USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1101 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 65 THR OG1 : rot 180:sc= 0.382 USER MOD Set 1.2: A 74 SER OG : rot 49:sc= 0.405 USER MOD Set 2.1: A 14 TYR OH : rot 102:sc= -0.571 USER MOD Set 2.2: A 107 ASN : amide:sc= 0 K(o=-0.57,f=-1.5) USER MOD Single : A 3 THR OG1 : rot 150:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 150:sc= -0.127 USER MOD Single : A 15 ASN : amide:sc= -1.75 K(o=-1.7,f=-7.3!) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -120:sc= -1.15 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 30:sc= 0 USER MOD Single : A 34 SER OG : rot 35:sc= 0.259 USER MOD Single : A 35 THR OG1 : rot 100:sc= 0.219 USER MOD Single : A 41 GLN : amide:sc= -0.534 X(o=-0.53,f=-0.68) USER MOD Single : A 45 TYR OH : rot -92:sc= 1.16 USER MOD Single : A 46 GLN : amide:sc= -0.133 K(o=-0.13,f=-0.72) USER MOD Single : A 47 HIS : no HD1:sc= -0.115 X(o=-0.12,f=-0.21) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.0436 X(o=-0.044,f=-0.1) USER MOD Single : A 52 CYS SG : rot 147:sc= 0.87 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0884 USER MOD Single : A 66 THR OG1 : rot 37:sc= 0.286 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= -0.0473 USER MOD Single : A 72 LYS NZ :NH3+ -121:sc= -0.589 (180deg=-1.89!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 100:sc= -0.23 USER MOD Single : A 85 ASN : amide:sc= 0.0504 X(o=0.05,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.24 X(o=-0.24,f=-0.2) USER MOD Single : A 93 LYS NZ :NH3+ -168:sc= -0.431 (180deg=-0.622) USER MOD Single : A 94 THR OG1 : rot 170:sc= -0.0534 USER MOD Single : A 96 THR OG1 : rot 31:sc= 0.958 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -144:sc= -1.06 (180deg=-2.8!) USER MOD Single : A 106 GLN : amide:sc= -0.217 K(o=-0.22,f=-2!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.348 X(o=-0.35,f=-0.011) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.0493 X(o=-0.049,f=0) USER MOD Single : A 141 THR OG1 : rot 180:sc=-0.00311 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -2.186 -18.350 -13.314 1.00 0.00 N ATOM 2 CA ALA A 2 -3.128 -19.023 -12.378 1.00 0.00 C ATOM 3 C ALA A 2 -3.392 -18.152 -11.147 1.00 0.00 C ATOM 4 O ALA A 2 -3.364 -18.632 -10.011 1.00 0.00 O ATOM 5 CB ALA A 2 -2.583 -20.387 -11.969 1.00 0.00 C ATOM 0 HA ALA A 2 -4.077 -19.170 -12.893 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.282 -20.868 -11.285 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -2.457 -21.009 -12.855 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.620 -20.261 -11.474 1.00 0.00 H new ATOM 13 N THR A 3 -3.651 -16.866 -11.384 1.00 0.00 N ATOM 14 CA THR A 3 -3.926 -15.919 -10.307 1.00 0.00 C ATOM 15 C THR A 3 -5.311 -15.300 -10.478 1.00 0.00 C ATOM 16 O THR A 3 -5.657 -14.827 -11.564 1.00 0.00 O ATOM 17 CB THR A 3 -2.856 -14.820 -10.273 1.00 0.00 C ATOM 18 OG1 THR A 3 -2.526 -14.391 -11.586 1.00 0.00 O ATOM 19 CG2 THR A 3 -1.574 -15.254 -9.589 1.00 0.00 C ATOM 0 H THR A 3 -3.676 -16.456 -12.318 1.00 0.00 H new ATOM 0 HA THR A 3 -3.901 -16.460 -9.361 1.00 0.00 H new ATOM 0 HB THR A 3 -3.298 -14.007 -9.697 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.256 -13.449 -11.564 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.860 -14.431 -9.599 1.00 0.00 H new ATOM 0 HG22 THR A 3 -1.789 -15.535 -8.558 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.151 -16.108 -10.117 1.00 0.00 H new ATOM 27 N LYS A 4 -6.101 -15.314 -9.407 1.00 0.00 N ATOM 28 CA LYS A 4 -7.451 -14.760 -9.443 1.00 0.00 C ATOM 29 C LYS A 4 -7.604 -13.621 -8.440 1.00 0.00 C ATOM 30 O LYS A 4 -6.961 -13.614 -7.391 1.00 0.00 O ATOM 31 CB LYS A 4 -8.482 -15.854 -9.151 1.00 0.00 C ATOM 32 CG LYS A 4 -8.775 -16.749 -10.346 1.00 0.00 C ATOM 33 CD LYS A 4 -10.040 -16.317 -11.070 1.00 0.00 C ATOM 34 CE LYS A 4 -10.329 -17.207 -12.269 1.00 0.00 C ATOM 35 NZ LYS A 4 -11.790 -17.328 -12.537 1.00 0.00 N ATOM 0 H LYS A 4 -5.829 -15.703 -8.504 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.624 -14.362 -10.443 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.123 -16.469 -8.326 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.410 -15.388 -8.820 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -7.932 -16.722 -11.037 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.881 -17.781 -10.012 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -10.884 -16.349 -10.381 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.937 -15.283 -11.400 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.832 -16.801 -13.150 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.909 -18.198 -12.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -11.942 -17.943 -13.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -12.262 -17.739 -11.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -12.187 -16.386 -12.730 1.00 0.00 H new ATOM 49 N ILE A 5 -8.464 -12.661 -8.773 1.00 0.00 N ATOM 50 CA ILE A 5 -8.714 -11.515 -7.904 1.00 0.00 C ATOM 51 C ILE A 5 -10.212 -11.270 -7.746 1.00 0.00 C ATOM 52 O ILE A 5 -10.950 -11.227 -8.732 1.00 0.00 O ATOM 53 CB ILE A 5 -8.035 -10.232 -8.439 1.00 0.00 C ATOM 54 CG1 ILE A 5 -8.229 -9.076 -7.452 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.581 -9.860 -9.813 1.00 0.00 C ATOM 56 CD1 ILE A 5 -7.277 -7.921 -7.675 1.00 0.00 C ATOM 0 H ILE A 5 -9.000 -12.655 -9.641 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.283 -11.753 -6.932 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.968 -10.427 -8.542 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -9.253 -8.711 -7.530 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.100 -9.451 -6.437 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.088 -8.955 -10.168 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.391 -10.674 -10.512 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.655 -9.685 -9.743 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.473 -7.141 -6.940 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.250 -8.270 -7.568 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.421 -7.519 -8.678 1.00 0.00 H new ATOM 68 N ASP A 6 -10.653 -11.112 -6.502 1.00 0.00 N ATOM 69 CA ASP A 6 -12.064 -10.872 -6.217 1.00 0.00 C ATOM 70 C ASP A 6 -12.413 -9.400 -6.403 1.00 0.00 C ATOM 71 O ASP A 6 -12.062 -8.557 -5.576 1.00 0.00 O ATOM 72 CB ASP A 6 -12.402 -11.321 -4.796 1.00 0.00 C ATOM 73 CG ASP A 6 -12.687 -12.810 -4.704 1.00 0.00 C ATOM 74 OD1 ASP A 6 -11.862 -13.608 -5.204 1.00 0.00 O ATOM 75 OD2 ASP A 6 -13.734 -13.177 -4.132 1.00 0.00 O ATOM 0 H ASP A 6 -10.055 -11.146 -5.676 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.658 -11.455 -6.921 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.573 -11.072 -4.134 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -13.271 -10.766 -4.441 1.00 0.00 H new ATOM 80 N LYS A 7 -13.109 -9.103 -7.499 1.00 0.00 N ATOM 81 CA LYS A 7 -13.518 -7.733 -7.809 1.00 0.00 C ATOM 82 C LYS A 7 -14.413 -7.173 -6.708 1.00 0.00 C ATOM 83 O LYS A 7 -14.272 -6.016 -6.312 1.00 0.00 O ATOM 84 CB LYS A 7 -14.248 -7.684 -9.156 1.00 0.00 C ATOM 85 CG LYS A 7 -13.325 -7.433 -10.340 1.00 0.00 C ATOM 86 CD LYS A 7 -14.049 -7.617 -11.665 1.00 0.00 C ATOM 87 CE LYS A 7 -14.606 -6.303 -12.190 1.00 0.00 C ATOM 88 NZ LYS A 7 -16.050 -6.138 -11.858 1.00 0.00 N ATOM 0 H LYS A 7 -13.402 -9.794 -8.189 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.621 -7.117 -7.872 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.774 -8.626 -9.309 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -15.004 -6.899 -9.122 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -12.924 -6.421 -10.281 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.476 -8.115 -10.291 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.363 -8.040 -12.399 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.862 -8.332 -11.539 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -14.039 -5.474 -11.767 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -14.475 -6.260 -13.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -16.391 -5.230 -12.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -16.595 -6.915 -12.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -16.173 -6.154 -10.825 1.00 0.00 H new ATOM 102 N GLU A 8 -15.329 -8.007 -6.213 1.00 0.00 N ATOM 103 CA GLU A 8 -16.245 -7.605 -5.150 1.00 0.00 C ATOM 104 C GLU A 8 -15.479 -7.253 -3.875 1.00 0.00 C ATOM 105 O GLU A 8 -15.775 -6.252 -3.221 1.00 0.00 O ATOM 106 CB GLU A 8 -17.251 -8.725 -4.866 1.00 0.00 C ATOM 107 CG GLU A 8 -18.643 -8.225 -4.515 1.00 0.00 C ATOM 108 CD GLU A 8 -19.720 -9.251 -4.805 1.00 0.00 C ATOM 109 OE1 GLU A 8 -19.792 -10.262 -4.073 1.00 0.00 O ATOM 110 OE2 GLU A 8 -20.491 -9.046 -5.766 1.00 0.00 O ATOM 0 H GLU A 8 -15.455 -8.967 -6.534 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.784 -6.718 -5.483 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -17.317 -9.372 -5.741 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.877 -9.337 -4.045 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.674 -7.960 -3.458 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.851 -7.315 -5.078 1.00 0.00 H new ATOM 117 N ALA A 9 -14.489 -8.081 -3.531 1.00 0.00 N ATOM 118 CA ALA A 9 -13.676 -7.858 -2.339 1.00 0.00 C ATOM 119 C ALA A 9 -12.860 -6.574 -2.463 1.00 0.00 C ATOM 120 O ALA A 9 -12.976 -5.676 -1.628 1.00 0.00 O ATOM 121 CB ALA A 9 -12.764 -9.050 -2.090 1.00 0.00 C ATOM 0 H ALA A 9 -14.233 -8.912 -4.064 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.346 -7.748 -1.487 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.164 -8.869 -1.198 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.368 -9.946 -1.946 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -12.106 -9.190 -2.948 1.00 0.00 H new ATOM 127 N CYS A 10 -12.042 -6.493 -3.513 1.00 0.00 N ATOM 128 CA CYS A 10 -11.211 -5.314 -3.755 1.00 0.00 C ATOM 129 C CYS A 10 -12.061 -4.047 -3.787 1.00 0.00 C ATOM 130 O CYS A 10 -11.693 -3.025 -3.206 1.00 0.00 O ATOM 131 CB CYS A 10 -10.450 -5.465 -5.074 1.00 0.00 C ATOM 132 SG CYS A 10 -9.158 -4.225 -5.328 1.00 0.00 S ATOM 0 H CYS A 10 -11.937 -7.231 -4.210 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.495 -5.229 -2.937 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -9.999 -6.457 -5.109 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -11.160 -5.408 -5.899 1.00 0.00 H new ATOM 0 HG CYS A 10 -8.202 -4.735 -6.047 1.00 0.00 H new ATOM 138 N ARG A 11 -13.205 -4.130 -4.467 1.00 0.00 N ATOM 139 CA ARG A 11 -14.125 -2.999 -4.577 1.00 0.00 C ATOM 140 C ARG A 11 -14.643 -2.588 -3.200 1.00 0.00 C ATOM 141 O ARG A 11 -14.681 -1.401 -2.874 1.00 0.00 O ATOM 142 CB ARG A 11 -15.298 -3.353 -5.498 1.00 0.00 C ATOM 143 CG ARG A 11 -16.282 -2.212 -5.713 1.00 0.00 C ATOM 144 CD ARG A 11 -15.972 -1.436 -6.984 1.00 0.00 C ATOM 145 NE ARG A 11 -15.190 -0.228 -6.714 1.00 0.00 N ATOM 146 CZ ARG A 11 -15.074 0.795 -7.565 1.00 0.00 C ATOM 147 NH1 ARG A 11 -15.691 0.768 -8.744 1.00 0.00 N ATOM 148 NH2 ARG A 11 -14.337 1.848 -7.235 1.00 0.00 N ATOM 0 H ARG A 11 -13.517 -4.972 -4.951 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.581 -2.158 -5.007 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.905 -3.668 -6.465 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.832 -4.205 -5.078 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -17.295 -2.610 -5.767 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -16.250 -1.537 -4.857 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -15.423 -2.076 -7.674 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -16.904 -1.161 -7.477 1.00 0.00 H new ATOM 0 HE ARG A 11 -14.703 -0.164 -5.820 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -16.258 -0.039 -9.004 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -15.596 1.554 -9.387 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -13.861 1.875 -6.333 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -14.247 2.631 -7.883 1.00 0.00 H new ATOM 162 N ALA A 12 -15.035 -3.579 -2.397 1.00 0.00 N ATOM 163 CA ALA A 12 -15.547 -3.328 -1.051 1.00 0.00 C ATOM 164 C ALA A 12 -14.555 -2.506 -0.231 1.00 0.00 C ATOM 165 O ALA A 12 -14.924 -1.491 0.362 1.00 0.00 O ATOM 166 CB ALA A 12 -15.857 -4.641 -0.348 1.00 0.00 C ATOM 0 H ALA A 12 -15.007 -4.565 -2.658 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.469 -2.753 -1.142 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.237 -4.437 0.653 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.608 -5.190 -0.917 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.948 -5.239 -0.276 1.00 0.00 H new ATOM 172 N ALA A 13 -13.295 -2.944 -0.211 1.00 0.00 N ATOM 173 CA ALA A 13 -12.249 -2.239 0.527 1.00 0.00 C ATOM 174 C ALA A 13 -12.102 -0.810 0.017 1.00 0.00 C ATOM 175 O ALA A 13 -12.118 0.143 0.799 1.00 0.00 O ATOM 176 CB ALA A 13 -10.925 -2.981 0.415 1.00 0.00 C ATOM 0 H ALA A 13 -12.976 -3.782 -0.697 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.537 -2.202 1.577 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.158 -2.442 0.970 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.034 -3.984 0.827 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.634 -3.049 -0.633 1.00 0.00 H new ATOM 182 N TYR A 14 -11.968 -0.672 -1.302 1.00 0.00 N ATOM 183 CA TYR A 14 -11.826 0.637 -1.935 1.00 0.00 C ATOM 184 C TYR A 14 -12.994 1.554 -1.568 1.00 0.00 C ATOM 185 O TYR A 14 -12.798 2.734 -1.276 1.00 0.00 O ATOM 186 CB TYR A 14 -11.746 0.481 -3.458 1.00 0.00 C ATOM 187 CG TYR A 14 -11.394 1.761 -4.186 1.00 0.00 C ATOM 188 CD1 TYR A 14 -12.325 2.782 -4.326 1.00 0.00 C ATOM 189 CD2 TYR A 14 -10.129 1.947 -4.732 1.00 0.00 C ATOM 190 CE1 TYR A 14 -12.009 3.951 -4.991 1.00 0.00 C ATOM 191 CE2 TYR A 14 -9.805 3.114 -5.399 1.00 0.00 C ATOM 192 CZ TYR A 14 -10.748 4.114 -5.524 1.00 0.00 C ATOM 193 OH TYR A 14 -10.430 5.278 -6.186 1.00 0.00 O ATOM 0 H TYR A 14 -11.955 -1.456 -1.955 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.905 1.091 -1.570 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.002 -0.279 -3.697 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -12.704 0.116 -3.827 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -13.313 2.660 -3.908 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -9.388 1.168 -4.634 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -12.746 4.734 -5.093 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -8.819 3.242 -5.820 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.896 5.853 -5.599 1.00 0.00 H new ATOM 203 N ASN A 15 -14.209 1.002 -1.591 1.00 0.00 N ATOM 204 CA ASN A 15 -15.412 1.765 -1.268 1.00 0.00 C ATOM 205 C ASN A 15 -15.414 2.233 0.190 1.00 0.00 C ATOM 206 O ASN A 15 -15.926 3.309 0.499 1.00 0.00 O ATOM 207 CB ASN A 15 -16.662 0.928 -1.550 1.00 0.00 C ATOM 208 CG ASN A 15 -17.067 0.951 -3.015 1.00 0.00 C ATOM 209 OD1 ASN A 15 -16.885 1.952 -3.709 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.624 -0.157 -3.495 1.00 0.00 N ATOM 0 H ASN A 15 -14.384 0.026 -1.831 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.418 2.651 -1.903 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -16.481 -0.102 -1.244 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.488 1.300 -0.943 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.918 -0.199 -4.471 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -17.757 -0.965 -2.887 1.00 0.00 H new ATOM 217 N LEU A 16 -14.844 1.422 1.083 1.00 0.00 N ATOM 218 CA LEU A 16 -14.791 1.767 2.504 1.00 0.00 C ATOM 219 C LEU A 16 -13.818 2.918 2.756 1.00 0.00 C ATOM 220 O LEU A 16 -14.141 3.870 3.467 1.00 0.00 O ATOM 221 CB LEU A 16 -14.385 0.547 3.338 1.00 0.00 C ATOM 222 CG LEU A 16 -15.095 0.416 4.689 1.00 0.00 C ATOM 223 CD1 LEU A 16 -14.730 1.579 5.603 1.00 0.00 C ATOM 224 CD2 LEU A 16 -16.604 0.341 4.495 1.00 0.00 C ATOM 0 H LEU A 16 -14.415 0.527 0.849 1.00 0.00 H new ATOM 0 HA LEU A 16 -15.788 2.088 2.806 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -14.579 -0.353 2.755 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.310 0.588 3.513 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.763 -0.508 5.162 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -15.245 1.467 6.557 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -13.653 1.586 5.770 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -15.031 2.517 5.136 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -17.091 0.248 5.466 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -16.953 1.247 3.999 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -16.849 -0.526 3.881 1.00 0.00 H new ATOM 236 N VAL A 17 -12.625 2.823 2.169 1.00 0.00 N ATOM 237 CA VAL A 17 -11.600 3.853 2.331 1.00 0.00 C ATOM 238 C VAL A 17 -12.004 5.158 1.641 1.00 0.00 C ATOM 239 O VAL A 17 -11.751 6.245 2.161 1.00 0.00 O ATOM 240 CB VAL A 17 -10.235 3.384 1.778 1.00 0.00 C ATOM 241 CG1 VAL A 17 -9.132 4.371 2.140 1.00 0.00 C ATOM 242 CG2 VAL A 17 -9.895 1.993 2.296 1.00 0.00 C ATOM 0 H VAL A 17 -12.345 2.042 1.576 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.505 4.034 3.402 1.00 0.00 H new ATOM 0 HB VAL A 17 -10.309 3.340 0.691 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.182 4.018 1.739 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.364 5.348 1.716 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.060 4.454 3.224 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -8.931 1.681 1.895 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.846 2.012 3.385 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.664 1.289 1.979 1.00 0.00 H new ATOM 252 N ARG A 18 -12.630 5.044 0.467 1.00 0.00 N ATOM 253 CA ARG A 18 -13.063 6.220 -0.291 1.00 0.00 C ATOM 254 C ARG A 18 -14.190 6.975 0.423 1.00 0.00 C ATOM 255 O ARG A 18 -14.381 8.169 0.188 1.00 0.00 O ATOM 256 CB ARG A 18 -13.511 5.816 -1.701 1.00 0.00 C ATOM 257 CG ARG A 18 -14.876 5.143 -1.744 1.00 0.00 C ATOM 258 CD ARG A 18 -15.275 4.765 -3.163 1.00 0.00 C ATOM 259 NE ARG A 18 -15.762 5.915 -3.925 1.00 0.00 N ATOM 260 CZ ARG A 18 -16.562 5.822 -4.991 1.00 0.00 C ATOM 261 NH1 ARG A 18 -16.961 4.633 -5.434 1.00 0.00 N ATOM 262 NH2 ARG A 18 -16.962 6.923 -5.616 1.00 0.00 N ATOM 0 H ARG A 18 -12.848 4.152 0.022 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.207 6.891 -0.366 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -13.534 6.704 -2.333 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.770 5.140 -2.128 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -14.860 4.249 -1.120 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -15.625 5.813 -1.322 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -14.418 4.328 -3.676 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -16.050 3.999 -3.129 1.00 0.00 H new ATOM 0 HE ARG A 18 -15.473 6.846 -3.624 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -16.656 3.783 -4.959 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -17.572 4.571 -6.249 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.659 7.838 -5.282 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.573 6.854 -6.430 1.00 0.00 H new ATOM 276 N ASP A 19 -14.939 6.279 1.286 1.00 0.00 N ATOM 277 CA ASP A 19 -16.043 6.901 2.017 1.00 0.00 C ATOM 278 C ASP A 19 -15.528 7.798 3.142 1.00 0.00 C ATOM 279 O ASP A 19 -15.699 7.493 4.325 1.00 0.00 O ATOM 280 CB ASP A 19 -16.988 5.832 2.577 1.00 0.00 C ATOM 281 CG ASP A 19 -18.414 6.328 2.698 1.00 0.00 C ATOM 282 OD1 ASP A 19 -19.163 6.229 1.702 1.00 0.00 O ATOM 283 OD2 ASP A 19 -18.784 6.817 3.786 1.00 0.00 O ATOM 0 H ASP A 19 -14.800 5.290 1.493 1.00 0.00 H new ATOM 0 HA ASP A 19 -16.597 7.525 1.316 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.965 4.955 1.930 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -16.632 5.514 3.557 1.00 0.00 H new ATOM 288 N ASP A 20 -14.889 8.906 2.756 1.00 0.00 N ATOM 289 CA ASP A 20 -14.332 9.864 3.712 1.00 0.00 C ATOM 290 C ASP A 20 -13.400 9.182 4.720 1.00 0.00 C ATOM 291 O ASP A 20 -13.129 9.729 5.790 1.00 0.00 O ATOM 292 CB ASP A 20 -15.461 10.598 4.446 1.00 0.00 C ATOM 293 CG ASP A 20 -15.301 12.105 4.393 1.00 0.00 C ATOM 294 OD1 ASP A 20 -14.452 12.638 5.136 1.00 0.00 O ATOM 295 OD2 ASP A 20 -16.024 12.751 3.605 1.00 0.00 O ATOM 0 H ASP A 20 -14.744 9.162 1.779 1.00 0.00 H new ATOM 0 HA ASP A 20 -13.740 10.586 3.150 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -16.418 10.321 4.004 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -15.485 10.274 5.487 1.00 0.00 H new ATOM 300 N GLY A 21 -12.911 7.985 4.372 1.00 0.00 N ATOM 301 CA GLY A 21 -12.019 7.252 5.257 1.00 0.00 C ATOM 302 C GLY A 21 -12.590 7.088 6.654 1.00 0.00 C ATOM 303 O GLY A 21 -12.067 7.661 7.610 1.00 0.00 O ATOM 0 H GLY A 21 -13.120 7.514 3.492 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -11.819 6.268 4.832 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -11.064 7.773 5.318 1.00 0.00 H new ATOM 307 N SER A 22 -13.668 6.311 6.765 1.00 0.00 N ATOM 308 CA SER A 22 -14.321 6.076 8.053 1.00 0.00 C ATOM 309 C SER A 22 -13.400 5.320 9.014 1.00 0.00 C ATOM 310 O SER A 22 -13.463 4.092 9.112 1.00 0.00 O ATOM 311 CB SER A 22 -15.626 5.299 7.848 1.00 0.00 C ATOM 312 OG SER A 22 -16.556 5.583 8.879 1.00 0.00 O ATOM 0 H SER A 22 -14.108 5.834 5.978 1.00 0.00 H new ATOM 0 HA SER A 22 -14.548 7.045 8.498 1.00 0.00 H new ATOM 0 HB2 SER A 22 -16.059 5.558 6.882 1.00 0.00 H new ATOM 0 HB3 SER A 22 -15.417 4.229 7.827 1.00 0.00 H new ATOM 0 HG SER A 22 -17.381 5.076 8.724 1.00 0.00 H new ATOM 318 N ALA A 23 -12.543 6.064 9.718 1.00 0.00 N ATOM 319 CA ALA A 23 -11.599 5.478 10.673 1.00 0.00 C ATOM 320 C ALA A 23 -10.683 4.448 10.005 1.00 0.00 C ATOM 321 O ALA A 23 -10.196 3.523 10.660 1.00 0.00 O ATOM 322 CB ALA A 23 -12.351 4.845 11.840 1.00 0.00 C ATOM 0 H ALA A 23 -12.484 7.080 9.644 1.00 0.00 H new ATOM 0 HA ALA A 23 -10.968 6.282 11.051 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -11.637 4.414 12.542 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.943 5.607 12.347 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -13.011 4.062 11.466 1.00 0.00 H new ATOM 328 N VAL A 24 -10.449 4.616 8.702 1.00 0.00 N ATOM 329 CA VAL A 24 -9.595 3.704 7.948 1.00 0.00 C ATOM 330 C VAL A 24 -8.777 4.463 6.904 1.00 0.00 C ATOM 331 O VAL A 24 -9.337 5.075 5.990 1.00 0.00 O ATOM 332 CB VAL A 24 -10.426 2.608 7.243 1.00 0.00 C ATOM 333 CG1 VAL A 24 -9.531 1.668 6.450 1.00 0.00 C ATOM 334 CG2 VAL A 24 -11.256 1.828 8.253 1.00 0.00 C ATOM 0 H VAL A 24 -10.841 5.378 8.148 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.921 3.231 8.662 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.104 3.100 6.545 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -10.142 0.907 5.965 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -8.988 2.234 5.693 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -8.821 1.188 7.123 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -11.833 1.062 7.735 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -10.595 1.356 8.980 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -11.935 2.507 8.768 1.00 0.00 H new ATOM 344 N ILE A 25 -7.454 4.418 7.044 1.00 0.00 N ATOM 345 CA ILE A 25 -6.559 5.101 6.109 1.00 0.00 C ATOM 346 C ILE A 25 -5.824 4.106 5.211 1.00 0.00 C ATOM 347 O ILE A 25 -5.474 4.430 4.075 1.00 0.00 O ATOM 348 CB ILE A 25 -5.521 5.979 6.844 1.00 0.00 C ATOM 349 CG1 ILE A 25 -4.690 5.138 7.819 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.210 7.122 7.578 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.198 5.278 7.613 1.00 0.00 C ATOM 0 H ILE A 25 -6.977 3.917 7.794 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.190 5.742 5.494 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.847 6.403 6.100 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.937 5.429 8.840 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.967 4.090 7.710 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.463 7.729 8.089 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.752 7.740 6.862 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.909 6.716 8.309 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -2.671 4.656 8.336 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -2.939 4.959 6.603 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -2.908 6.320 7.751 1.00 0.00 H new ATOM 363 N TRP A 26 -5.588 2.896 5.724 1.00 0.00 N ATOM 364 CA TRP A 26 -4.890 1.861 4.967 1.00 0.00 C ATOM 365 C TRP A 26 -5.660 0.545 4.988 1.00 0.00 C ATOM 366 O TRP A 26 -6.487 0.308 5.871 1.00 0.00 O ATOM 367 CB TRP A 26 -3.481 1.645 5.541 1.00 0.00 C ATOM 368 CG TRP A 26 -3.475 1.040 6.918 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.294 1.699 8.098 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.659 -0.344 7.258 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.355 0.816 9.148 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.578 -0.441 8.660 1.00 0.00 C ATOM 373 CE3 TRP A 26 -3.884 -1.508 6.517 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.718 -1.652 9.333 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.024 -2.709 7.188 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.941 -2.771 8.582 1.00 0.00 C ATOM 0 H TRP A 26 -5.871 2.611 6.662 1.00 0.00 H new ATOM 0 HA TRP A 26 -4.814 2.197 3.933 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -2.919 0.998 4.867 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -2.960 2.602 5.572 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.127 2.762 8.193 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.251 1.059 10.133 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -3.947 -1.470 5.440 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.653 -1.705 10.410 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.200 -3.614 6.626 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.056 -3.724 9.076 1.00 0.00 H new ATOM 387 N VAL A 27 -5.360 -0.316 4.021 1.00 0.00 N ATOM 388 CA VAL A 27 -5.992 -1.626 3.924 1.00 0.00 C ATOM 389 C VAL A 27 -4.990 -2.648 3.402 1.00 0.00 C ATOM 390 O VAL A 27 -4.074 -2.302 2.652 1.00 0.00 O ATOM 391 CB VAL A 27 -7.252 -1.605 3.024 1.00 0.00 C ATOM 392 CG1 VAL A 27 -7.123 -0.562 1.922 1.00 0.00 C ATOM 393 CG2 VAL A 27 -7.546 -2.979 2.432 1.00 0.00 C ATOM 0 H VAL A 27 -4.677 -0.127 3.288 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.316 -1.908 4.926 1.00 0.00 H new ATOM 0 HB VAL A 27 -8.095 -1.330 3.658 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.022 -0.570 1.306 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -6.998 0.425 2.368 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -6.257 -0.793 1.302 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.437 -2.923 1.807 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.699 -3.304 1.828 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.712 -3.694 3.238 1.00 0.00 H new ATOM 403 N THR A 28 -5.160 -3.903 3.803 1.00 0.00 N ATOM 404 CA THR A 28 -4.247 -4.960 3.365 1.00 0.00 C ATOM 405 C THR A 28 -4.748 -5.620 2.088 1.00 0.00 C ATOM 406 O THR A 28 -5.919 -5.499 1.734 1.00 0.00 O ATOM 407 CB THR A 28 -4.055 -6.023 4.454 1.00 0.00 C ATOM 408 OG1 THR A 28 -4.396 -5.519 5.733 1.00 0.00 O ATOM 409 CG2 THR A 28 -2.634 -6.543 4.533 1.00 0.00 C ATOM 0 H THR A 28 -5.909 -4.214 4.422 1.00 0.00 H new ATOM 0 HA THR A 28 -3.284 -4.489 3.167 1.00 0.00 H new ATOM 0 HB THR A 28 -4.718 -6.841 4.170 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.615 -5.568 6.323 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.564 -7.292 5.322 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.358 -6.994 3.580 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.957 -5.718 4.754 1.00 0.00 H new ATOM 417 N PHE A 29 -3.852 -6.325 1.408 1.00 0.00 N ATOM 418 CA PHE A 29 -4.196 -7.021 0.175 1.00 0.00 C ATOM 419 C PHE A 29 -3.356 -8.286 0.036 1.00 0.00 C ATOM 420 O PHE A 29 -2.179 -8.230 -0.327 1.00 0.00 O ATOM 421 CB PHE A 29 -4.005 -6.102 -1.035 1.00 0.00 C ATOM 422 CG PHE A 29 -5.148 -5.147 -1.241 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.192 -3.937 -0.563 1.00 0.00 C ATOM 424 CD2 PHE A 29 -6.183 -5.461 -2.108 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.244 -3.061 -0.747 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.239 -4.589 -2.294 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.268 -3.387 -1.614 1.00 0.00 C ATOM 0 H PHE A 29 -2.878 -6.430 1.691 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.247 -7.307 0.215 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.083 -5.534 -0.909 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.884 -6.712 -1.930 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.394 -3.677 0.117 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.164 -6.398 -2.644 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.266 -2.122 -0.213 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.041 -4.847 -2.970 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.091 -2.703 -1.760 1.00 0.00 H new ATOM 437 N LYS A 30 -3.967 -9.425 0.347 1.00 0.00 N ATOM 438 CA LYS A 30 -3.285 -10.713 0.276 1.00 0.00 C ATOM 439 C LYS A 30 -4.142 -11.738 -0.461 1.00 0.00 C ATOM 440 O LYS A 30 -5.357 -11.573 -0.576 1.00 0.00 O ATOM 441 CB LYS A 30 -2.957 -11.213 1.686 1.00 0.00 C ATOM 442 CG LYS A 30 -4.187 -11.469 2.546 1.00 0.00 C ATOM 443 CD LYS A 30 -3.812 -11.754 3.991 1.00 0.00 C ATOM 444 CE LYS A 30 -4.621 -12.910 4.557 1.00 0.00 C ATOM 445 NZ LYS A 30 -4.283 -13.184 5.981 1.00 0.00 N ATOM 0 H LYS A 30 -4.939 -9.482 0.652 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.356 -10.581 -0.278 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.380 -12.134 1.610 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.323 -10.479 2.184 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.847 -10.602 2.505 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.745 -12.313 2.141 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.749 -11.987 4.053 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.979 -10.862 4.594 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -5.684 -12.683 4.474 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -4.439 -13.805 3.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -4.857 -13.979 6.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -3.274 -13.426 6.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -4.481 -12.339 6.554 1.00 0.00 H new ATOM 459 N TYR A 31 -3.508 -12.796 -0.960 1.00 0.00 N ATOM 460 CA TYR A 31 -4.226 -13.836 -1.684 1.00 0.00 C ATOM 461 C TYR A 31 -4.158 -15.175 -0.953 1.00 0.00 C ATOM 462 O TYR A 31 -3.083 -15.619 -0.543 1.00 0.00 O ATOM 463 CB TYR A 31 -3.676 -13.982 -3.110 1.00 0.00 C ATOM 464 CG TYR A 31 -2.219 -14.389 -3.170 1.00 0.00 C ATOM 465 CD1 TYR A 31 -1.849 -15.729 -3.153 1.00 0.00 C ATOM 466 CD2 TYR A 31 -1.213 -13.433 -3.240 1.00 0.00 C ATOM 467 CE1 TYR A 31 -0.521 -16.104 -3.202 1.00 0.00 C ATOM 468 CE2 TYR A 31 0.118 -13.800 -3.289 1.00 0.00 C ATOM 469 CZ TYR A 31 0.459 -15.136 -3.271 1.00 0.00 C ATOM 470 OH TYR A 31 1.787 -15.504 -3.314 1.00 0.00 O ATOM 0 H TYR A 31 -2.504 -12.954 -0.876 1.00 0.00 H new ATOM 0 HA TYR A 31 -5.272 -13.535 -1.739 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -4.272 -14.722 -3.644 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.800 -13.035 -3.635 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -2.614 -16.490 -3.101 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -1.476 -12.386 -3.256 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -0.251 -17.150 -3.186 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.888 -13.044 -3.341 1.00 0.00 H new ATOM 0 HH TYR A 31 1.871 -16.376 -3.753 1.00 0.00 H new ATOM 480 N ASP A 32 -5.316 -15.817 -0.806 1.00 0.00 N ATOM 481 CA ASP A 32 -5.402 -17.112 -0.142 1.00 0.00 C ATOM 482 C ASP A 32 -5.345 -18.230 -1.178 1.00 0.00 C ATOM 483 O ASP A 32 -6.324 -18.487 -1.880 1.00 0.00 O ATOM 484 CB ASP A 32 -6.691 -17.213 0.680 1.00 0.00 C ATOM 485 CG ASP A 32 -6.459 -17.822 2.049 1.00 0.00 C ATOM 486 OD1 ASP A 32 -5.783 -17.176 2.878 1.00 0.00 O ATOM 487 OD2 ASP A 32 -6.951 -18.942 2.294 1.00 0.00 O ATOM 0 H ASP A 32 -6.210 -15.457 -1.140 1.00 0.00 H new ATOM 0 HA ASP A 32 -4.556 -17.214 0.537 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.123 -16.219 0.796 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.419 -17.815 0.136 1.00 0.00 H new ATOM 492 N GLY A 33 -4.185 -18.872 -1.286 1.00 0.00 N ATOM 493 CA GLY A 33 -4.015 -19.937 -2.257 1.00 0.00 C ATOM 494 C GLY A 33 -3.808 -19.393 -3.656 1.00 0.00 C ATOM 495 O GLY A 33 -2.694 -19.424 -4.181 1.00 0.00 O ATOM 0 H GLY A 33 -3.361 -18.673 -0.719 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -3.160 -20.553 -1.976 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -4.892 -20.584 -2.244 1.00 0.00 H new ATOM 499 N SER A 34 -4.882 -18.880 -4.257 1.00 0.00 N ATOM 500 CA SER A 34 -4.812 -18.312 -5.602 1.00 0.00 C ATOM 501 C SER A 34 -5.928 -17.287 -5.837 1.00 0.00 C ATOM 502 O SER A 34 -6.424 -17.142 -6.955 1.00 0.00 O ATOM 503 CB SER A 34 -4.888 -19.426 -6.653 1.00 0.00 C ATOM 504 OG SER A 34 -3.593 -19.871 -7.021 1.00 0.00 O ATOM 0 H SER A 34 -5.809 -18.846 -3.834 1.00 0.00 H new ATOM 0 HA SER A 34 -3.857 -17.795 -5.696 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.465 -20.263 -6.259 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.415 -19.062 -7.535 1.00 0.00 H new ATOM 0 HG SER A 34 -3.002 -19.841 -6.240 1.00 0.00 H new ATOM 510 N THR A 35 -6.314 -16.573 -4.776 1.00 0.00 N ATOM 511 CA THR A 35 -7.366 -15.560 -4.873 1.00 0.00 C ATOM 512 C THR A 35 -7.015 -14.333 -4.031 1.00 0.00 C ATOM 513 O THR A 35 -6.884 -14.425 -2.809 1.00 0.00 O ATOM 514 CB THR A 35 -8.717 -16.141 -4.434 1.00 0.00 C ATOM 515 OG1 THR A 35 -9.654 -15.106 -4.180 1.00 0.00 O ATOM 516 CG2 THR A 35 -8.632 -16.994 -3.186 1.00 0.00 C ATOM 0 H THR A 35 -5.915 -16.678 -3.843 1.00 0.00 H new ATOM 0 HA THR A 35 -7.445 -15.251 -5.915 1.00 0.00 H new ATOM 0 HB THR A 35 -9.037 -16.771 -5.264 1.00 0.00 H new ATOM 0 HG1 THR A 35 -10.251 -15.009 -4.951 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.623 -17.371 -2.935 1.00 0.00 H new ATOM 0 HG22 THR A 35 -7.959 -17.833 -3.364 1.00 0.00 H new ATOM 0 HG23 THR A 35 -8.252 -16.393 -2.360 1.00 0.00 H new ATOM 524 N ILE A 36 -6.861 -13.188 -4.696 1.00 0.00 N ATOM 525 CA ILE A 36 -6.521 -11.939 -4.017 1.00 0.00 C ATOM 526 C ILE A 36 -7.740 -11.338 -3.321 1.00 0.00 C ATOM 527 O ILE A 36 -8.822 -11.250 -3.906 1.00 0.00 O ATOM 528 CB ILE A 36 -5.938 -10.900 -5.001 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.780 -11.506 -5.798 1.00 0.00 C ATOM 530 CG2 ILE A 36 -5.474 -9.657 -4.256 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.620 -10.913 -7.181 1.00 0.00 C ATOM 0 H ILE A 36 -6.967 -13.100 -5.707 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.765 -12.184 -3.271 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.725 -10.611 -5.698 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.854 -11.364 -5.242 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.936 -12.581 -5.889 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -5.067 -8.938 -4.967 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -6.319 -9.211 -3.732 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.703 -9.931 -3.535 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.781 -11.390 -7.687 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.531 -11.078 -7.755 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.432 -9.842 -7.098 1.00 0.00 H new ATOM 543 N VAL A 37 -7.555 -10.923 -2.068 1.00 0.00 N ATOM 544 CA VAL A 37 -8.634 -10.328 -1.284 1.00 0.00 C ATOM 545 C VAL A 37 -8.079 -9.338 -0.253 1.00 0.00 C ATOM 546 O VAL A 37 -7.066 -9.610 0.394 1.00 0.00 O ATOM 547 CB VAL A 37 -9.467 -11.419 -0.569 1.00 0.00 C ATOM 548 CG1 VAL A 37 -8.608 -12.214 0.407 1.00 0.00 C ATOM 549 CG2 VAL A 37 -10.669 -10.811 0.142 1.00 0.00 C ATOM 0 H VAL A 37 -6.665 -10.989 -1.574 1.00 0.00 H new ATOM 0 HA VAL A 37 -9.283 -9.789 -1.974 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.836 -12.106 -1.330 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -9.219 -12.973 0.895 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.794 -12.696 -0.134 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -8.195 -11.542 1.159 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -11.237 -11.600 0.636 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -10.326 -10.091 0.885 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -11.305 -10.307 -0.585 1.00 0.00 H new ATOM 559 N PRO A 38 -8.736 -8.168 -0.086 1.00 0.00 N ATOM 560 CA PRO A 38 -8.295 -7.142 0.871 1.00 0.00 C ATOM 561 C PRO A 38 -8.229 -7.666 2.308 1.00 0.00 C ATOM 562 O PRO A 38 -8.877 -8.660 2.645 1.00 0.00 O ATOM 563 CB PRO A 38 -9.357 -6.041 0.748 1.00 0.00 C ATOM 564 CG PRO A 38 -10.523 -6.692 0.083 1.00 0.00 C ATOM 565 CD PRO A 38 -9.950 -7.752 -0.811 1.00 0.00 C ATOM 0 HA PRO A 38 -7.284 -6.799 0.650 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.631 -5.648 1.727 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -8.987 -5.201 0.160 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.200 -7.126 0.819 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.100 -5.967 -0.491 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.643 -8.582 -0.950 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.716 -7.363 -1.802 1.00 0.00 H new ATOM 573 N GLY A 39 -7.438 -6.991 3.145 1.00 0.00 N ATOM 574 CA GLY A 39 -7.288 -7.388 4.524 1.00 0.00 C ATOM 575 C GLY A 39 -7.552 -6.251 5.490 1.00 0.00 C ATOM 576 O GLY A 39 -8.312 -5.332 5.186 1.00 0.00 O ATOM 0 H GLY A 39 -6.896 -6.168 2.880 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.973 -8.208 4.739 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.278 -7.766 4.681 1.00 0.00 H new ATOM 580 N GLU A 40 -6.912 -6.330 6.654 1.00 0.00 N ATOM 581 CA GLU A 40 -7.051 -5.338 7.723 1.00 0.00 C ATOM 582 C GLU A 40 -7.217 -3.920 7.186 1.00 0.00 C ATOM 583 O GLU A 40 -6.575 -3.531 6.212 1.00 0.00 O ATOM 584 CB GLU A 40 -5.846 -5.401 8.667 1.00 0.00 C ATOM 585 CG GLU A 40 -5.934 -6.514 9.701 1.00 0.00 C ATOM 586 CD GLU A 40 -5.888 -7.899 9.081 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.939 -8.176 8.315 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.804 -8.704 9.354 1.00 0.00 O ATOM 0 H GLU A 40 -6.275 -7.092 6.886 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.960 -5.587 8.271 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.940 -5.537 8.076 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.750 -4.445 9.183 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.112 -6.411 10.410 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.859 -6.405 10.267 1.00 0.00 H new ATOM 595 N GLN A 41 -8.085 -3.158 7.843 1.00 0.00 N ATOM 596 CA GLN A 41 -8.355 -1.773 7.459 1.00 0.00 C ATOM 597 C GLN A 41 -8.476 -0.887 8.699 1.00 0.00 C ATOM 598 O GLN A 41 -9.528 -0.841 9.339 1.00 0.00 O ATOM 599 CB GLN A 41 -9.638 -1.683 6.620 1.00 0.00 C ATOM 600 CG GLN A 41 -9.813 -2.827 5.632 1.00 0.00 C ATOM 601 CD GLN A 41 -11.125 -2.752 4.873 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.128 -2.255 5.388 1.00 0.00 O ATOM 603 NE2 GLN A 41 -11.127 -3.245 3.639 1.00 0.00 N ATOM 0 H GLN A 41 -8.619 -3.478 8.651 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.519 -1.419 6.855 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.497 -1.661 7.290 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.636 -0.741 6.072 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.986 -2.817 4.922 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.762 -3.775 6.168 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.275 -3.648 3.249 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.981 -3.220 3.081 1.00 0.00 H new ATOM 612 N GLY A 42 -7.389 -0.194 9.038 1.00 0.00 N ATOM 613 CA GLY A 42 -7.389 0.672 10.209 1.00 0.00 C ATOM 614 C GLY A 42 -6.704 2.004 9.969 1.00 0.00 C ATOM 615 O GLY A 42 -6.010 2.188 8.968 1.00 0.00 O ATOM 0 H GLY A 42 -6.509 -0.216 8.523 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.418 0.851 10.520 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.892 0.159 11.032 1.00 0.00 H new ATOM 619 N ALA A 43 -6.896 2.930 10.908 1.00 0.00 N ATOM 620 CA ALA A 43 -6.290 4.255 10.827 1.00 0.00 C ATOM 621 C ALA A 43 -4.872 4.245 11.403 1.00 0.00 C ATOM 622 O ALA A 43 -4.067 5.127 11.102 1.00 0.00 O ATOM 623 CB ALA A 43 -7.151 5.276 11.560 1.00 0.00 C ATOM 0 H ALA A 43 -7.471 2.784 11.738 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.228 4.536 9.776 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.687 6.260 11.491 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.141 5.310 11.106 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.242 4.990 12.608 1.00 0.00 H new ATOM 629 N GLU A 44 -4.575 3.236 12.228 1.00 0.00 N ATOM 630 CA GLU A 44 -3.258 3.106 12.840 1.00 0.00 C ATOM 631 C GLU A 44 -2.360 2.216 11.988 1.00 0.00 C ATOM 632 O GLU A 44 -2.554 1.000 11.935 1.00 0.00 O ATOM 633 CB GLU A 44 -3.384 2.519 14.250 1.00 0.00 C ATOM 634 CG GLU A 44 -3.893 3.510 15.283 1.00 0.00 C ATOM 635 CD GLU A 44 -2.853 4.547 15.656 1.00 0.00 C ATOM 636 OE1 GLU A 44 -1.820 4.165 16.247 1.00 0.00 O ATOM 637 OE2 GLU A 44 -3.070 5.738 15.356 1.00 0.00 O ATOM 0 H GLU A 44 -5.232 2.499 12.485 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.810 4.098 12.906 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -4.058 1.663 14.218 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -2.410 2.146 14.567 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.779 4.012 14.894 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.200 2.970 16.179 1.00 0.00 H new ATOM 644 N TYR A 45 -1.382 2.822 11.314 1.00 0.00 N ATOM 645 CA TYR A 45 -0.468 2.069 10.461 1.00 0.00 C ATOM 646 C TYR A 45 0.443 1.153 11.277 1.00 0.00 C ATOM 647 O TYR A 45 0.983 0.183 10.743 1.00 0.00 O ATOM 648 CB TYR A 45 0.379 3.008 9.607 1.00 0.00 C ATOM 649 CG TYR A 45 0.913 2.345 8.357 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.082 2.078 7.279 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.248 1.986 8.263 1.00 0.00 C ATOM 652 CE1 TYR A 45 0.568 1.475 6.136 1.00 0.00 C ATOM 653 CE2 TYR A 45 2.745 1.381 7.123 1.00 0.00 C ATOM 654 CZ TYR A 45 1.901 1.128 6.062 1.00 0.00 C ATOM 655 OH TYR A 45 2.393 0.529 4.924 1.00 0.00 O ATOM 0 H TYR A 45 -1.205 3.826 11.343 1.00 0.00 H new ATOM 0 HA TYR A 45 -1.081 1.448 9.808 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -0.220 3.874 9.325 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.214 3.378 10.202 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.963 2.346 7.335 1.00 0.00 H new ATOM 0 HD2 TYR A 45 2.911 2.182 9.093 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -0.092 1.276 5.304 1.00 0.00 H new ATOM 0 HE2 TYR A 45 3.788 1.108 7.064 1.00 0.00 H new ATOM 0 HH TYR A 45 2.337 -0.445 5.017 1.00 0.00 H new ATOM 665 N GLN A 46 0.610 1.457 12.569 1.00 0.00 N ATOM 666 CA GLN A 46 1.451 0.646 13.448 1.00 0.00 C ATOM 667 C GLN A 46 1.149 -0.841 13.261 1.00 0.00 C ATOM 668 O GLN A 46 2.059 -1.673 13.249 1.00 0.00 O ATOM 669 CB GLN A 46 1.230 1.040 14.912 1.00 0.00 C ATOM 670 CG GLN A 46 2.221 2.073 15.424 1.00 0.00 C ATOM 671 CD GLN A 46 3.347 1.453 16.233 1.00 0.00 C ATOM 672 OE1 GLN A 46 3.126 0.545 17.033 1.00 0.00 O ATOM 673 NE2 GLN A 46 4.565 1.946 16.031 1.00 0.00 N ATOM 0 H GLN A 46 0.174 2.258 13.026 1.00 0.00 H new ATOM 0 HA GLN A 46 2.493 0.829 13.184 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.219 1.432 15.025 1.00 0.00 H new ATOM 0 HB3 GLN A 46 1.296 0.147 15.533 1.00 0.00 H new ATOM 0 HG2 GLN A 46 2.643 2.616 14.578 1.00 0.00 H new ATOM 0 HG3 GLN A 46 1.694 2.802 16.040 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.705 2.699 15.358 1.00 0.00 H new ATOM 0 HE22 GLN A 46 5.359 1.571 16.549 1.00 0.00 H new ATOM 682 N HIS A 47 -0.137 -1.159 13.102 1.00 0.00 N ATOM 683 CA HIS A 47 -0.576 -2.536 12.903 1.00 0.00 C ATOM 684 C HIS A 47 0.045 -3.143 11.647 1.00 0.00 C ATOM 685 O HIS A 47 0.480 -4.295 11.663 1.00 0.00 O ATOM 686 CB HIS A 47 -2.100 -2.600 12.796 1.00 0.00 C ATOM 687 CG HIS A 47 -2.795 -2.814 14.105 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.169 -2.683 15.328 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.077 -3.154 14.375 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.037 -2.934 16.292 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.201 -3.222 15.741 1.00 0.00 N ATOM 0 H HIS A 47 -0.894 -0.476 13.108 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.246 -3.112 13.767 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.462 -1.673 12.352 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.372 -3.407 12.116 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.857 -3.338 13.651 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.829 -2.908 17.351 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.055 -3.457 16.248 1.00 0.00 H new ATOM 700 N PHE A 48 0.089 -2.367 10.560 1.00 0.00 N ATOM 701 CA PHE A 48 0.663 -2.853 9.312 1.00 0.00 C ATOM 702 C PHE A 48 2.171 -3.050 9.447 1.00 0.00 C ATOM 703 O PHE A 48 2.714 -4.049 8.980 1.00 0.00 O ATOM 704 CB PHE A 48 0.351 -1.896 8.158 1.00 0.00 C ATOM 705 CG PHE A 48 0.626 -2.501 6.810 1.00 0.00 C ATOM 706 CD1 PHE A 48 -0.320 -3.306 6.196 1.00 0.00 C ATOM 707 CD2 PHE A 48 1.834 -2.281 6.168 1.00 0.00 C ATOM 708 CE1 PHE A 48 -0.066 -3.879 4.965 1.00 0.00 C ATOM 709 CE2 PHE A 48 2.093 -2.855 4.938 1.00 0.00 C ATOM 710 CZ PHE A 48 1.141 -3.654 4.336 1.00 0.00 C ATOM 0 H PHE A 48 -0.263 -1.410 10.523 1.00 0.00 H new ATOM 0 HA PHE A 48 0.209 -3.819 9.089 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.696 -1.599 8.211 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.945 -0.990 8.273 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -1.266 -3.487 6.685 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.581 -1.655 6.634 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.812 -4.503 4.495 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.039 -2.679 4.448 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.341 -4.102 3.374 1.00 0.00 H new ATOM 720 N ILE A 49 2.836 -2.096 10.097 1.00 0.00 N ATOM 721 CA ILE A 49 4.283 -2.170 10.303 1.00 0.00 C ATOM 722 C ILE A 49 4.664 -3.409 11.122 1.00 0.00 C ATOM 723 O ILE A 49 5.714 -4.011 10.896 1.00 0.00 O ATOM 724 CB ILE A 49 4.819 -0.909 11.021 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.431 0.356 10.247 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.331 -0.987 11.186 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.569 1.626 11.058 1.00 0.00 C ATOM 0 H ILE A 49 2.397 -1.263 10.490 1.00 0.00 H new ATOM 0 HA ILE A 49 4.737 -2.237 9.314 1.00 0.00 H new ATOM 0 HB ILE A 49 4.367 -0.862 12.012 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.055 0.433 9.357 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.400 0.262 9.906 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.688 -0.091 11.693 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.588 -1.866 11.778 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.801 -1.061 10.205 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.278 2.481 10.448 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.924 1.570 11.935 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.605 1.744 11.376 1.00 0.00 H new ATOM 739 N GLN A 50 3.805 -3.778 12.074 1.00 0.00 N ATOM 740 CA GLN A 50 4.052 -4.936 12.932 1.00 0.00 C ATOM 741 C GLN A 50 3.642 -6.243 12.250 1.00 0.00 C ATOM 742 O GLN A 50 4.303 -7.269 12.418 1.00 0.00 O ATOM 743 CB GLN A 50 3.292 -4.778 14.253 1.00 0.00 C ATOM 744 CG GLN A 50 3.912 -5.541 15.415 1.00 0.00 C ATOM 745 CD GLN A 50 3.304 -5.154 16.750 1.00 0.00 C ATOM 746 OE1 GLN A 50 2.390 -5.815 17.242 1.00 0.00 O ATOM 747 NE2 GLN A 50 3.807 -4.076 17.344 1.00 0.00 N ATOM 0 H GLN A 50 2.931 -3.290 12.270 1.00 0.00 H new ATOM 0 HA GLN A 50 5.123 -4.983 13.128 1.00 0.00 H new ATOM 0 HB2 GLN A 50 3.245 -3.720 14.510 1.00 0.00 H new ATOM 0 HB3 GLN A 50 2.266 -5.118 14.114 1.00 0.00 H new ATOM 0 HG2 GLN A 50 3.780 -6.611 15.255 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.985 -5.352 15.439 1.00 0.00 H new ATOM 0 HE21 GLN A 50 4.565 -3.557 16.901 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.435 -3.768 18.243 1.00 0.00 H new ATOM 756 N GLN A 51 2.545 -6.207 11.492 1.00 0.00 N ATOM 757 CA GLN A 51 2.051 -7.398 10.801 1.00 0.00 C ATOM 758 C GLN A 51 2.906 -7.739 9.577 1.00 0.00 C ATOM 759 O GLN A 51 3.217 -8.909 9.345 1.00 0.00 O ATOM 760 CB GLN A 51 0.588 -7.206 10.386 1.00 0.00 C ATOM 761 CG GLN A 51 -0.406 -7.797 11.374 1.00 0.00 C ATOM 762 CD GLN A 51 -0.438 -7.048 12.695 1.00 0.00 C ATOM 763 OE1 GLN A 51 -1.276 -6.171 12.903 1.00 0.00 O ATOM 764 NE2 GLN A 51 0.479 -7.388 13.598 1.00 0.00 N ATOM 0 H GLN A 51 1.984 -5.369 11.342 1.00 0.00 H new ATOM 0 HA GLN A 51 2.119 -8.234 11.498 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.387 -6.140 10.274 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.433 -7.664 9.409 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.402 -7.786 10.931 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -0.151 -8.840 11.559 1.00 0.00 H new ATOM 0 HE21 GLN A 51 1.156 -8.121 13.386 1.00 0.00 H new ATOM 0 HE22 GLN A 51 0.504 -6.916 14.502 1.00 0.00 H new ATOM 773 N CYS A 52 3.285 -6.720 8.801 1.00 0.00 N ATOM 774 CA CYS A 52 4.103 -6.928 7.605 1.00 0.00 C ATOM 775 C CYS A 52 5.544 -7.276 7.979 1.00 0.00 C ATOM 776 O CYS A 52 6.418 -6.409 8.020 1.00 0.00 O ATOM 777 CB CYS A 52 4.073 -5.687 6.705 1.00 0.00 C ATOM 778 SG CYS A 52 3.383 -5.986 5.061 1.00 0.00 S ATOM 0 H CYS A 52 3.039 -5.746 8.979 1.00 0.00 H new ATOM 0 HA CYS A 52 3.680 -7.768 7.054 1.00 0.00 H new ATOM 0 HB2 CYS A 52 3.489 -4.909 7.196 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.088 -5.304 6.598 1.00 0.00 H new ATOM 0 HG CYS A 52 2.761 -4.920 4.651 1.00 0.00 H new ATOM 784 N THR A 53 5.777 -8.559 8.247 1.00 0.00 N ATOM 785 CA THR A 53 7.107 -9.046 8.614 1.00 0.00 C ATOM 786 C THR A 53 7.967 -9.250 7.367 1.00 0.00 C ATOM 787 O THR A 53 7.451 -9.289 6.249 1.00 0.00 O ATOM 788 CB THR A 53 7.003 -10.359 9.405 1.00 0.00 C ATOM 789 OG1 THR A 53 5.692 -10.898 9.337 1.00 0.00 O ATOM 790 CG2 THR A 53 7.365 -10.210 10.868 1.00 0.00 C ATOM 0 H THR A 53 5.060 -9.283 8.217 1.00 0.00 H new ATOM 0 HA THR A 53 7.581 -8.295 9.246 1.00 0.00 H new ATOM 0 HB THR A 53 7.723 -11.028 8.934 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.655 -11.734 9.848 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.270 -11.175 11.366 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.393 -9.857 10.954 1.00 0.00 H new ATOM 0 HG23 THR A 53 6.693 -9.491 11.338 1.00 0.00 H new ATOM 798 N ASP A 54 9.280 -9.380 7.560 1.00 0.00 N ATOM 799 CA ASP A 54 10.204 -9.575 6.441 1.00 0.00 C ATOM 800 C ASP A 54 10.357 -11.057 6.081 1.00 0.00 C ATOM 801 O ASP A 54 11.454 -11.517 5.752 1.00 0.00 O ATOM 802 CB ASP A 54 11.571 -8.959 6.771 1.00 0.00 C ATOM 803 CG ASP A 54 11.831 -7.692 5.980 1.00 0.00 C ATOM 804 OD1 ASP A 54 11.884 -7.772 4.734 1.00 0.00 O ATOM 805 OD2 ASP A 54 11.975 -6.620 6.604 1.00 0.00 O ATOM 0 H ASP A 54 9.727 -9.354 8.477 1.00 0.00 H new ATOM 0 HA ASP A 54 9.784 -9.070 5.571 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.620 -8.737 7.837 1.00 0.00 H new ATOM 0 HB3 ASP A 54 12.356 -9.685 6.560 1.00 0.00 H new ATOM 810 N ASP A 55 9.253 -11.805 6.144 1.00 0.00 N ATOM 811 CA ASP A 55 9.268 -13.220 5.830 1.00 0.00 C ATOM 812 C ASP A 55 8.031 -13.625 5.030 1.00 0.00 C ATOM 813 O ASP A 55 7.400 -14.644 5.313 1.00 0.00 O ATOM 814 CB ASP A 55 9.349 -14.027 7.118 1.00 0.00 C ATOM 815 CG ASP A 55 8.722 -13.322 8.309 1.00 0.00 C ATOM 816 OD1 ASP A 55 9.439 -12.560 8.992 1.00 0.00 O ATOM 817 OD2 ASP A 55 7.515 -13.533 8.555 1.00 0.00 O ATOM 0 H ASP A 55 8.337 -11.444 6.412 1.00 0.00 H new ATOM 0 HA ASP A 55 10.143 -13.427 5.214 1.00 0.00 H new ATOM 0 HB2 ASP A 55 8.853 -14.986 6.970 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.395 -14.240 7.340 1.00 0.00 H new ATOM 822 N VAL A 56 7.704 -12.814 4.026 1.00 0.00 N ATOM 823 CA VAL A 56 6.542 -13.051 3.153 1.00 0.00 C ATOM 824 C VAL A 56 6.269 -11.833 2.269 1.00 0.00 C ATOM 825 O VAL A 56 6.651 -10.712 2.610 1.00 0.00 O ATOM 826 CB VAL A 56 5.244 -13.361 3.949 1.00 0.00 C ATOM 827 CG1 VAL A 56 5.032 -14.864 4.084 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.258 -12.685 5.316 1.00 0.00 C ATOM 0 H VAL A 56 8.232 -11.974 3.790 1.00 0.00 H new ATOM 0 HA VAL A 56 6.800 -13.920 2.548 1.00 0.00 H new ATOM 0 HB VAL A 56 4.405 -12.952 3.387 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.117 -15.053 4.645 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.949 -15.310 3.093 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.878 -15.305 4.611 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.337 -12.921 5.848 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.111 -13.044 5.891 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.336 -11.605 5.187 1.00 0.00 H new ATOM 838 N ARG A 57 5.587 -12.052 1.145 1.00 0.00 N ATOM 839 CA ARG A 57 5.247 -10.962 0.227 1.00 0.00 C ATOM 840 C ARG A 57 3.778 -10.578 0.381 1.00 0.00 C ATOM 841 O ARG A 57 2.911 -11.447 0.458 1.00 0.00 O ATOM 842 CB ARG A 57 5.545 -11.342 -1.233 1.00 0.00 C ATOM 843 CG ARG A 57 5.391 -12.826 -1.553 1.00 0.00 C ATOM 844 CD ARG A 57 3.929 -13.230 -1.689 1.00 0.00 C ATOM 845 NE ARG A 57 3.544 -14.238 -0.701 1.00 0.00 N ATOM 846 CZ ARG A 57 2.323 -14.340 -0.168 1.00 0.00 C ATOM 847 NH1 ARG A 57 1.355 -13.497 -0.520 1.00 0.00 N ATOM 848 NH2 ARG A 57 2.067 -15.292 0.722 1.00 0.00 N ATOM 0 H ARG A 57 5.259 -12.971 0.848 1.00 0.00 H new ATOM 0 HA ARG A 57 5.869 -10.105 0.484 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.881 -10.774 -1.884 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.564 -11.037 -1.472 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.918 -13.054 -2.479 1.00 0.00 H new ATOM 0 HG3 ARG A 57 5.859 -13.417 -0.766 1.00 0.00 H new ATOM 0 HD2 ARG A 57 3.297 -12.349 -1.573 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.752 -13.619 -2.692 1.00 0.00 H new ATOM 0 HE ARG A 57 4.253 -14.906 -0.400 1.00 0.00 H new ATOM 0 HH11 ARG A 57 1.541 -12.763 -1.204 1.00 0.00 H new ATOM 0 HH12 ARG A 57 0.427 -13.585 -0.106 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.802 -15.944 0.997 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.136 -15.372 1.130 1.00 0.00 H new ATOM 862 N LEU A 58 3.501 -9.274 0.440 1.00 0.00 N ATOM 863 CA LEU A 58 2.127 -8.794 0.604 1.00 0.00 C ATOM 864 C LEU A 58 1.896 -7.463 -0.115 1.00 0.00 C ATOM 865 O LEU A 58 2.838 -6.820 -0.580 1.00 0.00 O ATOM 866 CB LEU A 58 1.800 -8.632 2.092 1.00 0.00 C ATOM 867 CG LEU A 58 1.891 -9.915 2.926 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.901 -9.590 4.412 1.00 0.00 C ATOM 869 CD2 LEU A 58 0.740 -10.853 2.590 1.00 0.00 C ATOM 0 H LEU A 58 4.203 -8.537 0.377 1.00 0.00 H new ATOM 0 HA LEU A 58 1.468 -9.538 0.157 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.478 -7.893 2.518 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.791 -8.229 2.184 1.00 0.00 H new ATOM 0 HG LEU A 58 2.827 -10.418 2.681 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.966 -10.514 4.986 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.760 -8.959 4.641 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.984 -9.063 4.675 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.821 -11.758 3.192 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.207 -10.358 2.805 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.781 -11.115 1.533 1.00 0.00 H new ATOM 881 N PHE A 59 0.627 -7.056 -0.184 1.00 0.00 N ATOM 882 CA PHE A 59 0.243 -5.799 -0.825 1.00 0.00 C ATOM 883 C PHE A 59 -0.445 -4.882 0.186 1.00 0.00 C ATOM 884 O PHE A 59 -0.925 -5.344 1.224 1.00 0.00 O ATOM 885 CB PHE A 59 -0.695 -6.056 -2.007 1.00 0.00 C ATOM 886 CG PHE A 59 -0.088 -6.886 -3.102 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.130 -8.242 -2.922 1.00 0.00 C ATOM 888 CD2 PHE A 59 0.257 -6.310 -4.315 1.00 0.00 C ATOM 889 CE1 PHE A 59 0.682 -9.008 -3.929 1.00 0.00 C ATOM 890 CE2 PHE A 59 0.808 -7.072 -5.326 1.00 0.00 C ATOM 891 CZ PHE A 59 1.021 -8.422 -5.132 1.00 0.00 C ATOM 0 H PHE A 59 -0.157 -7.584 0.200 1.00 0.00 H new ATOM 0 HA PHE A 59 1.147 -5.316 -1.195 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.593 -6.555 -1.643 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.009 -5.099 -2.423 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -0.135 -8.705 -1.983 1.00 0.00 H new ATOM 0 HD2 PHE A 59 0.093 -5.254 -4.471 1.00 0.00 H new ATOM 0 HE1 PHE A 59 0.848 -10.064 -3.776 1.00 0.00 H new ATOM 0 HE2 PHE A 59 1.072 -6.613 -6.267 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.453 -9.020 -5.921 1.00 0.00 H new ATOM 901 N ALA A 60 -0.491 -3.586 -0.117 1.00 0.00 N ATOM 902 CA ALA A 60 -1.122 -2.619 0.778 1.00 0.00 C ATOM 903 C ALA A 60 -1.585 -1.376 0.026 1.00 0.00 C ATOM 904 O ALA A 60 -1.028 -1.022 -1.016 1.00 0.00 O ATOM 905 CB ALA A 60 -0.163 -2.230 1.893 1.00 0.00 C ATOM 0 H ALA A 60 -0.102 -3.184 -0.970 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.003 -3.094 1.211 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.645 -1.509 2.553 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.111 -3.117 2.464 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.734 -1.784 1.463 1.00 0.00 H new ATOM 911 N PHE A 61 -2.605 -0.718 0.569 1.00 0.00 N ATOM 912 CA PHE A 61 -3.153 0.491 -0.034 1.00 0.00 C ATOM 913 C PHE A 61 -3.485 1.523 1.040 1.00 0.00 C ATOM 914 O PHE A 61 -4.258 1.245 1.958 1.00 0.00 O ATOM 915 CB PHE A 61 -4.403 0.155 -0.846 1.00 0.00 C ATOM 916 CG PHE A 61 -4.584 1.034 -2.047 1.00 0.00 C ATOM 917 CD1 PHE A 61 -3.937 0.743 -3.239 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.398 2.153 -1.984 1.00 0.00 C ATOM 919 CE1 PHE A 61 -4.100 1.552 -4.347 1.00 0.00 C ATOM 920 CE2 PHE A 61 -5.566 2.967 -3.089 1.00 0.00 C ATOM 921 CZ PHE A 61 -4.916 2.666 -4.272 1.00 0.00 C ATOM 0 H PHE A 61 -3.070 -1.004 1.430 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.402 0.915 -0.701 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.349 -0.884 -1.170 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.279 0.244 -0.204 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.299 -0.126 -3.302 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -5.907 2.392 -1.062 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.591 1.315 -5.270 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.204 3.836 -3.028 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.046 3.300 -5.136 1.00 0.00 H new ATOM 931 N VAL A 62 -2.894 2.712 0.926 1.00 0.00 N ATOM 932 CA VAL A 62 -3.127 3.779 1.897 1.00 0.00 C ATOM 933 C VAL A 62 -3.476 5.098 1.211 1.00 0.00 C ATOM 934 O VAL A 62 -2.922 5.432 0.162 1.00 0.00 O ATOM 935 CB VAL A 62 -1.898 3.999 2.805 1.00 0.00 C ATOM 936 CG1 VAL A 62 -2.255 4.895 3.984 1.00 0.00 C ATOM 937 CG2 VAL A 62 -1.336 2.669 3.294 1.00 0.00 C ATOM 0 H VAL A 62 -2.252 2.960 0.173 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.971 3.458 2.507 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.128 4.496 2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.376 5.038 4.612 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.599 5.862 3.615 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.047 4.428 4.570 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.471 2.852 3.932 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.100 2.138 3.862 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.035 2.065 2.438 1.00 0.00 H new ATOM 947 N ARG A 63 -4.396 5.844 1.822 1.00 0.00 N ATOM 948 CA ARG A 63 -4.822 7.134 1.290 1.00 0.00 C ATOM 949 C ARG A 63 -4.162 8.279 2.056 1.00 0.00 C ATOM 950 O ARG A 63 -4.363 8.426 3.263 1.00 0.00 O ATOM 951 CB ARG A 63 -6.348 7.261 1.370 1.00 0.00 C ATOM 952 CG ARG A 63 -6.908 8.420 0.562 1.00 0.00 C ATOM 953 CD ARG A 63 -7.611 7.933 -0.694 1.00 0.00 C ATOM 954 NE ARG A 63 -8.123 9.040 -1.501 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.270 9.679 -1.257 1.00 0.00 C ATOM 956 NH1 ARG A 63 -10.026 9.338 -0.218 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.660 10.667 -2.057 1.00 0.00 N ATOM 0 H ARG A 63 -4.861 5.574 2.689 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.514 7.193 0.246 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.800 6.333 1.019 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.639 7.383 2.413 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -7.608 8.988 1.175 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.100 9.099 0.288 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.918 7.340 -1.291 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.435 7.276 -0.416 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.568 9.343 -2.302 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.732 8.583 0.401 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -10.900 9.832 -0.040 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -9.084 10.935 -2.855 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.536 11.157 -1.873 1.00 0.00 H new ATOM 971 N PHE A 64 -3.373 9.086 1.347 1.00 0.00 N ATOM 972 CA PHE A 64 -2.685 10.219 1.959 1.00 0.00 C ATOM 973 C PHE A 64 -3.397 11.528 1.638 1.00 0.00 C ATOM 974 O PHE A 64 -4.235 11.582 0.739 1.00 0.00 O ATOM 975 CB PHE A 64 -1.233 10.285 1.474 1.00 0.00 C ATOM 976 CG PHE A 64 -0.339 9.260 2.111 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.296 7.964 1.628 1.00 0.00 C ATOM 978 CD2 PHE A 64 0.459 9.595 3.194 1.00 0.00 C ATOM 979 CE1 PHE A 64 0.524 7.018 2.211 1.00 0.00 C ATOM 980 CE2 PHE A 64 1.283 8.653 3.782 1.00 0.00 C ATOM 981 CZ PHE A 64 1.315 7.364 3.290 1.00 0.00 C ATOM 0 H PHE A 64 -3.195 8.975 0.349 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.696 10.075 3.039 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.213 10.150 0.393 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.835 11.279 1.678 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.912 7.689 0.784 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.437 10.602 3.583 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.547 6.010 1.824 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.901 8.926 4.625 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.958 6.626 3.748 1.00 0.00 H new ATOM 991 N THR A 65 -3.058 12.583 2.375 1.00 0.00 N ATOM 992 CA THR A 65 -3.663 13.896 2.164 1.00 0.00 C ATOM 993 C THR A 65 -2.666 15.005 2.488 1.00 0.00 C ATOM 994 O THR A 65 -2.287 15.190 3.647 1.00 0.00 O ATOM 995 CB THR A 65 -4.925 14.050 3.023 1.00 0.00 C ATOM 996 OG1 THR A 65 -5.868 13.034 2.724 1.00 0.00 O ATOM 997 CG2 THR A 65 -5.616 15.384 2.840 1.00 0.00 C ATOM 0 H THR A 65 -2.367 12.554 3.125 1.00 0.00 H new ATOM 0 HA THR A 65 -3.944 13.978 1.114 1.00 0.00 H new ATOM 0 HB THR A 65 -4.579 13.975 4.054 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.664 13.151 3.284 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.500 15.426 3.476 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.933 16.188 3.114 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.913 15.500 1.798 1.00 0.00 H new ATOM 1005 N THR A 66 -2.239 15.736 1.460 1.00 0.00 N ATOM 1006 CA THR A 66 -1.279 16.823 1.639 1.00 0.00 C ATOM 1007 C THR A 66 -1.980 18.178 1.675 1.00 0.00 C ATOM 1008 O THR A 66 -2.603 18.593 0.695 1.00 0.00 O ATOM 1009 CB THR A 66 -0.228 16.801 0.524 1.00 0.00 C ATOM 1010 OG1 THR A 66 -0.842 16.840 -0.755 1.00 0.00 O ATOM 1011 CG2 THR A 66 0.666 15.580 0.569 1.00 0.00 C ATOM 0 H THR A 66 -2.542 15.596 0.496 1.00 0.00 H new ATOM 0 HA THR A 66 -0.780 16.673 2.596 1.00 0.00 H new ATOM 0 HB THR A 66 0.384 17.687 0.691 1.00 0.00 H new ATOM 0 HG1 THR A 66 -1.629 17.424 -0.723 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.387 15.627 -0.247 1.00 0.00 H new ATOM 0 HG22 THR A 66 1.196 15.552 1.521 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.059 14.681 0.466 1.00 0.00 H new ATOM 1019 N GLY A 67 -1.872 18.862 2.813 1.00 0.00 N ATOM 1020 CA GLY A 67 -2.495 20.166 2.965 1.00 0.00 C ATOM 1021 C GLY A 67 -1.886 20.975 4.093 1.00 0.00 C ATOM 1022 O GLY A 67 -1.284 20.415 5.011 1.00 0.00 O ATOM 0 H GLY A 67 -1.363 18.535 3.634 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.399 20.721 2.032 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.561 20.036 3.151 1.00 0.00 H new ATOM 1026 N ASP A 68 -2.043 22.297 4.027 1.00 0.00 N ATOM 1027 CA ASP A 68 -1.501 23.183 5.053 1.00 0.00 C ATOM 1028 C ASP A 68 -2.608 24.007 5.714 1.00 0.00 C ATOM 1029 O ASP A 68 -2.786 25.187 5.406 1.00 0.00 O ATOM 1030 CB ASP A 68 -0.434 24.110 4.454 1.00 0.00 C ATOM 1031 CG ASP A 68 -0.561 24.275 2.949 1.00 0.00 C ATOM 1032 OD1 ASP A 68 -1.539 24.912 2.502 1.00 0.00 O ATOM 1033 OD2 ASP A 68 0.315 23.765 2.220 1.00 0.00 O ATOM 0 H ASP A 68 -2.540 22.775 3.276 1.00 0.00 H new ATOM 0 HA ASP A 68 -1.038 22.562 5.820 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -0.505 25.089 4.928 1.00 0.00 H new ATOM 0 HB3 ASP A 68 0.554 23.714 4.687 1.00 0.00 H new ATOM 1038 N ALA A 69 -3.329 23.369 6.642 1.00 0.00 N ATOM 1039 CA ALA A 69 -4.420 24.006 7.391 1.00 0.00 C ATOM 1040 C ALA A 69 -5.149 25.079 6.585 1.00 0.00 C ATOM 1041 O ALA A 69 -5.359 26.199 7.059 1.00 0.00 O ATOM 1042 CB ALA A 69 -3.886 24.597 8.678 1.00 0.00 C ATOM 0 H ALA A 69 -3.173 22.394 6.896 1.00 0.00 H new ATOM 0 HA ALA A 69 -5.150 23.227 7.612 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -4.701 25.068 9.228 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.447 23.807 9.286 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.125 25.343 8.448 1.00 0.00 H new ATOM 1048 N MET A 70 -5.540 24.721 5.372 1.00 0.00 N ATOM 1049 CA MET A 70 -6.256 25.632 4.484 1.00 0.00 C ATOM 1050 C MET A 70 -6.647 24.950 3.173 1.00 0.00 C ATOM 1051 O MET A 70 -7.719 25.214 2.624 1.00 0.00 O ATOM 1052 CB MET A 70 -5.411 26.874 4.196 1.00 0.00 C ATOM 1053 CG MET A 70 -4.279 26.648 3.203 1.00 0.00 C ATOM 1054 SD MET A 70 -3.006 27.920 3.303 1.00 0.00 S ATOM 1055 CE MET A 70 -3.869 29.317 2.589 1.00 0.00 C ATOM 0 H MET A 70 -5.373 23.797 4.974 1.00 0.00 H new ATOM 0 HA MET A 70 -7.172 25.932 4.993 1.00 0.00 H new ATOM 0 HB2 MET A 70 -6.062 27.661 3.814 1.00 0.00 H new ATOM 0 HB3 MET A 70 -4.989 27.237 5.133 1.00 0.00 H new ATOM 0 HG2 MET A 70 -3.828 25.673 3.387 1.00 0.00 H new ATOM 0 HG3 MET A 70 -4.686 26.625 2.192 1.00 0.00 H new ATOM 0 HE1 MET A 70 -3.211 30.186 2.580 1.00 0.00 H new ATOM 0 HE2 MET A 70 -4.167 29.078 1.568 1.00 0.00 H new ATOM 0 HE3 MET A 70 -4.755 29.539 3.183 1.00 0.00 H new ATOM 1065 N SER A 71 -5.772 24.077 2.674 1.00 0.00 N ATOM 1066 CA SER A 71 -6.024 23.365 1.425 1.00 0.00 C ATOM 1067 C SER A 71 -5.386 21.978 1.450 1.00 0.00 C ATOM 1068 O SER A 71 -4.225 21.809 1.073 1.00 0.00 O ATOM 1069 CB SER A 71 -5.492 24.172 0.235 1.00 0.00 C ATOM 1070 OG SER A 71 -4.256 24.797 0.546 1.00 0.00 O ATOM 0 H SER A 71 -4.883 23.847 3.117 1.00 0.00 H new ATOM 0 HA SER A 71 -7.102 23.243 1.315 1.00 0.00 H new ATOM 0 HB2 SER A 71 -5.363 23.514 -0.624 1.00 0.00 H new ATOM 0 HB3 SER A 71 -6.223 24.929 -0.050 1.00 0.00 H new ATOM 0 HG SER A 71 -3.940 25.303 -0.232 1.00 0.00 H new ATOM 1076 N LYS A 72 -6.156 20.990 1.900 1.00 0.00 N ATOM 1077 CA LYS A 72 -5.675 19.615 1.978 1.00 0.00 C ATOM 1078 C LYS A 72 -6.411 18.727 0.975 1.00 0.00 C ATOM 1079 O LYS A 72 -7.639 18.632 1.004 1.00 0.00 O ATOM 1080 CB LYS A 72 -5.844 19.068 3.400 1.00 0.00 C ATOM 1081 CG LYS A 72 -7.277 19.111 3.913 1.00 0.00 C ATOM 1082 CD LYS A 72 -7.907 17.728 3.930 1.00 0.00 C ATOM 1083 CE LYS A 72 -7.595 16.988 5.222 1.00 0.00 C ATOM 1084 NZ LYS A 72 -8.187 15.621 5.242 1.00 0.00 N ATOM 0 H LYS A 72 -7.117 21.118 2.216 1.00 0.00 H new ATOM 0 HA LYS A 72 -4.614 19.610 1.727 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.490 18.037 3.426 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -5.209 19.640 4.076 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -7.291 19.530 4.919 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.870 19.774 3.283 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -8.987 17.818 3.813 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -7.541 17.150 3.081 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -6.514 16.916 5.346 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -7.976 17.560 6.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -8.833 15.534 6.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -8.714 15.458 4.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.428 14.915 5.327 1.00 0.00 H new ATOM 1098 N ARG A 73 -5.654 18.086 0.087 1.00 0.00 N ATOM 1099 CA ARG A 73 -6.234 17.214 -0.928 1.00 0.00 C ATOM 1100 C ARG A 73 -5.810 15.764 -0.710 1.00 0.00 C ATOM 1101 O ARG A 73 -4.640 15.485 -0.443 1.00 0.00 O ATOM 1102 CB ARG A 73 -5.824 17.672 -2.330 1.00 0.00 C ATOM 1103 CG ARG A 73 -4.456 18.335 -2.395 1.00 0.00 C ATOM 1104 CD ARG A 73 -3.929 18.383 -3.820 1.00 0.00 C ATOM 1105 NE ARG A 73 -2.709 17.590 -3.980 1.00 0.00 N ATOM 1106 CZ ARG A 73 -1.483 18.037 -3.699 1.00 0.00 C ATOM 1107 NH1 ARG A 73 -1.302 19.270 -3.235 1.00 0.00 N ATOM 1108 NH2 ARG A 73 -0.433 17.244 -3.879 1.00 0.00 N ATOM 0 H ARG A 73 -4.637 18.155 0.051 1.00 0.00 H new ATOM 0 HA ARG A 73 -7.319 17.275 -0.839 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -5.830 16.810 -2.998 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -6.572 18.371 -2.705 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -4.521 19.347 -1.996 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.755 17.788 -1.765 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -4.694 18.013 -4.502 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -3.728 19.418 -4.098 1.00 0.00 H new ATOM 0 HE ARG A 73 -2.802 16.636 -4.328 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -2.104 19.883 -3.091 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.361 19.602 -3.023 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -0.564 16.296 -4.231 1.00 0.00 H new ATOM 0 HH22 ARG A 73 0.505 17.583 -3.665 1.00 0.00 H new ATOM 1122 N SER A 74 -6.770 14.849 -0.828 1.00 0.00 N ATOM 1123 CA SER A 74 -6.502 13.425 -0.644 1.00 0.00 C ATOM 1124 C SER A 74 -5.885 12.811 -1.899 1.00 0.00 C ATOM 1125 O SER A 74 -6.156 13.252 -3.018 1.00 0.00 O ATOM 1126 CB SER A 74 -7.790 12.680 -0.283 1.00 0.00 C ATOM 1127 OG SER A 74 -7.537 11.633 0.639 1.00 0.00 O ATOM 0 H SER A 74 -7.741 15.069 -1.050 1.00 0.00 H new ATOM 0 HA SER A 74 -5.789 13.326 0.174 1.00 0.00 H new ATOM 0 HB2 SER A 74 -8.509 13.378 0.145 1.00 0.00 H new ATOM 0 HB3 SER A 74 -8.242 12.271 -1.187 1.00 0.00 H new ATOM 0 HG SER A 74 -6.990 11.973 1.378 1.00 0.00 H new ATOM 1133 N LYS A 75 -5.059 11.788 -1.698 1.00 0.00 N ATOM 1134 CA LYS A 75 -4.396 11.096 -2.799 1.00 0.00 C ATOM 1135 C LYS A 75 -4.277 9.601 -2.501 1.00 0.00 C ATOM 1136 O LYS A 75 -4.412 9.175 -1.353 1.00 0.00 O ATOM 1137 CB LYS A 75 -3.007 11.694 -3.043 1.00 0.00 C ATOM 1138 CG LYS A 75 -3.042 13.055 -3.723 1.00 0.00 C ATOM 1139 CD LYS A 75 -2.353 13.024 -5.079 1.00 0.00 C ATOM 1140 CE LYS A 75 -2.948 14.051 -6.030 1.00 0.00 C ATOM 1141 NZ LYS A 75 -3.060 13.526 -7.419 1.00 0.00 N ATOM 0 H LYS A 75 -4.832 11.418 -0.775 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.999 11.225 -3.698 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.488 11.787 -2.089 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.426 11.005 -3.657 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.077 13.373 -3.848 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.557 13.793 -3.085 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.288 13.218 -4.952 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -2.446 12.028 -5.513 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -3.935 14.346 -5.673 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -2.328 14.947 -6.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.470 14.257 -8.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.116 13.268 -7.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.673 12.686 -7.424 1.00 0.00 H new ATOM 1155 N PHE A 76 -4.026 8.812 -3.543 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.893 7.363 -3.395 1.00 0.00 C ATOM 1157 C PHE A 76 -2.432 6.937 -3.521 1.00 0.00 C ATOM 1158 O PHE A 76 -1.633 7.617 -4.168 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.741 6.636 -4.445 1.00 0.00 C ATOM 1160 CG PHE A 76 -6.111 7.228 -4.635 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.320 8.246 -5.553 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -7.188 6.768 -3.894 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -7.576 8.793 -5.728 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -8.447 7.312 -4.065 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.641 8.326 -4.984 1.00 0.00 C ATOM 0 H PHE A 76 -3.911 9.150 -4.498 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.251 7.091 -2.402 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.213 6.651 -5.399 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.844 5.590 -4.155 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.491 8.615 -6.138 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -7.042 5.976 -3.175 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -7.725 9.586 -6.446 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -9.278 6.945 -3.481 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.624 8.752 -5.120 1.00 0.00 H new ATOM 1175 N ALA A 77 -2.088 5.808 -2.901 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.721 5.297 -2.948 1.00 0.00 C ATOM 1177 C ALA A 77 -0.678 3.786 -2.742 1.00 0.00 C ATOM 1178 O ALA A 77 -1.199 3.269 -1.751 1.00 0.00 O ATOM 1179 CB ALA A 77 0.137 5.996 -1.905 1.00 0.00 C ATOM 0 H ALA A 77 -2.736 5.233 -2.363 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.321 5.507 -3.940 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.154 5.606 -1.950 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.150 7.068 -2.103 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.277 5.816 -0.913 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.044 3.087 -3.682 1.00 0.00 N ATOM 1186 CA LEU A 78 0.087 1.635 -3.608 1.00 0.00 C ATOM 1187 C LEU A 78 1.394 1.255 -2.921 1.00 0.00 C ATOM 1188 O LEU A 78 2.467 1.728 -3.305 1.00 0.00 O ATOM 1189 CB LEU A 78 0.034 1.022 -5.010 1.00 0.00 C ATOM 1190 CG LEU A 78 -0.107 -0.501 -5.047 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -1.046 -0.925 -6.165 1.00 0.00 C ATOM 1192 CD2 LEU A 78 1.254 -1.159 -5.215 1.00 0.00 C ATOM 0 H LEU A 78 0.388 3.505 -4.506 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.745 1.243 -3.023 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.804 1.462 -5.551 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.941 1.301 -5.546 1.00 0.00 H new ATOM 0 HG LEU A 78 -0.533 -0.829 -4.099 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.133 -2.011 -6.175 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.029 -0.484 -6.001 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -0.650 -0.584 -7.122 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.134 -2.242 -5.239 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.708 -0.823 -6.147 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.897 -0.884 -4.379 1.00 0.00 H new ATOM 1204 N ILE A 79 1.300 0.410 -1.896 1.00 0.00 N ATOM 1205 CA ILE A 79 2.478 -0.019 -1.150 1.00 0.00 C ATOM 1206 C ILE A 79 2.635 -1.537 -1.172 1.00 0.00 C ATOM 1207 O ILE A 79 1.884 -2.262 -0.515 1.00 0.00 O ATOM 1208 CB ILE A 79 2.420 0.462 0.318 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.065 1.951 0.380 1.00 0.00 C ATOM 1210 CG2 ILE A 79 3.748 0.201 1.016 1.00 0.00 C ATOM 1211 CD1 ILE A 79 1.861 2.466 1.788 1.00 0.00 C ATOM 0 H ILE A 79 0.422 0.010 -1.565 1.00 0.00 H new ATOM 0 HA ILE A 79 3.339 0.433 -1.642 1.00 0.00 H new ATOM 0 HB ILE A 79 1.642 -0.100 0.835 1.00 0.00 H new ATOM 0 HG12 ILE A 79 2.859 2.526 -0.097 1.00 0.00 H new ATOM 0 HG13 ILE A 79 1.156 2.124 -0.197 1.00 0.00 H new ATOM 0 HG21 ILE A 79 3.690 0.545 2.049 1.00 0.00 H new ATOM 0 HG22 ILE A 79 3.963 -0.868 1.001 1.00 0.00 H new ATOM 0 HG23 ILE A 79 4.543 0.738 0.498 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.613 3.527 1.755 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.047 1.917 2.262 1.00 0.00 H new ATOM 0 HD13 ILE A 79 2.776 2.325 2.363 1.00 0.00 H new ATOM 1223 N THR A 80 3.628 -2.010 -1.922 1.00 0.00 N ATOM 1224 CA THR A 80 3.905 -3.441 -2.022 1.00 0.00 C ATOM 1225 C THR A 80 5.026 -3.824 -1.061 1.00 0.00 C ATOM 1226 O THR A 80 6.061 -3.159 -1.013 1.00 0.00 O ATOM 1227 CB THR A 80 4.298 -3.815 -3.456 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.426 -3.209 -4.395 1.00 0.00 O ATOM 1229 CG2 THR A 80 4.282 -5.307 -3.713 1.00 0.00 C ATOM 0 H THR A 80 4.255 -1.422 -2.470 1.00 0.00 H new ATOM 0 HA THR A 80 3.001 -3.988 -1.755 1.00 0.00 H new ATOM 0 HB THR A 80 5.319 -3.452 -3.575 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.853 -2.410 -4.770 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.570 -5.501 -4.746 1.00 0.00 H new ATOM 0 HG22 THR A 80 4.986 -5.799 -3.042 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.279 -5.696 -3.536 1.00 0.00 H new ATOM 1237 N TRP A 81 4.817 -4.890 -0.293 1.00 0.00 N ATOM 1238 CA TRP A 81 5.821 -5.344 0.667 1.00 0.00 C ATOM 1239 C TRP A 81 6.379 -6.711 0.281 1.00 0.00 C ATOM 1240 O TRP A 81 5.646 -7.584 -0.186 1.00 0.00 O ATOM 1241 CB TRP A 81 5.227 -5.401 2.077 1.00 0.00 C ATOM 1242 CG TRP A 81 6.187 -5.934 3.098 1.00 0.00 C ATOM 1243 CD1 TRP A 81 6.142 -7.154 3.705 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.342 -5.268 3.618 1.00 0.00 C ATOM 1245 NE1 TRP A 81 7.195 -7.285 4.576 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.947 -6.141 4.540 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.923 -4.015 3.394 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 9.104 -5.802 5.236 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 9.071 -3.681 4.086 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.651 -4.572 4.996 1.00 0.00 C ATOM 0 H TRP A 81 3.967 -5.453 -0.316 1.00 0.00 H new ATOM 0 HA TRP A 81 6.640 -4.625 0.654 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.910 -4.401 2.372 1.00 0.00 H new ATOM 0 HB3 TRP A 81 4.335 -6.027 2.064 1.00 0.00 H new ATOM 0 HD1 TRP A 81 5.388 -7.907 3.527 1.00 0.00 H new ATOM 0 HE1 TRP A 81 7.386 -8.102 5.156 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.482 -3.322 2.693 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.554 -6.486 5.940 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.528 -2.716 3.922 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.550 -4.282 5.520 1.00 0.00 H new ATOM 1261 N ILE A 82 7.682 -6.889 0.492 1.00 0.00 N ATOM 1262 CA ILE A 82 8.347 -8.150 0.180 1.00 0.00 C ATOM 1263 C ILE A 82 9.317 -8.543 1.293 1.00 0.00 C ATOM 1264 O ILE A 82 10.406 -7.976 1.412 1.00 0.00 O ATOM 1265 CB ILE A 82 9.115 -8.079 -1.162 1.00 0.00 C ATOM 1266 CG1 ILE A 82 8.209 -7.546 -2.278 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.663 -9.452 -1.533 1.00 0.00 C ATOM 1268 CD1 ILE A 82 8.915 -7.388 -3.610 1.00 0.00 C ATOM 0 H ILE A 82 8.298 -6.174 0.878 1.00 0.00 H new ATOM 0 HA ILE A 82 7.566 -8.905 0.093 1.00 0.00 H new ATOM 0 HB ILE A 82 9.951 -7.390 -1.042 1.00 0.00 H new ATOM 0 HG12 ILE A 82 7.364 -8.223 -2.402 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.803 -6.581 -1.975 1.00 0.00 H new ATOM 0 HG21 ILE A 82 10.200 -9.386 -2.479 1.00 0.00 H new ATOM 0 HG22 ILE A 82 10.342 -9.796 -0.753 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.839 -10.158 -1.633 1.00 0.00 H new ATOM 0 HD11 ILE A 82 8.212 -7.007 -4.351 1.00 0.00 H new ATOM 0 HD12 ILE A 82 9.744 -6.688 -3.502 1.00 0.00 H new ATOM 0 HD13 ILE A 82 9.297 -8.355 -3.936 1.00 0.00 H new ATOM 1280 N GLY A 83 8.909 -9.516 2.107 1.00 0.00 N ATOM 1281 CA GLY A 83 9.747 -9.975 3.205 1.00 0.00 C ATOM 1282 C GLY A 83 10.793 -10.982 2.753 1.00 0.00 C ATOM 1283 O GLY A 83 10.456 -12.007 2.154 1.00 0.00 O ATOM 0 H GLY A 83 8.012 -9.995 2.026 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.244 -9.119 3.662 1.00 0.00 H new ATOM 0 HA3 GLY A 83 9.120 -10.427 3.973 1.00 0.00 H new ATOM 1287 N GLU A 84 12.062 -10.667 3.038 1.00 0.00 N ATOM 1288 CA GLU A 84 13.212 -11.505 2.664 1.00 0.00 C ATOM 1289 C GLU A 84 12.888 -12.989 2.543 1.00 0.00 C ATOM 1290 O GLU A 84 13.226 -13.612 1.535 1.00 0.00 O ATOM 1291 CB GLU A 84 14.334 -11.364 3.678 1.00 0.00 C ATOM 1292 CG GLU A 84 15.321 -10.253 3.360 1.00 0.00 C ATOM 1293 CD GLU A 84 14.759 -8.876 3.654 1.00 0.00 C ATOM 1294 OE1 GLU A 84 14.872 -8.425 4.815 1.00 0.00 O ATOM 1295 OE2 GLU A 84 14.205 -8.251 2.726 1.00 0.00 O ATOM 0 H GLU A 84 12.324 -9.818 3.538 1.00 0.00 H new ATOM 0 HA GLU A 84 13.510 -11.141 1.681 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.900 -11.180 4.661 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.874 -12.309 3.740 1.00 0.00 H new ATOM 0 HG2 GLU A 84 16.231 -10.402 3.941 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.602 -10.311 2.308 1.00 0.00 H new ATOM 1302 N ASN A 85 12.258 -13.564 3.572 1.00 0.00 N ATOM 1303 CA ASN A 85 11.923 -14.986 3.572 1.00 0.00 C ATOM 1304 C ASN A 85 10.798 -15.292 2.594 1.00 0.00 C ATOM 1305 O ASN A 85 9.825 -15.977 2.923 1.00 0.00 O ATOM 1306 CB ASN A 85 11.561 -15.456 4.979 1.00 0.00 C ATOM 1307 CG ASN A 85 12.697 -15.238 5.954 1.00 0.00 C ATOM 1308 OD1 ASN A 85 13.459 -16.156 6.251 1.00 0.00 O ATOM 1309 ND2 ASN A 85 12.815 -14.018 6.461 1.00 0.00 N ATOM 0 H ASN A 85 11.971 -13.065 4.414 1.00 0.00 H new ATOM 0 HA ASN A 85 12.805 -15.535 3.243 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.677 -14.920 5.325 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.302 -16.515 4.953 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.561 -13.812 7.126 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.160 -13.286 6.186 1.00 0.00 H new ATOM 1316 N VAL A 86 10.959 -14.789 1.383 1.00 0.00 N ATOM 1317 CA VAL A 86 9.989 -15.005 0.315 1.00 0.00 C ATOM 1318 C VAL A 86 10.592 -15.882 -0.783 1.00 0.00 C ATOM 1319 O VAL A 86 11.556 -15.490 -1.446 1.00 0.00 O ATOM 1320 CB VAL A 86 9.493 -13.672 -0.294 1.00 0.00 C ATOM 1321 CG1 VAL A 86 10.649 -12.854 -0.854 1.00 0.00 C ATOM 1322 CG2 VAL A 86 8.453 -13.933 -1.371 1.00 0.00 C ATOM 0 H VAL A 86 11.761 -14.221 1.109 1.00 0.00 H new ATOM 0 HA VAL A 86 9.131 -15.512 0.756 1.00 0.00 H new ATOM 0 HB VAL A 86 9.031 -13.092 0.505 1.00 0.00 H new ATOM 0 HG11 VAL A 86 10.267 -11.924 -1.274 1.00 0.00 H new ATOM 0 HG12 VAL A 86 11.355 -12.628 -0.055 1.00 0.00 H new ATOM 0 HG13 VAL A 86 11.154 -13.424 -1.634 1.00 0.00 H new ATOM 0 HG21 VAL A 86 8.115 -12.984 -1.788 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.893 -14.541 -2.162 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.604 -14.461 -0.937 1.00 0.00 H new ATOM 1332 N SER A 87 10.027 -17.073 -0.965 1.00 0.00 N ATOM 1333 CA SER A 87 10.518 -18.007 -1.976 1.00 0.00 C ATOM 1334 C SER A 87 10.262 -17.475 -3.385 1.00 0.00 C ATOM 1335 O SER A 87 9.412 -16.605 -3.585 1.00 0.00 O ATOM 1336 CB SER A 87 9.859 -19.379 -1.807 1.00 0.00 C ATOM 1337 OG SER A 87 10.813 -20.420 -1.928 1.00 0.00 O ATOM 0 H SER A 87 9.230 -17.414 -0.427 1.00 0.00 H new ATOM 0 HA SER A 87 11.594 -18.112 -1.838 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.375 -19.436 -0.832 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.079 -19.507 -2.558 1.00 0.00 H new ATOM 0 HG SER A 87 10.368 -21.286 -1.815 1.00 0.00 H new ATOM 1343 N GLY A 88 11.006 -18.007 -4.358 1.00 0.00 N ATOM 1344 CA GLY A 88 10.852 -17.580 -5.741 1.00 0.00 C ATOM 1345 C GLY A 88 9.413 -17.655 -6.221 1.00 0.00 C ATOM 1346 O GLY A 88 8.922 -16.727 -6.864 1.00 0.00 O ATOM 0 H GLY A 88 11.713 -18.727 -4.211 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.212 -16.556 -5.843 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.477 -18.203 -6.381 1.00 0.00 H new ATOM 1350 N LEU A 89 8.737 -18.759 -5.900 1.00 0.00 N ATOM 1351 CA LEU A 89 7.342 -18.951 -6.293 1.00 0.00 C ATOM 1352 C LEU A 89 6.464 -17.828 -5.743 1.00 0.00 C ATOM 1353 O LEU A 89 5.629 -17.273 -6.458 1.00 0.00 O ATOM 1354 CB LEU A 89 6.829 -20.306 -5.797 1.00 0.00 C ATOM 1355 CG LEU A 89 5.724 -20.935 -6.649 1.00 0.00 C ATOM 1356 CD1 LEU A 89 6.324 -21.813 -7.738 1.00 0.00 C ATOM 1357 CD2 LEU A 89 4.772 -21.741 -5.778 1.00 0.00 C ATOM 0 H LEU A 89 9.134 -19.534 -5.369 1.00 0.00 H new ATOM 0 HA LEU A 89 7.291 -18.930 -7.382 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.669 -20.999 -5.750 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.457 -20.186 -4.779 1.00 0.00 H new ATOM 0 HG LEU A 89 5.159 -20.134 -7.126 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.524 -22.252 -8.334 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.965 -21.209 -8.380 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.914 -22.608 -7.281 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.993 -22.181 -6.401 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.324 -22.534 -5.273 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.316 -21.087 -5.035 1.00 0.00 H new ATOM 1369 N GLN A 90 6.668 -17.498 -4.466 1.00 0.00 N ATOM 1370 CA GLN A 90 5.906 -16.436 -3.810 1.00 0.00 C ATOM 1371 C GLN A 90 6.256 -15.075 -4.405 1.00 0.00 C ATOM 1372 O GLN A 90 5.371 -14.262 -4.677 1.00 0.00 O ATOM 1373 CB GLN A 90 6.186 -16.437 -2.304 1.00 0.00 C ATOM 1374 CG GLN A 90 5.287 -17.375 -1.516 1.00 0.00 C ATOM 1375 CD GLN A 90 5.369 -18.812 -2.000 1.00 0.00 C ATOM 1376 OE1 GLN A 90 6.308 -19.536 -1.668 1.00 0.00 O ATOM 1377 NE2 GLN A 90 4.389 -19.231 -2.794 1.00 0.00 N ATOM 0 H GLN A 90 7.356 -17.952 -3.866 1.00 0.00 H new ATOM 0 HA GLN A 90 4.845 -16.624 -3.975 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.226 -16.719 -2.137 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.065 -15.424 -1.920 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.562 -17.335 -0.462 1.00 0.00 H new ATOM 0 HG3 GLN A 90 4.256 -17.030 -1.589 1.00 0.00 H new ATOM 0 HE21 GLN A 90 3.630 -18.598 -3.044 1.00 0.00 H new ATOM 0 HE22 GLN A 90 4.396 -20.186 -3.153 1.00 0.00 H new ATOM 1386 N ARG A 91 7.554 -14.839 -4.611 1.00 0.00 N ATOM 1387 CA ARG A 91 8.031 -13.581 -5.181 1.00 0.00 C ATOM 1388 C ARG A 91 7.422 -13.351 -6.564 1.00 0.00 C ATOM 1389 O ARG A 91 6.938 -12.258 -6.863 1.00 0.00 O ATOM 1390 CB ARG A 91 9.561 -13.583 -5.271 1.00 0.00 C ATOM 1391 CG ARG A 91 10.186 -12.208 -5.085 1.00 0.00 C ATOM 1392 CD ARG A 91 10.475 -11.538 -6.420 1.00 0.00 C ATOM 1393 NE ARG A 91 11.761 -11.956 -6.978 1.00 0.00 N ATOM 1394 CZ ARG A 91 12.402 -11.301 -7.949 1.00 0.00 C ATOM 1395 NH1 ARG A 91 11.878 -10.201 -8.481 1.00 0.00 N ATOM 1396 NH2 ARG A 91 13.572 -11.750 -8.389 1.00 0.00 N ATOM 0 H ARG A 91 8.294 -15.506 -4.390 1.00 0.00 H new ATOM 0 HA ARG A 91 7.719 -12.768 -4.526 1.00 0.00 H new ATOM 0 HB2 ARG A 91 9.960 -14.259 -4.515 1.00 0.00 H new ATOM 0 HB3 ARG A 91 9.859 -13.979 -6.242 1.00 0.00 H new ATOM 0 HG2 ARG A 91 9.515 -11.579 -4.500 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.111 -12.302 -4.517 1.00 0.00 H new ATOM 0 HD2 ARG A 91 9.679 -11.778 -7.125 1.00 0.00 H new ATOM 0 HD3 ARG A 91 10.471 -10.456 -6.290 1.00 0.00 H new ATOM 0 HE ARG A 91 12.195 -12.799 -6.602 1.00 0.00 H new ATOM 0 HH11 ARG A 91 10.980 -9.851 -8.148 1.00 0.00 H new ATOM 0 HH12 ARG A 91 12.374 -9.707 -9.222 1.00 0.00 H new ATOM 0 HH21 ARG A 91 13.979 -12.594 -7.985 1.00 0.00 H new ATOM 0 HH22 ARG A 91 14.063 -11.251 -9.131 1.00 0.00 H new ATOM 1410 N ALA A 92 7.438 -14.393 -7.399 1.00 0.00 N ATOM 1411 CA ALA A 92 6.875 -14.312 -8.746 1.00 0.00 C ATOM 1412 C ALA A 92 5.386 -13.971 -8.696 1.00 0.00 C ATOM 1413 O ALA A 92 4.892 -13.180 -9.505 1.00 0.00 O ATOM 1414 CB ALA A 92 7.095 -15.620 -9.491 1.00 0.00 C ATOM 0 H ALA A 92 7.835 -15.303 -7.164 1.00 0.00 H new ATOM 0 HA ALA A 92 7.388 -13.513 -9.282 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.670 -15.544 -10.492 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.164 -15.822 -9.564 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.609 -16.432 -8.951 1.00 0.00 H new ATOM 1420 N LYS A 93 4.679 -14.568 -7.733 1.00 0.00 N ATOM 1421 CA LYS A 93 3.248 -14.327 -7.566 1.00 0.00 C ATOM 1422 C LYS A 93 2.969 -12.840 -7.373 1.00 0.00 C ATOM 1423 O LYS A 93 2.045 -12.295 -7.975 1.00 0.00 O ATOM 1424 CB LYS A 93 2.703 -15.117 -6.375 1.00 0.00 C ATOM 1425 CG LYS A 93 1.407 -15.852 -6.676 1.00 0.00 C ATOM 1426 CD LYS A 93 1.649 -17.074 -7.545 1.00 0.00 C ATOM 1427 CE LYS A 93 0.342 -17.686 -8.023 1.00 0.00 C ATOM 1428 NZ LYS A 93 0.369 -17.991 -9.480 1.00 0.00 N ATOM 0 H LYS A 93 5.077 -15.221 -7.058 1.00 0.00 H new ATOM 0 HA LYS A 93 2.744 -14.663 -8.472 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.454 -15.838 -6.054 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.539 -14.435 -5.541 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.935 -16.156 -5.742 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.714 -15.178 -7.179 1.00 0.00 H new ATOM 0 HD2 LYS A 93 2.257 -16.795 -8.405 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.215 -17.816 -6.982 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.145 -18.601 -7.465 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.478 -17.000 -7.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.593 -18.213 -9.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.730 -17.166 -10.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.990 -18.807 -9.652 1.00 0.00 H new ATOM 1442 N THR A 94 3.783 -12.189 -6.538 1.00 0.00 N ATOM 1443 CA THR A 94 3.633 -10.760 -6.272 1.00 0.00 C ATOM 1444 C THR A 94 3.538 -9.975 -7.580 1.00 0.00 C ATOM 1445 O THR A 94 2.742 -9.044 -7.695 1.00 0.00 O ATOM 1446 CB THR A 94 4.809 -10.247 -5.431 1.00 0.00 C ATOM 1447 OG1 THR A 94 5.065 -11.119 -4.343 1.00 0.00 O ATOM 1448 CG2 THR A 94 4.588 -8.860 -4.865 1.00 0.00 C ATOM 0 H THR A 94 4.553 -12.631 -6.035 1.00 0.00 H new ATOM 0 HA THR A 94 2.710 -10.611 -5.712 1.00 0.00 H new ATOM 0 HB THR A 94 5.655 -10.208 -6.117 1.00 0.00 H new ATOM 0 HG1 THR A 94 5.910 -10.869 -3.915 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.459 -8.562 -4.282 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.439 -8.153 -5.681 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.707 -8.865 -4.224 1.00 0.00 H new ATOM 1456 N GLY A 95 4.345 -10.369 -8.566 1.00 0.00 N ATOM 1457 CA GLY A 95 4.328 -9.702 -9.856 1.00 0.00 C ATOM 1458 C GLY A 95 3.015 -9.890 -10.599 1.00 0.00 C ATOM 1459 O GLY A 95 2.451 -8.922 -11.113 1.00 0.00 O ATOM 0 H GLY A 95 5.010 -11.139 -8.492 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.509 -8.637 -9.712 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.145 -10.084 -10.468 1.00 0.00 H new ATOM 1463 N THR A 96 2.520 -11.129 -10.654 1.00 0.00 N ATOM 1464 CA THR A 96 1.258 -11.413 -11.342 1.00 0.00 C ATOM 1465 C THR A 96 0.079 -10.768 -10.617 1.00 0.00 C ATOM 1466 O THR A 96 -0.790 -10.161 -11.247 1.00 0.00 O ATOM 1467 CB THR A 96 1.018 -12.923 -11.453 1.00 0.00 C ATOM 1468 OG1 THR A 96 1.549 -13.609 -10.332 1.00 0.00 O ATOM 1469 CG2 THR A 96 1.621 -13.541 -12.694 1.00 0.00 C ATOM 0 H THR A 96 2.968 -11.944 -10.235 1.00 0.00 H new ATOM 0 HA THR A 96 1.335 -10.989 -12.343 1.00 0.00 H new ATOM 0 HB THR A 96 -0.066 -13.031 -11.502 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.511 -13.027 -9.544 1.00 0.00 H new ATOM 0 HG21 THR A 96 1.412 -14.611 -12.706 1.00 0.00 H new ATOM 0 HG22 THR A 96 1.187 -13.076 -13.579 1.00 0.00 H new ATOM 0 HG23 THR A 96 2.699 -13.382 -12.692 1.00 0.00 H new ATOM 1477 N ASP A 97 0.056 -10.903 -9.290 1.00 0.00 N ATOM 1478 CA ASP A 97 -1.017 -10.335 -8.482 1.00 0.00 C ATOM 1479 C ASP A 97 -1.046 -8.814 -8.608 1.00 0.00 C ATOM 1480 O ASP A 97 -2.118 -8.208 -8.628 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.861 -10.745 -7.013 1.00 0.00 C ATOM 1482 CG ASP A 97 -1.030 -12.240 -6.802 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -2.070 -12.788 -7.227 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -0.121 -12.863 -6.213 1.00 0.00 O ATOM 0 H ASP A 97 0.768 -11.400 -8.756 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.963 -10.728 -8.854 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.123 -10.441 -6.657 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.596 -10.211 -6.411 1.00 0.00 H new ATOM 1489 N LYS A 98 0.139 -8.206 -8.710 1.00 0.00 N ATOM 1490 CA LYS A 98 0.252 -6.755 -8.854 1.00 0.00 C ATOM 1491 C LYS A 98 -0.503 -6.273 -10.091 1.00 0.00 C ATOM 1492 O LYS A 98 -1.081 -5.187 -10.091 1.00 0.00 O ATOM 1493 CB LYS A 98 1.724 -6.341 -8.948 1.00 0.00 C ATOM 1494 CG LYS A 98 2.019 -4.979 -8.339 1.00 0.00 C ATOM 1495 CD LYS A 98 3.161 -5.052 -7.333 1.00 0.00 C ATOM 1496 CE LYS A 98 4.137 -3.898 -7.509 1.00 0.00 C ATOM 1497 NZ LYS A 98 5.310 -4.283 -8.342 1.00 0.00 N ATOM 0 H LYS A 98 1.033 -8.697 -8.695 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.192 -6.292 -7.973 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.336 -7.092 -8.448 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.023 -6.332 -9.996 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.274 -4.273 -9.130 1.00 0.00 H new ATOM 0 HG3 LYS A 98 1.124 -4.597 -7.848 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.757 -5.036 -6.321 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.690 -5.998 -7.450 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.623 -3.056 -7.973 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.481 -3.562 -6.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.950 -3.469 -8.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.816 -5.070 -7.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.984 -4.580 -9.284 1.00 0.00 H new ATOM 1511 N THR A 99 -0.500 -7.098 -11.140 1.00 0.00 N ATOM 1512 CA THR A 99 -1.189 -6.768 -12.385 1.00 0.00 C ATOM 1513 C THR A 99 -2.705 -6.835 -12.198 1.00 0.00 C ATOM 1514 O THR A 99 -3.436 -5.960 -12.666 1.00 0.00 O ATOM 1515 CB THR A 99 -0.754 -7.726 -13.500 1.00 0.00 C ATOM 1516 OG1 THR A 99 0.659 -7.781 -13.591 1.00 0.00 O ATOM 1517 CG2 THR A 99 -1.287 -7.349 -14.868 1.00 0.00 C ATOM 0 H THR A 99 -0.026 -8.001 -11.150 1.00 0.00 H new ATOM 0 HA THR A 99 -0.920 -5.750 -12.666 1.00 0.00 H new ATOM 0 HB THR A 99 -1.173 -8.693 -13.223 1.00 0.00 H new ATOM 0 HG1 THR A 99 0.917 -8.399 -14.307 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.938 -8.071 -15.606 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.377 -7.349 -14.847 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.930 -6.355 -15.136 1.00 0.00 H new ATOM 1525 N LEU A 100 -3.166 -7.879 -11.506 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.590 -8.072 -11.245 1.00 0.00 C ATOM 1527 C LEU A 100 -5.173 -6.891 -10.465 1.00 0.00 C ATOM 1528 O LEU A 100 -6.194 -6.317 -10.860 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.801 -9.375 -10.472 1.00 0.00 C ATOM 1530 CG LEU A 100 -4.568 -10.655 -11.283 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -4.634 -11.881 -10.387 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -5.584 -10.765 -12.410 1.00 0.00 C ATOM 0 H LEU A 100 -2.568 -8.607 -11.115 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.111 -8.131 -12.200 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.132 -9.382 -9.611 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.820 -9.389 -10.084 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.570 -10.604 -11.719 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -4.466 -12.777 -10.984 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.867 -11.810 -9.616 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.616 -11.936 -9.918 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.403 -11.680 -12.975 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.590 -10.790 -11.992 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.488 -9.905 -13.072 1.00 0.00 H new ATOM 1544 N VAL A 101 -4.516 -6.526 -9.362 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.963 -5.407 -8.530 1.00 0.00 C ATOM 1546 C VAL A 101 -4.842 -4.081 -9.285 1.00 0.00 C ATOM 1547 O VAL A 101 -5.637 -3.162 -9.076 1.00 0.00 O ATOM 1548 CB VAL A 101 -4.159 -5.320 -7.212 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -4.755 -4.273 -6.280 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -4.105 -6.675 -6.522 1.00 0.00 C ATOM 0 H VAL A 101 -3.672 -6.989 -9.024 1.00 0.00 H new ATOM 0 HA VAL A 101 -6.010 -5.590 -8.288 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.141 -5.018 -7.460 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.172 -4.231 -5.360 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.735 -3.298 -6.767 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.785 -4.540 -6.045 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.534 -6.590 -5.597 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -5.118 -7.008 -6.294 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.624 -7.399 -7.180 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.849 -3.990 -10.170 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.631 -2.784 -10.964 1.00 0.00 C ATOM 1562 C LYS A 102 -4.753 -2.586 -11.984 1.00 0.00 C ATOM 1563 O LYS A 102 -5.109 -1.453 -12.311 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.285 -2.858 -11.689 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.150 -2.170 -10.947 1.00 0.00 C ATOM 1566 CD LYS A 102 -1.143 -0.671 -11.205 1.00 0.00 C ATOM 1567 CE LYS A 102 -1.358 0.120 -9.922 1.00 0.00 C ATOM 1568 NZ LYS A 102 -2.793 0.150 -9.516 1.00 0.00 N ATOM 0 H LYS A 102 -3.182 -4.740 -10.354 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.627 -1.933 -10.282 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.023 -3.905 -11.844 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.389 -2.406 -12.675 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.248 -2.356 -9.877 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.198 -2.598 -11.259 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.193 -0.383 -11.656 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -1.925 -0.421 -11.922 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.764 -0.320 -9.121 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -0.999 1.140 -10.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -3.016 1.075 -9.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -3.393 -0.006 -10.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -2.972 -0.599 -8.817 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.302 -3.695 -12.483 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.381 -3.645 -13.467 1.00 0.00 C ATOM 1584 C GLU A 103 -7.669 -3.110 -12.843 1.00 0.00 C ATOM 1585 O GLU A 103 -8.313 -2.221 -13.400 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.620 -5.035 -14.064 1.00 0.00 C ATOM 1587 CG GLU A 103 -7.215 -5.005 -15.463 1.00 0.00 C ATOM 1588 CD GLU A 103 -6.197 -5.329 -16.542 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -5.108 -4.714 -16.539 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -6.490 -6.195 -17.393 1.00 0.00 O ATOM 0 H GLU A 103 -5.016 -4.638 -12.221 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.081 -2.964 -14.264 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.674 -5.576 -14.092 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.287 -5.593 -13.407 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -8.037 -5.719 -15.519 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -7.637 -4.018 -15.652 1.00 0.00 H new ATOM 1597 N VAL A 104 -8.042 -3.660 -11.686 1.00 0.00 N ATOM 1598 CA VAL A 104 -9.253 -3.238 -10.991 1.00 0.00 C ATOM 1599 C VAL A 104 -9.108 -1.840 -10.380 1.00 0.00 C ATOM 1600 O VAL A 104 -10.096 -1.118 -10.236 1.00 0.00 O ATOM 1601 CB VAL A 104 -9.645 -4.240 -9.885 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -10.225 -5.508 -10.493 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -8.457 -4.565 -8.988 1.00 0.00 C ATOM 0 H VAL A 104 -7.521 -4.398 -11.213 1.00 0.00 H new ATOM 0 HA VAL A 104 -10.042 -3.207 -11.743 1.00 0.00 H new ATOM 0 HB VAL A 104 -10.411 -3.773 -9.265 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -10.495 -6.202 -9.697 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -11.113 -5.259 -11.075 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -9.483 -5.972 -11.143 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.765 -5.273 -8.219 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -7.658 -5.004 -9.586 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.097 -3.651 -8.516 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.878 -1.459 -10.023 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.623 -0.145 -9.433 1.00 0.00 C ATOM 1615 C VAL A 105 -7.052 0.819 -10.472 1.00 0.00 C ATOM 1616 O VAL A 105 -5.867 0.757 -10.806 1.00 0.00 O ATOM 1617 CB VAL A 105 -6.655 -0.236 -8.231 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -6.441 1.135 -7.602 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -7.174 -1.227 -7.198 1.00 0.00 C ATOM 0 H VAL A 105 -7.047 -2.041 -10.132 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.581 0.234 -9.078 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.693 -0.595 -8.596 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.756 1.045 -6.759 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.017 1.813 -8.343 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -7.396 1.529 -7.254 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -6.479 -1.277 -6.360 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -8.151 -0.902 -6.840 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.264 -2.213 -7.653 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.907 1.707 -10.981 1.00 0.00 N ATOM 1630 CA GLN A 106 -7.498 2.688 -11.986 1.00 0.00 C ATOM 1631 C GLN A 106 -7.226 4.056 -11.355 1.00 0.00 C ATOM 1632 O GLN A 106 -6.373 4.808 -11.833 1.00 0.00 O ATOM 1633 CB GLN A 106 -8.577 2.824 -13.068 1.00 0.00 C ATOM 1634 CG GLN A 106 -8.526 1.731 -14.127 1.00 0.00 C ATOM 1635 CD GLN A 106 -9.603 0.674 -13.943 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -10.303 0.649 -12.930 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -9.741 -0.210 -14.927 1.00 0.00 N ATOM 0 H GLN A 106 -8.889 1.767 -10.713 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.573 2.330 -12.438 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -9.558 2.812 -12.593 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -8.471 3.794 -13.554 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -8.633 2.183 -15.113 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -7.547 1.253 -14.100 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -9.141 -0.155 -15.750 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -10.447 -0.943 -14.859 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.959 4.377 -10.287 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.802 5.657 -9.601 1.00 0.00 C ATOM 1648 C ASN A 107 -6.685 5.596 -8.557 1.00 0.00 C ATOM 1649 O ASN A 107 -6.936 5.339 -7.378 1.00 0.00 O ATOM 1650 CB ASN A 107 -9.117 6.072 -8.932 1.00 0.00 C ATOM 1651 CG ASN A 107 -10.231 6.338 -9.930 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -9.982 6.570 -11.113 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -11.473 6.308 -9.455 1.00 0.00 N ATOM 0 H ASN A 107 -8.667 3.766 -9.880 1.00 0.00 H new ATOM 0 HA ASN A 107 -7.530 6.401 -10.350 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.432 5.287 -8.244 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.948 6.969 -8.336 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -12.262 6.481 -10.078 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -11.637 6.112 -8.468 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.454 5.840 -8.999 1.00 0.00 N ATOM 1661 CA PHE A 108 -4.295 5.825 -8.109 1.00 0.00 C ATOM 1662 C PHE A 108 -3.327 6.957 -8.462 1.00 0.00 C ATOM 1663 O PHE A 108 -3.342 7.467 -9.583 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.578 4.471 -8.180 1.00 0.00 C ATOM 1665 CG PHE A 108 -3.139 4.084 -9.566 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.978 4.607 -10.108 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.886 3.195 -10.321 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -1.568 4.252 -11.378 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -3.482 2.835 -11.592 1.00 0.00 C ATOM 1670 CZ PHE A 108 -2.321 3.365 -12.122 1.00 0.00 C ATOM 0 H PHE A 108 -5.232 6.051 -9.972 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.648 5.978 -7.089 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.705 4.499 -7.528 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.242 3.699 -7.791 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -1.385 5.301 -9.531 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.794 2.779 -9.911 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.660 4.667 -11.789 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -4.073 2.140 -12.171 1.00 0.00 H new ATOM 0 HZ PHE A 108 -2.003 3.086 -13.116 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.491 7.347 -7.499 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.524 8.421 -7.716 1.00 0.00 C ATOM 1682 C ALA A 109 -0.126 7.869 -7.986 1.00 0.00 C ATOM 1683 O ALA A 109 0.460 8.134 -9.036 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.496 9.363 -6.520 1.00 0.00 C ATOM 0 H ALA A 109 -2.465 6.937 -6.566 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.841 8.978 -8.598 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.771 10.157 -6.699 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.484 9.800 -6.378 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.213 8.808 -5.626 1.00 0.00 H new ATOM 1690 N LYS A 110 0.408 7.112 -7.026 1.00 0.00 N ATOM 1691 CA LYS A 110 1.742 6.534 -7.158 1.00 0.00 C ATOM 1692 C LYS A 110 1.776 5.095 -6.646 1.00 0.00 C ATOM 1693 O LYS A 110 1.004 4.721 -5.761 1.00 0.00 O ATOM 1694 CB LYS A 110 2.759 7.386 -6.392 1.00 0.00 C ATOM 1695 CG LYS A 110 3.957 7.808 -7.229 1.00 0.00 C ATOM 1696 CD LYS A 110 5.266 7.392 -6.575 1.00 0.00 C ATOM 1697 CE LYS A 110 6.243 6.819 -7.590 1.00 0.00 C ATOM 1698 NZ LYS A 110 7.586 6.570 -6.993 1.00 0.00 N ATOM 0 H LYS A 110 -0.064 6.886 -6.150 1.00 0.00 H new ATOM 0 HA LYS A 110 2.002 6.522 -8.216 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.260 8.278 -6.012 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.111 6.825 -5.526 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.886 7.361 -8.220 1.00 0.00 H new ATOM 0 HG3 LYS A 110 3.944 8.889 -7.366 1.00 0.00 H new ATOM 0 HD2 LYS A 110 5.717 8.253 -6.082 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.067 6.650 -5.802 1.00 0.00 H new ATOM 0 HE2 LYS A 110 5.845 5.886 -7.990 1.00 0.00 H new ATOM 0 HE3 LYS A 110 6.341 7.509 -8.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 8.221 6.180 -7.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 7.978 7.464 -6.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 7.497 5.892 -6.209 1.00 0.00 H new ATOM 1712 N GLU A 111 2.680 4.293 -7.211 1.00 0.00 N ATOM 1713 CA GLU A 111 2.823 2.895 -6.814 1.00 0.00 C ATOM 1714 C GLU A 111 4.295 2.492 -6.750 1.00 0.00 C ATOM 1715 O GLU A 111 5.079 2.825 -7.640 1.00 0.00 O ATOM 1716 CB GLU A 111 2.075 1.982 -7.792 1.00 0.00 C ATOM 1717 CG GLU A 111 2.577 2.073 -9.226 1.00 0.00 C ATOM 1718 CD GLU A 111 1.775 1.212 -10.182 1.00 0.00 C ATOM 1719 OE1 GLU A 111 1.822 -0.030 -10.048 1.00 0.00 O ATOM 1720 OE2 GLU A 111 1.099 1.781 -11.064 1.00 0.00 O ATOM 0 H GLU A 111 3.323 4.590 -7.945 1.00 0.00 H new ATOM 0 HA GLU A 111 2.390 2.783 -5.820 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.163 0.950 -7.451 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.015 2.235 -7.772 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.535 3.111 -9.556 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.623 1.769 -9.260 1.00 0.00 H new ATOM 1727 N PHE A 112 4.664 1.775 -5.691 1.00 0.00 N ATOM 1728 CA PHE A 112 6.042 1.323 -5.514 1.00 0.00 C ATOM 1729 C PHE A 112 6.120 0.152 -4.535 1.00 0.00 C ATOM 1730 O PHE A 112 5.167 -0.132 -3.807 1.00 0.00 O ATOM 1731 CB PHE A 112 6.940 2.472 -5.032 1.00 0.00 C ATOM 1732 CG PHE A 112 6.300 3.371 -4.009 1.00 0.00 C ATOM 1733 CD1 PHE A 112 5.539 4.459 -4.404 1.00 0.00 C ATOM 1734 CD2 PHE A 112 6.467 3.133 -2.654 1.00 0.00 C ATOM 1735 CE1 PHE A 112 4.956 5.293 -3.470 1.00 0.00 C ATOM 1736 CE2 PHE A 112 5.886 3.962 -1.714 1.00 0.00 C ATOM 1737 CZ PHE A 112 5.129 5.043 -2.122 1.00 0.00 C ATOM 0 H PHE A 112 4.029 1.495 -4.943 1.00 0.00 H new ATOM 0 HA PHE A 112 6.401 0.983 -6.486 1.00 0.00 H new ATOM 0 HB2 PHE A 112 7.852 2.052 -4.609 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.235 3.073 -5.893 1.00 0.00 H new ATOM 0 HD1 PHE A 112 5.400 4.658 -5.456 1.00 0.00 H new ATOM 0 HD2 PHE A 112 7.058 2.290 -2.329 1.00 0.00 H new ATOM 0 HE1 PHE A 112 4.366 6.138 -3.792 1.00 0.00 H new ATOM 0 HE2 PHE A 112 6.024 3.765 -0.661 1.00 0.00 H new ATOM 0 HZ PHE A 112 4.673 5.692 -1.389 1.00 0.00 H new ATOM 1747 N VAL A 113 7.269 -0.523 -4.528 1.00 0.00 N ATOM 1748 CA VAL A 113 7.491 -1.665 -3.645 1.00 0.00 C ATOM 1749 C VAL A 113 8.526 -1.321 -2.574 1.00 0.00 C ATOM 1750 O VAL A 113 9.527 -0.662 -2.857 1.00 0.00 O ATOM 1751 CB VAL A 113 7.966 -2.904 -4.440 1.00 0.00 C ATOM 1752 CG1 VAL A 113 7.989 -4.144 -3.555 1.00 0.00 C ATOM 1753 CG2 VAL A 113 7.083 -3.134 -5.662 1.00 0.00 C ATOM 0 H VAL A 113 8.063 -0.297 -5.127 1.00 0.00 H new ATOM 0 HA VAL A 113 6.540 -1.900 -3.167 1.00 0.00 H new ATOM 0 HB VAL A 113 8.983 -2.713 -4.783 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.326 -5.001 -4.138 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.670 -3.982 -2.720 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.987 -4.337 -3.173 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.436 -4.010 -6.206 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.054 -3.295 -5.342 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.128 -2.261 -6.313 1.00 0.00 H new ATOM 1763 N ILE A 114 8.272 -1.764 -1.342 1.00 0.00 N ATOM 1764 CA ILE A 114 9.178 -1.496 -0.228 1.00 0.00 C ATOM 1765 C ILE A 114 9.620 -2.790 0.452 1.00 0.00 C ATOM 1766 O ILE A 114 8.832 -3.725 0.600 1.00 0.00 O ATOM 1767 CB ILE A 114 8.515 -0.579 0.824 1.00 0.00 C ATOM 1768 CG1 ILE A 114 7.945 0.677 0.158 1.00 0.00 C ATOM 1769 CG2 ILE A 114 9.514 -0.200 1.909 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.085 1.514 1.080 1.00 0.00 C ATOM 0 H ILE A 114 7.447 -2.309 -1.092 1.00 0.00 H new ATOM 0 HA ILE A 114 10.051 -0.994 -0.645 1.00 0.00 H new ATOM 0 HB ILE A 114 7.694 -1.126 1.288 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.769 1.288 -0.211 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.354 0.382 -0.709 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.029 0.446 2.641 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.874 -1.102 2.404 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.355 0.328 1.460 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.716 2.387 0.541 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.241 0.920 1.429 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.678 1.840 1.935 1.00 0.00 H new ATOM 1782 N SER A 115 10.885 -2.829 0.871 1.00 0.00 N ATOM 1783 CA SER A 115 11.437 -4.001 1.549 1.00 0.00 C ATOM 1784 C SER A 115 12.258 -3.599 2.780 1.00 0.00 C ATOM 1785 O SER A 115 13.161 -4.325 3.201 1.00 0.00 O ATOM 1786 CB SER A 115 12.293 -4.822 0.579 1.00 0.00 C ATOM 1787 OG SER A 115 13.378 -4.059 0.078 1.00 0.00 O ATOM 0 H SER A 115 11.547 -2.062 0.753 1.00 0.00 H new ATOM 0 HA SER A 115 10.604 -4.615 1.891 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.673 -5.709 1.087 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.676 -5.169 -0.250 1.00 0.00 H new ATOM 0 HG SER A 115 13.908 -4.608 -0.537 1.00 0.00 H new ATOM 1793 N ASP A 116 11.925 -2.443 3.360 1.00 0.00 N ATOM 1794 CA ASP A 116 12.610 -1.941 4.547 1.00 0.00 C ATOM 1795 C ASP A 116 11.606 -1.360 5.534 1.00 0.00 C ATOM 1796 O ASP A 116 10.667 -0.666 5.143 1.00 0.00 O ATOM 1797 CB ASP A 116 13.642 -0.878 4.171 1.00 0.00 C ATOM 1798 CG ASP A 116 14.432 -0.395 5.371 1.00 0.00 C ATOM 1799 OD1 ASP A 116 15.270 -1.168 5.884 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.207 0.755 5.799 1.00 0.00 O ATOM 0 H ASP A 116 11.179 -1.835 3.021 1.00 0.00 H new ATOM 0 HA ASP A 116 13.127 -2.778 5.016 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.327 -1.286 3.428 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.136 -0.031 3.707 1.00 0.00 H new ATOM 1805 N ARG A 117 11.809 -1.653 6.815 1.00 0.00 N ATOM 1806 CA ARG A 117 10.922 -1.169 7.869 1.00 0.00 C ATOM 1807 C ARG A 117 10.885 0.360 7.919 1.00 0.00 C ATOM 1808 O ARG A 117 9.838 0.950 8.200 1.00 0.00 O ATOM 1809 CB ARG A 117 11.358 -1.732 9.221 1.00 0.00 C ATOM 1810 CG ARG A 117 10.286 -1.632 10.290 1.00 0.00 C ATOM 1811 CD ARG A 117 10.467 -2.690 11.365 1.00 0.00 C ATOM 1812 NE ARG A 117 9.406 -2.625 12.370 1.00 0.00 N ATOM 1813 CZ ARG A 117 9.132 -3.600 13.238 1.00 0.00 C ATOM 1814 NH1 ARG A 117 9.839 -4.728 13.234 1.00 0.00 N ATOM 1815 NH2 ARG A 117 8.145 -3.446 14.114 1.00 0.00 N ATOM 0 H ARG A 117 12.584 -2.226 7.150 1.00 0.00 H new ATOM 0 HA ARG A 117 9.914 -1.516 7.642 1.00 0.00 H new ATOM 0 HB2 ARG A 117 11.640 -2.777 9.097 1.00 0.00 H new ATOM 0 HB3 ARG A 117 12.247 -1.200 9.558 1.00 0.00 H new ATOM 0 HG2 ARG A 117 10.316 -0.642 10.745 1.00 0.00 H new ATOM 0 HG3 ARG A 117 9.303 -1.743 9.832 1.00 0.00 H new ATOM 0 HD2 ARG A 117 10.474 -3.678 10.906 1.00 0.00 H new ATOM 0 HD3 ARG A 117 11.435 -2.557 11.848 1.00 0.00 H new ATOM 0 HE ARG A 117 8.838 -1.778 12.410 1.00 0.00 H new ATOM 0 HH11 ARG A 117 10.597 -4.852 12.563 1.00 0.00 H new ATOM 0 HH12 ARG A 117 9.622 -5.468 13.902 1.00 0.00 H new ATOM 0 HH21 ARG A 117 7.599 -2.584 14.121 1.00 0.00 H new ATOM 0 HH22 ARG A 117 7.933 -4.190 14.779 1.00 0.00 H new ATOM 1829 N LYS A 118 12.021 0.999 7.637 1.00 0.00 N ATOM 1830 CA LYS A 118 12.095 2.461 7.646 1.00 0.00 C ATOM 1831 C LYS A 118 11.264 3.041 6.505 1.00 0.00 C ATOM 1832 O LYS A 118 10.479 3.969 6.711 1.00 0.00 O ATOM 1833 CB LYS A 118 13.547 2.938 7.541 1.00 0.00 C ATOM 1834 CG LYS A 118 13.829 4.210 8.327 1.00 0.00 C ATOM 1835 CD LYS A 118 13.249 5.435 7.637 1.00 0.00 C ATOM 1836 CE LYS A 118 14.095 6.673 7.898 1.00 0.00 C ATOM 1837 NZ LYS A 118 13.308 7.930 7.762 1.00 0.00 N ATOM 0 H LYS A 118 12.897 0.532 7.401 1.00 0.00 H new ATOM 0 HA LYS A 118 11.689 2.815 8.593 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.207 2.147 7.897 1.00 0.00 H new ATOM 0 HB3 LYS A 118 13.790 3.108 6.492 1.00 0.00 H new ATOM 0 HG2 LYS A 118 13.406 4.121 9.328 1.00 0.00 H new ATOM 0 HG3 LYS A 118 14.905 4.334 8.446 1.00 0.00 H new ATOM 0 HD2 LYS A 118 13.187 5.255 6.564 1.00 0.00 H new ATOM 0 HD3 LYS A 118 12.232 5.606 7.991 1.00 0.00 H new ATOM 0 HE2 LYS A 118 14.518 6.617 8.901 1.00 0.00 H new ATOM 0 HE3 LYS A 118 14.932 6.693 7.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 13.924 8.747 7.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 12.926 7.997 6.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 12.524 7.924 8.445 1.00 0.00 H new ATOM 1851 N GLU A 119 11.428 2.481 5.306 1.00 0.00 N ATOM 1852 CA GLU A 119 10.674 2.938 4.139 1.00 0.00 C ATOM 1853 C GLU A 119 9.192 2.570 4.269 1.00 0.00 C ATOM 1854 O GLU A 119 8.324 3.269 3.742 1.00 0.00 O ATOM 1855 CB GLU A 119 11.249 2.343 2.853 1.00 0.00 C ATOM 1856 CG GLU A 119 12.434 3.122 2.301 1.00 0.00 C ATOM 1857 CD GLU A 119 13.745 2.733 2.954 1.00 0.00 C ATOM 1858 OE1 GLU A 119 14.356 1.741 2.509 1.00 0.00 O ATOM 1859 OE2 GLU A 119 14.161 3.420 3.911 1.00 0.00 O ATOM 0 H GLU A 119 12.073 1.714 5.118 1.00 0.00 H new ATOM 0 HA GLU A 119 10.761 4.023 4.091 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.557 1.315 3.044 1.00 0.00 H new ATOM 0 HB3 GLU A 119 10.465 2.306 2.097 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.505 2.955 1.226 1.00 0.00 H new ATOM 0 HG3 GLU A 119 12.262 4.188 2.447 1.00 0.00 H new ATOM 1866 N LEU A 120 8.911 1.475 4.984 1.00 0.00 N ATOM 1867 CA LEU A 120 7.538 1.015 5.196 1.00 0.00 C ATOM 1868 C LEU A 120 6.762 2.008 6.065 1.00 0.00 C ATOM 1869 O LEU A 120 5.548 2.148 5.925 1.00 0.00 O ATOM 1870 CB LEU A 120 7.534 -0.369 5.863 1.00 0.00 C ATOM 1871 CG LEU A 120 6.561 -1.396 5.269 1.00 0.00 C ATOM 1872 CD1 LEU A 120 6.534 -2.655 6.126 1.00 0.00 C ATOM 1873 CD2 LEU A 120 5.161 -0.809 5.143 1.00 0.00 C ATOM 0 H LEU A 120 9.620 0.890 5.426 1.00 0.00 H new ATOM 0 HA LEU A 120 7.051 0.944 4.223 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.542 -0.779 5.810 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.297 -0.241 6.919 1.00 0.00 H new ATOM 0 HG LEU A 120 6.910 -1.659 4.270 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.840 -3.375 5.693 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.532 -3.091 6.164 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.211 -2.401 7.136 1.00 0.00 H new ATOM 0 HD21 LEU A 120 4.490 -1.556 4.720 1.00 0.00 H new ATOM 0 HD22 LEU A 120 4.800 -0.514 6.128 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.190 0.064 4.491 1.00 0.00 H new ATOM 1885 N GLU A 121 7.478 2.691 6.963 1.00 0.00 N ATOM 1886 CA GLU A 121 6.874 3.670 7.860 1.00 0.00 C ATOM 1887 C GLU A 121 6.044 4.693 7.084 1.00 0.00 C ATOM 1888 O GLU A 121 6.494 5.244 6.076 1.00 0.00 O ATOM 1889 CB GLU A 121 7.962 4.378 8.671 1.00 0.00 C ATOM 1890 CG GLU A 121 7.436 5.118 9.895 1.00 0.00 C ATOM 1891 CD GLU A 121 8.390 6.187 10.406 1.00 0.00 C ATOM 1892 OE1 GLU A 121 9.604 6.102 10.114 1.00 0.00 O ATOM 1893 OE2 GLU A 121 7.920 7.111 11.103 1.00 0.00 O ATOM 0 H GLU A 121 8.484 2.580 7.085 1.00 0.00 H new ATOM 0 HA GLU A 121 6.206 3.141 8.540 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.699 3.642 8.992 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.480 5.087 8.025 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.480 5.581 9.649 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.246 4.399 10.692 1.00 0.00 H new ATOM 1900 N GLU A 122 4.825 4.930 7.564 1.00 0.00 N ATOM 1901 CA GLU A 122 3.900 5.875 6.932 1.00 0.00 C ATOM 1902 C GLU A 122 4.542 7.247 6.715 1.00 0.00 C ATOM 1903 O GLU A 122 4.259 7.920 5.720 1.00 0.00 O ATOM 1904 CB GLU A 122 2.636 6.022 7.785 1.00 0.00 C ATOM 1905 CG GLU A 122 1.568 6.904 7.153 1.00 0.00 C ATOM 1906 CD GLU A 122 0.565 6.121 6.326 1.00 0.00 C ATOM 1907 OE1 GLU A 122 0.974 5.155 5.645 1.00 0.00 O ATOM 1908 OE2 GLU A 122 -0.632 6.476 6.357 1.00 0.00 O ATOM 0 H GLU A 122 4.450 4.477 8.397 1.00 0.00 H new ATOM 0 HA GLU A 122 3.639 5.473 5.953 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.216 5.033 7.969 1.00 0.00 H new ATOM 0 HB3 GLU A 122 2.910 6.437 8.755 1.00 0.00 H new ATOM 0 HG2 GLU A 122 1.040 7.445 7.938 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.049 7.650 6.520 1.00 0.00 H new ATOM 1915 N ASN A 123 5.404 7.657 7.646 1.00 0.00 N ATOM 1916 CA ASN A 123 6.081 8.949 7.550 1.00 0.00 C ATOM 1917 C ASN A 123 6.949 9.008 6.299 1.00 0.00 C ATOM 1918 O ASN A 123 7.019 10.038 5.626 1.00 0.00 O ATOM 1919 CB ASN A 123 6.939 9.200 8.794 1.00 0.00 C ATOM 1920 CG ASN A 123 6.262 10.117 9.796 1.00 0.00 C ATOM 1921 OD1 ASN A 123 6.569 11.307 9.868 1.00 0.00 O ATOM 1922 ND2 ASN A 123 5.335 9.570 10.574 1.00 0.00 N ATOM 0 H ASN A 123 5.649 7.114 8.474 1.00 0.00 H new ATOM 0 HA ASN A 123 5.320 9.727 7.485 1.00 0.00 H new ATOM 0 HB2 ASN A 123 7.164 8.247 9.274 1.00 0.00 H new ATOM 0 HB3 ASN A 123 7.891 9.638 8.492 1.00 0.00 H new ATOM 0 HD21 ASN A 123 4.847 10.141 11.264 1.00 0.00 H new ATOM 0 HD22 ASN A 123 5.111 8.579 10.481 1.00 0.00 H new ATOM 1929 N PHE A 124 7.601 7.888 5.989 1.00 0.00 N ATOM 1930 CA PHE A 124 8.459 7.799 4.817 1.00 0.00 C ATOM 1931 C PHE A 124 7.633 7.854 3.532 1.00 0.00 C ATOM 1932 O PHE A 124 7.917 8.657 2.641 1.00 0.00 O ATOM 1933 CB PHE A 124 9.284 6.512 4.862 1.00 0.00 C ATOM 1934 CG PHE A 124 10.437 6.508 3.896 1.00 0.00 C ATOM 1935 CD1 PHE A 124 10.216 6.436 2.530 1.00 0.00 C ATOM 1936 CD2 PHE A 124 11.743 6.588 4.355 1.00 0.00 C ATOM 1937 CE1 PHE A 124 11.272 6.444 1.641 1.00 0.00 C ATOM 1938 CE2 PHE A 124 12.804 6.594 3.470 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.568 6.523 2.111 1.00 0.00 C ATOM 0 H PHE A 124 7.548 7.030 6.537 1.00 0.00 H new ATOM 0 HA PHE A 124 9.136 8.653 4.824 1.00 0.00 H new ATOM 0 HB2 PHE A 124 9.666 6.369 5.873 1.00 0.00 H new ATOM 0 HB3 PHE A 124 8.634 5.665 4.644 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.205 6.373 2.156 1.00 0.00 H new ATOM 0 HD2 PHE A 124 11.933 6.646 5.417 1.00 0.00 H new ATOM 0 HE1 PHE A 124 11.085 6.389 0.579 1.00 0.00 H new ATOM 0 HE2 PHE A 124 13.817 6.654 3.840 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.396 6.529 1.417 1.00 0.00 H new ATOM 1949 N ILE A 125 6.609 7.001 3.446 1.00 0.00 N ATOM 1950 CA ILE A 125 5.738 6.958 2.269 1.00 0.00 C ATOM 1951 C ILE A 125 5.153 8.338 1.971 1.00 0.00 C ATOM 1952 O ILE A 125 5.063 8.745 0.811 1.00 0.00 O ATOM 1953 CB ILE A 125 4.581 5.947 2.448 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.120 4.570 2.846 1.00 0.00 C ATOM 1955 CG2 ILE A 125 3.761 5.844 1.168 1.00 0.00 C ATOM 1956 CD1 ILE A 125 4.288 3.878 3.905 1.00 0.00 C ATOM 0 H ILE A 125 6.363 6.332 4.176 1.00 0.00 H new ATOM 0 HA ILE A 125 6.358 6.636 1.432 1.00 0.00 H new ATOM 0 HB ILE A 125 3.935 6.307 3.248 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.166 3.937 1.960 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.141 4.680 3.212 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.951 5.129 1.311 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.343 6.821 0.924 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.401 5.509 0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 125 4.728 2.908 4.138 1.00 0.00 H new ATOM 0 HD12 ILE A 125 4.263 4.491 4.806 1.00 0.00 H new ATOM 0 HD13 ILE A 125 3.273 3.736 3.535 1.00 0.00 H new ATOM 1968 N LYS A 126 4.762 9.051 3.029 1.00 0.00 N ATOM 1969 CA LYS A 126 4.190 10.392 2.897 1.00 0.00 C ATOM 1970 C LYS A 126 5.084 11.287 2.039 1.00 0.00 C ATOM 1971 O LYS A 126 4.594 12.044 1.198 1.00 0.00 O ATOM 1972 CB LYS A 126 4.000 11.017 4.283 1.00 0.00 C ATOM 1973 CG LYS A 126 3.159 12.283 4.283 1.00 0.00 C ATOM 1974 CD LYS A 126 3.219 12.994 5.627 1.00 0.00 C ATOM 1975 CE LYS A 126 2.345 12.304 6.667 1.00 0.00 C ATOM 1976 NZ LYS A 126 3.036 12.172 7.981 1.00 0.00 N ATOM 0 H LYS A 126 4.832 8.720 3.991 1.00 0.00 H new ATOM 0 HA LYS A 126 3.222 10.304 2.404 1.00 0.00 H new ATOM 0 HB2 LYS A 126 3.533 10.283 4.940 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.979 11.244 4.705 1.00 0.00 H new ATOM 0 HG2 LYS A 126 3.510 12.954 3.499 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.124 12.033 4.048 1.00 0.00 H new ATOM 0 HD2 LYS A 126 4.250 13.022 5.979 1.00 0.00 H new ATOM 0 HD3 LYS A 126 2.895 14.028 5.507 1.00 0.00 H new ATOM 0 HE2 LYS A 126 1.423 12.870 6.798 1.00 0.00 H new ATOM 0 HE3 LYS A 126 2.063 11.315 6.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 2.406 11.697 8.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 3.903 11.610 7.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.282 13.116 8.340 1.00 0.00 H new ATOM 1990 N SER A 127 6.395 11.191 2.257 1.00 0.00 N ATOM 1991 CA SER A 127 7.365 11.984 1.509 1.00 0.00 C ATOM 1992 C SER A 127 7.469 11.510 0.059 1.00 0.00 C ATOM 1993 O SER A 127 7.533 12.327 -0.861 1.00 0.00 O ATOM 1994 CB SER A 127 8.739 11.910 2.183 1.00 0.00 C ATOM 1995 OG SER A 127 9.662 12.788 1.562 1.00 0.00 O ATOM 0 H SER A 127 6.810 10.568 2.950 1.00 0.00 H new ATOM 0 HA SER A 127 7.021 13.018 1.504 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.644 12.165 3.238 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.116 10.888 2.135 1.00 0.00 H new ATOM 0 HG SER A 127 10.530 12.722 2.012 1.00 0.00 H new ATOM 2001 N GLU A 128 7.489 10.189 -0.137 1.00 0.00 N ATOM 2002 CA GLU A 128 7.590 9.606 -1.478 1.00 0.00 C ATOM 2003 C GLU A 128 6.473 10.105 -2.398 1.00 0.00 C ATOM 2004 O GLU A 128 6.685 10.273 -3.599 1.00 0.00 O ATOM 2005 CB GLU A 128 7.553 8.077 -1.404 1.00 0.00 C ATOM 2006 CG GLU A 128 7.924 7.394 -2.715 1.00 0.00 C ATOM 2007 CD GLU A 128 8.913 6.254 -2.537 1.00 0.00 C ATOM 2008 OE1 GLU A 128 9.803 6.363 -1.665 1.00 0.00 O ATOM 2009 OE2 GLU A 128 8.799 5.253 -3.273 1.00 0.00 O ATOM 0 H GLU A 128 7.437 9.503 0.616 1.00 0.00 H new ATOM 0 HA GLU A 128 8.544 9.925 -1.898 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.237 7.743 -0.624 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.553 7.760 -1.109 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.019 7.011 -3.186 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.349 8.133 -3.394 1.00 0.00 H new ATOM 2016 N LEU A 129 5.285 10.331 -1.834 1.00 0.00 N ATOM 2017 CA LEU A 129 4.140 10.803 -2.615 1.00 0.00 C ATOM 2018 C LEU A 129 4.386 12.203 -3.175 1.00 0.00 C ATOM 2019 O LEU A 129 4.194 12.443 -4.368 1.00 0.00 O ATOM 2020 CB LEU A 129 2.871 10.806 -1.757 1.00 0.00 C ATOM 2021 CG LEU A 129 1.912 9.641 -2.017 1.00 0.00 C ATOM 2022 CD1 LEU A 129 2.182 8.501 -1.046 1.00 0.00 C ATOM 2023 CD2 LEU A 129 0.467 10.105 -1.909 1.00 0.00 C ATOM 0 H LEU A 129 5.091 10.195 -0.842 1.00 0.00 H new ATOM 0 HA LEU A 129 4.008 10.117 -3.452 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.161 10.791 -0.706 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.337 11.741 -1.927 1.00 0.00 H new ATOM 0 HG LEU A 129 2.080 9.276 -3.030 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.491 7.682 -1.246 1.00 0.00 H new ATOM 0 HD12 LEU A 129 3.206 8.151 -1.172 1.00 0.00 H new ATOM 0 HD13 LEU A 129 2.042 8.853 -0.024 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.200 9.264 -2.097 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.284 10.497 -0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.280 10.888 -2.644 1.00 0.00 H new ATOM 2035 N LYS A 130 4.805 13.123 -2.307 1.00 0.00 N ATOM 2036 CA LYS A 130 5.071 14.500 -2.715 1.00 0.00 C ATOM 2037 C LYS A 130 6.342 14.593 -3.558 1.00 0.00 C ATOM 2038 O LYS A 130 6.387 15.329 -4.546 1.00 0.00 O ATOM 2039 CB LYS A 130 5.193 15.402 -1.485 1.00 0.00 C ATOM 2040 CG LYS A 130 5.414 16.868 -1.824 1.00 0.00 C ATOM 2041 CD LYS A 130 4.430 17.764 -1.089 1.00 0.00 C ATOM 2042 CE LYS A 130 4.587 19.221 -1.500 1.00 0.00 C ATOM 2043 NZ LYS A 130 5.478 19.971 -0.570 1.00 0.00 N ATOM 0 H LYS A 130 4.967 12.939 -1.317 1.00 0.00 H new ATOM 0 HA LYS A 130 4.233 14.836 -3.326 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.287 15.309 -0.885 1.00 0.00 H new ATOM 0 HB3 LYS A 130 6.021 15.052 -0.869 1.00 0.00 H new ATOM 0 HG2 LYS A 130 6.433 17.153 -1.563 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.308 17.014 -2.899 1.00 0.00 H new ATOM 0 HD2 LYS A 130 3.412 17.434 -1.296 1.00 0.00 H new ATOM 0 HD3 LYS A 130 4.583 17.670 -0.014 1.00 0.00 H new ATOM 0 HE2 LYS A 130 4.993 19.271 -2.510 1.00 0.00 H new ATOM 0 HE3 LYS A 130 3.607 19.698 -1.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.558 20.959 -0.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 5.078 19.946 0.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.421 19.533 -0.564 1.00 0.00 H new ATOM 2057 N LYS A 131 7.374 13.849 -3.159 1.00 0.00 N ATOM 2058 CA LYS A 131 8.647 13.853 -3.877 1.00 0.00 C ATOM 2059 C LYS A 131 8.529 13.146 -5.227 1.00 0.00 C ATOM 2060 O LYS A 131 9.130 13.578 -6.212 1.00 0.00 O ATOM 2061 CB LYS A 131 9.739 13.188 -3.034 1.00 0.00 C ATOM 2062 CG LYS A 131 10.459 14.150 -2.101 1.00 0.00 C ATOM 2063 CD LYS A 131 11.728 13.535 -1.531 1.00 0.00 C ATOM 2064 CE LYS A 131 12.887 14.522 -1.553 1.00 0.00 C ATOM 2065 NZ LYS A 131 13.552 14.635 -0.224 1.00 0.00 N ATOM 0 H LYS A 131 7.353 13.237 -2.343 1.00 0.00 H new ATOM 0 HA LYS A 131 8.919 14.893 -4.060 1.00 0.00 H new ATOM 0 HB2 LYS A 131 9.293 12.387 -2.443 1.00 0.00 H new ATOM 0 HB3 LYS A 131 10.468 12.726 -3.699 1.00 0.00 H new ATOM 0 HG2 LYS A 131 10.708 15.063 -2.641 1.00 0.00 H new ATOM 0 HG3 LYS A 131 9.793 14.433 -1.286 1.00 0.00 H new ATOM 0 HD2 LYS A 131 11.547 13.208 -0.507 1.00 0.00 H new ATOM 0 HD3 LYS A 131 11.994 12.648 -2.106 1.00 0.00 H new ATOM 0 HE2 LYS A 131 13.618 14.206 -2.298 1.00 0.00 H new ATOM 0 HE3 LYS A 131 12.522 15.502 -1.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 14.335 15.317 -0.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 12.862 14.961 0.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 13.924 13.706 0.058 1.00 0.00 H new ATOM 2079 N ALA A 132 7.758 12.056 -5.265 1.00 0.00 N ATOM 2080 CA ALA A 132 7.568 11.283 -6.492 1.00 0.00 C ATOM 2081 C ALA A 132 8.908 10.799 -7.042 1.00 0.00 C ATOM 2082 O ALA A 132 9.213 10.981 -8.224 1.00 0.00 O ATOM 2083 CB ALA A 132 6.825 12.113 -7.532 1.00 0.00 C ATOM 0 H ALA A 132 7.255 11.689 -4.457 1.00 0.00 H new ATOM 0 HA ALA A 132 6.965 10.406 -6.256 1.00 0.00 H new ATOM 0 HB1 ALA A 132 6.691 11.524 -8.439 1.00 0.00 H new ATOM 0 HB2 ALA A 132 5.850 12.401 -7.139 1.00 0.00 H new ATOM 0 HB3 ALA A 132 7.402 13.009 -7.762 1.00 0.00 H new ATOM 2089 N GLY A 133 9.711 10.192 -6.170 1.00 0.00 N ATOM 2090 CA GLY A 133 11.016 9.701 -6.570 1.00 0.00 C ATOM 2091 C GLY A 133 12.135 10.555 -6.009 1.00 0.00 C ATOM 2092 O GLY A 133 12.928 10.087 -5.190 1.00 0.00 O ATOM 0 H GLY A 133 9.478 10.032 -5.190 1.00 0.00 H new ATOM 0 HA2 GLY A 133 11.138 8.673 -6.229 1.00 0.00 H new ATOM 0 HA3 GLY A 133 11.081 9.686 -7.658 1.00 0.00 H new ATOM 2096 N GLY A 134 12.193 11.815 -6.444 1.00 0.00 N ATOM 2097 CA GLY A 134 13.220 12.723 -5.966 1.00 0.00 C ATOM 2098 C GLY A 134 12.946 14.160 -6.359 1.00 0.00 C ATOM 2099 O GLY A 134 13.160 14.544 -7.510 1.00 0.00 O ATOM 0 H GLY A 134 11.545 12.221 -7.119 1.00 0.00 H new ATOM 0 HA2 GLY A 134 13.288 12.652 -4.880 1.00 0.00 H new ATOM 0 HA3 GLY A 134 14.187 12.417 -6.366 1.00 0.00 H new ATOM 2103 N ALA A 135 12.475 14.960 -5.401 1.00 0.00 N ATOM 2104 CA ALA A 135 12.179 16.366 -5.659 1.00 0.00 C ATOM 2105 C ALA A 135 13.371 17.260 -5.319 1.00 0.00 C ATOM 2106 O ALA A 135 13.215 18.468 -5.130 1.00 0.00 O ATOM 2107 CB ALA A 135 10.948 16.799 -4.875 1.00 0.00 C ATOM 0 H ALA A 135 12.292 14.658 -4.444 1.00 0.00 H new ATOM 0 HA ALA A 135 11.976 16.475 -6.724 1.00 0.00 H new ATOM 0 HB1 ALA A 135 10.739 17.850 -5.077 1.00 0.00 H new ATOM 0 HB2 ALA A 135 10.093 16.194 -5.177 1.00 0.00 H new ATOM 0 HB3 ALA A 135 11.129 16.664 -3.809 1.00 0.00 H new ATOM 2113 N ASN A 136 14.562 16.658 -5.253 1.00 0.00 N ATOM 2114 CA ASN A 136 15.790 17.389 -4.946 1.00 0.00 C ATOM 2115 C ASN A 136 15.614 18.284 -3.717 1.00 0.00 C ATOM 2116 O ASN A 136 16.170 19.381 -3.648 1.00 0.00 O ATOM 2117 CB ASN A 136 16.224 18.214 -6.161 1.00 0.00 C ATOM 2118 CG ASN A 136 16.424 17.351 -7.396 1.00 0.00 C ATOM 2119 OD1 ASN A 136 17.553 17.024 -7.761 1.00 0.00 O ATOM 2120 ND2 ASN A 136 15.325 16.973 -8.045 1.00 0.00 N ATOM 0 H ASN A 136 14.700 15.660 -5.410 1.00 0.00 H new ATOM 0 HA ASN A 136 16.570 16.665 -4.713 1.00 0.00 H new ATOM 0 HB2 ASN A 136 15.472 18.975 -6.369 1.00 0.00 H new ATOM 0 HB3 ASN A 136 17.152 18.737 -5.931 1.00 0.00 H new ATOM 0 HD21 ASN A 136 15.400 16.390 -8.879 1.00 0.00 H new ATOM 0 HD22 ASN A 136 14.408 17.266 -7.709 1.00 0.00 H new ATOM 2127 N TYR A 137 14.835 17.801 -2.747 1.00 0.00 N ATOM 2128 CA TYR A 137 14.577 18.542 -1.519 1.00 0.00 C ATOM 2129 C TYR A 137 15.602 18.183 -0.446 1.00 0.00 C ATOM 2130 O TYR A 137 15.262 17.646 0.609 1.00 0.00 O ATOM 2131 CB TYR A 137 13.165 18.246 -1.025 1.00 0.00 C ATOM 2132 CG TYR A 137 12.391 19.478 -0.623 1.00 0.00 C ATOM 2133 CD1 TYR A 137 12.797 20.260 0.451 1.00 0.00 C ATOM 2134 CD2 TYR A 137 11.256 19.863 -1.323 1.00 0.00 C ATOM 2135 CE1 TYR A 137 12.090 21.387 0.819 1.00 0.00 C ATOM 2136 CE2 TYR A 137 10.543 20.990 -0.963 1.00 0.00 C ATOM 2137 CZ TYR A 137 10.965 21.750 0.108 1.00 0.00 C ATOM 2138 OH TYR A 137 10.258 22.872 0.470 1.00 0.00 O ATOM 0 H TYR A 137 14.371 16.894 -2.793 1.00 0.00 H new ATOM 0 HA TYR A 137 14.665 19.608 -1.728 1.00 0.00 H new ATOM 0 HB2 TYR A 137 12.617 17.724 -1.810 1.00 0.00 H new ATOM 0 HB3 TYR A 137 13.222 17.570 -0.172 1.00 0.00 H new ATOM 0 HD1 TYR A 137 13.680 19.982 1.007 1.00 0.00 H new ATOM 0 HD2 TYR A 137 10.925 19.271 -2.164 1.00 0.00 H new ATOM 0 HE1 TYR A 137 12.416 21.982 1.660 1.00 0.00 H new ATOM 0 HE2 TYR A 137 9.660 21.274 -1.517 1.00 0.00 H new ATOM 0 HH TYR A 137 9.495 22.986 -0.134 1.00 0.00 H new ATOM 2148 N ASP A 138 16.860 18.479 -0.739 1.00 0.00 N ATOM 2149 CA ASP A 138 17.960 18.190 0.182 1.00 0.00 C ATOM 2150 C ASP A 138 18.050 19.242 1.292 1.00 0.00 C ATOM 2151 O ASP A 138 17.418 20.297 1.218 1.00 0.00 O ATOM 2152 CB ASP A 138 19.286 18.124 -0.582 1.00 0.00 C ATOM 2153 CG ASP A 138 20.354 17.356 0.171 1.00 0.00 C ATOM 2154 OD1 ASP A 138 20.343 16.110 0.116 1.00 0.00 O ATOM 2155 OD2 ASP A 138 21.197 18.005 0.822 1.00 0.00 O ATOM 0 H ASP A 138 17.150 18.922 -1.611 1.00 0.00 H new ATOM 0 HA ASP A 138 17.761 17.224 0.646 1.00 0.00 H new ATOM 0 HB2 ASP A 138 19.120 17.653 -1.551 1.00 0.00 H new ATOM 0 HB3 ASP A 138 19.640 19.136 -0.776 1.00 0.00 H new ATOM 2160 N ALA A 139 18.844 18.940 2.322 1.00 0.00 N ATOM 2161 CA ALA A 139 19.028 19.848 3.454 1.00 0.00 C ATOM 2162 C ALA A 139 20.434 20.451 3.473 1.00 0.00 C ATOM 2163 O ALA A 139 20.605 21.624 3.808 1.00 0.00 O ATOM 2164 CB ALA A 139 18.747 19.120 4.762 1.00 0.00 C ATOM 0 H ALA A 139 19.371 18.070 2.394 1.00 0.00 H new ATOM 0 HA ALA A 139 18.319 20.668 3.341 1.00 0.00 H new ATOM 0 HB1 ALA A 139 18.887 19.806 5.598 1.00 0.00 H new ATOM 0 HB2 ALA A 139 17.720 18.754 4.761 1.00 0.00 H new ATOM 0 HB3 ALA A 139 19.432 18.278 4.865 1.00 0.00 H new ATOM 2170 N GLN A 140 21.439 19.648 3.111 1.00 0.00 N ATOM 2171 CA GLN A 140 22.828 20.112 3.088 1.00 0.00 C ATOM 2172 C GLN A 140 23.229 20.640 1.710 1.00 0.00 C ATOM 2173 O GLN A 140 24.416 20.816 1.426 1.00 0.00 O ATOM 2174 CB GLN A 140 23.770 18.980 3.490 1.00 0.00 C ATOM 2175 CG GLN A 140 23.858 18.752 4.992 1.00 0.00 C ATOM 2176 CD GLN A 140 23.245 17.430 5.423 1.00 0.00 C ATOM 2177 OE1 GLN A 140 22.335 17.398 6.250 1.00 0.00 O ATOM 2178 NE2 GLN A 140 23.745 16.331 4.866 1.00 0.00 N ATOM 0 H GLN A 140 21.316 18.675 2.830 1.00 0.00 H new ATOM 0 HA GLN A 140 22.907 20.931 3.803 1.00 0.00 H new ATOM 0 HB2 GLN A 140 23.439 18.058 3.012 1.00 0.00 H new ATOM 0 HB3 GLN A 140 24.767 19.197 3.107 1.00 0.00 H new ATOM 0 HG2 GLN A 140 24.904 18.780 5.299 1.00 0.00 H new ATOM 0 HG3 GLN A 140 23.352 19.568 5.509 1.00 0.00 H new ATOM 0 HE21 GLN A 140 24.500 16.403 4.184 1.00 0.00 H new ATOM 0 HE22 GLN A 140 23.373 15.416 5.121 1.00 0.00 H new ATOM 2187 N THR A 141 22.236 20.890 0.866 1.00 0.00 N ATOM 2188 CA THR A 141 22.470 21.397 -0.485 1.00 0.00 C ATOM 2189 C THR A 141 23.398 20.460 -1.266 1.00 0.00 C ATOM 2190 O THR A 141 24.272 20.912 -2.010 1.00 0.00 O ATOM 2191 CB THR A 141 23.059 22.813 -0.433 1.00 0.00 C ATOM 2192 OG1 THR A 141 22.670 23.481 0.757 1.00 0.00 O ATOM 2193 CG2 THR A 141 22.637 23.681 -1.601 1.00 0.00 C ATOM 0 H THR A 141 21.252 20.749 1.094 1.00 0.00 H new ATOM 0 HA THR A 141 21.512 21.438 -1.003 1.00 0.00 H new ATOM 0 HB THR A 141 24.139 22.674 -0.472 1.00 0.00 H new ATOM 0 HG1 THR A 141 23.058 24.381 0.769 1.00 0.00 H new ATOM 0 HG21 THR A 141 23.088 24.668 -1.502 1.00 0.00 H new ATOM 0 HG22 THR A 141 22.967 23.222 -2.533 1.00 0.00 H new ATOM 0 HG23 THR A 141 21.551 23.778 -1.609 1.00 0.00 H new ATOM 2201 N GLU A 142 23.197 19.153 -1.088 1.00 0.00 N ATOM 2202 CA GLU A 142 24.009 18.146 -1.769 1.00 0.00 C ATOM 2203 C GLU A 142 23.171 17.341 -2.763 1.00 0.00 C ATOM 2204 O GLU A 142 21.971 17.118 -2.489 1.00 0.00 O ATOM 2205 CB GLU A 142 24.664 17.208 -0.746 1.00 0.00 C ATOM 2206 CG GLU A 142 23.674 16.516 0.180 1.00 0.00 C ATOM 2207 CD GLU A 142 24.288 15.350 0.925 1.00 0.00 C ATOM 2208 OE1 GLU A 142 24.312 14.232 0.366 1.00 0.00 O ATOM 2209 OE2 GLU A 142 24.746 15.552 2.070 1.00 0.00 O ATOM 0 H GLU A 142 22.477 18.768 -0.477 1.00 0.00 H new ATOM 0 HA GLU A 142 24.790 18.664 -2.326 1.00 0.00 H new ATOM 0 HB2 GLU A 142 25.239 16.450 -1.279 1.00 0.00 H new ATOM 0 HB3 GLU A 142 25.371 17.780 -0.144 1.00 0.00 H new ATOM 0 HG2 GLU A 142 23.289 17.239 0.899 1.00 0.00 H new ATOM 0 HG3 GLU A 142 22.824 16.162 -0.403 1.00 0.00 H new TER 2216 GLU A 142