 -5.335 -4.528 1.00 0.00 C ATOM 876 CZ PHE A 60 1.201 -4.655 -5.250 1.00 0.00 C ATOM 0 H PHE A 60 3.595 -7.072 -9.537 1.00 0.00 H new ATOM 0 HA PHE A 60 5.035 -6.189 -7.450 1.00 0.00 H new ATOM 0 HB2 PHE A 60 2.914 -8.219 -7.873 1.00 0.00 H new ATOM 0 HB3 PHE A 60 3.815 -8.449 -6.388 1.00 0.00 H new ATOM 0 HD1 PHE A 60 1.580 -6.186 -8.227 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.663 -6.851 -4.572 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.240 -4.432 -7.147 1.00 0.00 H new ATOM 0 HE2 PHE A 60 2.325 -5.098 -3.487 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.613 -3.883 -4.775 1.00 0.00 H new ATOM 886 N SER A 61 5.790 -9.408 -7.715 1.00 0.00 N ATOM 887 CA SER A 61 6.857 -10.370 -7.439 1.00 0.00 C ATOM 888 C SER A 61 8.125 -10.042 -8.231 1.00 0.00 C ATOM 889 O SER A 61 9.171 -9.762 -7.645 1.00 0.00 O ATOM 890 CB SER A 61 6.399 -11.803 -7.744 1.00 0.00 C ATOM 891 OG SER A 61 5.586 -11.862 -8.906 1.00 0.00 O ATOM 0 H SER A 61 4.927 -9.819 -8.072 1.00 0.00 H new ATOM 0 HA SER A 61 7.091 -10.298 -6.377 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.272 -12.442 -7.878 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.844 -12.196 -6.892 1.00 0.00 H new ATOM 0 HG SER A 61 5.315 -12.790 -9.069 1.00 0.00 H new ATOM 897 N ASP A 62 8.030 -10.106 -9.561 1.00 0.00 N ATOM 898 CA ASP A 62 9.173 -9.836 -10.439 1.00 0.00 C ATOM 899 C ASP A 62 10.020 -8.671 -9.912 1.00 0.00 C ATOM 900 O ASP A 62 11.208 -8.834 -9.633 1.00 0.00 O ATOM 901 CB ASP A 62 8.687 -9.547 -11.867 1.00 0.00 C ATOM 902 CG ASP A 62 8.930 -10.710 -12.811 1.00 0.00 C ATOM 903 OD1 ASP A 62 9.803 -11.550 -12.509 1.00 0.00 O ATOM 904 OD2 ASP A 62 8.247 -10.777 -13.854 1.00 0.00 O ATOM 0 H ASP A 62 7.170 -10.343 -10.056 1.00 0.00 H new ATOM 0 HA ASP A 62 9.805 -10.724 -10.454 1.00 0.00 H new ATOM 0 HB2 ASP A 62 7.622 -9.318 -11.845 1.00 0.00 H new ATOM 0 HB3 ASP A 62 9.196 -8.662 -12.248 1.00 0.00 H new ATOM 909 N LEU A 63 9.399 -7.505 -9.763 1.00 0.00 N ATOM 910 CA LEU A 63 10.091 -6.322 -9.264 1.00 0.00 C ATOM 911 C LEU A 63 10.514 -6.505 -7.803 1.00 0.00 C ATOM 912 O LEU A 63 11.653 -6.213 -7.438 1.00 0.00 O ATOM 913 CB LEU A 63 9.179 -5.102 -9.397 1.00 0.00 C ATOM 914 CG LEU A 63 9.092 -4.512 -10.802 1.00 0.00 C ATOM 915 CD1 LEU A 63 8.085 -3.373 -10.843 1.00 0.00 C ATOM 916 CD2 LEU A 63 10.463 -4.037 -11.260 1.00 0.00 C ATOM 0 H LEU A 63 8.414 -7.354 -9.982 1.00 0.00 H new ATOM 0 HA LEU A 63 10.992 -6.172 -9.859 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.176 -5.380 -9.073 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.531 -4.328 -8.715 1.00 0.00 H new ATOM 0 HG LEU A 63 8.751 -5.290 -11.485 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.037 -2.966 -11.853 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.102 -3.746 -10.555 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.393 -2.590 -10.150 1.00 0.00 H new ATOM 0 HD21 LEU A 63 10.387 -3.619 -12.264 1.00 0.00 H new ATOM 0 HD22 LEU A 63 10.831 -3.273 -10.575 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.155 -4.879 -11.270 1.00 0.00 H new ATOM 928 N ALA A 64 9.584 -6.974 -6.973 1.00 0.00 N ATOM 929 CA ALA A 64 9.854 -7.184 -5.547 1.00 0.00 C ATOM 930 C ALA A 64 11.193 -7.876 -5.334 1.00 0.00 C ATOM 931 O ALA A 64 12.044 -7.385 -4.594 1.00 0.00 O ATOM 932 CB ALA A 64 8.749 -7.999 -4.888 1.00 0.00 C ATOM 0 H ALA A 64 8.636 -7.217 -7.261 1.00 0.00 H new ATOM 0 HA ALA A 64 9.889 -6.199 -5.082 1.00 0.00 H new ATOM 0 HB1 ALA A 64 8.979 -8.137 -3.832 1.00 0.00 H new ATOM 0 HB2 ALA A 64 7.800 -7.472 -4.987 1.00 0.00 H new ATOM 0 HB3 ALA A 64 8.676 -8.972 -5.373 1.00 0.00 H new ATOM 938 N ALA A 65 11.368 -9.018 -5.989 1.00 0.00 N ATOM 939 CA ALA A 65 12.602 -9.785 -5.876 1.00 0.00 C ATOM 940 C ALA A 65 13.784 -9.019 -6.462 1.00 0.00 C ATOM 941 O ALA A 65 14.888 -9.035 -5.908 1.00 0.00 O ATOM 942 CB ALA A 65 12.449 -11.131 -6.567 1.00 0.00 C ATOM 0 H ALA A 65 10.669 -9.433 -6.605 1.00 0.00 H new ATOM 0 HA ALA A 65 12.801 -9.951 -4.817 1.00 0.00 H new ATOM 0 HB1 ALA A 65 13.378 -11.695 -6.476 1.00 0.00 H new ATOM 0 HB2 ALA A 65 11.638 -11.690 -6.100 1.00 0.00 H new ATOM 0 HB3 ALA A 65 12.222 -10.975 -7.622 1.00 0.00 H new ATOM 948 N GLN A 66 13.548 -8.348 -7.592 1.00 0.00 N ATOM 949 CA GLN A 66 14.586 -7.577 -8.263 1.00 0.00 C ATOM 950 C GLN A 66 15.299 -6.645 -7.285 1.00 0.00 C ATOM 951 O GLN A 66 16.522 -6.693 -7.146 1.00 0.00 O ATOM 952 CB GLN A 66 13.985 -6.768 -9.420 1.00 0.00 C ATOM 953 CG GLN A 66 14.262 -7.363 -10.791 1.00 0.00 C ATOM 954 CD GLN A 66 14.072 -6.356 -11.910 1.00 0.00 C ATOM 955 OE1 GLN A 66 15.000 -5.637 -12.278 1.00 0.00 O ATOM 956 NE2 GLN A 66 12.863 -6.302 -12.460 1.00 0.00 N ATOM 0 H GLN A 66 12.642 -8.326 -8.060 1.00 0.00 H new ATOM 0 HA GLN A 66 15.320 -8.277 -8.662 1.00 0.00 H new ATOM 0 HB2 GLN A 66 12.907 -6.693 -9.277 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.382 -5.754 -9.387 1.00 0.00 H new ATOM 0 HG2 GLN A 66 15.283 -7.744 -10.819 1.00 0.00 H new ATOM 0 HG3 GLN A 66 13.600 -8.213 -10.955 1.00 0.00 H new ATOM 0 HE21 GLN A 66 12.122 -6.917 -12.124 1.00 0.00 H new ATOM 0 HE22 GLN A 66 12.676 -5.646 -13.218 1.00 0.00 H new ATOM 965 N LEU A 67 14.526 -5.804 -6.605 1.00 0.00 N ATOM 966 CA LEU A 67 15.082 -4.872 -5.633 1.00 0.00 C ATOM 967 C LEU A 67 15.356 -5.569 -4.302 1.00 0.00 C ATOM 968 O LEU A 67 16.180 -5.112 -3.510 1.00 0.00 O ATOM 969 CB LEU A 67 14.129 -3.686 -5.428 1.00 0.00 C ATOM 970 CG LEU A 67 14.630 -2.347 -5.981 1.00 0.00 C ATOM 971 CD1 LEU A 67 13.888 -1.983 -7.259 1.00 0.00 C ATOM 972 CD2 LEU A 67 14.472 -1.246 -4.944 1.00 0.00 C ATOM 0 H LEU A 67 13.513 -5.750 -6.710 1.00 0.00 H new ATOM 0 HA LEU A 67 16.030 -4.499 -6.022 1.00 0.00 H new ATOM 0 HB2 LEU A 67 13.174 -3.921 -5.898 1.00 0.00 H new ATOM 0 HB3 LEU A 67 13.939 -3.573 -4.361 1.00 0.00 H new ATOM 0 HG LEU A 67 15.690 -2.450 -6.215 1.00 0.00 H new ATOM 0 HD11 LEU A 67 14.258 -1.029 -7.636 1.00 0.00 H new ATOM 0 HD12 LEU A 67 14.052 -2.757 -8.008 1.00 0.00 H new ATOM 0 HD13 LEU A 67 12.821 -1.901 -7.050 1.00 0.00 H new ATOM 0 HD21 LEU A 67 14.833 -0.304 -5.356 1.00 0.00 H new ATOM 0 HD22 LEU A 67 13.420 -1.146 -4.677 1.00 0.00 H new ATOM 0 HD23 LEU A 67 15.049 -1.498 -4.055 1.00 0.00 H new ATOM 984 N HIS A 68 14.657 -6.679 -4.059 1.00 0.00 N ATOM 985 CA HIS A 68 14.823 -7.435 -2.818 1.00 0.00 C ATOM 986 C HIS A 68 16.298 -7.707 -2.528 1.00 0.00 C ATOM 987 O HIS A 68 16.831 -7.225 -1.528 1.00 0.00 O ATOM 988 CB HIS A 68 14.053 -8.752 -2.887 1.00 0.00 C ATOM 989 CG HIS A 68 13.193 -8.999 -1.688 1.00 0.00 C ATOM 990 ND1 HIS A 68 12.525 -7.993 -1.025 1.00 0.00 N ATOM 991 CD2 HIS A 68 12.898 -10.143 -1.027 1.00 0.00 C ATOM 992 CE1 HIS A 68 11.859 -8.503 -0.006 1.00 0.00 C ATOM 993 NE2 HIS A 68 12.067 -9.807 0.015 1.00 0.00 N ATOM 0 H HIS A 68 13.972 -7.073 -4.704 1.00 0.00 H new ATOM 0 HA HIS A 68 14.421 -6.830 -2.005 1.00 0.00 H new ATOM 0 HB2 HIS A 68 13.428 -8.753 -3.780 1.00 0.00 H new ATOM 0 HB3 HIS A 68 14.761 -9.574 -2.993 1.00 0.00 H new ATOM 0 HD2 HIS A 68 13.250 -11.134 -1.272 1.00 0.00 H new ATOM 0 HE1 HIS A 68 11.248 -7.949 0.691 1.00 0.00 H new ATOM 0 HE2 HIS A 68 11.675 -10.459 0.694 1.00 0.00 H new ATOM 1001 N VAL A 69 16.946 -8.493 -3.402 1.00 0.00 N ATOM 1002 CA VAL A 69 18.372 -8.835 -3.241 1.00 0.00 C ATOM 1003 C VAL A 69 19.132 -7.719 -2.516 1.00 0.00 C ATOM 1004 O VAL A 69 19.644 -7.922 -1.414 1.00 0.00 O ATOM 1005 CB VAL A 69 19.036 -9.139 -4.619 1.00 0.00 C ATOM 1006 CG1 VAL A 69 20.535 -8.821 -4.637 1.00 0.00 C ATOM 1007 CG2 VAL A 69 18.812 -10.596 -5.001 1.00 0.00 C ATOM 0 H VAL A 69 16.508 -8.904 -4.226 1.00 0.00 H new ATOM 0 HA VAL A 69 18.425 -9.736 -2.629 1.00 0.00 H new ATOM 0 HB VAL A 69 18.559 -8.486 -5.350 1.00 0.00 H new ATOM 0 HG11 VAL A 69 20.944 -9.052 -5.621 1.00 0.00 H new ATOM 0 HG12 VAL A 69 20.685 -7.763 -4.421 1.00 0.00 H new ATOM 0 HG13 VAL A 69 21.043 -9.421 -3.882 1.00 0.00 H new ATOM 0 HG21 VAL A 69 19.280 -10.796 -5.965 1.00 0.00 H new ATOM 0 HG22 VAL A 69 19.253 -11.243 -4.243 1.00 0.00 H new ATOM 0 HG23 VAL A 69 17.742 -10.794 -5.069 1.00 0.00 H new ATOM 1017 N THR A 70 19.194 -6.539 -3.134 1.00 0.00 N ATOM 1018 CA THR A 70 19.879 -5.399 -2.544 1.00 0.00 C ATOM 1019 C THR A 70 19.428 -5.177 -1.101 1.00 0.00 C ATOM 1020 O THR A 70 18.305 -4.738 -0.855 1.00 0.00 O ATOM 1021 CB THR A 70 19.608 -4.145 -3.375 1.00 0.00 C ATOM 1022 OG1 THR A 70 19.395 -4.484 -4.735 1.00 0.00 O ATOM 1023 CG2 THR A 70 20.741 -3.145 -3.323 1.00 0.00 C ATOM 0 H THR A 70 18.776 -6.352 -4.045 1.00 0.00 H new ATOM 0 HA THR A 70 20.949 -5.606 -2.539 1.00 0.00 H new ATOM 0 HB THR A 70 18.719 -3.689 -2.939 1.00 0.00 H new ATOM 0 HG1 THR A 70 18.439 -4.636 -4.889 1.00 0.00 H new ATOM 0 HG21 THR A 70 20.489 -2.277 -3.932 1.00 0.00 H new ATOM 0 HG22 THR A 70 20.901 -2.830 -2.292 1.00 0.00 H new ATOM 0 HG23 THR A 70 21.651 -3.606 -3.707 1.00 0.00 H new ATOM 1031 N PRO A 71 20.303 -5.478 -0.125 1.00 0.00 N ATOM 1032 CA PRO A 71 19.988 -5.309 1.295 1.00 0.00 C ATOM 1033 C PRO A 71 19.522 -3.898 1.617 1.00 0.00 C ATOM 1034 O PRO A 71 20.329 -3.013 1.907 1.00 0.00 O ATOM 1035 CB PRO A 71 21.313 -5.608 1.999 1.00 0.00 C ATOM 1036 CG PRO A 71 22.063 -6.468 1.045 1.00 0.00 C ATOM 1037 CD PRO A 71 21.664 -6.008 -0.328 1.00 0.00 C ATOM 0 HA PRO A 71 19.172 -5.959 1.609 1.00 0.00 H new ATOM 0 HB2 PRO A 71 21.860 -4.691 2.219 1.00 0.00 H new ATOM 0 HB3 PRO A 71 21.150 -6.118 2.948 1.00 0.00 H new ATOM 0 HG2 PRO A 71 23.138 -6.369 1.193 1.00 0.00 H new ATOM 0 HG3 PRO A 71 21.817 -7.520 1.191 1.00 0.00 H new ATOM 0 HD2 PRO A 71 22.341 -5.243 -0.709 1.00 0.00 H new ATOM 0 HD3 PRO A 71 21.674 -6.828 -1.046 1.00 0.00 H new ATOM 1045 N GLY A 72 18.213 -3.695 1.567 1.00 0.00 N ATOM 1046 CA GLY A 72 17.657 -2.392 1.860 1.00 0.00 C ATOM 1047 C GLY A 72 17.045 -2.332 3.243 1.00 0.00 C ATOM 1048 O GLY A 72 16.972 -3.342 3.945 1.00 0.00 O ATOM 0 H GLY A 72 17.527 -4.411 1.328 1.00 0.00 H new ATOM 0 HA2 GLY A 72 18.439 -1.638 1.777 1.00 0.00 H new ATOM 0 HA3 GLY A 72 16.898 -2.147 1.117 1.00 0.00 H new ATOM 1052 N SER A 73 16.594 -1.150 3.636 1.00 0.00 N ATOM 1053 CA SER A 73 15.979 -0.961 4.938 1.00 0.00 C ATOM 1054 C SER A 73 14.570 -1.544 4.966 1.00 0.00 C ATOM 1055 O SER A 73 13.981 -1.827 3.923 1.00 0.00 O ATOM 1056 CB SER A 73 15.936 0.531 5.278 1.00 0.00 C ATOM 1057 OG SER A 73 16.745 0.827 6.399 1.00 0.00 O ATOM 0 H SER A 73 16.644 -0.305 3.067 1.00 0.00 H new ATOM 0 HA SER A 73 16.578 -1.485 5.682 1.00 0.00 H new ATOM 0 HB2 SER A 73 16.274 1.111 4.420 1.00 0.00 H new ATOM 0 HB3 SER A 73 14.908 0.830 5.480 1.00 0.00 H new ATOM 0 HG SER A 73 16.699 1.787 6.591 1.00 0.00 H new ATOM 1063 N ALA A 74 14.042 -1.723 6.168 1.00 0.00 N ATOM 1064 CA ALA A 74 12.705 -2.274 6.349 1.00 0.00 C ATOM 1065 C ALA A 74 11.624 -1.309 5.840 1.00 0.00 C ATOM 1066 O ALA A 74 11.866 -0.526 4.919 1.00 0.00 O ATOM 1067 CB ALA A 74 12.499 -2.623 7.818 1.00 0.00 C ATOM 0 H ALA A 74 14.522 -1.493 7.038 1.00 0.00 H new ATOM 0 HA ALA A 74 12.613 -3.183 5.755 1.00 0.00 H new ATOM 0 HB1 ALA A 74 11.500 -3.036 7.957 1.00 0.00 H new ATOM 0 HB2 ALA A 74 13.242 -3.360 8.125 1.00 0.00 H new ATOM 0 HB3 ALA A 74 12.608 -1.724 8.424 1.00 0.00 H new ATOM 1073 N GLN A 75 10.428 -1.384 6.430 1.00 0.00 N ATOM 1074 CA GLN A 75 9.308 -0.540 6.032 1.00 0.00 C ATOM 1075 C GLN A 75 9.729 0.906 5.793 1.00 0.00 C ATOM 1076 O GLN A 75 9.388 1.501 4.768 1.00 0.00 O ATOM 1077 CB GLN A 75 8.195 -0.608 7.087 1.00 0.00 C ATOM 1078 CG GLN A 75 8.612 -0.099 8.462 1.00 0.00 C ATOM 1079 CD GLN A 75 8.785 -1.204 9.490 1.00 0.00 C ATOM 1080 OE1 GLN A 75 7.863 -2.159 9.514 1.00 0.00 O flip ATOM 1081 NE2 GLN A 75 9.746 -1.192 10.262 1.00 0.00 N flip ATOM 0 H GLN A 75 10.214 -2.028 7.191 1.00 0.00 H new ATOM 0 HA GLN A 75 8.931 -0.924 5.084 1.00 0.00 H new ATOM 0 HB2 GLN A 75 7.342 -0.025 6.739 1.00 0.00 H new ATOM 0 HB3 GLN A 75 7.859 -1.641 7.180 1.00 0.00 H new ATOM 0 HG2 GLN A 75 9.549 0.450 8.369 1.00 0.00 H new ATOM 0 HG3 GLN A 75 7.864 0.607 8.822 1.00 0.00 H new ATOM 0 HE21 GLN A 75 10.432 -0.439 10.210 1.00 0.00 H new ATOM 0 HE22 GLN A 75 9.855 -1.935 10.952 1.00 0.00 H new ATOM 1090 N GLN A 76 10.443 1.476 6.750 1.00 0.00 N ATOM 1091 CA GLN A 76 10.898 2.854 6.654 1.00 0.00 C ATOM 1092 C GLN A 76 11.577 3.114 5.319 1.00 0.00 C ATOM 1093 O GLN A 76 11.590 4.239 4.817 1.00 0.00 O ATOM 1094 CB GLN A 76 11.861 3.146 7.794 1.00 0.00 C ATOM 1095 CG GLN A 76 12.181 4.618 7.955 1.00 0.00 C ATOM 1096 CD GLN A 76 13.661 4.891 7.822 1.00 0.00 C ATOM 1097 OE1 GLN A 76 14.333 5.229 8.795 1.00 0.00 O ATOM 1098 NE2 GLN A 76 14.181 4.734 6.610 1.00 0.00 N ATOM 0 H GLN A 76 10.722 1.001 7.609 1.00 0.00 H new ATOM 0 HA GLN A 76 10.033 3.513 6.724 1.00 0.00 H new ATOM 0 HB2 GLN A 76 11.434 2.772 8.724 1.00 0.00 H new ATOM 0 HB3 GLN A 76 12.788 2.598 7.625 1.00 0.00 H new ATOM 0 HG2 GLN A 76 11.637 5.192 7.205 1.00 0.00 H new ATOM 0 HG3 GLN A 76 11.835 4.960 8.930 1.00 0.00 H new ATOM 0 HE21 GLN A 76 13.585 4.452 5.832 1.00 0.00 H new ATOM 0 HE22 GLN A 76 15.177 4.895 6.457 1.00 0.00 H new ATOM 1107 N ARG A 77 12.134 2.056 4.749 1.00 0.00 N ATOM 1108 CA ARG A 77 12.813 2.140 3.469 1.00 0.00 C ATOM 1109 C ARG A 77 11.832 2.400 2.345 1.00 0.00 C ATOM 1110 O ARG A 77 12.067 3.254 1.489 1.00 0.00 O ATOM 1111 CB ARG A 77 13.538 0.840 3.184 1.00 0.00 C ATOM 1112 CG ARG A 77 14.739 1.011 2.279 1.00 0.00 C ATOM 1113 CD ARG A 77 14.324 1.440 0.885 1.00 0.00 C ATOM 1114 NE ARG A 77 15.126 0.777 -0.139 1.00 0.00 N ATOM 1115 CZ ARG A 77 16.003 1.394 -0.924 1.00 0.00 C ATOM 1116 NH1 ARG A 77 16.226 2.699 -0.806 1.00 0.00 N ATOM 1117 NH2 ARG A 77 16.675 0.695 -1.827 1.00 0.00 N ATOM 0 H ARG A 77 12.127 1.122 5.159 1.00 0.00 H new ATOM 0 HA ARG A 77 13.521 2.967 3.523 1.00 0.00 H new ATOM 0 HB2 ARG A 77 13.862 0.398 4.126 1.00 0.00 H new ATOM 0 HB3 ARG A 77 12.843 0.137 2.725 1.00 0.00 H new ATOM 0 HG2 ARG A 77 15.414 1.754 2.704 1.00 0.00 H new ATOM 0 HG3 ARG A 77 15.291 0.073 2.223 1.00 0.00 H new ATOM 0 HD2 ARG A 77 13.270 1.208 0.730 1.00 0.00 H new ATOM 0 HD3 ARG A 77 14.430 2.521 0.789 1.00 0.00 H new ATOM 0 HE ARG A 77 15.005 -0.229 -0.260 1.00 0.00 H new ATOM 0 HH11 ARG A 77 15.721 3.241 -0.105 1.00 0.00 H new ATOM 0 HH12 ARG A 77 16.902 3.158 -1.416 1.00 0.00 H new ATOM 0 HH21 ARG A 77 16.517 -0.309 -1.916 1.00 0.00 H new ATOM 0 HH22 ARG A 77 17.350 1.161 -2.434 1.00 0.00 H new ATOM 1131 N PHE A 78 10.741 1.646 2.340 1.00 0.00 N ATOM 1132 CA PHE A 78 9.732 1.791 1.302 1.00 0.00 C ATOM 1133 C PHE A 78 9.200 3.222 1.271 1.00 0.00 C ATOM 1134 O PHE A 78 9.145 3.854 0.213 1.00 0.00 O ATOM 1135 CB PHE A 78 8.587 0.788 1.509 1.00 0.00 C ATOM 1136 CG PHE A 78 8.595 -0.377 0.540 1.00 0.00 C ATOM 1137 CD1 PHE A 78 9.094 -0.241 -0.747 1.00 0.00 C ATOM 1138 CD2 PHE A 78 8.098 -1.613 0.922 1.00 0.00 C ATOM 1139 CE1 PHE A 78 9.093 -1.313 -1.623 1.00 0.00 C ATOM 1140 CE2 PHE A 78 8.094 -2.683 0.054 1.00 0.00 C ATOM 1141 CZ PHE A 78 8.591 -2.536 -1.220 1.00 0.00 C ATOM 0 H PHE A 78 10.534 0.932 3.039 1.00 0.00 H new ATOM 0 HA PHE A 78 10.197 1.577 0.340 1.00 0.00 H new ATOM 0 HB2 PHE A 78 8.639 0.400 2.526 1.00 0.00 H new ATOM 0 HB3 PHE A 78 7.637 1.315 1.418 1.00 0.00 H new ATOM 0 HD1 PHE A 78 9.488 0.712 -1.069 1.00 0.00 H new ATOM 0 HD2 PHE A 78 7.706 -1.740 1.920 1.00 0.00 H new ATOM 0 HE1 PHE A 78 9.485 -1.193 -2.622 1.00 0.00 H new ATOM 0 HE2 PHE A 78 7.701 -3.637 0.374 1.00 0.00 H new ATOM 0 HZ PHE A 78 8.589 -3.373 -1.903 1.00 0.00 H new ATOM 1151 N THR A 79 8.829 3.735 2.438 1.00 0.00 N ATOM 1152 CA THR A 79 8.321 5.098 2.536 1.00 0.00 C ATOM 1153 C THR A 79 9.373 6.099 2.062 1.00 0.00 C ATOM 1154 O THR A 79 9.125 6.890 1.154 1.00 0.00 O ATOM 1155 CB THR A 79 7.899 5.410 3.972 1.00 0.00 C ATOM 1156 OG1 THR A 79 8.692 4.688 4.898 1.00 0.00 O ATOM 1157 CG2 THR A 79 6.449 5.076 4.249 1.00 0.00 C ATOM 0 H THR A 79 8.870 3.232 3.324 1.00 0.00 H new ATOM 0 HA THR A 79 7.447 5.185 1.891 1.00 0.00 H new ATOM 0 HB THR A 79 8.040 6.484 4.090 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.641 4.838 4.703 1.00 0.00 H new ATOM 0 HG21 THR A 79 6.211 5.320 5.284 1.00 0.00 H new ATOM 0 HG22 THR A 79 5.809 5.655 3.583 1.00 0.00 H new ATOM 0 HG23 THR A 79 6.282 4.012 4.079 1.00 0.00 H new ATOM 1165 N GLN A 80 10.546 6.062 2.691 1.00 0.00 N ATOM 1166 CA GLN A 80 11.643 6.969 2.341 1.00 0.00 C ATOM 1167 C GLN A 80 11.779 7.131 0.827 1.00 0.00 C ATOM 1168 O GLN A 80 12.039 8.228 0.333 1.00 0.00 O ATOM 1169 CB GLN A 80 12.962 6.454 2.922 1.00 0.00 C ATOM 1170 CG GLN A 80 14.126 7.413 2.730 1.00 0.00 C ATOM 1171 CD GLN A 80 15.399 6.712 2.293 1.00 0.00 C ATOM 1172 OE1 GLN A 80 15.915 5.840 2.994 1.00 0.00 O ATOM 1173 NE2 GLN A 80 15.913 7.092 1.130 1.00 0.00 N ATOM 0 H GLN A 80 10.764 5.413 3.447 1.00 0.00 H new ATOM 0 HA GLN A 80 11.411 7.944 2.768 1.00 0.00 H new ATOM 0 HB2 GLN A 80 12.831 6.264 3.987 1.00 0.00 H new ATOM 0 HB3 GLN A 80 13.207 5.500 2.455 1.00 0.00 H new ATOM 0 HG2 GLN A 80 13.855 8.162 1.986 1.00 0.00 H new ATOM 0 HG3 GLN A 80 14.311 7.944 3.664 1.00 0.00 H new ATOM 0 HE21 GLN A 80 15.452 7.818 0.582 1.00 0.00 H new ATOM 0 HE22 GLN A 80 16.769 6.658 0.784 1.00 0.00 H new ATOM 1182 N VAL A 81 11.601 6.032 0.098 1.00 0.00 N ATOM 1183 CA VAL A 81 11.704 6.049 -1.358 1.00 0.00 C ATOM 1184 C VAL A 81 10.616 6.920 -1.970 1.00 0.00 C ATOM 1185 O VAL A 81 10.893 7.869 -2.705 1.00 0.00 O ATOM 1186 CB VAL A 81 11.595 4.624 -1.937 1.00 0.00 C ATOM 1187 CG1 VAL A 81 11.802 4.640 -3.443 1.00 0.00 C ATOM 1188 CG2 VAL A 81 12.598 3.702 -1.261 1.00 0.00 C ATOM 0 H VAL A 81 11.384 5.117 0.493 1.00 0.00 H new ATOM 0 HA VAL A 81 12.680 6.464 -1.609 1.00 0.00 H new ATOM 0 HB VAL A 81 10.593 4.244 -1.740 1.00 0.00 H new ATOM 0 HG11 VAL A 81 11.721 3.625 -3.832 1.00 0.00 H new ATOM 0 HG12 VAL A 81 11.042 5.268 -3.908 1.00 0.00 H new ATOM 0 HG13 VAL A 81 12.791 5.038 -3.670 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.510 2.699 -1.679 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.608 4.078 -1.428 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.396 3.667 -0.190 1.00 0.00 H new ATOM 1198 N SER A 82 9.376 6.588 -1.646 1.00 0.00 N ATOM 1199 CA SER A 82 8.216 7.323 -2.136 1.00 0.00 C ATOM 1200 C SER A 82 8.366 8.822 -1.893 1.00 0.00 C ATOM 1201 O SER A 82 8.326 9.625 -2.825 1.00 0.00 O ATOM 1202 CB SER A 82 6.971 6.821 -1.419 1.00 0.00 C ATOM 1203 OG SER A 82 7.012 7.176 -0.049 1.00 0.00 O ATOM 0 H SER A 82 9.144 5.803 -1.037 1.00 0.00 H new ATOM 0 HA SER A 82 8.132 7.158 -3.210 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.081 7.244 -1.884 1.00 0.00 H new ATOM 0 HB3 SER A 82 6.898 5.738 -1.518 1.00 0.00 H new ATOM 0 HG SER A 82 7.763 6.719 0.385 1.00 0.00 H new ATOM 1209 N ASP A 83 8.536 9.184 -0.624 1.00 0.00 N ATOM 1210 CA ASP A 83 8.694 10.582 -0.235 1.00 0.00 C ATOM 1211 C ASP A 83 9.887 11.202 -0.954 1.00 0.00 C ATOM 1212 O ASP A 83 9.910 12.405 -1.225 1.00 0.00 O ATOM 1213 CB ASP A 83 8.881 10.695 1.286 1.00 0.00 C ATOM 1214 CG ASP A 83 7.965 11.726 1.918 1.00 0.00 C ATOM 1215 OD1 ASP A 83 7.822 12.828 1.345 1.00 0.00 O ATOM 1216 OD2 ASP A 83 7.395 11.436 2.991 1.00 0.00 O ATOM 0 H ASP A 83 8.568 8.526 0.155 1.00 0.00 H new ATOM 0 HA ASP A 83 7.792 11.123 -0.520 1.00 0.00 H new ATOM 0 HB2 ASP A 83 8.696 9.723 1.743 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.917 10.956 1.501 1.00 0.00 H new ATOM 1221 N GLU A 84 10.866 10.362 -1.274 1.00 0.00 N ATOM 1222 CA GLU A 84 12.062 10.809 -1.975 1.00 0.00 C ATOM 1223 C GLU A 84 11.691 11.486 -3.283 1.00 0.00 C ATOM 1224 O GLU A 84 12.030 12.646 -3.509 1.00 0.00 O ATOM 1225 CB GLU A 84 12.999 9.635 -2.251 1.00 0.00 C ATOM 1226 CG GLU A 84 14.451 9.929 -1.913 1.00 0.00 C ATOM 1227 CD GLU A 84 15.333 8.697 -1.992 1.00 0.00 C ATOM 1228 OE1 GLU A 84 14.858 7.659 -2.500 1.00 0.00 O ATOM 1229 OE2 GLU A 84 16.497 8.774 -1.549 1.00 0.00 O ATOM 0 H GLU A 84 10.853 9.365 -1.058 1.00 0.00 H new ATOM 0 HA GLU A 84 12.577 11.527 -1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 84 12.667 8.772 -1.674 1.00 0.00 H new ATOM 0 HB3 GLU A 84 12.927 9.362 -3.304 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.832 10.688 -2.596 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.508 10.348 -0.908 1.00 0.00 H new ATOM 1236 N LEU A 85 10.990 10.759 -4.143 1.00 0.00 N ATOM 1237 CA LEU A 85 10.576 11.312 -5.423 1.00 0.00 C ATOM 1238 C LEU A 85 9.485 12.359 -5.220 1.00 0.00 C ATOM 1239 O LEU A 85 9.591 13.480 -5.719 1.00 0.00 O ATOM 1240 CB LEU A 85 10.097 10.208 -6.369 1.00 0.00 C ATOM 1241 CG LEU A 85 9.837 10.666 -7.808 1.00 0.00 C ATOM 1242 CD1 LEU A 85 10.401 9.667 -8.808 1.00 0.00 C ATOM 1243 CD2 LEU A 85 8.350 10.875 -8.039 1.00 0.00 C ATOM 0 H LEU A 85 10.699 9.795 -3.979 1.00 0.00 H new ATOM 0 HA LEU A 85 11.439 11.794 -5.882 1.00 0.00 H new ATOM 0 HB2 LEU A 85 10.842 9.413 -6.384 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.180 9.777 -5.968 1.00 0.00 H new ATOM 0 HG LEU A 85 10.347 11.617 -7.959 1.00 0.00 H new ATOM 0 HD11 LEU A 85 10.203 10.016 -9.822 1.00 0.00 H new ATOM 0 HD12 LEU A 85 11.477 9.572 -8.660 1.00 0.00 H new ATOM 0 HD13 LEU A 85 9.928 8.697 -8.659 1.00 0.00 H new ATOM 0 HD21 LEU A 85 8.183 11.200 -9.066 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.820 9.939 -7.864 1.00 0.00 H new ATOM 0 HD23 LEU A 85 7.979 11.636 -7.353 1.00 0.00 H new ATOM 1255 N PHE A 86 8.433 11.993 -4.480 1.00 0.00 N ATOM 1256 CA PHE A 86 7.322 12.910 -4.210 1.00 0.00 C ATOM 1257 C PHE A 86 7.791 14.229 -3.615 1.00 0.00 C ATOM 1258 O PHE A 86 7.012 15.171 -3.531 1.00 0.00 O ATOM 1259 CB PHE A 86 6.347 12.277 -3.223 1.00 0.00 C ATOM 1260 CG PHE A 86 5.168 13.150 -2.876 1.00 0.00 C ATOM 1261 CD1 PHE A 86 5.240 14.022 -1.807 1.00 0.00 C ATOM 1262 CD2 PHE A 86 3.988 13.092 -3.606 1.00 0.00 C ATOM 1263 CE1 PHE A 86 4.166 14.822 -1.470 1.00 0.00 C ATOM 1264 CE2 PHE A 86 2.907 13.887 -3.271 1.00 0.00 C ATOM 1265 CZ PHE A 86 2.997 14.754 -2.202 1.00 0.00 C ATOM 0 H PHE A 86 8.328 11.070 -4.058 1.00 0.00 H new ATOM 0 HA PHE A 86 6.842 13.105 -5.169 1.00 0.00 H new ATOM 0 HB2 PHE A 86 5.981 11.340 -3.642 1.00 0.00 H new ATOM 0 HB3 PHE A 86 6.884 12.029 -2.307 1.00 0.00 H new ATOM 0 HD1 PHE A 86 6.149 14.079 -1.227 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.914 12.417 -4.446 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.240 15.501 -0.634 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.994 13.829 -3.845 1.00 0.00 H new ATOM 0 HZ PHE A 86 2.156 15.378 -1.938 1.00 0.00 H new ATOM 1275 N GLN A 87 9.051 14.291 -3.200 1.00 0.00 N ATOM 1276 CA GLN A 87 9.609 15.502 -2.605 1.00 0.00 C ATOM 1277 C GLN A 87 9.194 16.761 -3.370 1.00 0.00 C ATOM 1278 O GLN A 87 9.947 17.274 -4.200 1.00 0.00 O ATOM 1279 CB GLN A 87 11.131 15.395 -2.553 1.00 0.00 C ATOM 1280 CG GLN A 87 11.664 15.052 -1.173 1.00 0.00 C ATOM 1281 CD GLN A 87 13.159 15.269 -1.060 1.00 0.00 C ATOM 1282 OE1 GLN A 87 13.780 15.858 -1.944 1.00 0.00 O ATOM 1283 NE2 GLN A 87 13.742 14.790 0.030 1.00 0.00 N ATOM 0 H GLN A 87 9.709 13.514 -3.265 1.00 0.00 H new ATOM 0 HA GLN A 87 9.211 15.591 -1.594 1.00 0.00 H new ATOM 0 HB2 GLN A 87 11.459 14.634 -3.261 1.00 0.00 H new ATOM 0 HB3 GLN A 87 11.566 16.340 -2.878 1.00 0.00 H new ATOM 0 HG2 GLN A 87 11.154 15.662 -0.428 1.00 0.00 H new ATOM 0 HG3 GLN A 87 11.433 14.011 -0.946 1.00 0.00 H new ATOM 0 HE21 GLN A 87 13.186 14.308 0.736 1.00 0.00 H new ATOM 0 HE22 GLN A 87 14.747 14.903 0.162 1.00 0.00 H new ATOM 1292 N GLY A 88 7.987 17.244 -3.095 1.00 0.00 N ATOM 1293 CA GLY A 88 7.479 18.425 -3.770 1.00 0.00 C ATOM 1294 C GLY A 88 6.708 18.087 -5.030 1.00 0.00 C ATOM 1295 O GLY A 88 6.649 18.884 -5.967 1.00 0.00 O ATOM 0 H GLY A 88 7.348 16.836 -2.413 1.00 0.00 H new ATOM 0 HA2 GLY A 88 6.832 18.978 -3.089 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.312 19.082 -4.023 1.00 0.00 H new ATOM 1299 N GLY A 89 6.104 16.901 -5.044 1.00 0.00 N ATOM 1300 CA GLY A 89 5.326 16.468 -6.189 1.00 0.00 C ATOM 1301 C GLY A 89 3.904 16.113 -5.801 1.00 0.00 C ATOM 1302 O GLY A 89 3.566 14.936 -5.688 1.00 0.00 O ATOM 0 H GLY A 89 6.141 16.230 -4.277 1.00 0.00 H new ATOM 0 HA2 GLY A 89 5.312 17.259 -6.939 1.00 0.00 H new ATOM 0 HA3 GLY A 89 5.805 15.603 -6.648 1.00 0.00 H new ATOM 1306 N PRO A 90 3.042 17.120 -5.585 1.00 0.00 N ATOM 1307 CA PRO A 90 1.639 16.904 -5.198 1.00 0.00 C ATOM 1308 C PRO A 90 0.798 16.292 -6.315 1.00 0.00 C ATOM 1309 O PRO A 90 -0.362 16.661 -6.503 1.00 0.00 O ATOM 1310 CB PRO A 90 1.137 18.316 -4.879 1.00 0.00 C ATOM 1311 CG PRO A 90 2.032 19.229 -5.642 1.00 0.00 C ATOM 1312 CD PRO A 90 3.372 18.553 -5.695 1.00 0.00 C ATOM 0 HA PRO A 90 1.560 16.201 -4.369 1.00 0.00 H new ATOM 0 HB2 PRO A 90 0.097 18.442 -5.180 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.186 18.519 -3.809 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.645 19.405 -6.646 1.00 0.00 H new ATOM 0 HG3 PRO A 90 2.105 20.201 -5.154 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.896 18.774 -6.625 1.00 0.00 H new ATOM 0 HD3 PRO A 90 4.018 18.879 -4.880 1.00 0.00 H new ATOM 1320 N ASN A 91 1.385 15.356 -7.051 1.00 0.00 N ATOM 1321 CA ASN A 91 0.689 14.693 -8.141 1.00 0.00 C ATOM 1322 C ASN A 91 -0.026 13.440 -7.650 1.00 0.00 C ATOM 1323 O ASN A 91 0.262 12.924 -6.570 1.00 0.00 O ATOM 1324 CB ASN A 91 1.677 14.334 -9.252 1.00 0.00 C ATOM 1325 CG ASN A 91 2.522 15.517 -9.687 1.00 0.00 C ATOM 1326 OD1 ASN A 91 3.703 15.369 -9.998 1.00 0.00 O ATOM 1327 ND2 ASN A 91 1.919 16.699 -9.720 1.00 0.00 N ATOM 0 H ASN A 91 2.345 15.040 -6.910 1.00 0.00 H new ATOM 0 HA ASN A 91 -0.060 15.379 -8.536 1.00 0.00 H new ATOM 0 HB2 ASN A 91 2.331 13.533 -8.907 1.00 0.00 H new ATOM 0 HB3 ASN A 91 1.128 13.949 -10.111 1.00 0.00 H new ATOM 0 HD21 ASN A 91 2.437 17.528 -10.011 1.00 0.00 H new ATOM 0 HD22 ASN A 91 0.938 16.778 -9.454 1.00 0.00 H new ATOM 1334 N TRP A 92 -0.959 12.961 -8.458 1.00 0.00 N ATOM 1335 CA TRP A 92 -1.730 11.766 -8.133 1.00 0.00 C ATOM 1336 C TRP A 92 -0.883 10.505 -8.287 1.00 0.00 C ATOM 1337 O TRP A 92 -1.103 9.500 -7.608 1.00 0.00 O ATOM 1338 CB TRP A 92 -2.968 11.678 -9.035 1.00 0.00 C ATOM 1339 CG TRP A 92 -3.207 12.910 -9.863 1.00 0.00 C ATOM 1340 CD1 TRP A 92 -3.631 14.134 -9.414 1.00 0.00 C ATOM 1341 CD2 TRP A 92 -3.025 13.044 -11.277 1.00 0.00 C ATOM 1342 NE1 TRP A 92 -3.741 15.008 -10.472 1.00 0.00 N ATOM 1343 CE2 TRP A 92 -3.374 14.363 -11.622 1.00 0.00 C ATOM 1344 CE3 TRP A 92 -2.609 12.173 -12.291 1.00 0.00 C ATOM 1345 CZ2 TRP A 92 -3.320 14.831 -12.935 1.00 0.00 C ATOM 1346 CZ3 TRP A 92 -2.554 12.641 -13.591 1.00 0.00 C ATOM 1347 CH2 TRP A 92 -2.908 13.958 -13.903 1.00 0.00 C ATOM 0 H TRP A 92 -1.204 13.385 -9.353 1.00 0.00 H new ATOM 0 HA TRP A 92 -2.046 11.839 -7.092 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -2.861 10.821 -9.700 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -3.845 11.493 -8.415 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -3.847 14.376 -8.384 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -4.047 15.979 -10.409 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -2.336 11.154 -12.062 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -3.594 15.847 -13.178 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -2.232 11.978 -14.380 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -2.855 14.292 -14.929 1.00 0.00 H new ATOM 1358 N GLY A 93 0.088 10.555 -9.194 1.00 0.00 N ATOM 1359 CA GLY A 93 0.948 9.410 -9.424 1.00 0.00 C ATOM 1360 C GLY A 93 1.504 8.848 -8.137 1.00 0.00 C ATOM 1361 O GLY A 93 1.418 7.646 -7.880 1.00 0.00 O ATOM 0 H GLY A 93 0.294 11.369 -9.774 1.00 0.00 H new ATOM 0 HA2 GLY A 93 0.386 8.634 -9.945 1.00 0.00 H new ATOM 0 HA3 GLY A 93 1.771 9.701 -10.077 1.00 0.00 H new ATOM 1365 N ARG A 94 2.067 9.725 -7.326 1.00 0.00 N ATOM 1366 CA ARG A 94 2.637 9.327 -6.054 1.00 0.00 C ATOM 1367 C ARG A 94 1.571 8.849 -5.083 1.00 0.00 C ATOM 1368 O ARG A 94 1.883 8.223 -4.073 1.00 0.00 O ATOM 1369 CB ARG A 94 3.391 10.493 -5.442 1.00 0.00 C ATOM 1370 CG ARG A 94 4.867 10.219 -5.294 1.00 0.00 C ATOM 1371 CD ARG A 94 5.655 10.650 -6.520 1.00 0.00 C ATOM 1372 NE ARG A 94 5.172 11.906 -7.100 1.00 0.00 N ATOM 1373 CZ ARG A 94 4.873 12.067 -8.392 1.00 0.00 C ATOM 1374 NH1 ARG A 94 5.005 11.063 -9.253 1.00 0.00 N ATOM 1375 NH2 ARG A 94 4.441 13.242 -8.822 1.00 0.00 N ATOM 0 H ARG A 94 2.141 10.722 -7.528 1.00 0.00 H new ATOM 0 HA ARG A 94 3.318 8.497 -6.242 1.00 0.00 H new ATOM 0 HB2 ARG A 94 3.250 11.377 -6.063 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.968 10.720 -4.463 1.00 0.00 H new ATOM 0 HG2 ARG A 94 5.246 10.744 -4.417 1.00 0.00 H new ATOM 0 HG3 ARG A 94 5.022 9.154 -5.120 1.00 0.00 H new ATOM 0 HD2 ARG A 94 6.705 10.762 -6.249 1.00 0.00 H new ATOM 0 HD3 ARG A 94 5.602 9.864 -7.274 1.00 0.00 H new ATOM 0 HE ARG A 94 5.057 12.707 -6.479 1.00 0.00 H new ATOM 0 HH11 ARG A 94 5.338 10.155 -8.930 1.00 0.00 H new ATOM 0 HH12 ARG A 94 4.773 11.201 -10.237 1.00 0.00 H new ATOM 0 HH21 ARG A 94 4.338 14.018 -8.168 1.00 0.00 H new ATOM 0 HH22 ARG A 94 4.211 13.371 -9.807 1.00 0.00 H new ATOM 1389 N LEU A 95 0.314 9.137 -5.388 1.00 0.00 N ATOM 1390 CA LEU A 95 -0.772 8.725 -4.526 1.00 0.00 C ATOM 1391 C LEU A 95 -0.997 7.221 -4.658 1.00 0.00 C ATOM 1392 O LEU A 95 -0.912 6.485 -3.678 1.00 0.00 O ATOM 1393 CB LEU A 95 -2.046 9.512 -4.856 1.00 0.00 C ATOM 1394 CG LEU A 95 -3.364 8.817 -4.515 1.00 0.00 C ATOM 1395 CD1 LEU A 95 -3.693 8.996 -3.042 1.00 0.00 C ATOM 1396 CD2 LEU A 95 -4.487 9.357 -5.384 1.00 0.00 C ATOM 0 H LEU A 95 0.027 9.651 -6.221 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.510 8.941 -3.490 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -2.011 10.463 -4.325 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.043 9.741 -5.922 1.00 0.00 H new ATOM 0 HG LEU A 95 -3.257 7.751 -4.715 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -4.634 8.495 -2.816 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.897 8.563 -2.436 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.784 10.058 -2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -5.419 8.852 -5.129 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.596 10.428 -5.214 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.253 9.179 -6.434 1.00 0.00 H new ATOM 1408 N VAL A 96 -1.280 6.778 -5.876 1.00 0.00 N ATOM 1409 CA VAL A 96 -1.514 5.365 -6.142 1.00 0.00 C ATOM 1410 C VAL A 96 -0.285 4.520 -5.800 1.00 0.00 C ATOM 1411 O VAL A 96 -0.412 3.412 -5.281 1.00 0.00 O ATOM 1412 CB VAL A 96 -1.901 5.134 -7.618 1.00 0.00 C ATOM 1413 CG1 VAL A 96 -2.339 3.694 -7.839 1.00 0.00 C ATOM 1414 CG2 VAL A 96 -2.997 6.102 -8.038 1.00 0.00 C ATOM 0 H VAL A 96 -1.353 7.379 -6.697 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.341 5.054 -5.504 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.024 5.320 -8.238 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.608 3.552 -8.886 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.522 3.021 -7.580 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.202 3.476 -7.210 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.258 5.926 -9.081 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.877 5.949 -7.413 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.642 7.126 -7.921 1.00 0.00 H new ATOM 1424 N ALA A 97 0.904 5.048 -6.091 1.00 0.00 N ATOM 1425 CA ALA A 97 2.150 4.336 -5.809 1.00 0.00 C ATOM 1426 C ALA A 97 2.421 4.271 -4.304 1.00 0.00 C ATOM 1427 O ALA A 97 2.335 3.206 -3.693 1.00 0.00 O ATOM 1428 CB ALA A 97 3.309 5.001 -6.540 1.00 0.00 C ATOM 0 H ALA A 97 1.030 5.964 -6.521 1.00 0.00 H new ATOM 0 HA ALA A 97 2.050 3.312 -6.170 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.232 4.463 -6.323 1.00 0.00 H new ATOM 0 HB2 ALA A 97 3.121 4.982 -7.614 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.404 6.034 -6.207 1.00 0.00 H new ATOM 1434 N PHE A 98 2.745 5.416 -3.709 1.00 0.00 N ATOM 1435 CA PHE A 98 3.027 5.489 -2.271 1.00 0.00 C ATOM 1436 C PHE A 98 2.005 4.686 -1.472 1.00 0.00 C ATOM 1437 O PHE A 98 2.314 4.152 -0.407 1.00 0.00 O ATOM 1438 CB PHE A 98 3.023 6.950 -1.805 1.00 0.00 C ATOM 1439 CG PHE A 98 2.982 7.113 -0.310 1.00 0.00 C ATOM 1440 CD1 PHE A 98 1.810 6.912 0.403 1.00 0.00 C ATOM 1441 CD2 PHE A 98 4.124 7.458 0.379 1.00 0.00 C ATOM 1442 CE1 PHE A 98 1.789 7.052 1.779 1.00 0.00 C ATOM 1443 CE2 PHE A 98 4.111 7.602 1.751 1.00 0.00 C ATOM 1444 CZ PHE A 98 2.943 7.398 2.455 1.00 0.00 C ATOM 0 H PHE A 98 2.820 6.308 -4.197 1.00 0.00 H new ATOM 0 HA PHE A 98 4.014 5.059 -2.097 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.914 7.446 -2.190 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.162 7.457 -2.240 1.00 0.00 H new ATOM 0 HD1 PHE A 98 0.905 6.644 -0.121 1.00 0.00 H new ATOM 0 HD2 PHE A 98 5.044 7.618 -0.164 1.00 0.00 H new ATOM 0 HE1 PHE A 98 0.871 6.891 2.325 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.016 7.875 2.274 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.930 7.508 3.529 1.00 0.00 H new ATOM 1454 N PHE A 99 0.787 4.615 -1.991 1.00 0.00 N ATOM 1455 CA PHE A 99 -0.284 3.887 -1.327 1.00 0.00 C ATOM 1456 C PHE A 99 -0.059 2.382 -1.414 1.00 0.00 C ATOM 1457 O PHE A 99 0.039 1.703 -0.393 1.00 0.00 O ATOM 1458 CB PHE A 99 -1.630 4.250 -1.951 1.00 0.00 C ATOM 1459 CG PHE A 99 -2.808 3.835 -1.120 1.00 0.00 C ATOM 1460 CD1 PHE A 99 -3.014 2.505 -0.786 1.00 0.00 C ATOM 1461 CD2 PHE A 99 -3.710 4.781 -0.669 1.00 0.00 C ATOM 1462 CE1 PHE A 99 -4.098 2.129 -0.018 1.00 0.00 C ATOM 1463 CE2 PHE A 99 -4.796 4.412 0.097 1.00 0.00 C ATOM 1464 CZ PHE A 99 -4.991 3.085 0.424 1.00 0.00 C ATOM 0 H PHE A 99 0.516 5.054 -2.871 1.00 0.00 H new ATOM 0 HA PHE A 99 -0.287 4.172 -0.275 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.669 5.328 -2.109 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -1.705 3.781 -2.932 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.318 1.754 -1.131 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.562 5.821 -0.920 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.247 1.090 0.236 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -5.494 5.161 0.441 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.841 2.795 1.025 1.00 0.00 H new ATOM 1474 N VAL A 100 0.010 1.861 -2.638 1.00 0.00 N ATOM 1475 CA VAL A 100 0.208 0.429 -2.854 1.00 0.00 C ATOM 1476 C VAL A 100 1.330 -0.117 -1.984 1.00 0.00 C ATOM 1477 O VAL A 100 1.291 -1.269 -1.558 1.00 0.00 O ATOM 1478 CB VAL A 100 0.518 0.098 -4.329 1.00 0.00 C ATOM 1479 CG1 VAL A 100 1.771 0.811 -4.807 1.00 0.00 C ATOM 1480 CG2 VAL A 100 0.664 -1.401 -4.522 1.00 0.00 C ATOM 0 H VAL A 100 -0.068 2.409 -3.495 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.733 -0.047 -2.577 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.321 0.451 -4.928 1.00 0.00 H new ATOM 0 HG11 VAL A 100 1.960 0.555 -5.850 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.633 1.888 -4.717 1.00 0.00 H new ATOM 0 HG13 VAL A 100 2.620 0.502 -4.198 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.882 -1.614 -5.569 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.479 -1.770 -3.899 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -0.264 -1.897 -4.237 1.00 0.00 H new ATOM 1490 N PHE A 101 2.326 0.706 -1.726 1.00 0.00 N ATOM 1491 CA PHE A 101 3.445 0.277 -0.902 1.00 0.00 C ATOM 1492 C PHE A 101 3.052 0.254 0.570 1.00 0.00 C ATOM 1493 O PHE A 101 3.124 -0.788 1.223 1.00 0.00 O ATOM 1494 CB PHE A 101 4.659 1.181 -1.114 1.00 0.00 C ATOM 1495 CG PHE A 101 5.606 0.690 -2.174 1.00 0.00 C ATOM 1496 CD1 PHE A 101 5.875 -0.661 -2.341 1.00 0.00 C ATOM 1497 CD2 PHE A 101 6.225 1.592 -3.007 1.00 0.00 C ATOM 1498 CE1 PHE A 101 6.746 -1.091 -3.327 1.00 0.00 C ATOM 1499 CE2 PHE A 101 7.096 1.171 -3.995 1.00 0.00 C ATOM 1500 CZ PHE A 101 7.356 -0.172 -4.155 1.00 0.00 C ATOM 0 H PHE A 101 2.387 1.665 -2.069 1.00 0.00 H new ATOM 0 HA PHE A 101 3.716 -0.735 -1.205 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.314 2.179 -1.383 1.00 0.00 H new ATOM 0 HB3 PHE A 101 5.200 1.274 -0.172 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.400 -1.384 -1.695 1.00 0.00 H new ATOM 0 HD2 PHE A 101 6.028 2.647 -2.888 1.00 0.00 H new ATOM 0 HE1 PHE A 101 6.948 -2.145 -3.448 1.00 0.00 H new ATOM 0 HE2 PHE A 101 7.572 1.894 -4.640 1.00 0.00 H new ATOM 0 HZ PHE A 101 8.035 -0.504 -4.926 1.00 0.00 H new ATOM 1510 N GLY A 102 2.624 1.404 1.093 1.00 0.00 N ATOM 1511 CA GLY A 102 2.229 1.480 2.484 1.00 0.00 C ATOM 1512 C GLY A 102 1.261 0.380 2.884 1.00 0.00 C ATOM 1513 O GLY A 102 1.454 -0.276 3.905 1.00 0.00 O ATOM 0 H GLY A 102 2.546 2.280 0.576 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.118 1.421 3.113 1.00 0.00 H new ATOM 0 HA3 GLY A 102 1.768 2.449 2.673 1.00 0.00 H new ATOM 1517 N ALA A 103 0.217 0.180 2.085 1.00 0.00 N ATOM 1518 CA ALA A 103 -0.777 -0.846 2.378 1.00 0.00 C ATOM 1519 C ALA A 103 -0.195 -2.249 2.222 1.00 0.00 C ATOM 1520 O ALA A 103 -0.254 -3.060 3.146 1.00 0.00 O ATOM 1521 CB ALA A 103 -1.994 -0.674 1.482 1.00 0.00 C ATOM 0 H ALA A 103 0.038 0.712 1.234 1.00 0.00 H new ATOM 0 HA ALA A 103 -1.083 -0.727 3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -2.727 -1.447 1.712 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.436 0.308 1.653 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.692 -0.759 0.438 1.00 0.00 H new ATOM 1527 N ALA A 104 0.351 -2.533 1.044 1.00 0.00 N ATOM 1528 CA ALA A 104 0.932 -3.843 0.765 1.00 0.00 C ATOM 1529 C ALA A 104 1.914 -4.258 1.852 1.00 0.00 C ATOM 1530 O ALA A 104 1.821 -5.355 2.399 1.00 0.00 O ATOM 1531 CB ALA A 104 1.619 -3.849 -0.591 1.00 0.00 C ATOM 0 H ALA A 104 0.404 -1.874 0.267 1.00 0.00 H new ATOM 0 HA ALA A 104 0.117 -4.567 0.750 1.00 0.00 H new ATOM 0 HB1 ALA A 104 2.045 -4.835 -0.779 1.00 0.00 H new ATOM 0 HB2 ALA A 104 0.892 -3.614 -1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 104 2.413 -3.103 -0.600 1.00 0.00 H new ATOM 1537 N LEU A 105 2.856 -3.376 2.161 1.00 0.00 N ATOM 1538 CA LEU A 105 3.851 -3.658 3.186 1.00 0.00 C ATOM 1539 C LEU A 105 3.184 -3.977 4.513 1.00 0.00 C ATOM 1540 O LEU A 105 3.311 -5.088 5.027 1.00 0.00 O ATOM 1541 CB LEU A 105 4.786 -2.467 3.368 1.00 0.00 C ATOM 1542 CG LEU A 105 6.225 -2.805 3.760 1.00 0.00 C ATOM 1543 CD1 LEU A 105 6.981 -1.531 4.077 1.00 0.00 C ATOM 1544 CD2 LEU A 105 6.276 -3.746 4.961 1.00 0.00 C ATOM 0 H LEU A 105 2.951 -2.462 1.718 1.00 0.00 H new ATOM 0 HA LEU A 105 4.427 -4.523 2.859 1.00 0.00 H new ATOM 0 HB2 LEU A 105 4.807 -1.900 2.438 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.366 -1.812 4.131 1.00 0.00 H new ATOM 0 HG LEU A 105 6.691 -3.313 2.916 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.006 -1.776 4.356 1.00 0.00 H new ATOM 0 HD12 LEU A 105 6.988 -0.884 3.200 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.493 -1.015 4.904 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.315 -3.963 5.209 1.00 0.00 H new ATOM 0 HD22 LEU A 105 5.790 -3.273 5.814 1.00 0.00 H new ATOM 0 HD23 LEU A 105 5.760 -4.675 4.718 1.00 0.00 H new ATOM 1556 N CYS A 106 2.484 -2.989 5.070 1.00 0.00 N ATOM 1557 CA CYS A 106 1.808 -3.164 6.351 1.00 0.00 C ATOM 1558 C CYS A 106 1.171 -4.544 6.441 1.00 0.00 C ATOM 1559 O CYS A 106 1.447 -5.301 7.368 1.00 0.00 O ATOM 1560 CB CYS A 106 0.747 -2.079 6.555 1.00 0.00 C ATOM 1561 SG CYS A 106 1.417 -0.415 6.782 1.00 0.00 S ATOM 0 H CYS A 106 2.372 -2.064 4.655 1.00 0.00 H new ATOM 0 HA CYS A 106 2.554 -3.074 7.141 1.00 0.00 H new ATOM 0 HB2 CYS A 106 0.079 -2.074 5.694 1.00 0.00 H new ATOM 0 HB3 CYS A 106 0.144 -2.337 7.425 1.00 0.00 H new ATOM 0 HG CYS A 106 1.551 0.161 5.624 1.00 0.00 H new ATOM 1567 N ALA A 107 0.334 -4.870 5.460 1.00 0.00 N ATOM 1568 CA ALA A 107 -0.336 -6.166 5.423 1.00 0.00 C ATOM 1569 C ALA A 107 0.664 -7.315 5.491 1.00 0.00 C ATOM 1570 O ALA A 107 0.516 -8.235 6.297 1.00 0.00 O ATOM 1571 CB ALA A 107 -1.185 -6.280 4.165 1.00 0.00 C ATOM 0 H ALA A 107 0.104 -4.254 4.680 1.00 0.00 H new ATOM 0 HA ALA A 107 -0.981 -6.235 6.299 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -1.681 -7.251 4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -1.935 -5.489 4.160 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -0.548 -6.182 3.286 1.00 0.00 H new ATOM 1577 N GLU A 108 1.686 -7.266 4.633 1.00 0.00 N ATOM 1578 CA GLU A 108 2.711 -8.305 4.595 1.00 0.00 C ATOM 1579 C GLU A 108 3.180 -8.672 6.000 1.00 0.00 C ATOM 1580 O GLU A 108 3.299 -9.849 6.340 1.00 0.00 O ATOM 1581 CB GLU A 108 3.903 -7.848 3.751 1.00 0.00 C ATOM 1582 CG GLU A 108 4.825 -8.982 3.332 1.00 0.00 C ATOM 1583 CD GLU A 108 4.385 -9.644 2.041 1.00 0.00 C ATOM 1584 OE1 GLU A 108 3.927 -8.921 1.131 1.00 0.00 O ATOM 1585 OE2 GLU A 108 4.498 -10.883 1.940 1.00 0.00 O ATOM 0 H GLU A 108 1.823 -6.516 3.956 1.00 0.00 H new ATOM 0 HA GLU A 108 2.269 -9.191 4.140 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.533 -7.344 2.858 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.478 -7.114 4.317 1.00 0.00 H new ATOM 0 HG2 GLU A 108 5.837 -8.597 3.212 1.00 0.00 H new ATOM 0 HG3 GLU A 108 4.860 -9.729 4.125 1.00 0.00 H new ATOM 1592 N SER A 109 3.438 -7.654 6.812 1.00 0.00 N ATOM 1593 CA SER A 109 3.884 -7.865 8.181 1.00 0.00 C ATOM 1594 C SER A 109 2.715 -8.271 9.078 1.00 0.00 C ATOM 1595 O SER A 109 2.903 -8.958 10.084 1.00 0.00 O ATOM 1596 CB SER A 109 4.548 -6.597 8.725 1.00 0.00 C ATOM 1597 OG SER A 109 5.086 -5.811 7.674 1.00 0.00 O ATOM 0 H SER A 109 3.346 -6.674 6.545 1.00 0.00 H new ATOM 0 HA SER A 109 4.614 -8.675 8.179 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.818 -6.012 9.284 1.00 0.00 H new ATOM 0 HB3 SER A 109 5.340 -6.868 9.423 1.00 0.00 H new ATOM 0 HG SER A 109 5.503 -5.006 8.047 1.00 0.00 H new ATOM 1603 N VAL A 110 1.506 -7.843 8.711 1.00 0.00 N ATOM 1604 CA VAL A 110 0.310 -8.164 9.488 1.00 0.00 C ATOM 1605 C VAL A 110 0.130 -9.673 9.620 1.00 0.00 C ATOM 1606 O VAL A 110 0.303 -10.232 10.701 1.00 0.00 O ATOM 1607 CB VAL A 110 -0.965 -7.554 8.859 1.00 0.00 C ATOM 1608 CG1 VAL A 110 -2.211 -8.010 9.606 1.00 0.00 C ATOM 1609 CG2 VAL A 110 -0.885 -6.037 8.850 1.00 0.00 C ATOM 0 H VAL A 110 1.330 -7.275 7.882 1.00 0.00 H new ATOM 0 HA VAL A 110 0.454 -7.728 10.477 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.033 -7.906 7.830 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.094 -7.568 9.145 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.284 -9.097 9.562 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.148 -7.693 10.647 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.791 -5.628 8.404 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.787 -5.672 9.872 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.019 -5.722 8.268 1.00 0.00 H new ATOM 1619 N ASN A 111 -0.230 -10.324 8.516 1.00 0.00 N ATOM 1620 CA ASN A 111 -0.451 -11.770 8.511 1.00 0.00 C ATOM 1621 C ASN A 111 0.673 -12.508 9.234 1.00 0.00 C ATOM 1622 O ASN A 111 0.453 -13.557 9.840 1.00 0.00 O ATOM 1623 CB ASN A 111 -0.568 -12.282 7.074 1.00 0.00 C ATOM 1624 CG ASN A 111 -1.730 -13.239 6.892 1.00 0.00 C ATOM 1625 OD1 ASN A 111 -2.584 -13.371 7.770 1.00 0.00 O ATOM 1626 ND2 ASN A 111 -1.768 -13.914 5.749 1.00 0.00 N ATOM 0 H ASN A 111 -0.375 -9.874 7.612 1.00 0.00 H new ATOM 0 HA ASN A 111 -1.383 -11.966 9.042 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -0.690 -11.435 6.399 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.359 -12.783 6.793 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -2.526 -14.573 5.571 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -1.039 -13.773 5.049 1.00 0.00 H new ATOM 1633 N LYS A 112 1.877 -11.947 9.172 1.00 0.00 N ATOM 1634 CA LYS A 112 3.036 -12.546 9.826 1.00 0.00 C ATOM 1635 C LYS A 112 2.968 -12.384 11.349 1.00 0.00 C ATOM 1636 O LYS A 112 3.869 -12.818 12.066 1.00 0.00 O ATOM 1637 CB LYS A 112 4.321 -11.914 9.287 1.00 0.00 C ATOM 1638 CG LYS A 112 5.131 -12.842 8.399 1.00 0.00 C ATOM 1639 CD LYS A 112 5.831 -13.917 9.213 1.00 0.00 C ATOM 1640 CE LYS A 112 6.907 -13.325 10.111 1.00 0.00 C ATOM 1641 NZ LYS A 112 8.175 -14.102 10.044 1.00 0.00 N ATOM 0 H LYS A 112 2.076 -11.078 8.676 1.00 0.00 H new ATOM 0 HA LYS A 112 3.035 -13.613 9.604 1.00 0.00 H new ATOM 0 HB2 LYS A 112 4.065 -11.017 8.723 1.00 0.00 H new ATOM 0 HB3 LYS A 112 4.940 -11.597 10.127 1.00 0.00 H new ATOM 0 HG2 LYS A 112 4.475 -13.309 7.664 1.00 0.00 H new ATOM 0 HG3 LYS A 112 5.870 -12.264 7.845 1.00 0.00 H new ATOM 0 HD2 LYS A 112 5.099 -14.448 9.822 1.00 0.00 H new ATOM 0 HD3 LYS A 112 6.279 -14.650 8.541 1.00 0.00 H new ATOM 0 HE2 LYS A 112 7.098 -12.293 9.817 1.00 0.00 H new ATOM 0 HE3 LYS A 112 6.549 -13.302 11.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 8.882 -13.667 10.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.999 -15.081 10.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 8.531 -14.102 9.067 1.00 0.00 H new ATOM 1655 N GLU A 113 1.896 -11.758 11.836 1.00 0.00 N ATOM 1656 CA GLU A 113 1.710 -11.538 13.266 1.00 0.00 C ATOM 1657 C GLU A 113 2.703 -10.509 13.795 1.00 0.00 C ATOM 1658 O GLU A 113 3.033 -10.503 14.981 1.00 0.00 O ATOM 1659 CB GLU A 113 1.853 -12.855 14.034 1.00 0.00 C ATOM 1660 CG GLU A 113 0.579 -13.277 14.747 1.00 0.00 C ATOM 1661 CD GLU A 113 0.413 -12.598 16.093 1.00 0.00 C ATOM 1662 OE1 GLU A 113 1.435 -12.182 16.679 1.00 0.00 O ATOM 1663 OE2 GLU A 113 -0.738 -12.483 16.562 1.00 0.00 O ATOM 0 H GLU A 113 1.141 -11.393 11.255 1.00 0.00 H new ATOM 0 HA GLU A 113 0.703 -11.150 13.418 1.00 0.00 H new ATOM 0 HB2 GLU A 113 2.150 -13.641 13.340 1.00 0.00 H new ATOM 0 HB3 GLU A 113 2.655 -12.756 14.766 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -0.280 -13.043 14.118 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.586 -14.358 14.888 1.00 0.00 H new ATOM 1670 N MET A 114 3.174 -9.636 12.908 1.00 0.00 N ATOM 1671 CA MET A 114 4.125 -8.601 13.285 1.00 0.00 C ATOM 1672 C MET A 114 3.456 -7.227 13.316 1.00 0.00 C ATOM 1673 O MET A 114 3.849 -6.315 12.587 1.00 0.00 O ATOM 1674 CB MET A 114 5.307 -8.590 12.313 1.00 0.00 C ATOM 1675 CG MET A 114 6.038 -9.920 12.223 1.00 0.00 C ATOM 1676 SD MET A 114 7.830 -9.726 12.120 1.00 0.00 S ATOM 1677 CE MET A 114 7.976 -8.639 10.703 1.00 0.00 C ATOM 0 H MET A 114 2.910 -9.627 11.923 1.00 0.00 H new ATOM 0 HA MET A 114 4.491 -8.824 14.287 1.00 0.00 H new ATOM 0 HB2 MET A 114 4.948 -8.315 11.321 1.00 0.00 H new ATOM 0 HB3 MET A 114 6.012 -7.818 12.621 1.00 0.00 H new ATOM 0 HG2 MET A 114 5.792 -10.525 13.096 1.00 0.00 H new ATOM 0 HG3 MET A 114 5.685 -10.465 11.348 1.00 0.00 H new ATOM 0 HE1 MET A 114 8.754 -9.012 10.037 1.00 0.00 H new ATOM 0 HE2 MET A 114 7.026 -8.607 10.169 1.00 0.00 H new ATOM 0 HE3 MET A 114 8.237 -7.636 11.039 1.00 0.00 H new ATOM 1687 N GLU A 115 2.443 -7.087 14.168 1.00 0.00 N ATOM 1688 CA GLU A 115 1.717 -5.827 14.300 1.00 0.00 C ATOM 1689 C GLU A 115 2.583 -4.768 14.980 1.00 0.00 C ATOM 1690 O GLU A 115 2.430 -3.573 14.731 1.00 0.00 O ATOM 1691 CB GLU A 115 0.426 -6.041 15.095 1.00 0.00 C ATOM 1692 CG GLU A 115 -0.830 -5.997 14.239 1.00 0.00 C ATOM 1693 CD GLU A 115 -1.762 -7.162 14.509 1.00 0.00 C ATOM 1694 OE1 GLU A 115 -1.758 -7.673 15.648 1.00 0.00 O ATOM 1695 OE2 GLU A 115 -2.495 -7.563 13.581 1.00 0.00 O ATOM 0 H GLU A 115 2.106 -7.832 14.778 1.00 0.00 H new ATOM 0 HA GLU A 115 1.464 -5.473 13.301 1.00 0.00 H new ATOM 0 HB2 GLU A 115 0.477 -7.005 15.602 1.00 0.00 H new ATOM 0 HB3 GLU A 115 0.355 -5.277 15.869 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -1.359 -5.063 14.425 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -0.548 -5.999 13.186 1.00 0.00 H new ATOM 1702 N VAL A 116 3.488 -5.220 15.844 1.00 0.00 N ATOM 1703 CA VAL A 116 4.383 -4.315 16.568 1.00 0.00 C ATOM 1704 C VAL A 116 4.902 -3.200 15.661 1.00 0.00 C ATOM 1705 O VAL A 116 4.787 -2.018 15.984 1.00 0.00 O ATOM 1706 CB VAL A 116 5.587 -5.065 17.169 1.00 0.00 C ATOM 1707 CG1 VAL A 116 6.382 -4.149 18.087 1.00 0.00 C ATOM 1708 CG2 VAL A 116 5.127 -6.310 17.911 1.00 0.00 C ATOM 0 H VAL A 116 3.623 -6.207 16.061 1.00 0.00 H new ATOM 0 HA VAL A 116 3.793 -3.881 17.375 1.00 0.00 H new ATOM 0 HB VAL A 116 6.239 -5.379 16.354 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.229 -4.696 18.502 1.00 0.00 H new ATOM 0 HG12 VAL A 116 6.746 -3.293 17.520 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.742 -3.801 18.898 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.992 -6.826 18.328 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.451 -6.024 18.717 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.607 -6.974 17.220 1.00 0.00 H new ATOM 1718 N LEU A 117 5.469 -3.587 14.524 1.00 0.00 N ATOM 1719 CA LEU A 117 6.001 -2.622 13.568 1.00 0.00 C ATOM 1720 C LEU A 117 4.873 -1.900 12.836 1.00 0.00 C ATOM 1721 O LEU A 117 4.984 -0.716 12.521 1.00 0.00 O ATOM 1722 CB LEU A 117 6.918 -3.315 12.557 1.00 0.00 C ATOM 1723 CG LEU A 117 7.722 -4.492 13.113 1.00 0.00 C ATOM 1724 CD1 LEU A 117 7.013 -5.797 12.807 1.00 0.00 C ATOM 1725 CD2 LEU A 117 9.132 -4.501 12.538 1.00 0.00 C ATOM 0 H LEU A 117 5.572 -4.562 14.241 1.00 0.00 H new ATOM 0 HA LEU A 117 6.581 -1.886 14.125 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.312 -3.670 11.723 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.613 -2.578 12.155 1.00 0.00 H new ATOM 0 HG LEU A 117 7.799 -4.380 14.195 1.00 0.00 H new ATOM 0 HD11 LEU A 117 7.593 -6.629 13.207 1.00 0.00 H new ATOM 0 HD12 LEU A 117 6.024 -5.790 13.266 1.00 0.00 H new ATOM 0 HD13 LEU A 117 6.911 -5.911 11.728 1.00 0.00 H new ATOM 0 HD21 LEU A 117 9.686 -5.346 12.947 1.00 0.00 H new ATOM 0 HD22 LEU A 117 9.082 -4.591 11.453 1.00 0.00 H new ATOM 0 HD23 LEU A 117 9.639 -3.573 12.802 1.00 0.00 H new ATOM 1737 N VAL A 118 3.786 -2.619 12.568 1.00 0.00 N ATOM 1738 CA VAL A 118 2.638 -2.040 11.874 1.00 0.00 C ATOM 1739 C VAL A 118 2.258 -0.691 12.480 1.00 0.00 C ATOM 1740 O VAL A 118 2.299 0.338 11.803 1.00 0.00 O ATOM 1741 CB VAL A 118 1.417 -2.990 11.913 1.00 0.00 C ATOM 1742 CG1 VAL A 118 0.139 -2.267 11.505 1.00 0.00 C ATOM 1743 CG2 VAL A 118 1.656 -4.197 11.017 1.00 0.00 C ATOM 0 H VAL A 118 3.676 -3.601 12.820 1.00 0.00 H new ATOM 0 HA VAL A 118 2.930 -1.893 10.834 1.00 0.00 H new ATOM 0 HB VAL A 118 1.292 -3.334 12.940 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.700 -2.962 11.543 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.045 -1.439 12.189 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.246 -1.883 10.491 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.788 -4.856 11.055 1.00 0.00 H new ATOM 0 HG22 VAL A 118 1.814 -3.863 9.991 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.537 -4.737 11.362 1.00 0.00 H new ATOM 1753 N GLY A 119 1.894 -0.701 13.758 1.00 0.00 N ATOM 1754 CA GLY A 119 1.516 0.528 14.434 1.00 0.00 C ATOM 1755 C GLY A 119 2.557 1.623 14.279 1.00 0.00 C ATOM 1756 O GLY A 119 2.236 2.808 14.354 1.00 0.00 O ATOM 0 H GLY A 119 1.854 -1.539 14.339 1.00 0.00 H new ATOM 0 HA2 GLY A 119 0.563 0.879 14.037 1.00 0.00 H new ATOM 0 HA3 GLY A 119 1.364 0.324 15.494 1.00 0.00 H new ATOM 1760 N GLN A 120 3.809 1.227 14.067 1.00 0.00 N ATOM 1761 CA GLN A 120 4.897 2.185 13.903 1.00 0.00 C ATOM 1762 C GLN A 120 4.834 2.857 12.534 1.00 0.00 C ATOM 1763 O GLN A 120 4.927 4.079 12.429 1.00 0.00 O ATOM 1764 CB GLN A 120 6.251 1.493 14.086 1.00 0.00 C ATOM 1765 CG GLN A 120 6.444 0.889 15.468 1.00 0.00 C ATOM 1766 CD GLN A 120 7.536 -0.164 15.500 1.00 0.00 C ATOM 1767 OE1 GLN A 120 8.493 -0.106 14.728 1.00 0.00 O ATOM 1768 NE2 GLN A 120 7.393 -1.136 16.394 1.00 0.00 N ATOM 0 H GLN A 120 4.095 0.250 14.005 1.00 0.00 H new ATOM 0 HA GLN A 120 4.785 2.954 14.668 1.00 0.00 H new ATOM 0 HB2 GLN A 120 6.352 0.707 13.338 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.047 2.214 13.900 1.00 0.00 H new ATOM 0 HG2 GLN A 120 6.688 1.681 16.175 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.506 0.444 15.800 1.00 0.00 H new ATOM 0 HE21 GLN A 120 6.583 -1.144 17.014 1.00 0.00 H new ATOM 0 HE22 GLN A 120 8.093 -1.875 16.461 1.00 0.00 H new ATOM 1777 N VAL A 121 4.675 2.054 11.486 1.00 0.00 N ATOM 1778 CA VAL A 121 4.599 2.580 10.126 1.00 0.00 C ATOM 1779 C VAL A 121 3.458 3.579 9.991 1.00 0.00 C ATOM 1780 O VAL A 121 3.613 4.635 9.378 1.00 0.00 O ATOM 1781 CB VAL A 121 4.401 1.455 9.090 1.00 0.00 C ATOM 1782 CG1 VAL A 121 4.464 2.011 7.673 1.00 0.00 C ATOM 1783 CG2 VAL A 121 5.441 0.368 9.286 1.00 0.00 C ATOM 0 H VAL A 121 4.596 1.039 11.552 1.00 0.00 H new ATOM 0 HA VAL A 121 5.548 3.078 9.930 1.00 0.00 H new ATOM 0 HB VAL A 121 3.413 1.019 9.239 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.322 1.201 6.958 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.679 2.755 7.539 1.00 0.00 H new ATOM 0 HG13 VAL A 121 5.436 2.475 7.507 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.288 -0.419 8.548 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.438 0.792 9.164 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.345 -0.051 10.288 1.00 0.00 H new ATOM 1793 N GLN A 122 2.310 3.238 10.566 1.00 0.00 N ATOM 1794 CA GLN A 122 1.145 4.109 10.504 1.00 0.00 C ATOM 1795 C GLN A 122 1.433 5.452 11.171 1.00 0.00 C ATOM 1796 O GLN A 122 1.286 6.503 10.549 1.00 0.00 O ATOM 1797 CB GLN A 122 -0.061 3.436 11.162 1.00 0.00 C ATOM 1798 CG GLN A 122 -1.046 2.854 10.162 1.00 0.00 C ATOM 1799 CD GLN A 122 -1.155 1.345 10.258 1.00 0.00 C ATOM 1800 OE1 GLN A 122 -0.147 0.639 10.311 1.00 0.00 O ATOM 1801 NE2 GLN A 122 -2.384 0.841 10.282 1.00 0.00 N ATOM 0 H GLN A 122 2.163 2.368 11.078 1.00 0.00 H new ATOM 0 HA GLN A 122 0.914 4.292 9.455 1.00 0.00 H new ATOM 0 HB2 GLN A 122 0.290 2.641 11.820 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -0.577 4.164 11.788 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -2.029 3.296 10.327 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -0.738 3.128 9.153 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -3.191 1.463 10.236 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -2.520 -0.168 10.347 1.00 0.00 H new ATOM 1810 N GLU A 123 1.846 5.411 12.437 1.00 0.00 N ATOM 1811 CA GLU A 123 2.148 6.628 13.189 1.00 0.00 C ATOM 1812 C GLU A 123 3.002 7.586 12.361 1.00 0.00 C ATOM 1813 O GLU A 123 2.751 8.791 12.327 1.00 0.00 O ATOM 1814 CB GLU A 123 2.861 6.279 14.500 1.00 0.00 C ATOM 1815 CG GLU A 123 2.673 7.316 15.600 1.00 0.00 C ATOM 1816 CD GLU A 123 1.213 7.620 15.883 1.00 0.00 C ATOM 1817 OE1 GLU A 123 0.585 8.332 15.071 1.00 0.00 O ATOM 1818 OE2 GLU A 123 0.699 7.151 16.919 1.00 0.00 O ATOM 0 H GLU A 123 1.979 4.548 12.964 1.00 0.00 H new ATOM 0 HA GLU A 123 1.207 7.126 13.420 1.00 0.00 H new ATOM 0 HB2 GLU A 123 2.495 5.316 14.856 1.00 0.00 H new ATOM 0 HB3 GLU A 123 3.927 6.162 14.303 1.00 0.00 H new ATOM 0 HG2 GLU A 123 3.148 6.959 16.514 1.00 0.00 H new ATOM 0 HG3 GLU A 123 3.182 8.237 15.315 1.00 0.00 H new ATOM 1825 N TRP A 124 4.008 7.041 11.689 1.00 0.00 N ATOM 1826 CA TRP A 124 4.895 7.845 10.857 1.00 0.00 C ATOM 1827 C TRP A 124 4.135 8.475 9.694 1.00 0.00 C ATOM 1828 O TRP A 124 4.276 9.667 9.419 1.00 0.00 O ATOM 1829 CB TRP A 124 6.036 6.981 10.328 1.00 0.00 C ATOM 1830 CG TRP A 124 6.791 6.268 11.405 1.00 0.00 C ATOM 1831 CD1 TRP A 124 6.560 6.320 12.752 1.00 0.00 C ATOM 1832 CD2 TRP A 124 7.903 5.393 11.221 1.00 0.00 C ATOM 1833 NE1 TRP A 124 7.466 5.526 13.414 1.00 0.00 N ATOM 1834 CE2 TRP A 124 8.302 4.947 12.495 1.00 0.00 C ATOM 1835 CE3 TRP A 124 8.598 4.944 10.099 1.00 0.00 C ATOM 1836 CZ2 TRP A 124 9.370 4.071 12.673 1.00 0.00 C ATOM 1837 CZ3 TRP A 124 9.654 4.078 10.278 1.00 0.00 C ATOM 1838 CH2 TRP A 124 10.033 3.648 11.555 1.00 0.00 C ATOM 0 H TRP A 124 4.230 6.046 11.704 1.00 0.00 H new ATOM 0 HA TRP A 124 5.304 8.648 11.470 1.00 0.00 H new ATOM 0 HB2 TRP A 124 5.633 6.247 9.631 1.00 0.00 H new ATOM 0 HB3 TRP A 124 6.727 7.609 9.765 1.00 0.00 H new ATOM 0 HD1 TRP A 124 5.781 6.899 13.225 1.00 0.00 H new ATOM 0 HE1 TRP A 124 7.509 5.390 14.424 1.00 0.00 H new ATOM 0 HE3 TRP A 124 8.314 5.269 9.109 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 9.663 3.738 13.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 10.200 3.724 9.416 1.00 0.00 H new ATOM 0 HH2 TRP A 124 10.866 2.968 11.659 1.00 0.00 H new ATOM 1849 N MET A 125 3.324 7.667 9.015 1.00 0.00 N ATOM 1850 CA MET A 125 2.537 8.144 7.881 1.00 0.00 C ATOM 1851 C MET A 125 1.747 9.397 8.253 1.00 0.00 C ATOM 1852 O MET A 125 1.887 10.442 7.618 1.00 0.00 O ATOM 1853 CB MET A 125 1.588 7.046 7.398 1.00 0.00 C ATOM 1854 CG MET A 125 1.456 6.984 5.886 1.00 0.00 C ATOM 1855 SD MET A 125 -0.179 7.471 5.307 1.00 0.00 S ATOM 1856 CE MET A 125 0.246 8.948 4.395 1.00 0.00 C ATOM 0 H MET A 125 3.195 6.678 9.231 1.00 0.00 H new ATOM 0 HA MET A 125 3.223 8.401 7.074 1.00 0.00 H new ATOM 0 HB2 MET A 125 1.943 6.083 7.764 1.00 0.00 H new ATOM 0 HB3 MET A 125 0.603 7.210 7.835 1.00 0.00 H new ATOM 0 HG2 MET A 125 2.205 7.634 5.434 1.00 0.00 H new ATOM 0 HG3 MET A 125 1.669 5.970 5.549 1.00 0.00 H new ATOM 0 HE1 MET A 125 -0.628 9.303 3.850 1.00 0.00 H new ATOM 0 HE2 MET A 125 0.580 9.720 5.088 1.00 0.00 H new ATOM 0 HE3 MET A 125 1.046 8.723 3.690 1.00 0.00 H new ATOM 1866 N VAL A 126 0.923 9.286 9.288 1.00 0.00 N ATOM 1867 CA VAL A 126 0.117 10.412 9.747 1.00 0.00 C ATOM 1868 C VAL A 126 1.001 11.582 10.178 1.00 0.00 C ATOM 1869 O VAL A 126 0.580 12.738 10.133 1.00 0.00 O ATOM 1870 CB VAL A 126 -0.792 10.007 10.924 1.00 0.00 C ATOM 1871 CG1 VAL A 126 -1.724 11.147 11.301 1.00 0.00 C ATOM 1872 CG2 VAL A 126 -1.583 8.754 10.578 1.00 0.00 C ATOM 0 H VAL A 126 0.795 8.429 9.825 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.505 10.721 8.907 1.00 0.00 H new ATOM 0 HB VAL A 126 -0.162 9.787 11.786 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.357 10.840 12.134 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -1.135 12.016 11.594 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -2.349 11.404 10.446 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.220 8.482 11.420 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -2.202 8.945 9.702 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -0.894 7.936 10.365 1.00 0.00 H new ATOM 1882 N ALA A 127 2.228 11.274 10.595 1.00 0.00 N ATOM 1883 CA ALA A 127 3.170 12.298 11.034 1.00 0.00 C ATOM 1884 C ALA A 127 3.517 13.270 9.910 1.00 0.00 C ATOM 1885 O ALA A 127 3.230 14.464 10.001 1.00 0.00 O ATOM 1886 CB ALA A 127 4.437 11.655 11.579 1.00 0.00 C ATOM 0 H ALA A 127 2.592 10.322 10.637 1.00 0.00 H new ATOM 0 HA ALA A 127 2.686 12.867 11.828 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.129 12.432 11.902 1.00 0.00 H new ATOM 0 HB2 ALA A 127 4.186 11.017 12.427 1.00 0.00 H new ATOM 0 HB3 ALA A 127 4.905 11.054 10.799 1.00 0.00 H new ATOM 1892 N TYR A 128 4.123 12.753 8.845 1.00 0.00 N ATOM 1893 CA TYR A 128 4.498 13.581 7.706 1.00 0.00 C ATOM 1894 C TYR A 128 3.256 14.186 7.052 1.00 0.00 C ATOM 1895 O TYR A 128 3.332 15.227 6.398 1.00 0.00 O ATOM 1896 CB TYR A 128 5.292 12.753 6.689 1.00 0.00 C ATOM 1897 CG TYR A 128 5.521 13.449 5.362 1.00 0.00 C ATOM 1898 CD1 TYR A 128 6.507 14.419 5.222 1.00 0.00 C ATOM 1899 CD2 TYR A 128 4.751 13.133 4.250 1.00 0.00 C ATOM 1900 CE1 TYR A 128 6.716 15.054 4.010 1.00 0.00 C ATOM 1901 CE2 TYR A 128 4.954 13.763 3.037 1.00 0.00 C ATOM 1902 CZ TYR A 128 5.937 14.721 2.922 1.00 0.00 C ATOM 1903 OH TYR A 128 6.138 15.353 1.715 1.00 0.00 O ATOM 0 H TYR A 128 4.364 11.767 8.748 1.00 0.00 H new ATOM 0 HA TYR A 128 5.129 14.396 8.060 1.00 0.00 H new ATOM 0 HB2 TYR A 128 6.258 12.496 7.123 1.00 0.00 H new ATOM 0 HB3 TYR A 128 4.764 11.817 6.509 1.00 0.00 H new ATOM 0 HD1 TYR A 128 7.119 14.681 6.072 1.00 0.00 H new ATOM 0 HD2 TYR A 128 3.980 12.382 4.335 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.485 15.806 3.917 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.345 13.505 2.183 1.00 0.00 H new ATOM 0 HH TYR A 128 6.719 14.802 1.150 1.00 0.00 H new ATOM 1913 N LEU A 129 2.114 13.525 7.237 1.00 0.00 N ATOM 1914 CA LEU A 129 0.857 13.997 6.667 1.00 0.00 C ATOM 1915 C LEU A 129 0.516 15.394 7.176 1.00 0.00 C ATOM 1916 O LEU A 129 0.350 16.328 6.393 1.00 0.00 O ATOM 1917 CB LEU A 129 -0.283 13.035 7.005 1.00 0.00 C ATOM 1918 CG LEU A 129 -0.931 12.346 5.802 1.00 0.00 C ATOM 1919 CD1 LEU A 129 -1.629 11.071 6.244 1.00 0.00 C ATOM 1920 CD2 LEU A 129 -1.919 13.274 5.109 1.00 0.00 C ATOM 0 H LEU A 129 2.035 12.663 7.776 1.00 0.00 H new ATOM 0 HA LEU A 129 0.980 14.039 5.585 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.097 12.269 7.681 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.053 13.585 7.547 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.146 12.093 5.089 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.087 10.589 5.380 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -0.902 10.395 6.694 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -2.400 11.313 6.975 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.365 12.760 4.258 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.702 13.561 5.811 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.398 14.166 4.762 1.00 0.00 H new ATOM 1932 N GLU A 130 0.395 15.523 8.493 1.00 0.00 N ATOM 1933 CA GLU A 130 0.060 16.803 9.103 1.00 0.00 C ATOM 1934 C GLU A 130 1.276 17.724 9.185 1.00 0.00 C ATOM 1935 O GLU A 130 1.148 18.905 9.518 1.00 0.00 O ATOM 1936 CB GLU A 130 -0.546 16.583 10.490 1.00 0.00 C ATOM 1937 CG GLU A 130 -2.046 16.828 10.536 1.00 0.00 C ATOM 1938 CD GLU A 130 -2.791 15.773 11.331 1.00 0.00 C ATOM 1939 OE1 GLU A 130 -2.255 15.320 12.365 1.00 0.00 O ATOM 1940 OE2 GLU A 130 -3.910 15.400 10.921 1.00 0.00 O ATOM 0 H GLU A 130 0.524 14.759 9.156 1.00 0.00 H new ATOM 0 HA GLU A 130 -0.678 17.294 8.468 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.342 15.561 10.810 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.055 17.245 11.203 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -2.236 17.808 10.974 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -2.437 16.853 9.519 1.00 0.00 H new ATOM 1947 N THR A 131 2.455 17.175 8.907 1.00 0.00 N ATOM 1948 CA THR A 131 3.691 17.946 8.963 1.00 0.00 C ATOM 1949 C THR A 131 3.923 18.722 7.665 1.00 0.00 C ATOM 1950 O THR A 131 3.839 19.948 7.645 1.00 0.00 O ATOM 1951 CB THR A 131 4.873 17.011 9.235 1.00 0.00 C ATOM 1952 OG1 THR A 131 4.714 16.366 10.489 1.00 0.00 O ATOM 1953 CG2 THR A 131 6.214 17.717 9.238 1.00 0.00 C ATOM 0 H THR A 131 2.580 16.198 8.641 1.00 0.00 H new ATOM 0 HA THR A 131 3.605 18.669 9.774 1.00 0.00 H new ATOM 0 HB THR A 131 4.872 16.292 8.416 1.00 0.00 H new ATOM 0 HG1 THR A 131 3.956 15.746 10.444 1.00 0.00 H new ATOM 0 HG21 THR A 131 7.005 16.994 9.437 1.00 0.00 H new ATOM 0 HG22 THR A 131 6.383 18.182 8.267 1.00 0.00 H new ATOM 0 HG23 THR A 131 6.220 18.484 10.013 1.00 0.00 H new ATOM 1961 N ARG A 132 4.230 18.000 6.587 1.00 0.00 N ATOM 1962 CA ARG A 132 4.490 18.628 5.289 1.00 0.00 C ATOM 1963 C ARG A 132 3.352 18.378 4.303 1.00 0.00 C ATOM 1964 O ARG A 132 3.253 19.045 3.274 1.00 0.00 O ATOM 1965 CB ARG A 132 5.793 18.094 4.696 1.00 0.00 C ATOM 1966 CG ARG A 132 7.011 18.334 5.569 1.00 0.00 C ATOM 1967 CD ARG A 132 7.770 19.581 5.140 1.00 0.00 C ATOM 1968 NE ARG A 132 8.938 19.257 4.321 1.00 0.00 N ATOM 1969 CZ ARG A 132 9.101 19.635 3.052 1.00 0.00 C ATOM 1970 NH1 ARG A 132 8.166 20.340 2.425 1.00 0.00 N ATOM 1971 NH2 ARG A 132 10.208 19.301 2.402 1.00 0.00 N ATOM 0 H ARG A 132 4.305 16.983 6.585 1.00 0.00 H new ATOM 0 HA ARG A 132 4.570 19.702 5.458 1.00 0.00 H new ATOM 0 HB2 ARG A 132 5.689 17.023 4.521 1.00 0.00 H new ATOM 0 HB3 ARG A 132 5.957 18.561 3.725 1.00 0.00 H new ATOM 0 HG2 ARG A 132 6.700 18.436 6.609 1.00 0.00 H new ATOM 0 HG3 ARG A 132 7.672 17.469 5.518 1.00 0.00 H new ATOM 0 HD2 ARG A 132 7.104 20.236 4.578 1.00 0.00 H new ATOM 0 HD3 ARG A 132 8.089 20.133 6.024 1.00 0.00 H new ATOM 0 HE ARG A 132 9.680 18.703 4.750 1.00 0.00 H new ATOM 0 HH11 ARG A 132 7.309 20.600 2.914 1.00 0.00 H new ATOM 0 HH12 ARG A 132 8.305 20.622 1.455 1.00 0.00 H new ATOM 0 HH21 ARG A 132 10.931 18.757 2.872 1.00 0.00 H new ATOM 0 HH22 ARG A 132 10.336 19.588 1.432 1.00 0.00 H new ATOM 1985 N LEU A 133 2.499 17.417 4.621 1.00 0.00 N ATOM 1986 CA LEU A 133 1.371 17.080 3.764 1.00 0.00 C ATOM 1987 C LEU A 133 0.130 17.878 4.162 1.00 0.00 C ATOM 1988 O LEU A 133 -0.935 17.718 3.575 1.00 0.00 O ATOM 1989 CB LEU A 133 1.094 15.580 3.860 1.00 0.00 C ATOM 1990 CG LEU A 133 1.164 14.804 2.544 1.00 0.00 C ATOM 1991 CD1 LEU A 133 1.468 13.338 2.814 1.00 0.00 C ATOM 1992 CD2 LEU A 133 -0.140 14.944 1.778 1.00 0.00 C ATOM 0 H LEU A 133 2.566 16.854 5.469 1.00 0.00 H new ATOM 0 HA LEU A 133 1.618 17.337 2.734 1.00 0.00 H new ATOM 0 HB2 LEU A 133 1.809 15.142 4.557 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.102 15.440 4.290 1.00 0.00 H new ATOM 0 HG LEU A 133 1.967 15.219 1.935 1.00 0.00 H new ATOM 0 HD11 LEU A 133 1.515 12.796 1.869 1.00 0.00 H new ATOM 0 HD12 LEU A 133 2.425 13.254 3.329 1.00 0.00 H new ATOM 0 HD13 LEU A 133 0.682 12.912 3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -0.075 14.386 0.844 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -0.959 14.550 2.379 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -0.323 15.996 1.560 1.00 0.00 H new ATOM 2004 N ALA A 134 0.281 18.735 5.169 1.00 0.00 N ATOM 2005 CA ALA A 134 -0.824 19.555 5.649 1.00 0.00 C ATOM 2006 C ALA A 134 -1.134 20.686 4.680 1.00 0.00 C ATOM 2007 O ALA A 134 -2.226 21.252 4.706 1.00 0.00 O ATOM 2008 CB ALA A 134 -0.509 20.120 7.028 1.00 0.00 C ATOM 0 H ALA A 134 1.159 18.878 5.668 1.00 0.00 H new ATOM 0 HA ALA A 134 -1.705 18.917 5.720 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -1.345 20.730 7.371 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -0.346 19.301 7.728 1.00 0.00 H new ATOM 0 HB3 ALA A 134 0.390 20.734 6.973 1.00 0.00 H new ATOM 2014 N ASP A 135 -0.170 21.014 3.815 1.00 0.00 N ATOM 2015 CA ASP A 135 -0.352 22.075 2.839 1.00 0.00 C ATOM 2016 C ASP A 135 -1.056 21.546 1.598 1.00 0.00 C ATOM 2017 O ASP A 135 -2.192 21.924 1.311 1.00 0.00 O ATOM 2018 CB ASP A 135 1.004 22.670 2.455 1.00 0.00 C ATOM 2019 CG ASP A 135 1.341 23.913 3.255 1.00 0.00 C ATOM 2020 OD1 ASP A 135 0.661 24.166 4.272 1.00 0.00 O ATOM 2021 OD2 ASP A 135 2.281 24.634 2.863 1.00 0.00 O ATOM 0 H ASP A 135 0.741 20.557 3.776 1.00 0.00 H new ATOM 0 HA ASP A 135 -0.972 22.853 3.285 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.782 21.922 2.608 1.00 0.00 H new ATOM 0 HB3 ASP A 135 1.002 22.915 1.393 1.00 0.00 H new ATOM 2026 N TRP A 136 -0.376 20.673 0.854 1.00 0.00 N ATOM 2027 CA TRP A 136 -0.944 20.110 -0.364 1.00 0.00 C ATOM 2028 C TRP A 136 -2.343 19.546 -0.105 1.00 0.00 C ATOM 2029 O TRP A 136 -3.184 19.512 -1.003 1.00 0.00 O ATOM 2030 CB TRP A 136 -0.020 19.024 -0.927 1.00 0.00 C ATOM 2031 CG TRP A 136 -0.611 18.285 -2.089 1.00 0.00 C ATOM 2032 CD1 TRP A 136 -0.535 16.945 -2.328 1.00 0.00 C ATOM 2033 CD2 TRP A 136 -1.371 18.844 -3.166 1.00 0.00 C ATOM 2034 NE1 TRP A 136 -1.209 16.634 -3.487 1.00 0.00 N ATOM 2035 CE2 TRP A 136 -1.729 17.784 -4.019 1.00 0.00 C ATOM 2036 CE3 TRP A 136 -1.784 20.139 -3.493 1.00 0.00 C ATOM 2037 CZ2 TRP A 136 -2.483 17.981 -5.173 1.00 0.00 C ATOM 2038 CZ3 TRP A 136 -2.531 20.333 -4.639 1.00 0.00 C ATOM 2039 CH2 TRP A 136 -2.874 19.258 -5.467 1.00 0.00 C ATOM 0 H TRP A 136 0.564 20.344 1.075 1.00 0.00 H new ATOM 0 HA TRP A 136 -1.035 20.908 -1.101 1.00 0.00 H new ATOM 0 HB2 TRP A 136 0.920 19.481 -1.237 1.00 0.00 H new ATOM 0 HB3 TRP A 136 0.217 18.313 -0.136 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -0.021 16.232 -1.700 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -1.305 15.700 -3.885 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -1.523 20.974 -2.860 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -2.750 17.154 -5.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -2.855 21.330 -4.900 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -3.459 19.441 -6.356 1.00 0.00 H new ATOM 2050 N ILE A 137 -2.587 19.115 1.128 1.00 0.00 N ATOM 2051 CA ILE A 137 -3.889 18.565 1.502 1.00 0.00 C ATOM 2052 C ILE A 137 -4.891 19.681 1.767 1.00 0.00 C ATOM 2053 O ILE A 137 -6.021 19.633 1.290 1.00 0.00 O ATOM 2054 CB ILE A 137 -3.789 17.649 2.746 1.00 0.00 C ATOM 2055 CG1 ILE A 137 -2.956 16.414 2.404 1.00 0.00 C ATOM 2056 CG2 ILE A 137 -5.171 17.247 3.252 1.00 0.00 C ATOM 2057 CD1 ILE A 137 -3.664 15.427 1.501 1.00 0.00 C ATOM 0 H ILE A 137 -1.904 19.135 1.885 1.00 0.00 H new ATOM 0 HA ILE A 137 -4.235 17.963 0.662 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.299 18.202 3.547 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -2.032 16.733 1.923 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.676 15.909 3.329 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -5.066 16.604 4.126 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -5.733 18.140 3.524 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -5.703 16.709 2.468 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -3.008 14.579 1.304 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -4.574 15.077 1.988 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -3.920 15.914 0.560 1.00 0.00 H new ATOM 2069 N HIS A 138 -4.473 20.682 2.528 1.00 0.00 N ATOM 2070 CA HIS A 138 -5.348 21.805 2.849 1.00 0.00 C ATOM 2071 C HIS A 138 -5.889 22.464 1.584 1.00 0.00 C ATOM 2072 O HIS A 138 -6.979 23.038 1.592 1.00 0.00 O ATOM 2073 CB HIS A 138 -4.603 22.837 3.695 1.00 0.00 C ATOM 2074 CG HIS A 138 -4.946 22.765 5.149 1.00 0.00 C ATOM 2075 ND1 HIS A 138 -5.465 21.637 5.745 1.00 0.00 N ATOM 2076 CD2 HIS A 138 -4.845 23.693 6.128 1.00 0.00 C ATOM 2077 CE1 HIS A 138 -5.669 21.872 7.029 1.00 0.00 C ATOM 2078 NE2 HIS A 138 -5.300 23.112 7.287 1.00 0.00 N ATOM 0 H HIS A 138 -3.539 20.742 2.934 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.191 21.416 3.420 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -3.530 22.690 3.574 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -4.832 23.836 3.323 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -4.476 24.702 6.019 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -6.069 21.169 7.745 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -5.345 23.566 8.199 1.00 0.00 H new ATOM 2086 N SER A 139 -5.126 22.387 0.499 1.00 0.00 N ATOM 2087 CA SER A 139 -5.540 22.985 -0.765 1.00 0.00 C ATOM 2088 C SER A 139 -6.653 22.172 -1.419 1.00 0.00 C ATOM 2089 O SER A 139 -7.729 22.694 -1.713 1.00 0.00 O ATOM 2090 CB SER A 139 -4.347 23.088 -1.716 1.00 0.00 C ATOM 2091 OG SER A 139 -3.630 21.872 -1.766 1.00 0.00 O ATOM 0 H SER A 139 -4.221 21.918 0.469 1.00 0.00 H new ATOM 0 HA SER A 139 -5.922 23.984 -0.555 1.00 0.00 H new ATOM 0 HB2 SER A 139 -4.696 23.349 -2.715 1.00 0.00 H new ATOM 0 HB3 SER A 139 -3.686 23.891 -1.389 1.00 0.00 H new ATOM 0 HG SER A 139 -3.229 21.765 -2.654 1.00 0.00 H new ATOM 2097 N SER A 140 -6.386 20.892 -1.644 1.00 0.00 N ATOM 2098 CA SER A 140 -7.357 20.001 -2.264 1.00 0.00 C ATOM 2099 C SER A 140 -8.391 19.518 -1.245 1.00 0.00 C ATOM 2100 O SER A 140 -9.416 18.944 -1.614 1.00 0.00 O ATOM 2101 CB SER A 140 -6.637 18.807 -2.894 1.00 0.00 C ATOM 2102 OG SER A 140 -5.240 19.029 -2.961 1.00 0.00 O ATOM 0 H SER A 140 -5.500 20.446 -1.405 1.00 0.00 H new ATOM 0 HA SER A 140 -7.884 20.554 -3.041 1.00 0.00 H new ATOM 0 HB2 SER A 140 -6.838 17.909 -2.310 1.00 0.00 H new ATOM 0 HB3 SER A 140 -7.028 18.630 -3.896 1.00 0.00 H new ATOM 0 HG SER A 140 -4.877 18.589 -3.758 1.00 0.00 H new ATOM 2108 N GLY A 141 -8.112 19.746 0.035 1.00 0.00 N ATOM 2109 CA GLY A 141 -9.021 19.325 1.086 1.00 0.00 C ATOM 2110 C GLY A 141 -8.796 17.887 1.501 1.00 0.00 C ATOM 2111 O GLY A 141 -8.991 17.529 2.666 1.00 0.00 O ATOM 0 H GLY A 141 -7.269 20.217 0.364 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -8.896 19.974 1.953 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -10.049 19.445 0.743 1.00 0.00 H new ATOM 2115 N GLY A 142 -8.392 17.059 0.548 1.00 0.00 N ATOM 2116 CA GLY A 142 -8.140 15.672 0.824 1.00 0.00 C ATOM 2117 C GLY A 142 -8.423 14.817 -0.393 1.00 0.00 C ATOM 2118 O GLY A 142 -8.039 15.154 -1.514 1.00 0.00 O ATOM 0 H GLY A 142 -8.235 17.335 -0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -7.102 15.541 1.131 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.763 15.344 1.656 1.00 0.00 H new ATOM 2122 N TRP A 143 -9.108 13.721 -0.169 1.00 0.00 N ATOM 2123 CA TRP A 143 -9.466 12.797 -1.238 1.00 0.00 C ATOM 2124 C TRP A 143 -10.298 13.492 -2.323 1.00 0.00 C ATOM 2125 O TRP A 143 -10.403 12.996 -3.446 1.00 0.00 O ATOM 2126 CB TRP A 143 -10.232 11.606 -0.649 1.00 0.00 C ATOM 2127 CG TRP A 143 -9.470 10.871 0.423 1.00 0.00 C ATOM 2128 CD1 TRP A 143 -9.256 11.284 1.710 1.00 0.00 C ATOM 2129 CD2 TRP A 143 -8.827 9.591 0.307 1.00 0.00 C ATOM 2130 NE1 TRP A 143 -8.508 10.350 2.390 1.00 0.00 N ATOM 2131 CE2 TRP A 143 -8.235 9.303 1.549 1.00 0.00 C ATOM 2132 CE3 TRP A 143 -8.691 8.667 -0.725 1.00 0.00 C ATOM 2133 CZ2 TRP A 143 -7.520 8.130 1.780 1.00 0.00 C ATOM 2134 CZ3 TRP A 143 -7.985 7.502 -0.498 1.00 0.00 C ATOM 2135 CH2 TRP A 143 -7.405 7.242 0.746 1.00 0.00 C ATOM 0 H TRP A 143 -9.436 13.438 0.754 1.00 0.00 H new ATOM 0 HA TRP A 143 -8.550 12.440 -1.709 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -11.176 11.961 -0.234 1.00 0.00 H new ATOM 0 HB3 TRP A 143 -10.478 10.910 -1.451 1.00 0.00 H new ATOM 0 HD1 TRP A 143 -9.621 12.209 2.131 1.00 0.00 H new ATOM 0 HE1 TRP A 143 -8.206 10.425 3.361 1.00 0.00 H new ATOM 0 HE3 TRP A 143 -9.132 8.859 -1.692 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 -7.072 7.929 2.742 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 -7.880 6.781 -1.295 1.00 0.00 H new ATOM 0 HH2 TRP A 143 -6.856 6.324 0.894 1.00 0.00 H new ATOM 2146 N ALA A 144 -10.896 14.636 -1.976 1.00 0.00 N ATOM 2147 CA ALA A 144 -11.732 15.397 -2.913 1.00 0.00 C ATOM 2148 C ALA A 144 -11.145 15.393 -4.321 1.00 0.00 C ATOM 2149 O ALA A 144 -11.784 14.932 -5.268 1.00 0.00 O ATOM 2150 CB ALA A 144 -11.894 16.828 -2.424 1.00 0.00 C ATOM 0 H ALA A 144 -10.817 15.057 -1.050 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.708 14.913 -2.955 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -12.516 17.384 -3.126 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -12.368 16.826 -1.442 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -10.915 17.301 -2.353 1.00 0.00 H new ATOM 2156 N GLU A 145 -9.929 15.901 -4.454 1.00 0.00 N ATOM 2157 CA GLU A 145 -9.264 15.944 -5.749 1.00 0.00 C ATOM 2158 C GLU A 145 -9.014 14.537 -6.271 1.00 0.00 C ATOM 2159 O GLU A 145 -9.074 14.292 -7.473 1.00 0.00 O ATOM 2160 CB GLU A 145 -7.933 16.682 -5.639 1.00 0.00 C ATOM 2161 CG GLU A 145 -7.031 16.122 -4.554 1.00 0.00 C ATOM 2162 CD GLU A 145 -5.559 16.250 -4.890 1.00 0.00 C ATOM 2163 OE1 GLU A 145 -5.140 17.346 -5.320 1.00 0.00 O ATOM 2164 OE2 GLU A 145 -4.827 15.254 -4.722 1.00 0.00 O ATOM 0 H GLU A 145 -9.383 16.288 -3.684 1.00 0.00 H new ATOM 0 HA GLU A 145 -9.916 16.473 -6.444 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -7.415 16.630 -6.597 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -8.124 17.736 -5.437 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -7.232 16.642 -3.617 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -7.272 15.071 -4.394 1.00 0.00 H new ATOM 2171 N PHE A 146 -8.726 13.616 -5.359 1.00 0.00 N ATOM 2172 CA PHE A 146 -8.458 12.235 -5.735 1.00 0.00 C ATOM 2173 C PHE A 146 -9.692 11.595 -6.360 1.00 0.00 C ATOM 2174 O PHE A 146 -9.583 10.768 -7.265 1.00 0.00 O ATOM 2175 CB PHE A 146 -8.005 11.434 -4.511 1.00 0.00 C ATOM 2176 CG PHE A 146 -8.342 9.971 -4.589 1.00 0.00 C ATOM 2177 CD1 PHE A 146 -7.731 9.140 -5.516 1.00 0.00 C ATOM 2178 CD2 PHE A 146 -9.272 9.433 -3.735 1.00 0.00 C ATOM 2179 CE1 PHE A 146 -8.053 7.794 -5.578 1.00 0.00 C ATOM 2180 CE2 PHE A 146 -9.598 8.096 -3.790 1.00 0.00 C ATOM 2181 CZ PHE A 146 -8.991 7.273 -4.708 1.00 0.00 C ATOM 0 H PHE A 146 -8.672 13.800 -4.357 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.659 12.229 -6.476 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -6.927 11.544 -4.394 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -8.467 11.857 -3.619 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -6.997 9.546 -6.196 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -9.756 10.068 -3.008 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -7.573 7.155 -6.304 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -10.333 7.693 -3.109 1.00 0.00 H new ATOM 0 HZ PHE A 146 -9.246 6.224 -4.749 1.00 0.00 H new ATOM 2191 N THR A 147 -10.863 11.977 -5.867 1.00 0.00 N ATOM 2192 CA THR A 147 -12.113 11.433 -6.375 1.00 0.00 C ATOM 2193 C THR A 147 -12.403 11.948 -7.774 1.00 0.00 C ATOM 2194 O THR A 147 -12.841 11.201 -8.648 1.00 0.00 O ATOM 2195 CB THR A 147 -13.263 11.787 -5.434 1.00 0.00 C ATOM 2196 OG1 THR A 147 -12.881 11.580 -4.083 1.00 0.00 O ATOM 2197 CG2 THR A 147 -14.516 10.979 -5.695 1.00 0.00 C ATOM 0 H THR A 147 -10.972 12.660 -5.117 1.00 0.00 H new ATOM 0 HA THR A 147 -12.016 10.349 -6.426 1.00 0.00 H new ATOM 0 HB THR A 147 -13.487 12.837 -5.622 1.00 0.00 H new ATOM 0 HG1 THR A 147 -13.628 11.813 -3.493 1.00 0.00 H new ATOM 0 HG21 THR A 147 -15.295 11.278 -4.993 1.00 0.00 H new ATOM 0 HG22 THR A 147 -14.858 11.157 -6.715 1.00 0.00 H new ATOM 0 HG23 THR A 147 -14.299 9.919 -5.565 1.00 0.00 H new ATOM 2205 N ALA A 148 -12.151 13.228 -7.978 1.00 0.00 N ATOM 2206 CA ALA A 148 -12.375 13.855 -9.275 1.00 0.00 C ATOM 2207 C ALA A 148 -11.133 13.751 -10.157 1.00 0.00 C ATOM 2208 O ALA A 148 -11.112 14.263 -11.277 1.00 0.00 O ATOM 2209 CB ALA A 148 -12.764 15.311 -9.092 1.00 0.00 C ATOM 0 H ALA A 148 -11.790 13.858 -7.262 1.00 0.00 H new ATOM 0 HA ALA A 148 -13.190 13.327 -9.771 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -12.929 15.769 -10.067 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -13.679 15.372 -8.503 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -11.964 15.839 -8.574 1.00 0.00 H new ATOM 2215 N LEU A 149 -10.097 13.096 -9.645 1.00 0.00 N ATOM 2216 CA LEU A 149 -8.854 12.940 -10.383 1.00 0.00 C ATOM 2217 C LEU A 149 -8.879 11.681 -11.233 1.00 0.00 C ATOM 2218 O LEU A 149 -8.822 11.737 -12.461 1.00 0.00 O ATOM 2219 CB LEU A 149 -7.671 12.884 -9.411 1.00 0.00 C ATOM 2220 CG LEU A 149 -6.324 12.531 -10.039 1.00 0.00 C ATOM 2221 CD1 LEU A 149 -6.134 11.021 -10.110 1.00 0.00 C ATOM 2222 CD2 LEU A 149 -6.202 13.159 -11.422 1.00 0.00 C ATOM 0 H LEU A 149 -10.096 12.665 -8.721 1.00 0.00 H new ATOM 0 HA LEU A 149 -8.741 13.800 -11.044 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -7.581 13.852 -8.919 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -7.894 12.152 -8.635 1.00 0.00 H new ATOM 0 HG LEU A 149 -5.535 12.937 -9.406 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -5.167 10.797 -10.561 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -6.171 10.602 -9.104 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -6.927 10.583 -10.715 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -5.237 12.898 -11.856 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -7.001 12.786 -12.063 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -6.281 14.243 -11.338 1.00 0.00 H new ATOM 2234 N TYR A 150 -8.948 10.547 -10.566 1.00 0.00 N ATOM 2235 CA TYR A 150 -8.961 9.263 -11.238 1.00 0.00 C ATOM 2236 C TYR A 150 -10.386 8.808 -11.523 1.00 0.00 C ATOM 2237 O TYR A 150 -10.694 7.619 -11.431 1.00 0.00 O ATOM 2238 CB TYR A 150 -8.240 8.228 -10.376 1.00 0.00 C ATOM 2239 CG TYR A 150 -9.068 7.710 -9.218 1.00 0.00 C ATOM 2240 CD1 TYR A 150 -10.098 8.462 -8.655 1.00 0.00 C ATOM 2241 CD2 TYR A 150 -8.820 6.456 -8.700 1.00 0.00 C ATOM 2242 CE1 TYR A 150 -10.855 7.964 -7.614 1.00 0.00 C ATOM 2243 CE2 TYR A 150 -9.564 5.956 -7.663 1.00 0.00 C ATOM 2244 CZ TYR A 150 -10.583 6.711 -7.122 1.00 0.00 C ATOM 2245 OH TYR A 150 -11.336 6.205 -6.091 1.00 0.00 O ATOM 0 H TYR A 150 -8.996 10.489 -9.549 1.00 0.00 H new ATOM 0 HA TYR A 150 -8.445 9.365 -12.192 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -7.946 7.387 -11.004 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -7.323 8.670 -9.985 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.307 9.449 -9.039 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -8.025 5.857 -9.119 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -11.654 8.554 -7.190 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.352 4.972 -7.270 1.00 0.00 H new ATOM 0 HH TYR A 150 -10.949 6.485 -5.235 1.00 0.00 H new ATOM 2255 N GLY A 151 -11.256 9.754 -11.848 1.00 0.00 N ATOM 2256 CA GLY A 151 -12.636 9.418 -12.122 1.00 0.00 C ATOM 2257 C GLY A 151 -12.779 8.440 -13.269 1.00 0.00 C ATOM 2258 O GLY A 151 -13.248 7.319 -13.082 1.00 0.00 O ATOM 0 H GLY A 151 -11.030 10.746 -11.926 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -13.087 8.991 -11.226 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -13.189 10.328 -12.354 1.00 0.00 H new ATOM 2262 N ASP A 152 -12.375 8.862 -14.463 1.00 0.00 N ATOM 2263 CA ASP A 152 -12.465 8.006 -15.639 1.00 0.00 C ATOM 2264 C ASP A 152 -11.267 8.209 -16.558 1.00 0.00 C ATOM 2265 O ASP A 152 -10.838 9.338 -16.798 1.00 0.00 O ATOM 2266 CB ASP A 152 -13.765 8.283 -16.396 1.00 0.00 C ATOM 2267 CG ASP A 152 -14.963 7.621 -15.743 1.00 0.00 C ATOM 2268 OD1 ASP A 152 -14.828 6.465 -15.288 1.00 0.00 O ATOM 2269 OD2 ASP A 152 -16.035 8.259 -15.685 1.00 0.00 O ATOM 0 H ASP A 152 -11.984 9.787 -14.641 1.00 0.00 H new ATOM 0 HA ASP A 152 -12.463 6.969 -15.304 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -13.931 9.359 -16.448 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -13.669 7.926 -17.421 1.00 0.00 H new ATOM 2274 N GLY A 153 -10.731 7.106 -17.066 1.00 0.00 N ATOM 2275 CA GLY A 153 -9.586 7.178 -17.953 1.00 0.00 C ATOM 2276 C GLY A 153 -8.773 5.898 -17.957 1.00 0.00 C ATOM 2277 O GLY A 153 -8.829 5.115 -17.008 1.00 0.00 O ATOM 0 H GLY A 153 -11.069 6.162 -16.879 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -9.928 7.391 -18.966 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -8.948 8.009 -17.651 1.00 0.00 H new ATOM 2281 N ALA A 154 -8.014 5.687 -19.029 1.00 0.00 N ATOM 2282 CA ALA A 154 -7.184 4.497 -19.161 1.00 0.00 C ATOM 2283 C ALA A 154 -6.307 4.295 -17.929 1.00 0.00 C ATOM 2284 O ALA A 154 -5.608 5.208 -17.491 1.00 0.00 O ATOM 2285 CB ALA A 154 -6.324 4.593 -20.413 1.00 0.00 C ATOM 0 H ALA A 154 -7.958 6.328 -19.820 1.00 0.00 H new ATOM 0 HA ALA A 154 -7.843 3.633 -19.248 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -5.708 3.698 -20.501 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -6.966 4.679 -21.290 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -5.681 5.471 -20.346 1.00 0.00 H new ATOM 2291 N LEU A 155 -6.355 3.090 -17.373 1.00 0.00 N ATOM 2292 CA LEU A 155 -5.569 2.759 -16.189 1.00 0.00 C ATOM 2293 C LEU A 155 -4.090 2.619 -16.530 1.00 0.00 C ATOM 2294 O LEU A 155 -3.228 3.138 -15.822 1.00 0.00 O ATOM 2295 CB LEU A 155 -6.083 1.464 -15.558 1.00 0.00 C ATOM 2296 CG LEU A 155 -7.521 1.522 -15.041 1.00 0.00 C ATOM 2297 CD1 LEU A 155 -8.494 1.054 -16.112 1.00 0.00 C ATOM 2298 CD2 LEU A 155 -7.665 0.685 -13.778 1.00 0.00 C ATOM 0 H LEU A 155 -6.931 2.324 -17.723 1.00 0.00 H new ATOM 0 HA LEU A 155 -5.679 3.575 -15.475 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -6.010 0.665 -16.295 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -5.426 1.195 -14.731 1.00 0.00 H new ATOM 0 HG LEU A 155 -7.759 2.557 -14.795 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -9.512 1.103 -15.725 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -8.408 1.697 -16.988 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -8.261 0.027 -16.392 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -8.694 0.737 -13.423 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -7.408 -0.351 -13.997 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -6.996 1.070 -13.008 1.00 0.00 H new ATOM 2310 N GLU A 156 -3.801 1.918 -17.622 1.00 0.00 N ATOM 2311 CA GLU A 156 -2.421 1.713 -18.059 1.00 0.00 C ATOM 2312 C GLU A 156 -1.651 3.037 -18.091 1.00 0.00 C ATOM 2313 O GLU A 156 -0.426 3.059 -17.963 1.00 0.00 O ATOM 2314 CB GLU A 156 -2.400 1.055 -19.443 1.00 0.00 C ATOM 2315 CG GLU A 156 -1.280 0.043 -19.623 1.00 0.00 C ATOM 2316 CD GLU A 156 -0.259 0.477 -20.655 1.00 0.00 C ATOM 2317 OE1 GLU A 156 -0.064 1.700 -20.820 1.00 0.00 O ATOM 2318 OE2 GLU A 156 0.346 -0.406 -21.300 1.00 0.00 O ATOM 0 H GLU A 156 -4.502 1.482 -18.221 1.00 0.00 H new ATOM 0 HA GLU A 156 -1.931 1.054 -17.343 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -3.356 0.560 -19.614 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -2.302 1.831 -20.203 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -0.780 -0.113 -18.667 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -1.706 -0.915 -19.920 1.00 0.00 H new ATOM 2325 N GLU A 157 -2.385 4.136 -18.260 1.00 0.00 N ATOM 2326 CA GLU A 157 -1.793 5.468 -18.310 1.00 0.00 C ATOM 2327 C GLU A 157 -1.046 5.798 -17.016 1.00 0.00 C ATOM 2328 O GLU A 157 0.186 5.797 -16.973 1.00 0.00 O ATOM 2329 CB GLU A 157 -2.893 6.508 -18.562 1.00 0.00 C ATOM 2330 CG GLU A 157 -2.488 7.614 -19.520 1.00 0.00 C ATOM 2331 CD GLU A 157 -2.049 7.083 -20.871 1.00 0.00 C ATOM 2332 OE1 GLU A 157 -2.317 5.897 -21.159 1.00 0.00 O ATOM 2333 OE2 GLU A 157 -1.437 7.852 -21.642 1.00 0.00 O ATOM 0 H GLU A 157 -3.400 4.127 -18.365 1.00 0.00 H new ATOM 0 HA GLU A 157 -1.070 5.491 -19.125 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -3.773 6.002 -18.958 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -3.183 6.953 -17.610 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -3.327 8.296 -19.657 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -1.676 8.192 -19.079 1.00 0.00 H new ATOM 2340 N ALA A 158 -1.800 6.077 -15.958 1.00 0.00 N ATOM 2341 CA ALA A 158 -1.214 6.404 -14.665 1.00 0.00 C ATOM 2342 C ALA A 158 -0.134 5.395 -14.286 1.00 0.00 C ATOM 2343 O ALA A 158 0.883 5.750 -13.690 1.00 0.00 O ATOM 2344 CB ALA A 158 -2.302 6.451 -13.607 1.00 0.00 C ATOM 0 H ALA A 158 -2.820 6.083 -15.972 1.00 0.00 H new ATOM 0 HA ALA A 158 -0.743 7.385 -14.731 1.00 0.00 H new ATOM 0 HB1 ALA A 158 -1.860 6.696 -12.641 1.00 0.00 H new ATOM 0 HB2 ALA A 158 -3.036 7.212 -13.873 1.00 0.00 H new ATOM 0 HB3 ALA A 158 -2.792 5.479 -13.546 1.00 0.00 H new ATOM 2350 N ARG A 159 -0.359 4.135 -14.647 1.00 0.00 N ATOM 2351 CA ARG A 159 0.600 3.073 -14.358 1.00 0.00 C ATOM 2352 C ARG A 159 2.000 3.460 -14.828 1.00 0.00 C ATOM 2353 O ARG A 159 2.846 3.865 -14.029 1.00 0.00 O ATOM 2354 CB ARG A 159 0.183 1.764 -15.036 1.00 0.00 C ATOM 2355 CG ARG A 159 1.189 0.650 -14.839 1.00 0.00 C ATOM 2356 CD ARG A 159 2.006 0.400 -16.090 1.00 0.00 C ATOM 2357 NE ARG A 159 2.572 -0.943 -16.113 1.00 0.00 N ATOM 2358 CZ ARG A 159 2.012 -1.972 -16.741 1.00 0.00 C ATOM 2359 NH1 ARG A 159 0.838 -1.837 -17.349 1.00 0.00 N ATOM 2360 NH2 ARG A 159 2.617 -3.149 -16.736 1.00 0.00 N ATOM 0 H ARG A 159 -1.196 3.824 -15.140 1.00 0.00 H new ATOM 0 HA ARG A 159 0.614 2.929 -13.278 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -0.783 1.448 -14.641 1.00 0.00 H new ATOM 0 HB3 ARG A 159 0.049 1.941 -16.103 1.00 0.00 H new ATOM 0 HG2 ARG A 159 1.855 0.904 -14.015 1.00 0.00 H new ATOM 0 HG3 ARG A 159 0.667 -0.265 -14.557 1.00 0.00 H new ATOM 0 HD2 ARG A 159 1.377 0.543 -16.969 1.00 0.00 H new ATOM 0 HD3 ARG A 159 2.810 1.133 -16.151 1.00 0.00 H new ATOM 0 HE ARG A 159 3.449 -1.103 -15.618 1.00 0.00 H new ATOM 0 HH11 ARG A 159 0.358 -0.937 -17.337 1.00 0.00 H new ATOM 0 HH12 ARG A 159 0.417 -2.633 -17.828 1.00 0.00 H new ATOM 0 HH21 ARG A 159 3.508 -3.263 -16.252 1.00 0.00 H new ATOM 0 HH22 ARG A 159 2.193 -3.943 -17.216 1.00 0.00 H new ATOM 2374 N ARG A 160 2.237 3.308 -16.133 1.00 0.00 N ATOM 2375 CA ARG A 160 3.524 3.613 -16.740 1.00 0.00 C ATOM 2376 C ARG A 160 4.118 4.885 -16.155 1.00 0.00 C ATOM 2377 O ARG A 160 5.333 5.018 -16.027 1.00 0.00 O ATOM 2378 CB ARG A 160 3.357 3.737 -18.253 1.00 0.00 C ATOM 2379 CG ARG A 160 2.419 4.854 -18.667 1.00 0.00 C ATOM 2380 CD ARG A 160 3.145 6.183 -18.761 1.00 0.00 C ATOM 2381 NE ARG A 160 2.916 6.831 -20.048 1.00 0.00 N ATOM 2382 CZ ARG A 160 1.775 7.425 -20.375 1.00 0.00 C ATOM 2383 NH1 ARG A 160 0.768 7.448 -19.514 1.00 0.00 N ATOM 2384 NH2 ARG A 160 1.633 7.994 -21.567 1.00 0.00 N ATOM 0 H ARG A 160 1.538 2.970 -16.795 1.00 0.00 H new ATOM 0 HA ARG A 160 4.217 2.800 -16.523 1.00 0.00 H new ATOM 0 HB2 ARG A 160 4.334 3.907 -18.706 1.00 0.00 H new ATOM 0 HB3 ARG A 160 2.982 2.793 -18.648 1.00 0.00 H new ATOM 0 HG2 ARG A 160 1.969 4.615 -19.631 1.00 0.00 H new ATOM 0 HG3 ARG A 160 1.605 4.933 -17.946 1.00 0.00 H new ATOM 0 HD2 ARG A 160 2.809 6.839 -17.958 1.00 0.00 H new ATOM 0 HD3 ARG A 160 4.214 6.025 -18.618 1.00 0.00 H new ATOM 0 HE ARG A 160 3.672 6.827 -20.732 1.00 0.00 H new ATOM 0 HH11 ARG A 160 0.869 7.009 -18.599 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -0.108 7.905 -19.766 1.00 0.00 H new ATOM 0 HH21 ARG A 160 2.403 7.976 -22.236 1.00 0.00 H new ATOM 0 HH22 ARG A 160 0.754 8.449 -21.813 1.00 0.00 H new ATOM 2398 N LEU A 161 3.248 5.809 -15.788 1.00 0.00 N ATOM 2399 CA LEU A 161 3.685 7.065 -15.195 1.00 0.00 C ATOM 2400 C LEU A 161 4.308 6.822 -13.818 1.00 0.00 C ATOM 2401 O LEU A 161 5.478 7.134 -13.590 1.00 0.00 O ATOM 2402 CB LEU A 161 2.506 8.031 -15.069 1.00 0.00 C ATOM 2403 CG LEU A 161 2.869 9.435 -14.586 1.00 0.00 C ATOM 2404 CD1 LEU A 161 3.766 10.128 -15.598 1.00 0.00 C ATOM 2405 CD2 LEU A 161 1.610 10.254 -14.332 1.00 0.00 C ATOM 0 H LEU A 161 2.237 5.716 -15.889 1.00 0.00 H new ATOM 0 HA LEU A 161 4.438 7.507 -15.847 1.00 0.00 H new ATOM 0 HB2 LEU A 161 2.017 8.112 -16.040 1.00 0.00 H new ATOM 0 HB3 LEU A 161 1.778 7.603 -14.380 1.00 0.00 H new ATOM 0 HG LEU A 161 3.415 9.348 -13.647 1.00 0.00 H new ATOM 0 HD11 LEU A 161 4.015 11.127 -15.239 1.00 0.00 H new ATOM 0 HD12 LEU A 161 4.681 9.550 -15.729 1.00 0.00 H new ATOM 0 HD13 LEU A 161 3.246 10.205 -16.553 1.00 0.00 H new ATOM 0 HD21 LEU A 161 1.887 11.251 -13.989 1.00 0.00 H new ATOM 0 HD22 LEU A 161 1.036 10.335 -15.255 1.00 0.00 H new ATOM 0 HD23 LEU A 161 1.004 9.763 -13.570 1.00 0.00 H new ATOM 2417 N ARG A 162 3.510 6.276 -12.901 1.00 0.00 N ATOM 2418 CA ARG A 162 3.973 6.003 -11.536 1.00 0.00 C ATOM 2419 C ARG A 162 5.238 5.151 -11.522 1.00 0.00 C ATOM 2420 O ARG A 162 6.229 5.509 -10.887 1.00 0.00 O ATOM 2421 CB ARG A 162 2.880 5.323 -10.700 1.00 0.00 C ATOM 2422 CG ARG A 162 2.563 3.890 -11.111 1.00 0.00 C ATOM 2423 CD ARG A 162 2.283 3.015 -9.898 1.00 0.00 C ATOM 2424 NE ARG A 162 3.438 2.190 -9.555 1.00 0.00 N ATOM 2425 CZ ARG A 162 3.369 1.074 -8.835 1.00 0.00 C ATOM 2426 NH1 ARG A 162 2.205 0.652 -8.354 1.00 0.00 N ATOM 2427 NH2 ARG A 162 4.471 0.378 -8.601 1.00 0.00 N ATOM 0 H ARG A 162 2.540 6.013 -13.076 1.00 0.00 H new ATOM 0 HA ARG A 162 4.208 6.969 -11.090 1.00 0.00 H new ATOM 0 HB2 ARG A 162 3.186 5.327 -9.654 1.00 0.00 H new ATOM 0 HB3 ARG A 162 1.968 5.916 -10.768 1.00 0.00 H new ATOM 0 HG2 ARG A 162 1.698 3.883 -11.774 1.00 0.00 H new ATOM 0 HG3 ARG A 162 3.400 3.477 -11.674 1.00 0.00 H new ATOM 0 HD2 ARG A 162 2.018 3.644 -9.048 1.00 0.00 H new ATOM 0 HD3 ARG A 162 1.424 2.375 -10.100 1.00 0.00 H new ATOM 0 HE ARG A 162 4.355 2.488 -9.888 1.00 0.00 H new ATOM 0 HH11 ARG A 162 1.355 1.185 -8.536 1.00 0.00 H new ATOM 0 HH12 ARG A 162 2.162 -0.205 -7.803 1.00 0.00 H new ATOM 0 HH21 ARG A 162 5.365 0.699 -8.972 1.00 0.00 H new ATOM 0 HH22 ARG A 162 4.426 -0.479 -8.050 1.00 0.00 H new ATOM 2441 N GLU A 163 5.196 4.023 -12.219 1.00 0.00 N ATOM 2442 CA GLU A 163 6.329 3.118 -12.282 1.00 0.00 C ATOM 2443 C GLU A 163 7.399 3.670 -13.210 1.00 0.00 C ATOM 2444 O GLU A 163 8.528 3.191 -13.227 1.00 0.00 O ATOM 2445 CB GLU A 163 5.844 1.742 -12.741 1.00 0.00 C ATOM 2446 CG GLU A 163 6.944 0.764 -13.129 1.00 0.00 C ATOM 2447 CD GLU A 163 7.351 0.886 -14.585 1.00 0.00 C ATOM 2448 OE1 GLU A 163 6.884 1.829 -15.255 1.00 0.00 O ATOM 2449 OE2 GLU A 163 8.134 0.032 -15.056 1.00 0.00 O ATOM 0 H GLU A 163 4.382 3.714 -12.751 1.00 0.00 H new ATOM 0 HA GLU A 163 6.778 3.019 -11.294 1.00 0.00 H new ATOM 0 HB2 GLU A 163 5.251 1.298 -11.942 1.00 0.00 H new ATOM 0 HB3 GLU A 163 5.180 1.875 -13.595 1.00 0.00 H new ATOM 0 HG2 GLU A 163 7.816 0.935 -12.497 1.00 0.00 H new ATOM 0 HG3 GLU A 163 6.604 -0.253 -12.935 1.00 0.00 H new ATOM 2456 N GLY A 164 7.043 4.698 -13.969 1.00 0.00 N ATOM 2457 CA GLY A 164 7.995 5.301 -14.866 1.00 0.00 C ATOM 2458 C GLY A 164 9.071 6.054 -14.107 1.00 0.00 C ATOM 2459 O GLY A 164 10.251 5.702 -14.171 1.00 0.00 O ATOM 0 H GLY A 164 6.114 5.120 -13.976 1.00 0.00 H new ATOM 0 HA2 GLY A 164 8.455 4.529 -15.483 1.00 0.00 H new ATOM 0 HA3 GLY A 164 7.479 5.983 -15.542 1.00 0.00 H new ATOM 2463 N ASN A 165 8.664 7.093 -13.380 1.00 0.00 N ATOM 2464 CA ASN A 165 9.604 7.900 -12.607 1.00 0.00 C ATOM 2465 C ASN A 165 10.151 7.125 -11.411 1.00 0.00 C ATOM 2466 O ASN A 165 11.323 7.252 -11.063 1.00 0.00 O ATOM 2467 CB ASN A 165 8.934 9.187 -12.126 1.00 0.00 C ATOM 2468 CG ASN A 165 8.346 9.993 -13.266 1.00 0.00 C ATOM 2469 OD1 ASN A 165 8.784 9.881 -14.412 1.00 0.00 O ATOM 2470 ND2 ASN A 165 7.347 10.810 -12.959 1.00 0.00 N ATOM 0 H ASN A 165 7.692 7.395 -13.311 1.00 0.00 H new ATOM 0 HA ASN A 165 10.438 8.152 -13.262 1.00 0.00 H new ATOM 0 HB2 ASN A 165 8.146 8.939 -11.415 1.00 0.00 H new ATOM 0 HB3 ASN A 165 9.664 9.796 -11.593 1.00 0.00 H new ATOM 0 HD21 ASN A 165 6.910 11.377 -13.686 1.00 0.00 H new ATOM 0 HD22 ASN A 165 7.016 10.871 -11.996 1.00 0.00 H new ATOM 2477 N TRP A 166 9.300 6.328 -10.779 1.00 0.00 N ATOM 2478 CA TRP A 166 9.718 5.546 -9.626 1.00 0.00 C ATOM 2479 C TRP A 166 10.691 4.450 -10.040 1.00 0.00 C ATOM 2480 O TRP A 166 11.858 4.466 -9.649 1.00 0.00 O ATOM 2481 CB TRP A 166 8.505 4.942 -8.932 1.00 0.00 C ATOM 2482 CG TRP A 166 7.891 5.862 -7.930 1.00 0.00 C ATOM 2483 CD1 TRP A 166 7.816 7.225 -7.995 1.00 0.00 C ATOM 2484 CD2 TRP A 166 7.273 5.481 -6.706 1.00 0.00 C ATOM 2485 NE1 TRP A 166 7.187 7.711 -6.875 1.00 0.00 N ATOM 2486 CE2 TRP A 166 6.842 6.658 -6.067 1.00 0.00 C ATOM 2487 CE3 TRP A 166 7.042 4.256 -6.089 1.00 0.00 C ATOM 2488 CZ2 TRP A 166 6.193 6.639 -4.836 1.00 0.00 C ATOM 2489 CZ3 TRP A 166 6.399 4.240 -4.875 1.00 0.00 C ATOM 2490 CH2 TRP A 166 5.980 5.421 -4.257 1.00 0.00 C ATOM 0 H TRP A 166 8.322 6.207 -11.044 1.00 0.00 H new ATOM 0 HA TRP A 166 10.229 6.210 -8.928 1.00 0.00 H new ATOM 0 HB2 TRP A 166 7.758 4.678 -9.681 1.00 0.00 H new ATOM 0 HB3 TRP A 166 8.800 4.017 -8.436 1.00 0.00 H new ATOM 0 HD1 TRP A 166 8.195 7.830 -8.806 1.00 0.00 H new ATOM 0 HE1 TRP A 166 7.006 8.695 -6.676 1.00 0.00 H new ATOM 0 HE3 TRP A 166 7.362 3.336 -6.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 166 5.871 7.552 -4.357 1.00 0.00 H new ATOM 0 HZ3 TRP A 166 6.213 3.294 -4.388 1.00 0.00 H new ATOM 0 HH2 TRP A 166 5.478 5.369 -3.302 1.00 0.00 H new ATOM 2501 N ALA A 167 10.210 3.503 -10.840 1.00 0.00 N ATOM 2502 CA ALA A 167 11.053 2.407 -11.305 1.00 0.00 C ATOM 2503 C ALA A 167 12.184 2.917 -12.195 1.00 0.00 C ATOM 2504 O ALA A 167 13.124 2.178 -12.492 1.00 0.00 O ATOM 2505 CB ALA A 167 10.228 1.366 -12.042 1.00 0.00 C ATOM 0 H ALA A 167 9.248 3.472 -11.178 1.00 0.00 H new ATOM 0 HA ALA A 167 11.498 1.938 -10.427 1.00 0.00 H new ATOM 0 HB1 ALA A 167 10.878 0.559 -12.379 1.00 0.00 H new ATOM 0 HB2 ALA A 167 9.467 0.964 -11.373 1.00 0.00 H new ATOM 0 HB3 ALA A 167 9.746 1.827 -12.904 1.00 0.00 H new ATOM 2511 N SER A 168 12.098 4.181 -12.614 1.00 0.00 N ATOM 2512 CA SER A 168 13.127 4.777 -13.459 1.00 0.00 C ATOM 2513 C SER A 168 14.521 4.533 -12.879 1.00 0.00 C ATOM 2514 O SER A 168 15.515 4.541 -13.606 1.00 0.00 O ATOM 2515 CB SER A 168 12.881 6.282 -13.611 1.00 0.00 C ATOM 2516 OG SER A 168 12.468 6.600 -14.928 1.00 0.00 O ATOM 0 H SER A 168 11.328 4.808 -12.381 1.00 0.00 H new ATOM 0 HA SER A 168 13.075 4.304 -14.440 1.00 0.00 H new ATOM 0 HB2 SER A 168 12.120 6.603 -12.900 1.00 0.00 H new ATOM 0 HB3 SER A 168 13.793 6.829 -13.370 1.00 0.00 H new ATOM 0 HG SER A 168 11.489 6.606 -14.971 1.00 0.00 H new ATOM 2522 N VAL A 169 14.587 4.317 -11.563 1.00 0.00 N ATOM 2523 CA VAL A 169 15.857 4.072 -10.892 1.00 0.00 C ATOM 2524 C VAL A 169 16.463 2.741 -11.326 1.00 0.00 C ATOM 2525 O VAL A 169 15.844 1.686 -11.188 1.00 0.00 O ATOM 2526 CB VAL A 169 15.699 4.094 -9.354 1.00 0.00 C ATOM 2527 CG1 VAL A 169 15.188 5.451 -8.894 1.00 0.00 C ATOM 2528 CG2 VAL A 169 14.772 2.985 -8.869 1.00 0.00 C ATOM 0 H VAL A 169 13.775 4.308 -10.946 1.00 0.00 H new ATOM 0 HA VAL A 169 16.530 4.878 -11.184 1.00 0.00 H new ATOM 0 HB VAL A 169 16.682 3.918 -8.917 1.00 0.00 H new ATOM 0 HG11 VAL A 169 15.082 5.451 -7.809 1.00 0.00 H new ATOM 0 HG12 VAL A 169 15.896 6.226 -9.189 1.00 0.00 H new ATOM 0 HG13 VAL A 169 14.220 5.650 -9.353 1.00 0.00 H new ATOM 0 HG21 VAL A 169 14.685 3.032 -7.783 1.00 0.00 H new ATOM 0 HG22 VAL A 169 13.787 3.112 -9.318 1.00 0.00 H new ATOM 0 HG23 VAL A 169 15.180 2.017 -9.159 1.00 0.00 H new ATOM 2538 N ARG A 170 17.679 2.796 -11.862 1.00 0.00 N ATOM 2539 CA ARG A 170 18.363 1.593 -12.320 1.00 0.00 C ATOM 2540 C ARG A 170 18.548 0.611 -11.169 1.00 0.00 C ATOM 2541 O ARG A 170 18.066 0.842 -10.060 1.00 0.00 O ATOM 2542 CB ARG A 170 19.717 1.941 -12.943 1.00 0.00 C ATOM 2543 CG ARG A 170 19.617 2.395 -14.390 1.00 0.00 C ATOM 2544 CD ARG A 170 20.665 1.723 -15.264 1.00 0.00 C ATOM 2545 NE ARG A 170 21.933 2.452 -15.250 1.00 0.00 N ATOM 2546 CZ ARG A 170 23.034 2.037 -14.623 1.00 0.00 C ATOM 2547 NH1 ARG A 170 23.044 0.896 -13.942 1.00 0.00 N ATOM 2548 NH2 ARG A 170 24.135 2.773 -14.678 1.00 0.00 N ATOM 0 H ARG A 170 18.209 3.658 -11.989 1.00 0.00 H new ATOM 0 HA ARG A 170 17.744 1.122 -13.084 1.00 0.00 H new ATOM 0 HB2 ARG A 170 20.188 2.729 -12.355 1.00 0.00 H new ATOM 0 HB3 ARG A 170 20.369 1.069 -12.888 1.00 0.00 H new ATOM 0 HG2 ARG A 170 18.623 2.168 -14.775 1.00 0.00 H new ATOM 0 HG3 ARG A 170 19.740 3.477 -14.441 1.00 0.00 H new ATOM 0 HD2 ARG A 170 20.828 0.703 -14.916 1.00 0.00 H new ATOM 0 HD3 ARG A 170 20.296 1.656 -16.287 1.00 0.00 H new ATOM 0 HE ARG A 170 21.978 3.338 -15.754 1.00 0.00 H new ATOM 0 HH11 ARG A 170 22.201 0.324 -13.893 1.00 0.00 H new ATOM 0 HH12 ARG A 170 23.895 0.593 -13.468 1.00 0.00 H new ATOM 0 HH21 ARG A 170 24.136 3.651 -15.198 1.00 0.00 H new ATOM 0 HH22 ARG A 170 24.981 2.462 -14.201 1.00 0.00 H new ATOM 2562 N LEU A 171 19.229 -0.493 -11.445 1.00 0.00 N ATOM 2563 CA LEU A 171 19.459 -1.517 -10.437 1.00 0.00 C ATOM 2564 C LEU A 171 20.887 -2.053 -10.527 1.00 0.00 C ATOM 2565 O LEU A 171 21.741 -1.461 -11.188 1.00 0.00 O ATOM 2566 CB LEU A 171 18.456 -2.664 -10.614 1.00 0.00 C ATOM 2567 CG LEU A 171 16.974 -2.262 -10.634 1.00 0.00 C ATOM 2568 CD1 LEU A 171 16.564 -1.723 -11.998 1.00 0.00 C ATOM 2569 CD2 LEU A 171 16.102 -3.453 -10.261 1.00 0.00 C ATOM 0 H LEU A 171 19.631 -0.702 -12.359 1.00 0.00 H new ATOM 0 HA LEU A 171 19.320 -1.069 -9.453 1.00 0.00 H new ATOM 0 HB2 LEU A 171 18.685 -3.180 -11.546 1.00 0.00 H new ATOM 0 HB3 LEU A 171 18.607 -3.381 -9.807 1.00 0.00 H new ATOM 0 HG LEU A 171 16.832 -1.468 -9.901 1.00 0.00 H new ATOM 0 HD11 LEU A 171 15.510 -1.448 -11.978 1.00 0.00 H new ATOM 0 HD12 LEU A 171 17.164 -0.845 -12.238 1.00 0.00 H new ATOM 0 HD13 LEU A 171 16.725 -2.490 -12.756 1.00 0.00 H new ATOM 0 HD21 LEU A 171 15.053 -3.156 -10.279 1.00 0.00 H new ATOM 0 HD22 LEU A 171 16.263 -4.260 -10.976 1.00 0.00 H new ATOM 0 HD23 LEU A 171 16.365 -3.797 -9.261 1.00 0.00 H new ATOM 2581 N GLU A 172 21.141 -3.177 -9.860 1.00 0.00 N ATOM 2582 CA GLU A 172 22.466 -3.792 -9.871 1.00 0.00 C ATOM 2583 C GLU A 172 22.361 -5.307 -10.030 1.00 0.00 C ATOM 2584 O GLU A 172 21.454 -5.936 -9.486 1.00 0.00 O ATOM 2585 CB GLU A 172 23.218 -3.453 -8.583 1.00 0.00 C ATOM 2586 CG GLU A 172 23.751 -2.030 -8.548 1.00 0.00 C ATOM 2587 CD GLU A 172 23.779 -1.453 -7.147 1.00 0.00 C ATOM 2588 OE1 GLU A 172 22.899 -1.815 -6.338 1.00 0.00 O ATOM 2589 OE2 GLU A 172 24.682 -0.641 -6.857 1.00 0.00 O ATOM 0 H GLU A 172 20.448 -3.680 -9.306 1.00 0.00 H new ATOM 0 HA GLU A 172 23.018 -3.393 -10.722 1.00 0.00 H new ATOM 0 HB2 GLU A 172 22.553 -3.604 -7.733 1.00 0.00 H new ATOM 0 HB3 GLU A 172 24.050 -4.147 -8.464 1.00 0.00 H new ATOM 0 HG2 GLU A 172 24.758 -2.013 -8.964 1.00 0.00 H new ATOM 0 HG3 GLU A 172 23.132 -1.398 -9.185 1.00 0.00 H new ATOM 2596 N HIS A 173 23.296 -5.884 -10.780 1.00 0.00 N ATOM 2597 CA HIS A 173 23.309 -7.325 -11.012 1.00 0.00 C ATOM 2598 C HIS A 173 23.590 -8.083 -9.718 1.00 0.00 C ATOM 2599 O HIS A 173 24.349 -7.617 -8.867 1.00 0.00 O ATOM 2600 CB HIS A 173 24.361 -7.682 -12.066 1.00 0.00 C ATOM 2601 CG HIS A 173 24.112 -8.992 -12.748 1.00 0.00 C ATOM 2602 ND1 HIS A 173 23.121 -9.869 -12.362 1.00 0.00 N ATOM 2603 CD2 HIS A 173 24.739 -9.578 -13.796 1.00 0.00 C ATOM 2604 CE1 HIS A 173 23.146 -10.936 -13.139 1.00 0.00 C ATOM 2605 NE2 HIS A 173 24.118 -10.784 -14.018 1.00 0.00 N ATOM 0 H HIS A 173 24.054 -5.376 -11.237 1.00 0.00 H new ATOM 0 HA HIS A 173 22.324 -7.619 -11.376 1.00 0.00 H new ATOM 0 HB2 HIS A 173 24.392 -6.892 -12.817 1.00 0.00 H new ATOM 0 HB3 HIS A 173 25.342 -7.710 -11.592 1.00 0.00 H new ATOM 0 HD2 HIS A 173 25.571 -9.173 -14.353 1.00 0.00 H new ATOM 0 HE1 HIS A 173 22.485 -11.787 -13.067 1.00 0.00 H new ATOM 0 HE2 HIS A 173 24.368 -11.454 -14.745 1.00 0.00 H new ATOM 2613 N HIS A 174 22.975 -9.253 -9.576 1.00 0.00 N ATOM 2614 CA HIS A 174 23.159 -10.076 -8.387 1.00 0.00 C ATOM 2615 C HIS A 174 23.330 -11.545 -8.764 1.00 0.00 C ATOM 2616 O HIS A 174 22.977 -11.958 -9.868 1.00 0.00 O ATOM 2617 CB HIS A 174 21.965 -9.916 -7.445 1.00 0.00 C ATOM 2618 CG HIS A 174 20.641 -9.956 -8.144 1.00 0.00 C ATOM 2619 ND1 HIS A 174 20.304 -10.926 -9.063 1.00 0.00 N ATOM 2620 CD2 HIS A 174 19.568 -9.134 -8.059 1.00 0.00 C ATOM 2621 CE1 HIS A 174 19.084 -10.702 -9.514 1.00 0.00 C ATOM 2622 NE2 HIS A 174 18.614 -9.619 -8.919 1.00 0.00 N ATOM 0 H HIS A 174 22.344 -9.652 -10.271 1.00 0.00 H new ATOM 0 HA HIS A 174 24.064 -9.742 -7.879 1.00 0.00 H new ATOM 0 HB2 HIS A 174 21.995 -10.707 -6.696 1.00 0.00 H new ATOM 0 HB3 HIS A 174 22.057 -8.969 -6.913 1.00 0.00 H new ATOM 0 HD1 HIS A 174 20.905 -11.698 -9.350 1.00 0.00 H new ATOM 0 HD2 HIS A 174 19.479 -8.260 -7.431 1.00 0.00 H new ATOM 0 HE1 HIS A 174 18.560 -11.301 -10.244 1.00 0.00 H new ATOM 2630 N HIS A 175 23.875 -12.329 -7.839 1.00 0.00 N ATOM 2631 CA HIS A 175 24.092 -13.752 -8.074 1.00 0.00 C ATOM 2632 C HIS A 175 23.588 -14.581 -6.896 1.00 0.00 C ATOM 2633 O HIS A 175 23.525 -14.096 -5.766 1.00 0.00 O ATOM 2634 CB HIS A 175 25.578 -14.032 -8.314 1.00 0.00 C ATOM 2635 CG HIS A 175 25.928 -14.234 -9.757 1.00 0.00 C ATOM 2636 ND1 HIS A 175 24.986 -14.265 -10.764 1.00 0.00 N ATOM 2637 CD2 HIS A 175 27.126 -14.418 -10.361 1.00 0.00 C ATOM 2638 CE1 HIS A 175 25.588 -14.459 -11.924 1.00 0.00 C ATOM 2639 NE2 HIS A 175 26.887 -14.555 -11.707 1.00 0.00 N ATOM 0 H HIS A 175 24.174 -12.003 -6.920 1.00 0.00 H new ATOM 0 HA HIS A 175 23.529 -14.038 -8.963 1.00 0.00 H new ATOM 0 HB2 HIS A 175 26.163 -13.201 -7.920 1.00 0.00 H new ATOM 0 HB3 HIS A 175 25.867 -14.920 -7.752 1.00 0.00 H new ATOM 0 HD2 HIS A 175 28.090 -14.451 -9.875 1.00 0.00 H new ATOM 0 HE1 HIS A 175 25.101 -14.527 -12.885 1.00 0.00 H new ATOM 0 HE2 HIS A 175 27.598 -14.706 -12.423 1.00 0.00 H new ATOM 2647 N HIS A 176 23.231 -15.832 -7.168 1.00 0.00 N ATOM 2648 CA HIS A 176 22.734 -16.728 -6.130 1.00 0.00 C ATOM 2649 C HIS A 176 23.708 -17.878 -5.892 1.00 0.00 C ATOM 2650 O HIS A 176 23.950 -18.693 -6.783 1.00 0.00 O ATOM 2651 CB HIS A 176 21.359 -17.277 -6.518 1.00 0.00 C ATOM 2652 CG HIS A 176 20.353 -17.206 -5.410 1.00 0.00 C ATOM 2653 ND1 HIS A 176 19.114 -16.617 -5.554 1.00 0.00 N ATOM 2654 CD2 HIS A 176 20.406 -17.655 -4.133 1.00 0.00 C ATOM 2655 CE1 HIS A 176 18.450 -16.704 -4.415 1.00 0.00 C ATOM 2656 NE2 HIS A 176 19.212 -17.330 -3.538 1.00 0.00 N ATOM 0 H HIS A 176 23.277 -16.248 -8.098 1.00 0.00 H new ATOM 0 HA HIS A 176 22.642 -16.159 -5.205 1.00 0.00 H new ATOM 0 HB2 HIS A 176 20.983 -16.720 -7.376 1.00 0.00 H new ATOM 0 HB3 HIS A 176 21.467 -18.315 -6.834 1.00 0.00 H new ATOM 0 HD2 HIS A 176 21.233 -18.172 -3.669 1.00 0.00 H new ATOM 0 HE1 HIS A 176 17.454 -16.327 -4.233 1.00 0.00 H new ATOM 0 HE2 HIS A 176 18.955 -17.539 -2.573 1.00 0.00 H new ATOM 2664 N HIS A 177 24.262 -17.938 -4.686 1.00 0.00 N ATOM 2665 CA HIS A 177 25.209 -18.988 -4.332 1.00 0.00 C ATOM 2666 C HIS A 177 24.536 -20.069 -3.492 1.00 0.00 C ATOM 2667 O HIS A 177 24.017 -19.794 -2.409 1.00 0.00 O ATOM 2668 CB HIS A 177 26.396 -18.398 -3.568 1.00 0.00 C ATOM 2669 CG HIS A 177 27.245 -17.482 -4.395 1.00 0.00 C ATOM 2670 ND1 HIS A 177 28.536 -17.787 -4.771 1.00 0.00 N ATOM 2671 CD2 HIS A 177 26.981 -16.263 -4.921 1.00 0.00 C ATOM 2672 CE1 HIS A 177 29.031 -16.797 -5.490 1.00 0.00 C ATOM 2673 NE2 HIS A 177 28.107 -15.859 -5.597 1.00 0.00 N ATOM 0 H HIS A 177 24.071 -17.272 -3.937 1.00 0.00 H new ATOM 0 HA HIS A 177 25.569 -19.442 -5.255 1.00 0.00 H new ATOM 0 HB2 HIS A 177 26.024 -17.852 -2.701 1.00 0.00 H new ATOM 0 HB3 HIS A 177 27.015 -19.212 -3.190 1.00 0.00 H new ATOM 0 HD2 HIS A 177 26.058 -15.711 -4.827 1.00 0.00 H new ATOM 0 HE1 HIS A 177 30.022 -16.760 -5.918 1.00 0.00 H new ATOM 0 HE2 HIS A 177 28.212 -14.978 -6.100 1.00 0.00 H new ATOM 2681 N HIS A 178 24.546 -21.297 -3.998 1.00 0.00 N ATOM 2682 CA HIS A 178 23.937 -22.420 -3.294 1.00 0.00 C ATOM 2683 C HIS A 178 25.002 -23.385 -2.783 1.00 0.00 C ATOM 2684 O HIS A 178 26.113 -23.394 -3.352 1.00 0.00 O ATOM 2685 CB HIS A 178 22.963 -23.158 -4.215 1.00 0.00 C ATOM 2686 CG HIS A 178 21.609 -22.525 -4.285 1.00 0.00 C ATOM 2687 ND1 HIS A 178 20.845 -22.503 -5.433 1.00 0.00 N ATOM 2688 CD2 HIS A 178 20.878 -21.885 -3.340 1.00 0.00 C ATOM 2689 CE1 HIS A 178 19.706 -21.880 -5.193 1.00 0.00 C ATOM 2690 NE2 HIS A 178 19.701 -21.495 -3.930 1.00 0.00 N ATOM 2691 OXT HIS A 178 24.715 -24.123 -1.817 1.00 0.00 O ATOM 0 H HIS A 178 24.969 -21.541 -4.894 1.00 0.00 H new ATOM 0 HA HIS A 178 23.390 -22.026 -2.438 1.00 0.00 H new ATOM 0 HB2 HIS A 178 23.387 -23.202 -5.218 1.00 0.00 H new ATOM 0 HB3 HIS A 178 22.857 -24.186 -3.869 1.00 0.00 H new ATOM 0 HD2 HIS A 178 21.167 -21.714 -2.314 1.00 0.00 H new ATOM 0 HE1 HIS A 178 18.914 -21.714 -5.908 1.00 0.00 H new ATOM 0 HE2 HIS A 178 18.945 -20.990 -3.467 1.00 0.00 H new TER 2699 HIS A 178